A0A087Y8A7_POEFO Loading...

Leucine rich repeat containing 49

AlphaFold DB , UniProt , Accession A0A087Y8A7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 796 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	33.7	Very low	31	Very low	215 Å²	215	149.4 Å²	149.4	100%	1.059	78%	0.78	S	S	*	*				0	96.3	0	-61.2	-179.3	-174.5	0	0	111.3
2	E	31.3	Very low	30.7	Very low	162 Å²	162	146.4 Å²	146.4	76%	0.757	78%	0.779	S	S	*	*			cis	165.6	153.8	-20.5	-104.8	121.7	-136.1	0	0	106.1
3	S	32.6	Very low	30.4	Very low	103 Å²	103	141.5 Å²	141.5	72%	0.72	79%	0.785	S	S	*	*			cis	-170.9	160.8	-17.1	45	0	0	0	0	109.4
4	E	34.5	Very low	30.1	Very low	161 Å²	161	136.6 Å²	136.6	75%	0.752	78%	0.783	S	S	*	*			cis	-156.2	139.2	-34.8	-95.2	-148.9	154.7	0	0	105.7
5	L	34.6	Very low	29.9	Very low	133 Å²	133	143.1 Å²	143.1	70%	0.696	79%	0.789	S	S	*	*				56.7	142.3	96	-49.9	-177.3	0	0	0	114.5
6	T	31.3	Very low	29.7	Very low	106 Å²	106	144.6 Å²	144.6	65%	0.65	79%	0.786	S	S	*	*			cis	-168.9	162.8	4.4	7	0	0	0	0	115.4
7	N	28.5	Very low	29.7	Very low	148 Å²	148	143.1 Å²	143.1	79%	0.791	77%	0.772	S	S	*	*			trans	56.2	150.8	139	-73.5	-38.1	0	0	0	125.9
8	G	27.6	Very low	29.6	Very low	67 Å²	67	142.7 Å²	142.7	69%	0.691	76%	0.764	S	S	*	*			trans	130.8	106.6	159.3	0	0	0	0	0	112.6
9	K	29.3	Very low	29.6	Very low	193 Å²	193	141.8 Å²	141.8	84%	0.839	76%	0.759	S	S	*	*			cis	60.2	127.8	24.3	-83.5	175.9	179	168.7	0	112.2
10	T	29.4	Very low	29.5	Very low	121 Å²	121	141.3 Å²	141.3	74%	0.742	76%	0.756	S	S	*	*			cis	-142.3	146.2	32.8	33.7	0	0	0	0	113.8
11	R	28.8	Very low	29.7	Very low	234 Å²	234	140.1 Å²	140.1	88%	0.883	75%	0.754	S	S	*	*				72.6	138.1	79.8	-136.2	-164.8	-171.8	177.5	1	112.6
12	C	26.6	Very low	29.8	Very low	114 Å²	114	134.4 Å²	134.4	77%	0.77	74%	0.736	S	S	*	*			cis	-129	176.4	11.1	-60	0	0	0	0	110.6
13	G	26.9	Very low	29.8	Very low	83 Å²	83	133 Å²	133	86%	0.856	73%	0.733	S	S	*	*			cis	115.9	130.5	6.3	0	0	0	0	0	112.2
14	G	27	Very low	29.6	Very low	73 Å²	73	137.9 Å²	137.9	75%	0.753	74%	0.741	S	S	*	*			cis	164.7	175.7	-10.4	0	0	0	0	0	113.9
15	R	26.4	Very low	29.6	Very low	233 Å²	233	136 Å²	136	88%	0.879	74%	0.744	S	S	*	*			trans	69.6	126	157.7	-70.4	-170	175.3	-170.9	-1.5	118.9
16	K	27.5	Very low	29.8	Very low	168 Å²	168	137.7 Å²	137.7	73%	0.73	75%	0.754	S	S	*	*				76.7	147.2	72.6	-78.2	-176.9	162.8	-124.7	0	113.5
17	Q	28.4	Very low	30	Very low	119 Å²	119	140.1 Å²	140.1	56%	0.556	76%	0.762	S	S	*	*			cis	-173.1	165.1	-8.9	-121.3	174	-51.6	0	0	110.7
18	H	27.8	Very low	30.6	Very low	136 Å²	136	139.3 Å²	139.3	63%	0.63	76%	0.757	S	S	*	*			trans	68.9	131.1	148.7	-74.8	-45.6	0	0	0	121.5
19	N	30	Very low	31.3	Very low	125 Å²	125	142 Å²	142	67%	0.668	76%	0.76	S	S	*	*				75.9	153.5	93.9	-64.4	28	0	0	0	114.8
20	N	28.6	Very low	31.7	Very low	131 Å²	131	137.1 Å²	137.1	70%	0.701	75%	0.748	S	S	*	*			cis	-159.3	152.9	-1.9	-122.3	14.7	0	0	0	112.8
21	V	32.9	Very low	32.1	Very low	117 Å²	117	136.6 Å²	136.6	71%	0.709	74%	0.738	S	S	*	*			trans	39.7	127	131.7	-178.8	0	0	0	0	122.9
22	S	34.9	Very low	32.9	Very low	96 Å²	96	131.4 Å²	131.4	67%	0.671	73%	0.727	S	S	*	*			trans	51.3	155.9	151.8	95.4	0	0	0	0	120.3
23	D	33.2	Very low	33.6	Very low	133 Å²	133	132 Å²	132	71%	0.711	72%	0.722	S	S	*	*			cis	-158.7	159.6	20.7	-120.8	-50	0	0	0	112.5
24	K	28.4	Very low	34.3	Very low	204 Å²	204	129.9 Å²	129.9	89%	0.887	70%	0.695	S	S	*	*			trans	161.7	117.2	139.4	-92.2	161.8	-175.9	173.3	0	114.4
25	C	34.3	Very low	34.8	Very low	121 Å²	121	129.2 Å²	129.2	82%	0.818	68%	0.678	S	S	*	*			trans	-82.6	137.7	160.7	-62.1	0	0	0	0	111.4
26	L	38.8	Very low	35.6	Very low	170 Å²	170	126 Å²	126	89%	0.89	67%	0.67	S	S	*	*			trans	174.6	87.3	150.8	-102.1	164.8	0	0	0	110.2
27	L	35.2	Very low	36.4	Very low	156 Å²	156	124 Å²	124	82%	0.817	67%	0.667	S	S	*	*			trans	-166.6	-1	174.6	-115.1	162.3	0	0	0	116.8	P30	L27-P30 VanDerWaalsContact O-CD 3.31Å; L27-P30 WeakPolarHBondContact O-CD 3.22Å
28	L	40.7	Very low	37	Very low	131 Å²	131	121.9 Å²	121.9	69%	0.686	66%	0.656	S	S	*	*			trans	-89.7	-4.2	-157.8	-107.1	161.4	0	0	0	117.3	M31	L28-M31 HydrophobicContact CD2-CE 3.48Å; L28-M31 VanDerWaalsContact CD2-CE 3.48Å
29	T	42.3	Very low	37.7	Very low	125 Å²	125	121.3 Å²	121.3	77%	0.767	66%	0.658	S	S	*	*	S	Bend	trans	-72.8	-31.6	-176.6	0.4	0	0	0	0	116.9
30	P	38.4	Very low	38.3	Very low	89 Å²	89	121.8 Å²	121.8	58%	0.578	66%	0.657	S	S	*	*	S	Bend	trans	-70.4	-35.4	-174.4	-23.3	34.9	0	0	0	115.6	L27 I32 N33	L27-P30 VanDerWaalsContact O-CD 3.31Å; L27-P30 WeakPolarHBondContact O-CD 3.22Å; P30-I32 VanDerWaalsContact C-N 3.29Å; P30-I32 PolarHBondContact O-N 3.49Å; P30-N33 PolarHBondContact O-N 2.98Å
31	M	38	Very low	39	Very low	111 Å²	111	119.1 Å²	119.1	55%	0.547	65%	0.646	S	S	.	*	H	α-helix	trans	-63.1	-30.4	-166.4	-72.4	-162.5	-70.2	0	0	114.4	L28 N33 S34 C35	L28-M31 HydrophobicContact CD2-CE 3.48Å; L28-M31 VanDerWaalsContact CD2-CE 3.48Å; M31-N33 VanDerWaalsContact C-N 3.31Å; M31-N33 PolarHBondContact O-N 3.45Å; M31-S34 PolarHBondContact O-N 2.64Å; M31-C35 PolarHBondContact O-N 3Å; M31-C35 PolarHBondContact O-SG 2.85Å
32	I	45.2	Very low	39.3	Very low	124 Å²	124	115.1 Å²	115.1	64%	0.636	63%	0.625	S	S	*	*	H	α-helix	trans	-64.7	-35.1	-172.3	-61.4	177	0	0	0	111.7	P30	P30-I32 VanDerWaalsContact C-N 3.29Å; P30-I32 PolarHBondContact O-N 3.49Å
33	N	41.3	Very low	39.6	Very low	127 Å²	127	118 Å²	118	68%	0.679	63%	0.626	S	S	*	*	H	α-helix	trans	-79.4	-34.4	-178.3	-74.3	-14.4	0	0	0	112.9	P30 M31 K36	P30-N33 PolarHBondContact O-N 2.98Å; M31-N33 VanDerWaalsContact C-N 3.31Å; M31-N33 PolarHBondContact O-N 3.45Å; N33-K36 PolarHBondContact O-N 3.39Å
34	S	40.7	Very low	40	Very low	39 Å²	39	116.5 Å²	116.5	27%	0.273	62%	0.621	S	S	.	*	H	α-helix	trans	-67.3	-45.6	175.4	-180	0	0	0	0	111.6	M31 K36 L37 H38	M31-S34 PolarHBondContact O-N 2.64Å; S34-K36 PolarHBondContact O-N 3.33Å; S34-K36 VanDerWaalsContact O-N 3.11Å; S34-L37 PolarHBondContact O-N 2.86Å; S34-H38 PolarHBondContact O-N 3.12Å
35	C	38.4	Very low	40.6	Very low	59 Å²	59	111.9 Å²	111.9	40%	0.399	61%	0.606	S	S	.	*	H	α-helix	trans	-55.6	-34.2	177.2	-65.9	0	0	0	0	112.9	M31 L37 L39	M31-C35 PolarHBondContact O-N 3Å; M31-C35 PolarHBondContact O-SG 2.85Å; C35-L37 VanDerWaalsContact C-N 3.33Å; C35-L37 PolarHBondContact O-N 3.22Å; C35-L39 WeakPolarHBondContact O-CB 3.25Å; C35-L39 PolarHBondContact O-N 3.02Å
36	K	41.6	Very low	41	Very low	164 Å²	164	111 Å²	111	71%	0.713	60%	0.596	S	S	*	*	H	α-helix	trans	-72.2	-25.2	-179.7	-151.9	174.9	-173.2	-179.3	0	113.2	N33 S34	N33-K36 PolarHBondContact O-N 3.39Å; S34-K36 PolarHBondContact O-N 3.33Å; S34-K36 VanDerWaalsContact O-N 3.11Å
37	L	44.7	Very low	41	Very low	127 Å²	127	106.2 Å²	106.2	67%	0.665	58%	0.582	S	S	*	*	H	α-helix	trans	-80.8	-48.4	176.4	-158.2	74.3	0	0	0	111.1	S34 C35 L39 M40 T41	S34-L37 PolarHBondContact O-N 2.86Å; C35-L37 VanDerWaalsContact C-N 3.33Å; C35-L37 PolarHBondContact O-N 3.22Å; L37-L39 VanDerWaalsContact C-N 3.26Å; L37-L39 PolarHBondContact O-N 2.77Å; L37-M40 WeakPolarHBondContact O-CB 3.39Å; L37-M40 PolarHBondContact O-N 2.87Å; L37-M40 VanDerWaalsContact O-N 3.08Å; L37-T41 PolarHBondContact O-N 3.4Å
38	H	41.8	Very low	41.1	Very low	74 Å²	74	101.1 Å²	101.1	34%	0.343	57%	0.566	S	S	.	*	H	α-helix	trans	-64.3	-28.3	178.9	-76.2	-107.2	0	0	0	113	S34 M40 T41 A42 D773	S34-H38 PolarHBondContact O-N 3.12Å; H38-M40 VanDerWaalsContact C-N 3.28Å; H38-M40 PolarHBondContact O-N 3.06Å; H38-T41 WeakPolarHBondContact CA-OG1 3.22Å; H38-T41 PolarHBondContact O-N 2.81Å; H38-T41 PolarHBondContact O-OG1 2.71Å; H38-T41 VanDerWaalsContact O-OG1 3.13Å; H38-A42 WeakPolarHBondContact O-CB 3.17Å; H38-A42 PolarHBondContact O-N 2.72Å; H38-D773 IonicContact CE1-OD2 3.52Å
39	L	43.1	Very low	41	Very low	125 Å²	125	102.7 Å²	102.7	65%	0.654	57%	0.568	S	S	*	*	H	α-helix	trans	-71.1	-21.3	175.5	-156.1	73.3	0	0	0	113.3	C35 L37	C35-L39 WeakPolarHBondContact O-CB 3.25Å; C35-L39 PolarHBondContact O-N 3.02Å; L37-L39 VanDerWaalsContact C-N 3.26Å; L37-L39 PolarHBondContact O-N 2.77Å
40	M	42.5	Very low	40.6	Very low	135 Å²	135	103.9 Å²	103.9	67%	0.665	57%	0.569	S	S	*	*	H	α-helix	trans	-78.5	-44.9	172.3	-75	-67.8	-158.2	0	0	111.6	L37 H38 A42 K43	L37-M40 WeakPolarHBondContact O-CB 3.39Å; L37-M40 PolarHBondContact O-N 2.87Å; L37-M40 VanDerWaalsContact O-N 3.08Å; H38-M40 VanDerWaalsContact C-N 3.28Å; H38-M40 PolarHBondContact O-N 3.06Å; M40-A42 VanDerWaalsContact C-N 3.34Å; M40-A42 PolarHBondContact O-N 2.89Å; M40-K43 PolarHBondContact O-N 3.41Å
41	T	42.4	Very low	40.5	Very low	74 Å²	74	107.4 Å²	107.4	45%	0.454	58%	0.577	S	S	.	*	H	α-helix	trans	-69	-30.1	177.7	46.8	0	0	0	0	112.8	L37 H38 K43 T44 L45	L37-T41 PolarHBondContact O-N 3.4Å; H38-T41 WeakPolarHBondContact CA-OG1 3.22Å; H38-T41 PolarHBondContact O-N 2.81Å; H38-T41 PolarHBondContact O-OG1 2.71Å; H38-T41 VanDerWaalsContact O-OG1 3.13Å; T41-K43 VanDerWaalsContact C-N 3.28Å; T41-K43 PolarHBondContact O-N 3.21Å; T41-T44 PolarHBondContact O-N 2.72Å; T41-T44 PolarHBondContact O-OG1 3.39Å; T41-L45 PolarHBondContact O-N 2.75Å; T41-L45 VanDerWaalsContact O-N 3.11Å
42	A	40	Very low	40.3	Very low	33 Å²	33	107 Å²	107	27%	0.273	58%	0.581	S	S	.	*	H	α-helix	trans	-59.7	-37.2	170.6	0	0	0	0	0	112.6	H38 M40 V46	H38-A42 WeakPolarHBondContact O-CB 3.17Å; H38-A42 PolarHBondContact O-N 2.72Å; M40-A42 VanDerWaalsContact C-N 3.34Å; M40-A42 PolarHBondContact O-N 2.89Å; A42-V46 WeakPolarHBondContact O-CG2 3.49Å; A42-V46 PolarHBondContact O-N 2.98Å
43	K	40.9	Very low	39.5	Very low	158 Å²	158	110.2 Å²	110.2	69%	0.687	60%	0.596	S	S	*	*	H	α-helix	trans	-68.2	-34.6	178.9	-77.3	-173.7	174	-174.4	0	113.4	M40 T41	M40-K43 PolarHBondContact O-N 3.41Å; T41-K43 VanDerWaalsContact C-N 3.28Å; T41-K43 PolarHBondContact O-N 3.21Å
44	T	40.8	Very low	38.9	Very low	101 Å²	101	108.3 Å²	108.3	62%	0.62	59%	0.593	S	S	*	*	H	α-helix	trans	-77.6	-36.8	177.2	51.3	0	0	0	0	112.2	T41 V46 A47 G48	T41-T44 PolarHBondContact O-N 2.72Å; T41-T44 PolarHBondContact O-OG1 3.39Å; T44-V46 PolarHBondContact O-N 3.37Å; T44-A47 PolarHBondContact O-N 2.85Å; T44-G48 PolarHBondContact O-N 3.27Å
45	L	41.8	Very low	38.2	Very low	107 Å²	107	113 Å²	113	56%	0.56	62%	0.615	S	S	*	*	H	α-helix	trans	-64.7	-36.3	176.2	-97	154	0	0	0	113.7	T41 A47 G48 K49	T41-L45 PolarHBondContact O-N 2.75Å; T41-L45 VanDerWaalsContact O-N 3.11Å; L45-A47 VanDerWaalsContact C-N 3.34Å; L45-G48 PolarHBondContact O-N 2.93Å; L45-K49 PolarHBondContact O-N 3.13Å
46	V	41.8	Very low	37.6	Very low	101 Å²	101	115 Å²	115	61%	0.612	63%	0.63	S	S	*	*	H	α-helix	trans	-68.8	-32.1	176.6	170.3	0	0	0	0	112.2	A42 T44	A42-V46 WeakPolarHBondContact O-CG2 3.49Å; A42-V46 PolarHBondContact O-N 2.98Å; T44-V46 PolarHBondContact O-N 3.37Å
47	A	39.6	Very low	37	Very low	71 Å²	71	115.4 Å²	115.4	59%	0.587	63%	0.634	S	S	*	*	H	α-helix	trans	-70	-42.7	174	0	0	0	0	0	112.1	T44 L45 K49	T44-A47 PolarHBondContact O-N 2.85Å; L45-A47 VanDerWaalsContact C-N 3.34Å; A47-K49 PolarHBondContact O-N 3.27Å
48	G	37.2	Very low	36.1	Very low	48 Å²	48	114.9 Å²	114.9	50%	0.495	63%	0.632	S	S	.	*	H	α-helix	trans	-68	-29.9	-175.8	0	0	0	0	0	115.2	T44 L45	T44-G48 PolarHBondContact O-N 3.27Å; L45-G48 PolarHBondContact O-N 2.93Å
49	K	38.5	Very low	35.3	Very low	164 Å²	164	119.6 Å²	119.6	71%	0.713	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-2.2	-174.5	-83.2	-172.1	172.2	-177.1	0	116.1	L45 A47	L45-K49 PolarHBondContact O-N 3.13Å; A47-K49 PolarHBondContact O-N 3.27Å
50	L	34.3	Very low	34.4	Very low	151 Å²	151	119.2 Å²	119.2	79%	0.791	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-9.1	171.9	-100.7	91.6	0	0	0	114
51	Q	36.3	Very low	33.7	Very low	162 Å²	162	120.4 Å²	120.4	76%	0.757	65%	0.652	S	S	*	*	S	Bend	trans	-97.9	-6.1	-171.8	-148.4	74.7	41.6	0	0	114.4
52	T	34.1	Very low	32.9	Very low	103 Å²	103	123.6 Å²	123.6	63%	0.632	66%	0.661	S	S	*	*	S	Bend	trans	-139	46.1	-165.7	66.8	0	0	0	0	114.4
53	M	28.1	Very low	32.3	Very low	191 Å²	191	127.3 Å²	127.3	94%	0.941	68%	0.68	S	S	*	*			trans	-144.2	53.8	158.1	-80.4	-157.6	160	0	0	111.4
54	S	27.6	Very low	31.6	Very low	88 Å²	88	126.4 Å²	126.4	62%	0.615	68%	0.683	S	S	*	*			trans	-81.9	163.7	139.7	57.4	0	0	0	0	109.3
55	D	26.7	Very low	31	Very low	138 Å²	138	128.7 Å²	128.7	74%	0.738	69%	0.69	S	S	*	*			trans	80.8	112.4	159.5	-45.5	-46	0	0	0	120.2
56	S	26.9	Very low	30.2	Very low	101 Å²	101	128.9 Å²	128.9	71%	0.706	70%	0.701	S	S	*	*			trans	65	102.9	143.2	54	0	0	0	0	122.5
57	Q	27.4	Very low	29.6	Very low	172 Å²	172	127.9 Å²	127.9	80%	0.804	70%	0.703	S	S	*	*				58.4	124.8	109	-72.2	-172.9	-93.2	0	0	123.4
58	D	27.3	Very low	29	Very low	116 Å²	116	129.7 Å²	129.7	62%	0.62	71%	0.707	S	S	*	*				80.2	126.9	124.3	-69	-41.2	0	0	0	125.4
59	F	24.2	Very low	28.6	Very low	173 Å²	173	135.4 Å²	135.4	76%	0.759	72%	0.721	S	S	*	*			trans	66.2	101.7	142	-84.6	-94.7	0	0	0	123.7
60	N	24.5	Very low	27.9	Very low	116 Å²	116	134 Å²	134	62%	0.62	73%	0.726	S	S	*	*				82.9	130.6	119.9	-114.1	-7	0	0	0	122.8
61	K	27.1	Very low	27.5	Very low	161 Å²	161	130.8 Å²	130.8	70%	0.7	73%	0.729	S	S	*	*			trans	65.5	156	146	-68.4	171.7	166.5	-172.2	0	117.9
62	Q	26.3	Very low	26.9	Very low	141 Å²	141	126.5 Å²	126.5	66%	0.659	73%	0.728	S	S	*	*			cis	-152.3	169.2	-19.6	-116	167.6	-74.1	0	0	105.5
63	T	26	Very low	26.3	Very low	110 Å²	110	129.1 Å²	129.1	68%	0.675	74%	0.738	S	S	*	*				170.3	144.9	78.4	38.4	0	0	0	0	111.4
64	N	26.3	Very low	26.1	Very low	139 Å²	139	125.6 Å²	125.6	74%	0.743	73%	0.731	S	S	*	*			trans	64.5	167.3	140.1	-54.3	-7.8	0	0	0	117.5
65	I	28.6	Very low	25.7	Very low	149 Å²	149	129 Å²	129	76%	0.764	74%	0.742	S	S	*	*			cis	-136.6	121.5	22.3	-73.2	173	0	0	0	111.8
66	S	26.3	Very low	26.1	Very low	112 Å²	112	128.3 Å²	128.3	78%	0.783	75%	0.746	S	S	*	*			trans	44.3	170.4	133.4	89.3	0	0	0	0	121.8
67	A	28.6	Very low	25.8	Very low	79 Å²	79	131.9 Å²	131.9	65%	0.653	75%	0.751	S	S	*	*			cis	-146.1	-175.7	-0.8	0	0	0	0	0	108.6
68	T	27	Very low	25.5	Very low	109 Å²	109	129.2 Å²	129.2	67%	0.669	75%	0.751	S	S	*	*			cis	-145.6	135.3	14	13.8	0	0	0	0	108.8
69	Q	28.1	Very low	25.2	Very low	169 Å²	169	131.9 Å²	131.9	79%	0.79	76%	0.76	S	S	*	*				59.2	135.1	100.1	-61.5	177.4	-24	0	0	115.6
70	T	25.1	Very low	25.1	Very low	134 Å²	134	130 Å²	130	82%	0.822	76%	0.757	S	S	*	*			cis	-161	144	-6	14.5	0	0	0	0	105.9
71	G	24.4	Very low	25.1	Very low	83 Å²	83	132.4 Å²	132.4	86%	0.856	76%	0.764	S	S	*	*				90.6	134.9	64.8	0	0	0	0	0	110
72	G	24.1	Very low	24.9	Very low	72 Å²	72	128.7 Å²	128.7	74%	0.742	76%	0.759	S	S	*	*			cis	-135	-142.9	-11.2	0	0	0	0	0	108.6
73	D	22.7	Very low	25	Very low	158 Å²	158	128.6 Å²	128.6	85%	0.845	76%	0.763	S	S	*	*			cis	-170.6	171.5	-12.7	-128.1	-41.9	0	0	0	108.5
74	C	22.4	Very low	24.9	Very low	118 Å²	118	130 Å²	130	80%	0.797	77%	0.766	S	S	*	*			trans	72.1	138.2	165.3	-63.8	0	0	0	0	122.6
75	N	20.2	Very low	24.8	Very low	158 Å²	158	129.4 Å²	129.4	85%	0.845	76%	0.763	S	S	*	*			trans	-75.1	-179.4	156.7	-74.9	-16.3	0	0	0	110.6
76	P	33.9	Very low	24.7	Very low	124 Å²	124	126.9 Å²	126.9	81%	0.805	76%	0.755	S	S	*	*			cis	-139.5	-129.6	14.7	44.3	-21.9	0	0	0	115.1
77	E	20.6	Very low	24.5	Very low	177 Å²	177	132.3 Å²	132.3	83%	0.827	76%	0.758	S	S	*	*			trans	-80.8	-166.8	-168.2	-53.4	169.8	113.2	0	0	115.4
78	S	21.1	Very low	24.2	Very low	115 Å²	115	135.4 Å²	135.4	80%	0.804	77%	0.768	S	S	*	*			trans	77.2	124.5	-177.4	69.2	0	0	0	0	114.8
79	E	20.8	Very low	24.1	Very low	173 Å²	173	134.1 Å²	134.1	81%	0.808	77%	0.769	S	S	*	*			cis	92.7	148.6	40.3	-165	-178.2	-106.8	0	0	112.4
80	L	22.7	Very low	23.8	Very low	132 Å²	132	131 Å²	131	69%	0.691	77%	0.766	S	S	*	*			trans	73.4	142.1	-176.6	-45.8	179.4	0	0	0	112.4
81	H	24.6	Very low	23.7	Very low	167 Å²	167	131.1 Å²	131.1	77%	0.773	76%	0.761	S	S	*	*			cis	-154.2	166.8	7.9	-105.1	-16.1	0	0	0	107.3
82	S	23.8	Very low	23.7	Very low	83 Å²	83	133.6 Å²	133.6	58%	0.58	76%	0.755	S	S	*	*			cis	-167.7	179.4	2.4	47.8	0	0	0	0	110.4
83	N	26.8	Very low	23.6	Very low	139 Å²	139	135.4 Å²	135.4	74%	0.743	76%	0.756	S	S	*	*			trans	72.9	94.1	155.7	-60.2	-21.9	0	0	0	120.5
84	N	23.9	Very low	23.6	Very low	139 Å²	139	131.7 Å²	131.7	74%	0.743	75%	0.747	S	S	*	*				28.5	144	95.3	-60.5	-7.3	0	0	0	117.9
85	N	25.2	Very low	23.7	Very low	128 Å²	128	134.7 Å²	134.7	68%	0.684	75%	0.75	S	S	*	*			cis	-161.6	152.6	22.3	-137.1	1.1	0	0	0	116.2
86	T	25.6	Very low	23.8	Very low	96 Å²	96	137 Å²	137	59%	0.589	75%	0.747	S	S	*	*			trans	43.8	122.7	147.4	49	0	0	0	0	124.4
87	R	23.1	Very low	23.2	Very low	226 Å²	226	137.8 Å²	137.8	85%	0.853	74%	0.743	S	S	*	*				64	124.5	126.1	-64.5	178.6	174.7	179.1	-2.5	119.5
88	V	23.1	Very low	23.4	Very low	143 Å²	143	135.1 Å²	135.1	87%	0.867	74%	0.739	S	S	*	*				86.5	136.1	51.5	170.4	0	0	0	0	113.8
89	A	23.6	Very low	23.4	Very low	83 Å²	83	140.1 Å²	140.1	69%	0.686	74%	0.74	S	S	*	*			trans	101.4	96.4	165.3	0	0	0	0	0	119.7
90	S	22.7	Very low	23.6	Very low	103 Å²	103	140.2 Å²	140.2	72%	0.72	75%	0.746	S	S	*	*				53.9	134.9	122.9	63	0	0	0	0	124.6
91	D	22.2	Very low	23.6	Very low	136 Å²	136	139.3 Å²	139.3	73%	0.727	75%	0.75	S	S	*	*			trans	93	128.4	132.2	-84.4	33.4	0	0	0	124.1
92	N	23.8	Very low	23.6	Very low	135 Å²	135	135 Å²	135	72%	0.722	75%	0.75	S	S	*	*			trans	58.2	124.6	145	-66.9	-45.9	0	0	0	119.6
93	S	22.9	Very low	23.6	Very low	110 Å²	110	136 Å²	136	77%	0.769	76%	0.764	S	S	*	*			cis	167.9	-178	26.6	52.1	0	0	0	0	110.5
94	A	23.3	Very low	23.4	Very low	80 Å²	80	133.9 Å²	133.9	66%	0.661	77%	0.766	S	S	*	*			trans	80.7	101.9	151.6	0	0	0	0	0	122.7
95	Q	23.7	Very low	23.9	Very low	182 Å²	182	132.8 Å²	132.8	85%	0.85	77%	0.766	S	S	*	*			trans	66.3	155.6	136.5	-48.8	-178.2	15.5	0	0	117.9
96	R	22.1	Very low	23.8	Very low	205 Å²	205	132.4 Å²	132.4	77%	0.774	77%	0.768	S	S	*	*			cis	-170.4	128.5	34.7	-171.6	177.6	-169.6	-162.7	4.8	114.1
97	L	22.1	Very low	23.8	Very low	141 Å²	141	132.3 Å²	132.3	74%	0.738	77%	0.771	S	S	*	*			trans	60.6	163.1	162.6	-88.5	77.3	0	0	0	116.8
98	V	24.6	Very low	23.9	Very low	122 Å²	122	129.8 Å²	129.8	74%	0.739	77%	0.769	S	S	*	*			cis	-135	140.6	26.2	172.4	0	0	0	0	113.7
99	R	21.8	Very low	24	Very low	220 Å²	220	128.7 Å²	128.7	83%	0.83	77%	0.766	S	S	*	*			trans	3.1	137.6	155.7	-54	169.6	178.7	159.3	-2.4	120.5
100	L	25	Very low	24.2	Very low	175 Å²	175	130.6 Å²	130.6	92%	0.916	77%	0.772	S	S	*	*				-139.3	167.3	114.2	-112.2	172.1	0	0	0	109.9
101	S	22.6	Very low	24.3	Very low	113 Å²	113	132.1 Å²	132.1	79%	0.79	77%	0.772	S	S	*	*			trans	-145	144.5	-161.9	55.8	0	0	0	0	113.6
102	G	23.2	Very low	24.4	Very low	75 Å²	75	133.7 Å²	133.7	77%	0.773	78%	0.775	S	S	*	*			trans	160.6	122.9	160.8	0	0	0	0	0	116.8
103	A	24.3	Very low	24.4	Very low	105 Å²	105	131.5 Å²	131.5	87%	0.868	78%	0.775	S	S	*	*			trans	44.8	109	150.7	0	0	0	0	0	121
104	A	23.7	Very low	24.4	Very low	94 Å²	94	138.3 Å²	138.3	78%	0.777	78%	0.784	S	S	*	*			trans	-87.9	173.6	133.2	0	0	0	0	0	108.6
105	P	32.7	Very low	24.3	Very low	116 Å²	116	138.2 Å²	138.2	75%	0.753	79%	0.791	S	S	*	*				-155.4	-174.3	71.1	45.3	-25.4	0	0	0	116.4
106	V	23.7	Very low	24.3	Very low	120 Å²	120	140.5 Å²	140.5	73%	0.727	79%	0.792	S	S	*	*			trans	50.7	91.6	162	-170.9	0	0	0	0	116.4
107	S	25.7	Very low	24.3	Very low	94 Å²	94	138.3 Å²	138.3	66%	0.657	80%	0.795	S	S	*	*				65.6	119.1	68.3	83.6	0	0	0	0	116.9
108	H	24.3	Very low	24.3	Very low	173 Å²	173	137 Å²	137	80%	0.801	80%	0.797	S	S	*	*			trans	-169	133.3	130.4	-108.1	-65.7	0	0	0	112.8
109	C	25.3	Very low	24.1	Very low	120 Å²	120	143 Å²	143	81%	0.811	81%	0.806	S	S	*	*			trans	-108.4	138.7	147	-71.2	0	0	0	0	107.2
110	P	28	Very low	24.1	Very low	123 Å²	123	139.8 Å²	139.8	80%	0.799	80%	0.803	S	S	*	*			trans	-104.3	151.4	175.5	36.1	-30.8	0	0	0	113.8
111	N	24.6	Very low	24.3	Very low	135 Å²	135	137 Å²	137	72%	0.722	80%	0.795	S	S	*	*			trans	-83.6	164.8	-175.9	-96.7	20.4	0	0	0	114.9
112	E	24.3	Very low	24.4	Very low	170 Å²	170	139.2 Å²	139.2	79%	0.794	79%	0.793	S	S	*	*			trans	43.9	141.7	137.4	-58.7	170	98.6	0	0	122.7
113	A	24.4	Very low	24.3	Very low	88 Å²	88	141 Å²	141	73%	0.727	79%	0.794	S	S	*	*				146.2	126.5	106.3	0	0	0	0	0	117.5
114	R	23.4	Very low	24.3	Very low	254 Å²	254	140.8 Å²	140.8	96%	0.958	79%	0.792	S	S	*	*			trans	57.6	127	137.9	-65.5	175.9	168.3	174.2	-2.9	122.2
115	G	21.4	Very low	24.2	Very low	78 Å²	78	142.5 Å²	142.5	80%	0.804	78%	0.784	S	S	*	*			trans	-156.6	49.7	174.7	0	0	0	0	0	118.5
116	R	22.5	Very low	23.9	Very low	230 Å²	230	144.1 Å²	144.1	87%	0.868	78%	0.784	S	S	*	*			trans	26.5	122.2	157.4	-67.7	-175.6	175.5	-157.8	-0.3	123.2
117	L	23	Very low	23.9	Very low	159 Å²	159	144.2 Å²	144.2	83%	0.832	79%	0.786	S	S	*	*				61.4	120.2	128.7	-66.3	164.3	0	0	0	122.4
118	S	21.5	Very low	23.7	Very low	114 Å²	114	146 Å²	146	80%	0.797	80%	0.796	S	S	*	*				-160.4	140.7	117.6	69.8	0	0	0	0	115.2
119	R	20.5	Very low	23.7	Very low	246 Å²	246	146.3 Å²	146.3	93%	0.928	80%	0.798	S	S	*	*			trans	49.6	130.3	154	-67.6	-178.5	173.9	168.8	-1.3	124.4
120	M	21.6	Very low	23.8	Very low	153 Å²	153	149 Å²	149	75%	0.754	80%	0.798	S	S	*	*			trans	-57.6	168.1	158.1	-83.5	-76.6	179.9	0	0	113.6
121	P	29.8	Very low	23.6	Very low	117 Å²	117	152 Å²	152	76%	0.76	80%	0.804	S	S	*	*			cis	-143.6	-178.8	36.4	43.1	-22.9	0	0	0	120.1
122	H	23.9	Very low	23.5	Very low	159 Å²	159	150.2 Å²	150.2	74%	0.736	80%	0.801	S	S	*	*			trans	-52	142.2	-174.2	-44.3	-82.6	0	0	0	119.1
123	S	21.9	Very low	23.6	Very low	113 Å²	113	150.5 Å²	150.5	79%	0.79	81%	0.807	S	S	*	*				-170.9	100.9	108	56.6	0	0	0	0	109.4
124	A	24.4	Very low	23.6	Very low	100 Å²	100	155 Å²	155	83%	0.826	81%	0.81	S	S	*	*				85.1	78.3	81.2	0	0	0	0	0	113.6
125	E	22.1	Very low	23.6	Very low	131 Å²	131	150.9 Å²	150.9	61%	0.612	80%	0.801	S	S	*	*			trans	-137.4	158	166.5	-86.8	-177.1	134.8	0	0	111.1	R376	E125-R376 VanDerWaalsContact CD-CZ 3.46Å; E125-R376 IonicContact OE1-CZ 2.66Å; E125-R376 IonicContact OE1-NE 3.29Å; E125-R376 IonicContact OE1-NH1 3.84Å; E125-R376 PolarHBondContact OE1-NH1 3.45Å; E125-R376 WeakPolarHBondContact OE2-CD 3.49Å; E125-R376 IonicContact OE2-CZ 3.34Å; E125-R376 IonicContact OE2-NE 3.5Å; E125-R376 PolarHBondContact OE2-NE 3.22Å; E125-R376 VanDerWaalsContact OE2-NE 3.16Å; E125-R376 IonicContact OE2-NH1 2.7Å
126	I	26.2	Very low	23.7	Very low	149 Å²	149	155.6 Å²	155.6	76%	0.764	81%	0.807	S	S	*	*			trans	-97.2	133.3	-162.1	-60.3	168.9	0	0	0	111.6
127	T	22.5	Very low	23.8	Very low	123 Å²	123	153.5 Å²	153.5	76%	0.755	80%	0.804	S	S	*	*			trans	-133.4	136.2	163.5	7.6	0	0	0	0	109.2	H129	T127-H129 PolarHBondContact O-N 2.91Å
128	C	22.7	Very low	23.9	Very low	131 Å²	131	152 Å²	152	89%	0.885	80%	0.804	S	S	*	*			trans	-69	116	-173.7	-68.9	0	0	0	0	111.6
129	H	24.3	Very low	24.1	Very low	180 Å²	180	153.6 Å²	153.6	83%	0.833	81%	0.809	S	S	*	*			trans	-76.2	139.1	-173.9	-108.3	-81	0	0	0	113.6	T127 M131	T127-H129 PolarHBondContact O-N 2.91Å; H129-M131 PolarHBondContact O-N 2.89Å; H129-M131 VanDerWaalsContact O-N 3.09Å
130	H	27.1	Very low	24.3	Very low	175 Å²	175	144.9 Å²	144.9	81%	0.81	80%	0.796	S	S	*	*			trans	-56	104.7	160.9	-166	63.7	0	0	0	110.5	C132	H130-C132 PolarHBondContact O-N 2.84Å; H130-C132 VanDerWaalsContact O-N 3.14Å
131	M	24	Very low	24.4	Very low	187 Å²	187	143 Å²	143	92%	0.921	80%	0.798	S	S	*	*			trans	-80	85.6	176.9	-88.2	-83.4	-156.6	0	0	110.9	H129 L133	H129-M131 PolarHBondContact O-N 2.89Å; H129-M131 VanDerWaalsContact O-N 3.09Å; M131-L133 PolarHBondContact O-N 3.45Å
132	C	22.6	Very low	24.2	Very low	98 Å²	98	145.6 Å²	145.6	66%	0.662	80%	0.799	S	S	*	*			trans	-83	110.5	171.6	-171.1	0	0	0	0	110.4	H130 K134	H130-C132 PolarHBondContact O-N 2.84Å; H130-C132 VanDerWaalsContact O-N 3.14Å; C132-K134 PolarHBondContact O-N 3.07Å
133	L	25.2	Very low	24.3	Very low	176 Å²	176	141.8 Å²	141.8	92%	0.921	80%	0.803	S	S	*	*			trans	-66.9	122.4	174.4	-91	165.6	0	0	0	110.6	M131	M131-L133 PolarHBondContact O-N 3.45Å
134	K	25.5	Very low	24.5	Very low	181 Å²	181	144.1 Å²	144.1	79%	0.787	80%	0.799	S	S	*	*			trans	-88	133.1	-175.2	-73.8	-178.6	176.8	176.3	0	113	C132	C132-K134 PolarHBondContact O-N 3.07Å
135	H	23.1	Very low	24.5	Very low	168 Å²	168	147.4 Å²	147.4	78%	0.778	80%	0.803	S	S	*	*			trans	48	107.3	151.5	-62.7	-49.1	0	0	0	119.5
136	L	23.7	Very low	24.7	Very low	177 Å²	177	150.9 Å²	150.9	93%	0.927	81%	0.812	S	S	*	*				-111.7	150.7	121.6	-79.9	167.5	0	0	0	108.8
137	K	24.8	Very low	24.5	Very low	187 Å²	187	149.1 Å²	149.1	81%	0.813	81%	0.813	S	S	*	*			trans	-85.1	151.7	178.6	-79.4	-176.1	176.8	179.7	0	110.7	V139	K137-V139 PolarHBondContact O-N 2.84Å
138	P	25.3	Very low	25.1	Very low	127 Å²	127	148.1 Å²	148.1	83%	0.825	82%	0.817	S	S	*	*			trans	-69.4	127.8	171.9	29.6	-33.9	0	0	0	110.7
139	V	25.1	Very low	25.3	Very low	148 Å²	148	147 Å²	147	90%	0.897	81%	0.811	S	S	*	*			trans	-101.2	114.5	153.7	178.8	0	0	0	0	105.4	K137	K137-V139 PolarHBondContact O-N 2.84Å
140	G	24.3	Very low	25.6	Very low	63 Å²	63	144.4 Å²	144.4	65%	0.649	81%	0.813	S	S	*	*			trans	-87.3	156.6	-171.9	0	0	0	0	0	113.3
141	S	24.5	Very low	25.9	Very low	114 Å²	114	138.5 Å²	138.5	80%	0.797	80%	0.799	S	S	*	*			trans	-158.1	131.8	144.3	-85.9	0	0	0	0	111.2
142	Q	26.2	Very low	26.6	Very low	170 Å²	170	136.2 Å²	136.2	79%	0.794	79%	0.785	S	S	*	*			trans	45.4	104.9	152.8	-55.5	-176.3	8.1	0	0	117.5
143	G	25.7	Very low	27.1	Very low	79 Å²	79	136.2 Å²	136.2	81%	0.814	78%	0.781	S	S	*	*			trans	-78.9	152.7	165.6	0	0	0	0	0	112.1
144	F	25.6	Very low	27.7	Very low	163 Å²	163	129.9 Å²	129.9	72%	0.715	75%	0.751	S	S	*	*			trans	-117.4	123.3	162.3	-81.6	-90.9	0	0	0	108.8	Y146	F144-Y146 HydrophobicContact CB-CD2 4.16Å; F144-Y146 HydrophobicContact CB-CE2 4.11Å; F144-Y146 PolarHBondContact O-N 2.78Å
145	N	23.9	Very low	28.3	Very low	168 Å²	168	125 Å²	125	90%	0.898	74%	0.74	S	S	*	*			trans	-71.4	124.6	167.5	-72.2	-22.8	0	0	0	108.6
146	Y	26.7	Very low	29.2	Very low	204 Å²	204	125.2 Å²	125.2	80%	0.8	74%	0.741	S	S	*	*			trans	-125	121.3	163.4	-89.3	-83.3	0	0	0	110.2	F144	F144-Y146 HydrophobicContact CB-CD2 4.16Å; F144-Y146 HydrophobicContact CB-CE2 4.11Å; F144-Y146 PolarHBondContact O-N 2.78Å
147	S	22.7	Very low	30.2	Very low	113 Å²	113	121.9 Å²	121.9	79%	0.79	72%	0.723	S	S	*	*			trans	-70.3	149.4	170.5	48.1	0	0	0	0	110.9	S149	S147-S149 PolarHBondContact O-N 3.06Å
148	A	34.6	Very low	30.9	Very low	101 Å²	101	119.2 Å²	119.2	84%	0.835	72%	0.723	S	S	*	*			trans	-59.1	132.9	-172	0	0	0	0	0	114.6
149	S	27.1	Very low	31.6	Very low	108 Å²	108	117.8 Å²	117.8	76%	0.755	72%	0.716	S	S	*	*			trans	178.5	158.6	138.5	46	0	0	0	0	111.3	S147	S147-S149 PolarHBondContact O-N 3.06Å
150	S	29.7	Very low	32.3	Very low	126 Å²	126	115.8 Å²	115.8	88%	0.881	72%	0.715	S	S	*	*	S	Bend	trans	68	145.3	178.8	74.1	0	0	0	0	116.8
151	G	34.6	Very low	33.2	Very low	51 Å²	51	115.9 Å²	115.9	53%	0.526	71%	0.71	S	S	.	*			trans	-79	159.4	-165.7	0	0	0	0	0	115.4	T153	G151-T153 VanDerWaalsContact C-N 3.33Å; G151-T153 PolarHBondContact O-N 3.14Å
152	F	38.5	Very low	34.4	Very low	139 Å²	139	115.1 Å²	115.1	61%	0.61	70%	0.704	S	S	*	*			trans	-70	80.7	179	-117.9	-84.6	0	0	0	111.7	C154 L173	F152-C154 PolarHBondContact O-N 3.34Å; F152-L173 HydrophobicContact CB-CD2 4.43Å; F152-L173 HydrophobicContact CD2-CD2 3.74Å; F152-L173 HydrophobicContact CE2-CD2 4.28Å; F152-L173 HydrophobicContact CG-CD2 4.23Å
153	T	33.1	Very low	36.1	Very low	97 Å²	97	111.1 Å²	111.1	60%	0.595	68%	0.684	S	S	*	*			trans	-71.8	126	168.4	69.6	0	0	0	0	109.4	G151 S155	G151-T153 VanDerWaalsContact C-N 3.33Å; G151-T153 PolarHBondContact O-N 3.14Å; T153-S155 PolarHBondContact O-N 3.08Å; T153-S155 PolarHBondContact OG1-OG 3.18Å
154	C	38	Very low	38.8	Very low	43 Å²	43	110.3 Å²	110.3	29%	0.291	66%	0.659	S	S	.	*	S	Bend	trans	-78.5	50.3	178.4	-163.2	0	0	0	0	111.4	F152 F181	F152-C154 PolarHBondContact O-N 3.34Å; C154-F181 HydrophobicContact CB-CE2 3.83Å; C154-F181 HydrophobicContact CB-CZ 3.94Å
155	S	37.4	Very low	41.7	Very low	78 Å²	78	111.4 Å²	111.4	55%	0.545	66%	0.659	S	S	.	*			trans	-98.7	-9.3	-172.3	56.9	0	0	0	0	113.9	T153	T153-S155 PolarHBondContact O-N 3.08Å; T153-S155 PolarHBondContact OG1-OG 3.18Å
156	Q	40.9	Very low	44.7	Very low	174 Å²	174	104.8 Å²	104.8	81%	0.813	62%	0.623	S	S	*	*	S	Bend	trans	-114.1	5	-173.9	-64.1	-174.3	-8.6	0	0	114.5	T158	Q156-T158 PolarHBondContact O-N 3.23Å; Q156-T158 VanDerWaalsContact O-N 3.16Å
157	I	45.3	Very low	47.7	Very low	107 Å²	107	99.5 Å²	99.5	55%	0.549	61%	0.608	S	S	.	*			trans	-90.7	54	178	-43.7	-170.8	0	0	0	110.7	S159 F163	I157-S159 PolarHBondContact O-N 3.48Å; I157-F163 HydrophobicContact CG2-CE1 4.05Å
158	T	40.7	Very low	50.9	Low	131 Å²	131	95.6 Å²	95.6	80%	0.804	58%	0.579	S	S	*	*			trans	-98.3	61.2	179.8	32	0	0	0	0	112.2	Q156	Q156-T158 PolarHBondContact O-N 3.23Å; Q156-T158 VanDerWaalsContact O-N 3.16Å
159	S	38.4	Very low	53.6	Low	96 Å²	96	92.8 Å²	92.8	67%	0.671	55%	0.55	S	S	*	.	S	Bend	trans	-155.8	120.8	160.2	-166	0	0	0	0	113.7	I157 A161	I157-S159 PolarHBondContact O-N 3.48Å; S159-A161 PolarHBondContact O-N 2.85Å
160	A	40.7	Very low	56.6	Low	107 Å²	107	95.1 Å²	95.1	88%	0.884	54%	0.542	S	S	*	.			trans	1.4	80.3	158.9	0	0	0	0	0	118.6
161	A	43.3	Very low	59.5	Low	65 Å²	65	95.9 Å²	95.9	54%	0.537	53%	0.525	S	S	.	.			trans	-137.9	144.8	160.9	0	0	0	0	0	109.7	S159 F163	S159-A161 PolarHBondContact O-N 2.85Å; A161-F163 PolarHBondContact O-N 2.86Å
162	S	49.6	Very low	62.1	Low	97 Å²	97	97.8 Å²	97.8	68%	0.678	53%	0.529	S	S	*	.			trans	-65.7	104.6	-177.7	55.5	0	0	0	0	111.1	H164	S162-H164 PolarHBondContact O-N 3.46Å
163	F	62.6	Low	64.5	Low	87 Å²	87	91.9 Å²	91.9	38%	0.382	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	15.1	-169.5	-68.4	-57.3	0	0	0	115.9	I157 A161 R165 M182 L185	I157-F163 HydrophobicContact CG2-CE1 4.05Å; A161-F163 PolarHBondContact O-N 2.86Å; F163-R165 PolarHBondContact O-N 3.15Å; F163-M182 HydrophobicContact CB-CE 3.83Å; F163-M182 HydrophobicContact CD1-CE 3.28Å; F163-M182 HydrophobicContact CD2-CE 4.44Å; F163-M182 HydrophobicContact CE1-CE 3.87Å; F163-M182 HydrophobicContact CG-CE 3.62Å; F163-L185 WeakPolarHBondContact O-CD1 3.18Å
164	H	81.1	Confident	67.3	Low	61 Å²	61	93.8 Å²	93.8	28%	0.282	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-14.7	176.1	-51.7	-46.9	0	0	0	114	S162 E184 Q186 L187	S162-H164 PolarHBondContact O-N 3.46Å; H164-E184 IonicContact CE1-OE2 3.29Å; H164-E184 PolarHBondContact CE1-OE2 2.84Å; H164-E184 PolarHBondContact ND1-O 3.48Å; H164-Q186 HydrophobicContact CB-CB 4.41Å; H164-Q186 HydrophobicContact CB-CG 4.25Å; H164-Q186 CarbonylContact O-C 3.34Å; H164-Q186 WeakPolarHBondContact O-CA 3.43Å; H164-Q186 WeakPolarHBondContact O-CB 3.39Å; H164-Q186 PolarHBondContact O-N 2.89Å; H164-L187 PolarHBondContact O-N 3.47Å
165	R	86.3	Confident	69.6	Low	186 Å²	186	98.5 Å²	98.5	70%	0.702	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.4	132	-179.3	-53.6	-167.6	173.1	161.1	1	111.8	F163 L187	F163-R165 PolarHBondContact O-N 3.15Å; R165-L187 WeakPolarHBondContact CA-O 3.28Å; R165-L187 HydrophobicContact CB-CB 4.27Å; R165-L187 HydrophobicContact CG-CB 3.96Å
166	I	88.6	Confident	72	Confident	30 Å²	30	95.1 Å²	95.1	15%	0.154	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.5	173.3	-66.2	170.3	0	0	0	108.8	L168 V179 M182 L185 L187 L188 N189	I166-L168 HydrophobicContact CG2-CD1 3.96Å; I166-L168 HydrophobicContact CG2-CG 3.92Å; I166-V179 HydrophobicContact CD1-CG1 4.31Å; I166-M182 HydrophobicContact CD1-CE 3.63Å; I166-M182 HydrophobicContact CD1-SD 3.61Å; I166-M182 HydrophobicContact CG1-CE 4.34Å; I166-L185 HydrophobicContact CB-CD1 4.1Å; I166-L185 HydrophobicContact CD1-CD1 3.69Å; I166-L185 HydrophobicContact CD1-CD2 3.71Å; I166-L185 HydrophobicContact CD1-CG 4.36Å; I166-L185 HydrophobicContact CG1-CD1 3.62Å; I166-L185 HydrophobicContact CG1-CD2 4.46Å; I166-L187 PolarHBondContact N-O 3.35Å; I166-L188 HydrophobicContact CB-CD1 3.97Å; I166-L188 HydrophobicContact CG2-CD1 3.86Å; I166-N189 PolarHBondContact O-N 2.81Å
167	D	88.8	Confident	74	Confident	92 Å²	92	87.4 Å²	87.4	49%	0.492	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	120.8	173.4	-159.8	-43.5	0	0	0	111.5	D169 N189	D167-D169 VanDerWaalsContact OD1-CB 3.28Å; D167-D169 WeakPolarHBondContact OD1-CB 3.43Å; D167-D169 PolarHBondContact OD1-N 3.04Å; D167-N189 HydrophobicContact CB-CB 4.31Å; D167-N189 VanDerWaalsContact CG-ND2 3.28Å; D167-N189 PolarHBondContact OD1-ND2 3.24Å; D167-N189 PolarHBondContact OD2-ND2 3.24Å
168	L	89.8	Confident	75.7	Confident	32 Å²	32	87.2 Å²	87.2	17%	0.168	46%	0.462	C	S	.	.			trans	-131.6	36.7	-179.7	-63.6	171.9	0	0	0	110.4	I166 R171 L173 P177 N189 L190 N193	I166-L168 HydrophobicContact CG2-CD1 3.96Å; I166-L168 HydrophobicContact CG2-CG 3.92Å; L168-R171 HydrophobicContact CB-CG 4.2Å; L168-R171 HydrophobicContact CD2-CG 4.5Å; L168-R171 WeakPolarHBondContact O-CG 3.43Å; L168-L173 HydrophobicContact CB-CD1 4.26Å; L168-L173 HydrophobicContact CD1-CD1 4.38Å; L168-P177 HydrophobicContact CD1-CB 4.45Å; L168-P177 HydrophobicContact CD1-CG 4.03Å; L168-N189 PolarHBondContact N-O 2.95Å; L168-L190 HydrophobicContact CB-CD2 3.88Å; L168-L190 HydrophobicContact CD1-CD2 4.01Å; L168-N193 PolarHBondContact O-ND2 3.1Å
169	D	91.4	Very high	77.5	Confident	42 Å²	42	81.2 Å²	81.2	23%	0.225	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	140	169.3	-172.2	7.7	0	0	0	112	D167 R171 Q191 H192	D167-D169 VanDerWaalsContact OD1-CB 3.28Å; D167-D169 WeakPolarHBondContact OD1-CB 3.43Å; D167-D169 PolarHBondContact OD1-N 3.04Å; D169-R171 PolarHBondContact O-N 3.31Å; D169-Q191 WeakPolarHBondContact CA-O 3.49Å; D169-Q191 HydrophobicContact CB-CG 3.96Å; D169-Q191 VanDerWaalsContact CG-CG 3.49Å; D169-Q191 VanDerWaalsContact CG-NE2 3.33Å; D169-Q191 WeakPolarHBondContact OD1-CG 3.47Å; D169-Q191 PolarHBondContact OD2-NE2 3.35Å; D169-H192 IonicContact OD1-CE1 2.77Å; D169-H192 IonicContact OD1-CG 3.34Å; D169-H192 IonicContact OD1-ND1 3.59Å; D169-H192 PolarHBondContact OD1-ND1 3.14Å; D169-H192 IonicContact OD2-ND1 3.81Å
170	R	90.7	Very high	78.9	Confident	157 Å²	157	77.5 Å²	77.5	59%	0.592	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	48.8	175.6	-69.5	168.3	-149.4	-66.6	-3.4	114.4	Q191 H192	R170-Q191 PolarHBondContact N-O 3.36Å; R170-H192 WeakPolarHBondContact CA-O 3.39Å; R170-H192 HydrophobicContact CG-CB 3.68Å; R170-H192 VanDerWaalsContact CZ-CG 3.45Å; R170-H192 PolarHBondContact NH1-CD2 2.91Å; R170-H192 VanDerWaalsContact NH1-CG 3.32Å; R170-H192 PolarHBondContact NH2-CD2 3.03Å; R170-H192 PolarHBondContact NH2-CE1 2.77Å; R170-H192 PolarHBondContact NH2-ND1 3.09Å; R170-H192 VanDerWaalsContact NH2-ND1 3.19Å; R170-H192 PolarHBondContact NH2-NE2 3.34Å
171	R	90.2	Very high	80.4	Confident	142 Å²	142	78.2 Å²	78.2	54%	0.536	38%	0.384	S	S	.	.			trans	-104.8	1.1	177.9	-60.8	-51.1	-175.5	113.1	8.9	114.5	L168 D169 L173 N193	L168-R171 HydrophobicContact CB-CG 4.2Å; L168-R171 HydrophobicContact CD2-CG 4.5Å; L168-R171 WeakPolarHBondContact O-CG 3.43Å; D169-R171 PolarHBondContact O-N 3.31Å; R171-L173 HydrophobicContact CB-CD1 4.11Å; R171-L173 HydrophobicContact CB-CD2 4.42Å; R171-L173 HydrophobicContact CB-CG 3.82Å; R171-L173 PolarHBondContact O-N 2.91Å; R171-N193 VanDerWaalsContact C-OD1 3.27Å; R171-N193 WeakPolarHBondContact CA-OD1 3.48Å; R171-N193 PolarHBondContact N-OD1 3Å
172	C	89	Confident	82	Confident	90 Å²	90	76.1 Å²	76.1	61%	0.608	36%	0.364	S	S	*	.			trans	53.8	32.7	-176.6	-57.5	0	0	0	0	113.4	E174 N193 L194	C172-E174 PolarHBondContact O-N 3.1Å; C172-N193 PolarHBondContact N-OD1 3.1Å; C172-L194 HydrophobicContact CB-CD1 4.48Å
173	L	89.8	Confident	83.4	Confident	16 Å²	16	77.4 Å²	77.4	8%	0.084	36%	0.359	C	S	.	.			trans	-69.3	117.8	179.7	-62.9	169.9	0	0	0	110.2	F152 L168 R171 P177 L190 N193 L194 I195	F152-L173 HydrophobicContact CB-CD2 4.43Å; F152-L173 HydrophobicContact CD2-CD2 3.74Å; F152-L173 HydrophobicContact CE2-CD2 4.28Å; F152-L173 HydrophobicContact CG-CD2 4.23Å; L168-L173 HydrophobicContact CB-CD1 4.26Å; L168-L173 HydrophobicContact CD1-CD1 4.38Å; R171-L173 HydrophobicContact CB-CD1 4.11Å; R171-L173 HydrophobicContact CB-CD2 4.42Å; R171-L173 HydrophobicContact CB-CG 3.82Å; R171-L173 PolarHBondContact O-N 2.91Å; L173-P177 HydrophobicContact CD1-CG 4.43Å; L173-L190 HydrophobicContact CD1-CD2 4.03Å; L173-N193 HydrophobicContact CB-CB 4.23Å; L173-N193 PolarHBondContact N-OD1 3.49Å; L173-L194 CarbonylContact O-C 3.46Å; L173-L194 WeakPolarHBondContact O-CA 3.38Å; L173-L194 PolarHBondContact O-N 3.15Å; L173-I195 HydrophobicContact CB-CG1 4.23Å; L173-I195 VanDerWaalsContact O-CG1 3.29Å; L173-I195 WeakPolarHBondContact O-CG1 3.35Å; L173-I195 PolarHBondContact O-N 3.2Å
174	E	89.8	Confident	84.4	Confident	137 Å²	137	78.6 Å²	78.6	64%	0.64	37%	0.366	S	S	*	.	S	Bend	trans	-83	-29.1	174.6	-63.2	179.3	-173.4	0	0	112.2	C172 L194	C172-E174 PolarHBondContact O-N 3.1Å; E174-L194 HydrophobicContact CG-CB 4.02Å; E174-L194 HydrophobicContact CG-CD1 4.14Å
175	E	88.2	Confident	84.6	Confident	141 Å²	141	75.7 Å²	75.7	66%	0.659	35%	0.353	S	S	*	.	S	Bend	trans	-111.5	153.6	177.7	-62.8	-169	146.6	0	0	111.6
176	F	86.6	Confident	84.8	Confident	7 Å²	7	70.3 Å²	70.3	3%	0.031	34%	0.335	C	S	.	.			trans	-73.5	125.8	177.1	-154.8	-75.4	0	0	0	110.4	V179 L188 L190 I195 I198 Q199 L201 L212	F176-V179 HydrophobicContact CE1-CG2 4.33Å; F176-L188 HydrophobicContact CE1-CD2 4.11Å; F176-L188 HydrophobicContact CZ-CD2 3.99Å; F176-L190 HydrophobicContact CD2-CD1 4.42Å; F176-L190 HydrophobicContact CE1-CD1 3.83Å; F176-L190 HydrophobicContact CE2-CD1 3.69Å; F176-L190 HydrophobicContact CZ-CD1 3.32Å; F176-I195 HydrophobicContact CB-CG2 4.37Å; F176-I195 HydrophobicContact CD2-CD1 4.42Å; F176-I195 HydrophobicContact CD2-CG2 3.95Å; F176-I198 HydrophobicContact CD2-CG2 4.49Å; F176-I198 HydrophobicContact CE2-CG2 4.1Å; F176-Q199 HydrophobicContact CB-CG 3.59Å; F176-Q199 WeakPolarHBondContact CD1-O 3.12Å; F176-Q199 HydrophobicContact CG-CG 4.4Å; F176-L201 HydrophobicContact CE1-CD2 3.58Å; F176-L201 HydrophobicContact CE1-CG 4.03Å; F176-L201 HydrophobicContact CE2-CD1 4.44Å; F176-L201 HydrophobicContact CZ-CD1 3.97Å; F176-L201 HydrophobicContact CZ-CD2 3.6Å; F176-L201 HydrophobicContact CZ-CG 3.89Å; F176-L212 HydrophobicContact CE2-CD1 4.23Å; F176-L212 HydrophobicContact CE2-CD2 3.83Å
177	P	84	Confident	85	Confident	12 Å²	12	70.9 Å²	70.9	8%	0.078	34%	0.339	C	S	.	.			trans	-65.6	139.7	-176.3	26	-33.8	0	0	0	111.9	L168 L173 V179 L190	L168-P177 HydrophobicContact CD1-CB 4.45Å; L168-P177 HydrophobicContact CD1-CG 4.03Å; L173-P177 HydrophobicContact CD1-CG 4.43Å; P177-V179 HydrophobicContact CB-CG1 4.46Å; P177-V179 HydrophobicContact CG-CG1 4.45Å; P177-V179 PolarHBondContact O-N 3.42Å; P177-L190 HydrophobicContact CG-CD1 4.42Å; P177-L190 HydrophobicContact CG-CD2 3.74Å
178	Q	81.1	Confident	85.2	Confident	104 Å²	104	66.5 Å²	66.5	49%	0.486	32%	0.315	S	S	.	.			trans	-74	94.8	-180	-167.6	177.8	10.6	0	0	110.5	F181	Q178-F181 HydrophobicContact CG-CE1 4.15Å; Q178-F181 HydrophobicContact CG-CZ 4.37Å; Q178-F181 WeakPolarHBondContact O-CE2 3.32Å; Q178-F181 WeakPolarHBondContact O-CZ 3.21Å
179	V	78.6	Confident	85.3	Confident	5 Å²	5	65.6 Å²	65.6	3%	0.03	31%	0.31	C	S	.	.			trans	-108	7.1	-177.9	-68.9	0	0	0	0	113.9	I166 F176 P177 F181 M182 L188 L201 L204	I166-V179 HydrophobicContact CD1-CG1 4.31Å; F176-V179 HydrophobicContact CE1-CG2 4.33Å; P177-V179 HydrophobicContact CB-CG1 4.46Å; P177-V179 HydrophobicContact CG-CG1 4.45Å; P177-V179 PolarHBondContact O-N 3.42Å; V179-F181 PolarHBondContact O-N 3.22Å; V179-M182 WeakPolarHBondContact O-CB 3.5Å; V179-M182 PolarHBondContact O-N 3.18Å; V179-M182 VanDerWaalsContact O-N 3.11Å; V179-L188 HydrophobicContact CG2-CD2 4.29Å; V179-L201 HydrophobicContact CG2-CD2 4.42Å; V179-L204 HydrophobicContact CG2-CD1 3.78Å
180	G	67.9	Low	85.4	Confident	17 Å²	17	63.6 Å²	63.6	18%	0.175	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-6.9	-167.6	0	0	0	0	0	117.1	H203	G180-H203 WeakPolarHBondContact O-CB 3.4Å
181	F	71.1	Confident	85.5	Confident	122 Å²	122	58 Å²	58	54%	0.535	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	7.1	176.7	23.1	-101.6	0	0	0	113.6	C154 Q178 V179	C154-F181 HydrophobicContact CB-CE2 3.83Å; C154-F181 HydrophobicContact CB-CZ 3.94Å; Q178-F181 HydrophobicContact CG-CE1 4.15Å; Q178-F181 HydrophobicContact CG-CZ 4.37Å; Q178-F181 WeakPolarHBondContact O-CE2 3.32Å; Q178-F181 WeakPolarHBondContact O-CZ 3.21Å; V179-F181 PolarHBondContact O-N 3.22Å
182	M	76.6	Confident	85.7	Confident	21 Å²	21	53 Å²	53	10%	0.103	26%	0.263	C	S	.	.			trans	-111.7	57.5	-171.4	-53.4	-176.6	75.1	0	0	111.7	F163 I166 V179 E184 L185 L204	F163-M182 HydrophobicContact CB-CE 3.83Å; F163-M182 HydrophobicContact CD1-CE 3.28Å; F163-M182 HydrophobicContact CD2-CE 4.44Å; F163-M182 HydrophobicContact CE1-CE 3.87Å; F163-M182 HydrophobicContact CG-CE 3.62Å; I166-M182 HydrophobicContact CD1-CE 3.63Å; I166-M182 HydrophobicContact CD1-SD 3.61Å; I166-M182 HydrophobicContact CG1-CE 4.34Å; V179-M182 WeakPolarHBondContact O-CB 3.5Å; V179-M182 PolarHBondContact O-N 3.18Å; V179-M182 VanDerWaalsContact O-N 3.11Å; M182-E184 PolarHBondContact O-N 3.31Å; M182-E184 VanDerWaalsContact O-N 3.08Å; M182-L185 HydrophobicContact CB-CB 4.43Å; M182-L185 WeakPolarHBondContact O-CB 3.28Å; M182-L185 PolarHBondContact O-N 3.49Å; M182-L204 WeakPolarHBondContact O-CD2 3.28Å
183	E	80	Confident	86	Confident	124 Å²	124	49 Å²	49	58%	0.579	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.3	-167.1	-59.1	-173.1	166	0	0	115.3	L185	E183-L185 VanDerWaalsContact C-N 3.3Å; E183-L185 PolarHBondContact O-N 3.15Å
184	E	82.4	Confident	86.2	Confident	113 Å²	113	51.4 Å²	51.4	53%	0.528	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	9	176.9	-57.1	-168.5	153.4	0	0	114.6	H164 M182 Q186	H164-E184 IonicContact CE1-OE2 3.29Å; H164-E184 PolarHBondContact CE1-OE2 2.84Å; H164-E184 PolarHBondContact ND1-O 3.48Å; M182-E184 PolarHBondContact O-N 3.31Å; M182-E184 VanDerWaalsContact O-N 3.08Å; E184-Q186 PolarHBondContact O-N 3.11Å
185	L	86.5	Confident	86.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.217	C	C	.	.			trans	-69.3	119.5	-179.8	-176.1	63.9	0	0	0	111.2	F163 I166 M182 E183 L187 L188 L204 Q206 L207	F163-L185 WeakPolarHBondContact O-CD1 3.18Å; I166-L185 HydrophobicContact CB-CD1 4.1Å; I166-L185 HydrophobicContact CD1-CD1 3.69Å; I166-L185 HydrophobicContact CD1-CD2 3.71Å; I166-L185 HydrophobicContact CD1-CG 4.36Å; I166-L185 HydrophobicContact CG1-CD1 3.62Å; I166-L185 HydrophobicContact CG1-CD2 4.46Å; M182-L185 HydrophobicContact CB-CB 4.43Å; M182-L185 WeakPolarHBondContact O-CB 3.28Å; M182-L185 PolarHBondContact O-N 3.49Å; E183-L185 VanDerWaalsContact C-N 3.3Å; E183-L185 PolarHBondContact O-N 3.15Å; L185-L187 VanDerWaalsContact CD1-O 3.3Å; L185-L187 WeakPolarHBondContact CD1-O 3.4Å; L185-L188 HydrophobicContact CD2-CB 4.12Å; L185-L188 HydrophobicContact CD2-CD1 4.41Å; L185-L188 HydrophobicContact CD2-CD2 4.38Å; L185-L204 HydrophobicContact CB-CD2 4.33Å; L185-L204 HydrophobicContact CD2-CD1 3.99Å; L185-Q206 CarbonylContact O-C 3.5Å; L185-L207 HydrophobicContact CD2-CD1 4.28Å; L185-L207 HydrophobicContact CG-CD1 3.94Å; L185-L207 WeakPolarHBondContact O-CA 3.46Å; L185-L207 PolarHBondContact O-N 3.44Å
186	Q	90.3	Very high	86.6	Confident	73 Å²	73	41.8 Å²	41.8	34%	0.341	21%	0.208	S	C	.	.			trans	-103.3	-27.7	-178.7	-62.8	177.2	-3.2	0	0	113.2	H164 E184 T208 I209	H164-Q186 HydrophobicContact CB-CB 4.41Å; H164-Q186 HydrophobicContact CB-CG 4.25Å; H164-Q186 CarbonylContact O-C 3.34Å; H164-Q186 WeakPolarHBondContact O-CA 3.43Å; H164-Q186 WeakPolarHBondContact O-CB 3.39Å; H164-Q186 PolarHBondContact O-N 2.89Å; E184-Q186 PolarHBondContact O-N 3.11Å; Q186-T208 WeakPolarHBondContact O-CA 3.24Å; Q186-T208 WeakPolarHBondContact O-CB 3.45Å; Q186-T208 PolarHBondContact O-N 2.87Å; Q186-I209 PolarHBondContact O-N 3.3Å
187	L	92.3	Very high	86.8	Confident	42 Å²	42	50 Å²	50	22%	0.22	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	124.2	178.7	-175.5	160.5	0	0	0	110.6	H164 R165 I166 L185 N189 I209	H164-L187 PolarHBondContact O-N 3.47Å; R165-L187 WeakPolarHBondContact CA-O 3.28Å; R165-L187 HydrophobicContact CB-CB 4.27Å; R165-L187 HydrophobicContact CG-CB 3.96Å; I166-L187 PolarHBondContact N-O 3.35Å; L185-L187 VanDerWaalsContact CD1-O 3.3Å; L185-L187 WeakPolarHBondContact CD1-O 3.4Å; L187-N189 HydrophobicContact CD2-CB 4.14Å; L187-I209 WeakPolarHBondContact CA-O 3.38Å; L187-I209 HydrophobicContact CB-CB 4.34Å; L187-I209 HydrophobicContact CD1-CB 4.48Å; L187-I209 HydrophobicContact CD1-CD1 4.24Å; L187-I209 HydrophobicContact CD1-CG2 4.45Å; L187-I209 HydrophobicContact CG-CB 4.09Å; L187-I209 HydrophobicContact CG-CG2 4.16Å
188	L	92.4	Very high	87.2	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	112.8	172.4	179.9	54.9	0	0	0	109.8	I166 F176 V179 L185 L190 L201 L207 I209 L210 N211	I166-L188 HydrophobicContact CB-CD1 3.97Å; I166-L188 HydrophobicContact CG2-CD1 3.86Å; F176-L188 HydrophobicContact CE1-CD2 4.11Å; F176-L188 HydrophobicContact CZ-CD2 3.99Å; V179-L188 HydrophobicContact CG2-CD2 4.29Å; L185-L188 HydrophobicContact CD2-CB 4.12Å; L185-L188 HydrophobicContact CD2-CD1 4.41Å; L185-L188 HydrophobicContact CD2-CD2 4.38Å; L188-L190 HydrophobicContact CD1-CD1 4.02Å; L188-L190 HydrophobicContact CD1-CG 4Å; L188-L190 HydrophobicContact CD2-CD1 3.81Å; L188-L190 HydrophobicContact CG-CD1 3.75Å; L188-L190 HydrophobicContact CG-CG 4.07Å; L188-L201 HydrophobicContact CD2-CD2 3.96Å; L188-L207 HydrophobicContact CB-CD1 3.89Å; L188-I209 PolarHBondContact N-O 3.38Å; L188-L210 HydrophobicContact CB-CD1 4.09Å; L188-L210 HydrophobicContact CD2-CD1 4.04Å; L188-L210 HydrophobicContact CG-CD1 4.11Å; L188-N211 PolarHBondContact O-N 3Å
189	N	92.6	Very high	87.5	Confident	12 Å²	12	48.5 Å²	48.5	6%	0.064	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.4	174.8	-170.4	23	0	0	0	110.8	I166 D167 L168 L187 Q191 N211	I166-N189 PolarHBondContact O-N 2.81Å; D167-N189 HydrophobicContact CB-CB 4.31Å; D167-N189 VanDerWaalsContact CG-ND2 3.28Å; D167-N189 PolarHBondContact OD1-ND2 3.24Å; D167-N189 PolarHBondContact OD2-ND2 3.24Å; L168-N189 PolarHBondContact N-O 2.95Å; L187-N189 HydrophobicContact CD2-CB 4.14Å; N189-Q191 PolarHBondContact ND2-NE2 2.88Å; N189-Q191 WeakPolarHBondContact OD1-CG 3.44Å; N189-Q191 PolarHBondContact OD1-N 3.32Å; N189-N211 WeakPolarHBondContact OD1-CB 3.49Å; N189-N211 PolarHBondContact OD1-ND2 3.18Å
190	L	93.2	Very high	87.7	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.247	C	C	.	.			trans	-133.5	20.8	-176.7	-74.5	166.7	0	0	0	111.5	L168 L173 F176 P177 L188 N193 I195 N211 L212 N215	L168-L190 HydrophobicContact CB-CD2 3.88Å; L168-L190 HydrophobicContact CD1-CD2 4.01Å; L173-L190 HydrophobicContact CD1-CD2 4.03Å; F176-L190 HydrophobicContact CD2-CD1 4.42Å; F176-L190 HydrophobicContact CE1-CD1 3.83Å; F176-L190 HydrophobicContact CE2-CD1 3.69Å; F176-L190 HydrophobicContact CZ-CD1 3.32Å; P177-L190 HydrophobicContact CG-CD1 4.42Å; P177-L190 HydrophobicContact CG-CD2 3.74Å; L188-L190 HydrophobicContact CD1-CD1 4.02Å; L188-L190 HydrophobicContact CD1-CG 4Å; L188-L190 HydrophobicContact CD2-CD1 3.81Å; L188-L190 HydrophobicContact CG-CD1 3.75Å; L188-L190 HydrophobicContact CG-CG 4.07Å; L190-N193 VanDerWaalsContact C-ND2 3.34Å; L190-N193 PolarHBondContact O-ND2 2.88Å; L190-I195 HydrophobicContact CB-CD1 4.1Å; L190-I195 HydrophobicContact CD1-CD1 4.26Å; L190-I195 HydrophobicContact CD2-CD1 4.11Å; L190-I195 HydrophobicContact CG-CD1 4.4Å; L190-N211 WeakPolarHBondContact CA-O 3.47Å; L190-N211 PolarHBondContact N-O 3.43Å; L190-L212 HydrophobicContact CB-CD2 3.6Å; L190-L212 HydrophobicContact CB-CG 4.48Å; L190-L212 HydrophobicContact CD1-CD2 3.85Å; L190-L212 HydrophobicContact CG-CD2 4.38Å; L190-N215 PolarHBondContact O-ND2 3.4Å
191	Q	93.3	Very high	88.5	Confident	39 Å²	39	51.2 Å²	51.2	18%	0.182	24%	0.239	C	C	.	.			trans	-64.3	156.5	-177.8	66.2	-179	6	0	0	113.9	D169 R170 N189 N193 N211 H213	D169-Q191 WeakPolarHBondContact CA-O 3.49Å; D169-Q191 HydrophobicContact CB-CG 3.96Å; D169-Q191 VanDerWaalsContact CG-CG 3.49Å; D169-Q191 VanDerWaalsContact CG-NE2 3.33Å; D169-Q191 WeakPolarHBondContact OD1-CG 3.47Å; D169-Q191 PolarHBondContact OD2-NE2 3.35Å; R170-Q191 PolarHBondContact N-O 3.36Å; N189-Q191 PolarHBondContact ND2-NE2 2.88Å; N189-Q191 WeakPolarHBondContact OD1-CG 3.44Å; N189-Q191 PolarHBondContact OD1-N 3.32Å; Q191-N193 PolarHBondContact O-N 3.09Å; Q191-N193 PolarHBondContact O-ND2 2.7Å; Q191-N193 VanDerWaalsContact O-ND2 3.16Å; Q191-N211 PolarHBondContact OE1-ND2 3.31Å; Q191-H213 CarbonylContact C-O 3.23Å; Q191-H213 WeakPolarHBondContact CA-O 3.19Å; Q191-H213 HydrophobicContact CB-CB 4.05Å; Q191-H213 WeakPolarHBondContact CB-O 3.47Å
192	H	94.4	Very high	89	Confident	38 Å²	38	48.2 Å²	48.2	18%	0.176	23%	0.233	C	C	.	.	S	Bend	trans	53	49.4	-179.4	-41.6	98.5	0	0	0	113.2	D169 R170 H213 D214	D169-H192 IonicContact OD1-CE1 2.77Å; D169-H192 IonicContact OD1-CG 3.34Å; D169-H192 IonicContact OD1-ND1 3.59Å; D169-H192 PolarHBondContact OD1-ND1 3.14Å; D169-H192 IonicContact OD2-ND1 3.81Å; R170-H192 WeakPolarHBondContact CA-O 3.39Å; R170-H192 HydrophobicContact CG-CB 3.68Å; R170-H192 VanDerWaalsContact CZ-CG 3.45Å; R170-H192 PolarHBondContact NH1-CD2 2.91Å; R170-H192 VanDerWaalsContact NH1-CG 3.32Å; R170-H192 PolarHBondContact NH2-CD2 3.03Å; R170-H192 PolarHBondContact NH2-CE1 2.77Å; R170-H192 PolarHBondContact NH2-ND1 3.09Å; R170-H192 VanDerWaalsContact NH2-ND1 3.19Å; R170-H192 PolarHBondContact NH2-NE2 3.34Å; H192-H213 PolarHBondContact N-O 3.14Å; H192-D214 WeakPolarHBondContact CA-O 3.37Å; H192-D214 IonicContact CD2-OD2 3.49Å; H192-D214 PolarHBondContact CD2-OD2 3.13Å; H192-D214 PolarHBondContact N-O 3.37Å
193	N	94.2	Very high	89.3	Confident	6 Å²	6	52.5 Å²	52.5	3%	0.032	25%	0.253	C	S	.	.	S	Bend	trans	-120.8	-172.7	174.5	-76.7	-68.7	0	0	0	109.9	L168 R171 C172 L173 L190 Q191 I195 D214 N215	L168-N193 PolarHBondContact O-ND2 3.1Å; R171-N193 VanDerWaalsContact C-OD1 3.27Å; R171-N193 WeakPolarHBondContact CA-OD1 3.48Å; R171-N193 PolarHBondContact N-OD1 3Å; C172-N193 PolarHBondContact N-OD1 3.1Å; L173-N193 HydrophobicContact CB-CB 4.23Å; L173-N193 PolarHBondContact N-OD1 3.49Å; L190-N193 VanDerWaalsContact C-ND2 3.34Å; L190-N193 PolarHBondContact O-ND2 2.88Å; Q191-N193 PolarHBondContact O-N 3.09Å; Q191-N193 PolarHBondContact O-ND2 2.7Å; Q191-N193 VanDerWaalsContact O-ND2 3.16Å; N193-I195 HydrophobicContact CB-CD1 4.27Å; N193-I195 HydrophobicContact CB-CG1 4.02Å; N193-D214 PolarHBondContact N-O 3.29Å; N193-N215 WeakPolarHBondContact CA-OD1 3.39Å; N193-N215 VanDerWaalsContact CB-OD1 3.25Å; N193-N215 WeakPolarHBondContact CB-OD1 3.46Å; N193-N215 PolarHBondContact O-OD1 3.44Å
194	L	94.6	Very high	89.5	Confident	66 Å²	66	46.6 Å²	46.6	35%	0.346	23%	0.225	S	C	.	.			trans	-111.1	19.6	-177.6	-58.9	177.3	0	0	0	111.5	C172 L173 E174 T196	C172-L194 HydrophobicContact CB-CD1 4.48Å; L173-L194 CarbonylContact O-C 3.46Å; L173-L194 WeakPolarHBondContact O-CA 3.38Å; L173-L194 PolarHBondContact O-N 3.15Å; E174-L194 HydrophobicContact CG-CB 4.02Å; E174-L194 HydrophobicContact CG-CD1 4.14Å; L194-T196 PolarHBondContact O-N 2.98Å
195	I	94.1	Very high	89.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.227	C	C	.	.			trans	-64.6	125.1	-169.5	-59.2	175.4	0	0	0	109.4	L173 F176 L190 N193 R197 L212 N215 H216 I217	L173-I195 HydrophobicContact CB-CG1 4.23Å; L173-I195 VanDerWaalsContact O-CG1 3.29Å; L173-I195 WeakPolarHBondContact O-CG1 3.35Å; L173-I195 PolarHBondContact O-N 3.2Å; F176-I195 HydrophobicContact CB-CG2 4.37Å; F176-I195 HydrophobicContact CD2-CD1 4.42Å; F176-I195 HydrophobicContact CD2-CG2 3.95Å; L190-I195 HydrophobicContact CB-CD1 4.1Å; L190-I195 HydrophobicContact CD1-CD1 4.26Å; L190-I195 HydrophobicContact CD2-CD1 4.11Å; L190-I195 HydrophobicContact CG-CD1 4.4Å; N193-I195 HydrophobicContact CB-CD1 4.27Å; N193-I195 HydrophobicContact CB-CG1 4.02Å; I195-R197 VanDerWaalsContact CG2-O 3.23Å; I195-R197 WeakPolarHBondContact CG2-O 3.44Å; I195-L212 HydrophobicContact CD1-CD2 4.2Å; I195-N215 VanDerWaalsContact CB-OD1 3.26Å; I195-N215 WeakPolarHBondContact CB-OD1 3.49Å; I195-N215 WeakPolarHBondContact CG1-OD1 3.19Å; I195-N215 PolarHBondContact N-OD1 3.32Å; I195-H216 CarbonylContact O-C 3.19Å; I195-H216 VanDerWaalsContact O-C 3.23Å; I195-H216 WeakPolarHBondContact O-CA 3.43Å; I195-H216 PolarHBondContact O-N 2.88Å; I195-I217 WeakPolarHBondContact O-CG1 3.33Å; I195-I217 PolarHBondContact O-N 3.36Å
196	T	92.4	Very high	89.7	Confident	76 Å²	76	51.1 Å²	51.1	47%	0.466	25%	0.246	S	C	.	.			trans	-96.1	-21.6	-177.4	57	0	0	0	0	114	L194 H216	L194-T196 PolarHBondContact O-N 2.98Å; T196-H216 HydrophobicContact CG2-CB 4.24Å
197	R	91.8	Very high	89.8	Confident	179 Å²	179	47.6 Å²	47.6	68%	0.675	23%	0.23	S	C	*	.			trans	-145	143.1	-175.8	-67.3	-178	176.3	159	0.1	111.4	I195	I195-R197 VanDerWaalsContact CG2-O 3.23Å; I195-R197 WeakPolarHBondContact CG2-O 3.44Å
198	I	91.5	Very high	89.9	Confident	13 Å²	13	47.8 Å²	47.8	7%	0.067	23%	0.233	C	C	.	.			trans	-87.8	125.8	170.7	-55.4	175.2	0	0	0	108.2	F176 L201 L212 I217 N221 I223 L234	F176-I198 HydrophobicContact CD2-CG2 4.49Å; F176-I198 HydrophobicContact CE2-CG2 4.1Å; I198-L201 HydrophobicContact CG2-CD1 3.37Å; I198-L201 HydrophobicContact CG2-CG 4.14Å; I198-L212 HydrophobicContact CD1-CD1 3.83Å; I198-L212 HydrophobicContact CG1-CD1 3.99Å; I198-I217 HydrophobicContact CD1-CD1 4.2Å; I198-I217 HydrophobicContact CD1-CG2 4.2Å; I198-I217 HydrophobicContact CG1-CD1 3.89Å; I198-I217 HydrophobicContact CG1-CG1 4.43Å; I198-I217 HydrophobicContact CG1-CG2 4.08Å; I198-N221 WeakPolarHBondContact CB-O 3.35Å; I198-I223 HydrophobicContact CD1-CG2 3.88Å; I198-I223 HydrophobicContact CG2-CG2 4.05Å; I198-L234 HydrophobicContact CD1-CD2 4.1Å
199	Q	88.4	Confident	90	Very high	72 Å²	72	50.6 Å²	50.6	34%	0.336	25%	0.247	S	C	.	.			trans	-154.5	169.6	-179.1	56.7	-175.2	44.8	0	0	111.3	F176 L201	F176-Q199 HydrophobicContact CB-CG 3.59Å; F176-Q199 WeakPolarHBondContact CD1-O 3.12Å; F176-Q199 HydrophobicContact CG-CG 4.4Å; Q199-L201 PolarHBondContact O-N 3.18Å; Q199-L201 VanDerWaalsContact O-N 3.11Å
200	H	82.4	Confident	90.2	Very high	79 Å²	79	50 Å²	50	37%	0.366	24%	0.244	S	C	.	.	S	Bend	trans	61.7	10.4	-179.9	-46.2	-52.4	0	0	0	117
201	L	84.4	Confident	90.3	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	25%	0.248	C	C	.	.			trans	-84	-9.4	-179.4	-67.4	-174.2	0	0	0	115.3	F176 V179 L188 I198 Q199 H203 L204 L210 L226	F176-L201 HydrophobicContact CE1-CD2 3.58Å; F176-L201 HydrophobicContact CE1-CG 4.03Å; F176-L201 HydrophobicContact CE2-CD1 4.44Å; F176-L201 HydrophobicContact CZ-CD1 3.97Å; F176-L201 HydrophobicContact CZ-CD2 3.6Å; F176-L201 HydrophobicContact CZ-CG 3.89Å; V179-L201 HydrophobicContact CG2-CD2 4.42Å; L188-L201 HydrophobicContact CD2-CD2 3.96Å; I198-L201 HydrophobicContact CG2-CD1 3.37Å; I198-L201 HydrophobicContact CG2-CG 4.14Å; Q199-L201 PolarHBondContact O-N 3.18Å; Q199-L201 VanDerWaalsContact O-N 3.11Å; L201-H203 PolarHBondContact O-N 2.95Å; L201-L204 HydrophobicContact CD2-CD1 3.72Å; L201-L204 PolarHBondContact O-N 3.43Å; L201-L210 HydrophobicContact CD1-CD2 3.74Å; L201-L226 HydrophobicContact CB-CD2 4.27Å; L201-L226 HydrophobicContact CD1-CD1 4.02Å
202	S	82.1	Confident	90.4	Very high	59 Å²	59	48.9 Å²	48.9	41%	0.413	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.7	-167.6	-46	0	0	0	0	116.2
203	H	81.9	Confident	90.5	Very high	110 Å²	110	48.2 Å²	48.2	51%	0.509	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-12.5	-177.5	-59.4	-86.5	0	0	0	113.4	G180 L201 Q205	G180-H203 WeakPolarHBondContact O-CB 3.4Å; L201-H203 PolarHBondContact O-N 2.95Å; H203-Q205 VanDerWaalsContact C-N 3.26Å; H203-Q205 PolarHBondContact O-N 2.89Å
204	L	85.1	Confident	90.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.252	C	S	.	.			trans	-86.3	58.1	-169.2	-59.1	-176.9	0	0	0	112.6	V179 M182 L185 L201 Q206 L207 L226	V179-L204 HydrophobicContact CG2-CD1 3.78Å; M182-L204 WeakPolarHBondContact O-CD2 3.28Å; L185-L204 HydrophobicContact CB-CD2 4.33Å; L185-L204 HydrophobicContact CD2-CD1 3.99Å; L201-L204 HydrophobicContact CD2-CD1 3.72Å; L201-L204 PolarHBondContact O-N 3.43Å; L204-Q206 PolarHBondContact O-N 3.44Å; L204-L207 HydrophobicContact CB-CB 4.21Å; L204-L207 VanDerWaalsContact O-CB 3.27Å; L204-L207 WeakPolarHBondContact O-CB 3.44Å; L204-L207 PolarHBondContact O-N 2.85Å; L204-L226 HydrophobicContact CB-CD2 4.13Å; L204-L226 WeakPolarHBondContact O-CD2 3.42Å
205	Q	85.2	Confident	90.6	Very high	120 Å²	120	48.1 Å²	48.1	56%	0.561	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-17.4	-173.2	-60.9	-172.2	11.4	0	0	114.3	H203 S228	H203-Q205 VanDerWaalsContact C-N 3.26Å; H203-Q205 PolarHBondContact O-N 2.89Å; Q205-S228 WeakPolarHBondContact O-CB 3.45Å; Q205-S228 PolarHBondContact O-OG 3.15Å
206	Q	87.9	Confident	90.7	Very high	88 Å²	88	51.1 Å²	51.1	41%	0.411	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-4.4	174	-58.8	-163.5	22.2	0	0	113.9	L185 L204 T208	L185-Q206 CarbonylContact O-C 3.5Å; L204-Q206 PolarHBondContact O-N 3.44Å; Q206-T208 PolarHBondContact O-N 2.94Å; Q206-T208 VanDerWaalsContact O-N 3.1Å; Q206-T208 PolarHBondContact O-OG1 3.47Å; Q206-T208 VanDerWaalsContact O-OG1 3.08Å
207	L	91.4	Very high	90.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.228	C	C	.	.			trans	-62.1	118.5	-175.5	-165.7	70.7	0	0	0	110.5	L185 L188 L204 L210 L226 S228 L229	L185-L207 HydrophobicContact CD2-CD1 4.28Å; L185-L207 HydrophobicContact CG-CD1 3.94Å; L185-L207 WeakPolarHBondContact O-CA 3.46Å; L185-L207 PolarHBondContact O-N 3.44Å; L188-L207 HydrophobicContact CB-CD1 3.89Å; L204-L207 HydrophobicContact CB-CB 4.21Å; L204-L207 VanDerWaalsContact O-CB 3.27Å; L204-L207 WeakPolarHBondContact O-CB 3.44Å; L204-L207 PolarHBondContact O-N 2.85Å; L207-L210 HydrophobicContact CD2-CB 4.03Å; L207-L210 HydrophobicContact CD2-CD1 4.29Å; L207-L210 HydrophobicContact CD2-CD2 4.42Å; L207-L210 HydrophobicContact CD2-CG 4.48Å; L207-L226 HydrophobicContact CB-CD2 4.17Å; L207-L226 HydrophobicContact CD2-CD1 4.23Å; L207-L226 HydrophobicContact CD2-CD2 4.12Å; L207-S228 CarbonylContact O-C 3.37Å; L207-S228 VanDerWaalsContact O-C 3.28Å; L207-L229 HydrophobicContact CD2-CD1 4.38Å; L207-L229 HydrophobicContact CG-CD1 4.22Å; L207-L229 VanDerWaalsContact O-CA 3.22Å; L207-L229 WeakPolarHBondContact O-CA 3.47Å; L207-L229 PolarHBondContact O-N 3.39Å; L207-L229 VanDerWaalsContact O-N 3.13Å
208	T	94.4	Very high	91	Very high	45 Å²	45	41 Å²	41	28%	0.276	21%	0.21	S	C	.	.			trans	-104.7	-32.1	-173.9	-59.5	0	0	0	0	111.2	Q186 Q206 R230 V231	Q186-T208 WeakPolarHBondContact O-CA 3.24Å; Q186-T208 WeakPolarHBondContact O-CB 3.45Å; Q186-T208 PolarHBondContact O-N 2.87Å; Q206-T208 PolarHBondContact O-N 2.94Å; Q206-T208 VanDerWaalsContact O-N 3.1Å; Q206-T208 PolarHBondContact O-OG1 3.47Å; Q206-T208 VanDerWaalsContact O-OG1 3.08Å; T208-R230 HydrophobicContact CG2-CB 4.02Å; T208-R230 HydrophobicContact CG2-CG 4Å; T208-R230 PolarHBondContact O-N 3.21Å; T208-V231 PolarHBondContact O-N 3.37Å
209	I	95.3	Very high	91	Very high	59 Å²	59	44.3 Å²	44.3	30%	0.303	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	123.3	180	-56.9	-176.6	0	0	0	109.4	Q186 L187 L188 V231	Q186-I209 PolarHBondContact O-N 3.3Å; L187-I209 WeakPolarHBondContact CA-O 3.38Å; L187-I209 HydrophobicContact CB-CB 4.34Å; L187-I209 HydrophobicContact CD1-CB 4.48Å; L187-I209 HydrophobicContact CD1-CD1 4.24Å; L187-I209 HydrophobicContact CD1-CG2 4.45Å; L187-I209 HydrophobicContact CG-CB 4.09Å; L187-I209 HydrophobicContact CG-CG2 4.16Å; L188-I209 PolarHBondContact N-O 3.38Å; I209-V231 WeakPolarHBondContact CA-O 3.46Å; I209-V231 HydrophobicContact CB-CB 4.44Å; I209-V231 HydrophobicContact CG1-CB 4.11Å; I209-V231 HydrophobicContact CG1-CG2 4.22Å; I209-V231 HydrophobicContact CG2-CB 4.21Å; I209-V231 HydrophobicContact CG2-CG1 4.37Å
210	L	95.4	Very high	91.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	117.9	172.1	178.4	57.8	0	0	0	109.3	L188 L201 L207 L212 I223 L226 L229 V231 L232 M233	L188-L210 HydrophobicContact CB-CD1 4.09Å; L188-L210 HydrophobicContact CD2-CD1 4.04Å; L188-L210 HydrophobicContact CG-CD1 4.11Å; L201-L210 HydrophobicContact CD1-CD2 3.74Å; L207-L210 HydrophobicContact CD2-CB 4.03Å; L207-L210 HydrophobicContact CD2-CD1 4.29Å; L207-L210 HydrophobicContact CD2-CD2 4.42Å; L207-L210 HydrophobicContact CD2-CG 4.48Å; L210-L212 HydrophobicContact CD1-CD1 3.94Å; L210-L212 HydrophobicContact CD1-CG 4.08Å; L210-L212 HydrophobicContact CD2-CD1 3.88Å; L210-L212 HydrophobicContact CG-CD1 3.85Å; L210-L212 HydrophobicContact CG-CG 4.26Å; L210-I223 HydrophobicContact CD2-CG2 4.38Å; L210-L226 HydrophobicContact CD2-CD1 4.1Å; L210-L229 HydrophobicContact CB-CD1 3.84Å; L210-V231 PolarHBondContact N-O 3.15Å; L210-L232 HydrophobicContact CB-CD1 4.13Å; L210-L232 HydrophobicContact CD2-CD1 3.97Å; L210-L232 HydrophobicContact CG-CD1 4.11Å; L210-M233 PolarHBondContact O-N 2.87Å
211	N	96	Very high	91.7	Very high	16 Å²	16	41.1 Å²	41.1	9%	0.086	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	116.9	176.6	-176.9	12.8	0	0	0	111	L188 N189 L190 Q191 H213 M233	L188-N211 PolarHBondContact O-N 3Å; N189-N211 WeakPolarHBondContact OD1-CB 3.49Å; N189-N211 PolarHBondContact OD1-ND2 3.18Å; L190-N211 WeakPolarHBondContact CA-O 3.47Å; L190-N211 PolarHBondContact N-O 3.43Å; Q191-N211 PolarHBondContact OE1-ND2 3.31Å; N211-H213 VanDerWaalsContact OD1-CB 3.25Å; N211-H213 WeakPolarHBondContact OD1-CB 3.4Å; N211-H213 PolarHBondContact OD1-N 3.5Å; N211-M233 HydrophobicContact CB-CB 4.37Å; N211-M233 WeakPolarHBondContact OD1-CB 3.22Å
212	L	95.4	Very high	91.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.226	C	C	.	.			trans	-128.7	28.1	179.7	-73	161.4	0	0	0	110.3	F176 L190 I195 I198 L210 N215 I217 M233 L234 N237	F176-L212 HydrophobicContact CE2-CD1 4.23Å; F176-L212 HydrophobicContact CE2-CD2 3.83Å; L190-L212 HydrophobicContact CB-CD2 3.6Å; L190-L212 HydrophobicContact CB-CG 4.48Å; L190-L212 HydrophobicContact CD1-CD2 3.85Å; L190-L212 HydrophobicContact CG-CD2 4.38Å; I195-L212 HydrophobicContact CD1-CD2 4.2Å; I198-L212 HydrophobicContact CD1-CD1 3.83Å; I198-L212 HydrophobicContact CG1-CD1 3.99Å; L210-L212 HydrophobicContact CD1-CD1 3.94Å; L210-L212 HydrophobicContact CD1-CG 4.08Å; L210-L212 HydrophobicContact CD2-CD1 3.88Å; L210-L212 HydrophobicContact CG-CD1 3.85Å; L210-L212 HydrophobicContact CG-CG 4.26Å; L212-N215 PolarHBondContact O-ND2 3.29Å; L212-I217 HydrophobicContact CB-CD1 3.85Å; L212-I217 HydrophobicContact CD1-CD1 4.01Å; L212-I217 HydrophobicContact CD2-CD1 4.13Å; L212-I217 HydrophobicContact CG-CD1 4.23Å; L212-M233 CarbonylContact C-O 3.37Å; L212-M233 WeakPolarHBondContact CA-O 3.45Å; L212-M233 PolarHBondContact N-O 2.99Å; L212-L234 HydrophobicContact CB-CD2 3.71Å; L212-L234 HydrophobicContact CD1-CD2 3.96Å; L212-L234 HydrophobicContact CG-CD2 4.5Å; L212-N237 PolarHBondContact O-ND2 3.05Å
213	H	96.1	Very high	92.3	Very high	23 Å²	23	39.3 Å²	39.3	11%	0.106	21%	0.207	C	C	.	.			trans	-58.3	144.3	176.7	-178.9	63.8	0	0	0	112.1	Q191 H192 N211 N215 G235 H257	Q191-H213 CarbonylContact C-O 3.23Å; Q191-H213 WeakPolarHBondContact CA-O 3.19Å; Q191-H213 HydrophobicContact CB-CB 4.05Å; Q191-H213 WeakPolarHBondContact CB-O 3.47Å; H192-H213 PolarHBondContact N-O 3.14Å; N211-H213 VanDerWaalsContact OD1-CB 3.25Å; N211-H213 WeakPolarHBondContact OD1-CB 3.4Å; N211-H213 PolarHBondContact OD1-N 3.5Å; H213-N215 PolarHBondContact O-ND2 3.39Å; H213-N215 VanDerWaalsContact O-ND2 3.08Å; H213-G235 WeakPolarHBondContact CA-O 3.5Å; H213-G235 PolarHBondContact ND1-O 2.86Å; H213-H257 AromaticContact CE1-CE1 3.53Å; H213-H257 AromaticContact CE1-NE2 3.29Å; H213-H257 PolarHBondContact CE1-NE2 2.94Å; H213-H257 VanDerWaalsContact CE1-NE2 3.29Å; H213-H257 AromaticContact ND1-CE1 3.7Å; H213-H257 AromaticContact ND1-NE2 3.87Å
214	D	96.2	Very high	92.7	Very high	67 Å²	67	37.7 Å²	37.7	36%	0.358	20%	0.199	S	C	.	.	S	Bend	trans	53.4	70.1	177.2	-157	32.8	0	0	0	112.2	H192 N193 G235 K236	H192-D214 WeakPolarHBondContact CA-O 3.37Å; H192-D214 IonicContact CD2-OD2 3.49Å; H192-D214 PolarHBondContact CD2-OD2 3.13Å; H192-D214 PolarHBondContact N-O 3.37Å; N193-D214 PolarHBondContact N-O 3.29Å; D214-G235 PolarHBondContact N-O 3.03Å; D214-K236 VanDerWaalsContact CA-O 3.28Å; D214-K236 WeakPolarHBondContact CA-O 3.25Å; D214-K236 HydrophobicContact CB-CB 4.23Å; D214-K236 HydrophobicContact CB-CD 4.48Å; D214-K236 PolarHBondContact N-O 3.32Å
215	N	96	Very high	92.8	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.021	22%	0.215	C	C	.	.	S	Bend	trans	-140.5	-168.4	-178.7	-90.4	-87.5	0	0	0	109.8	L190 N193 I195 L212 H213 I217 K236 N237	L190-N215 PolarHBondContact O-ND2 3.4Å; N193-N215 WeakPolarHBondContact CA-OD1 3.39Å; N193-N215 VanDerWaalsContact CB-OD1 3.25Å; N193-N215 WeakPolarHBondContact CB-OD1 3.46Å; N193-N215 PolarHBondContact O-OD1 3.44Å; I195-N215 VanDerWaalsContact CB-OD1 3.26Å; I195-N215 WeakPolarHBondContact CB-OD1 3.49Å; I195-N215 WeakPolarHBondContact CG1-OD1 3.19Å; I195-N215 PolarHBondContact N-OD1 3.32Å; L212-N215 PolarHBondContact O-ND2 3.29Å; H213-N215 PolarHBondContact O-ND2 3.39Å; H213-N215 VanDerWaalsContact O-ND2 3.08Å; N215-I217 HydrophobicContact CB-CD1 4.29Å; N215-I217 HydrophobicContact CB-CG1 4.3Å; N215-K236 PolarHBondContact N-O 2.86Å; N215-N237 WeakPolarHBondContact CA-OD1 3.43Å; N215-N237 WeakPolarHBondContact CB-OD1 3.41Å; N215-N237 PolarHBondContact O-OD1 2.84Å
216	H	95.9	Very high	93.1	Very high	63 Å²	63	35.4 Å²	35.4	29%	0.292	19%	0.189	S	C	.	.			trans	-120.8	27.5	-175.9	-69.7	0.5	0	0	0	113.2	I195 T196 N237 R238	I195-H216 CarbonylContact O-C 3.19Å; I195-H216 VanDerWaalsContact O-C 3.23Å; I195-H216 WeakPolarHBondContact O-CA 3.43Å; I195-H216 PolarHBondContact O-N 2.88Å; T196-H216 HydrophobicContact CG2-CB 4.24Å; H216-N237 PolarHBondContact N-OD1 3.39Å; H216-R238 PolarHBondContact CD2-NH2 2.94Å; H216-R238 PolarHBondContact CE1-NH2 2.98Å; H216-R238 VanDerWaalsContact CE1-NH2 3.32Å; H216-R238 PolarHBondContact ND1-NH2 3.31Å; H216-R238 PolarHBondContact NE2-NH2 3.47Å
217	I	95.9	Very high	93.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.			trans	-72.3	125.8	-175.6	-57.5	165.6	0	0	0	110.5	I195 I198 L212 N215 D219 L234 N237 R238 I239	I195-I217 WeakPolarHBondContact O-CG1 3.33Å; I195-I217 PolarHBondContact O-N 3.36Å; I198-I217 HydrophobicContact CD1-CD1 4.2Å; I198-I217 HydrophobicContact CD1-CG2 4.2Å; I198-I217 HydrophobicContact CG1-CD1 3.89Å; I198-I217 HydrophobicContact CG1-CG1 4.43Å; I198-I217 HydrophobicContact CG1-CG2 4.08Å; L212-I217 HydrophobicContact CB-CD1 3.85Å; L212-I217 HydrophobicContact CD1-CD1 4.01Å; L212-I217 HydrophobicContact CD2-CD1 4.13Å; L212-I217 HydrophobicContact CG-CD1 4.23Å; N215-I217 HydrophobicContact CB-CD1 4.29Å; N215-I217 HydrophobicContact CB-CG1 4.3Å; I217-D219 WeakPolarHBondContact CG2-O 3.42Å; I217-L234 HydrophobicContact CD1-CD2 3.81Å; I217-N237 HydrophobicContact CB-CB 4.38Å; I217-N237 VanDerWaalsContact CB-OD1 3.31Å; I217-N237 WeakPolarHBondContact CB-OD1 3.41Å; I217-N237 WeakPolarHBondContact CG1-OD1 3.4Å; I217-N237 PolarHBondContact N-OD1 3.36Å; I217-R238 CarbonylContact O-C 3.47Å; I217-R238 WeakPolarHBondContact O-CA 3.3Å; I217-R238 PolarHBondContact O-N 3.43Å; I217-I239 PolarHBondContact O-N 3.49Å
218	S	93.8	Very high	93.2	Very high	42 Å²	42	34.3 Å²	34.3	29%	0.294	19%	0.19	S	C	.	.			trans	-96.1	-25.2	178	-58	0	0	0	0	114.4	I239	S218-I239 WeakPolarHBondContact O-CA 3.4Å
219	D	92.8	Very high	93.2	Very high	83 Å²	83	32.1 Å²	32.1	44%	0.444	18%	0.177	S	C	.	.			trans	-138.5	145.2	-173.2	-61.2	-68.6	0	0	0	110.6	I217 N221	I217-D219 WeakPolarHBondContact CG2-O 3.42Å; D219-N221 PolarHBondContact O-N 2.79Å
220	M	93.4	Very high	93.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.			trans	-86	9.3	-178.3	-58.1	173.7	60.7	0	0	113.5	I223 L232 L234 I239 I242 L245 L256	M220-I223 HydrophobicContact CB-CD1 4.06Å; M220-I223 HydrophobicContact CE-CD1 3.85Å; M220-I223 WeakPolarHBondContact O-CG1 3.2Å; M220-L232 HydrophobicContact CE-CD2 4.33Å; M220-L234 HydrophobicContact CE-CD1 3.94Å; M220-L234 HydrophobicContact CG-CD1 4.27Å; M220-I239 HydrophobicContact CG-CD1 3.93Å; M220-I239 HydrophobicContact CG-CG1 4.38Å; M220-I239 HydrophobicContact CG-CG2 3.92Å; M220-I239 HydrophobicContact SD-CD1 4.48Å; M220-I239 HydrophobicContact SD-CG2 4.04Å; M220-I242 HydrophobicContact SD-CG2 4.4Å; M220-L245 HydrophobicContact CE-CD1 4.36Å; M220-L245 HydrophobicContact CE-CD2 3.69Å; M220-L245 HydrophobicContact CE-CG 4.11Å; M220-L256 HydrophobicContact CE-CD2 4.36Å; M220-L256 HydrophobicContact SD-CD2 4.17Å
221	N	91.5	Very high	93.3	Very high	83 Å²	83	35.3 Å²	35.3	44%	0.444	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	141	-175.9	-58.9	-11.5	0	0	0	111.7	I198 D219 C243 C244	I198-N221 WeakPolarHBondContact CB-O 3.35Å; D219-N221 PolarHBondContact O-N 2.79Å; N221-C243 PolarHBondContact OD1-SG 3.37Å; N221-C244 PolarHBondContact OD1-SG 2.91Å
222	G	86.6	Confident	93.4	Very high	23 Å²	23	34.6 Å²	34.6	24%	0.237	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	98	-11.3	178.6	0	0	0	0	0	116.1	E224	G222-E224 VanDerWaalsContact C-N 3.31Å
223	I	92	Very high	93.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.198	C	C	.	.			trans	-80.3	-9.7	172.2	69.8	-174	0	0	0	113.9	I198 L210 M220 H225 L226 L232 C244 L245 L248	I198-I223 HydrophobicContact CD1-CG2 3.88Å; I198-I223 HydrophobicContact CG2-CG2 4.05Å; L210-I223 HydrophobicContact CD2-CG2 4.38Å; M220-I223 HydrophobicContact CB-CD1 4.06Å; M220-I223 HydrophobicContact CE-CD1 3.85Å; M220-I223 WeakPolarHBondContact O-CG1 3.2Å; I223-H225 PolarHBondContact O-N 3.13Å; I223-L226 HydrophobicContact CB-CD1 3.98Å; I223-L226 HydrophobicContact CG2-CD1 4.29Å; I223-L226 WeakPolarHBondContact O-CB 3.36Å; I223-L226 WeakPolarHBondContact O-CG 3.34Å; I223-L226 PolarHBondContact O-N 3.04Å; I223-L226 VanDerWaalsContact O-N 3.1Å; I223-L232 HydrophobicContact CD1-CD2 3.86Å; I223-C244 HydrophobicContact CD1-CB 4.34Å; I223-C244 HydrophobicContact CG1-CB 3.84Å; I223-L245 HydrophobicContact CD1-CD2 3.81Å; I223-L248 HydrophobicContact CD1-CD1 4.16Å; I223-L248 HydrophobicContact CG1-CD1 4.26Å
224	E	90.4	Very high	93.5	Very high	75 Å²	75	36.3 Å²	36.3	35%	0.35	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-24.4	-168.3	-61.7	166.2	-166.5	0	0	115.6	G222 C244 R247	G222-E224 VanDerWaalsContact C-N 3.31Å; E224-C244 HydrophobicContact CG-CB 3.54Å; E224-C244 PolarHBondContact OE1-SG 3.17Å; E224-R247 WeakPolarHBondContact O-CB 3.39Å; E224-R247 WeakPolarHBondContact O-CD 3.25Å
225	H	87.9	Confident	93.5	Very high	73 Å²	73	33.1 Å²	33.1	34%	0.338	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-2.7	-172.3	-65.5	80	0	0	0	113.2	I223 S227 R247	I223-H225 PolarHBondContact O-N 3.13Å; H225-S227 VanDerWaalsContact C-N 3.26Å; H225-S227 PolarHBondContact O-N 2.69Å; H225-R247 PolarHBondContact CD2-NH1 2.98Å; H225-R247 VanDerWaalsContact CD2-NH1 3.33Å; H225-R247 PolarHBondContact NE2-NH1 3.25Å
226	L	90.6	Very high	93.5	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.			trans	-82.7	54.4	-172.7	-55.3	171.9	0	0	0	113.2	L201 L204 L207 L210 I223 S228 L229 L248	L201-L226 HydrophobicContact CB-CD2 4.27Å; L201-L226 HydrophobicContact CD1-CD1 4.02Å; L204-L226 HydrophobicContact CB-CD2 4.13Å; L204-L226 WeakPolarHBondContact O-CD2 3.42Å; L207-L226 HydrophobicContact CB-CD2 4.17Å; L207-L226 HydrophobicContact CD2-CD1 4.23Å; L207-L226 HydrophobicContact CD2-CD2 4.12Å; L210-L226 HydrophobicContact CD2-CD1 4.1Å; I223-L226 HydrophobicContact CB-CD1 3.98Å; I223-L226 HydrophobicContact CG2-CD1 4.29Å; I223-L226 WeakPolarHBondContact O-CB 3.36Å; I223-L226 WeakPolarHBondContact O-CG 3.34Å; I223-L226 PolarHBondContact O-N 3.04Å; I223-L226 VanDerWaalsContact O-N 3.1Å; L226-S228 PolarHBondContact O-N 2.91Å; L226-L229 HydrophobicContact CB-CB 4.12Å; L226-L229 HydrophobicContact CD1-CD2 4.33Å; L226-L229 VanDerWaalsContact O-CB 3.23Å; L226-L229 WeakPolarHBondContact O-CB 3.49Å; L226-L229 PolarHBondContact O-N 3.22Å; L226-L248 HydrophobicContact CB-CD2 4.07Å; L226-L248 VanDerWaalsContact O-CD2 3.23Å; L226-L248 WeakPolarHBondContact O-CD2 3.34Å
227	S	89.3	Confident	93.6	Very high	34 Å²	34	34.5 Å²	34.5	24%	0.238	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-2.8	-171.8	71	0	0	0	0	116.9	H225 K250	H225-S227 VanDerWaalsContact C-N 3.26Å; H225-S227 PolarHBondContact O-N 2.69Å; S227-K250 WeakPolarHBondContact O-CE 3.43Å; S227-K250 PolarHBondContact O-NZ 2.92Å; S227-K250 VanDerWaalsContact O-NZ 3.13Å
228	S	92.2	Very high	93.6	Very high	30 Å²	30	39.8 Å²	39.8	21%	0.21	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-2	172	-58.4	0	0	0	0	114.3	Q205 L207 L226 R230	Q205-S228 WeakPolarHBondContact O-CB 3.45Å; Q205-S228 PolarHBondContact O-OG 3.15Å; L207-S228 CarbonylContact O-C 3.37Å; L207-S228 VanDerWaalsContact O-C 3.28Å; L226-S228 PolarHBondContact O-N 2.91Å; S228-R230 PolarHBondContact O-N 2.87Å
229	L	94.9	Very high	93.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.188	C	C	.	.			trans	-65.3	125.1	-173.6	-161.5	70.9	0	0	0	111.5	L207 L210 L226 L232 L248 K250 L251	L207-L229 HydrophobicContact CD2-CD1 4.38Å; L207-L229 HydrophobicContact CG-CD1 4.22Å; L207-L229 VanDerWaalsContact O-CA 3.22Å; L207-L229 WeakPolarHBondContact O-CA 3.47Å; L207-L229 PolarHBondContact O-N 3.39Å; L207-L229 VanDerWaalsContact O-N 3.13Å; L210-L229 HydrophobicContact CB-CD1 3.84Å; L226-L229 HydrophobicContact CB-CB 4.12Å; L226-L229 HydrophobicContact CD1-CD2 4.33Å; L226-L229 VanDerWaalsContact O-CB 3.23Å; L226-L229 WeakPolarHBondContact O-CB 3.49Å; L226-L229 PolarHBondContact O-N 3.22Å; L229-L232 HydrophobicContact CD2-CB 3.92Å; L229-L232 HydrophobicContact CD2-CD1 4.22Å; L229-L232 HydrophobicContact CD2-CD2 4.24Å; L229-L232 HydrophobicContact CD2-CG 4.35Å; L229-L248 HydrophobicContact CD2-CD1 4.26Å; L229-K250 CarbonylContact O-C 3.58Å; L229-L251 HydrophobicContact CD2-CD1 4.22Å; L229-L251 HydrophobicContact CG-CD1 4.17Å; L229-L251 WeakPolarHBondContact O-CA 3.47Å; L229-L251 PolarHBondContact O-N 3.16Å
230	R	96	Very high	93.8	Very high	98 Å²	98	38.2 Å²	38.2	37%	0.37	19%	0.187	S	C	.	.			trans	-109	-30.5	177.7	-65.8	-162.9	163.4	-72.6	8	113	T208 S228 K250 S252 I253 E272	T208-R230 HydrophobicContact CG2-CB 4.02Å; T208-R230 HydrophobicContact CG2-CG 4Å; T208-R230 PolarHBondContact O-N 3.21Å; S228-R230 PolarHBondContact O-N 2.87Å; R230-K250 PolarHBondContact NH1-O 2.63Å; R230-S252 WeakPolarHBondContact O-CA 3.41Å; R230-S252 PolarHBondContact O-N 2.95Å; R230-I253 PolarHBondContact O-N 2.94Å; R230-E272 IonicContact CZ-OE2 3.74Å; R230-E272 IonicContact NH1-OE2 2.75Å; R230-E272 PolarHBondContact NH1-OE2 2.8Å; R230-E272 IonicContact NH2-OE2 3.78Å; R230-E272 PolarHBondContact NH2-OE2 3.42Å
231	V	97.3	Very high	93.9	Very high	28 Å²	28	43 Å²	43	17%	0.17	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	122.4	-179.9	-177.1	0	0	0	0	109.5	T208 I209 L210 M233 I253	T208-V231 PolarHBondContact O-N 3.37Å; I209-V231 WeakPolarHBondContact CA-O 3.46Å; I209-V231 HydrophobicContact CB-CB 4.44Å; I209-V231 HydrophobicContact CG1-CB 4.11Å; I209-V231 HydrophobicContact CG1-CG2 4.22Å; I209-V231 HydrophobicContact CG2-CB 4.21Å; I209-V231 HydrophobicContact CG2-CG1 4.37Å; L210-V231 PolarHBondContact N-O 3.15Å; V231-M233 HydrophobicContact CG1-CG 4.05Å; V231-M233 HydrophobicContact CG1-SD 4.43Å; V231-I253 HydrophobicContact CG1-CB 4.21Å; V231-I253 HydrophobicContact CG1-CG2 4.35Å; V231-I253 HydrophobicContact CG2-CB 4.27Å; V231-I253 HydrophobicContact CG2-CD1 4.22Å; V231-I253 HydrophobicContact CG2-CG1 4.44Å
232	L	97.1	Very high	94.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	115.7	174.1	179.9	53.9	0	0	0	109.5	L210 M220 I223 L229 L234 L245 L251 I253 L254 D255	L210-L232 HydrophobicContact CB-CD1 4.13Å; L210-L232 HydrophobicContact CD2-CD1 3.97Å; L210-L232 HydrophobicContact CG-CD1 4.11Å; M220-L232 HydrophobicContact CE-CD2 4.33Å; I223-L232 HydrophobicContact CD1-CD2 3.86Å; L229-L232 HydrophobicContact CD2-CB 3.92Å; L229-L232 HydrophobicContact CD2-CD1 4.22Å; L229-L232 HydrophobicContact CD2-CD2 4.24Å; L229-L232 HydrophobicContact CD2-CG 4.35Å; L232-L234 HydrophobicContact CD1-CD1 3.83Å; L232-L234 HydrophobicContact CD1-CG 3.93Å; L232-L234 HydrophobicContact CD2-CD1 3.87Å; L232-L234 HydrophobicContact CG-CD1 3.83Å; L232-L234 HydrophobicContact CG-CG 4.2Å; L232-L245 HydrophobicContact CD2-CD2 4.25Å; L232-L251 HydrophobicContact CB-CD1 3.83Å; L232-I253 PolarHBondContact N-O 3.16Å; L232-L254 HydrophobicContact CB-CD1 4.1Å; L232-L254 HydrophobicContact CD2-CD1 3.95Å; L232-L254 HydrophobicContact CG-CD1 4.06Å; L232-D255 PolarHBondContact O-N 2.88Å
233	M	97.6	Very high	94.3	Very high	60 Å²	60	39 Å²	39	30%	0.296	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	113	177.5	-58.5	-179.6	70.2	0	0	109.9	L210 N211 L212 V231 D255	L210-M233 PolarHBondContact O-N 2.87Å; N211-M233 HydrophobicContact CB-CB 4.37Å; N211-M233 WeakPolarHBondContact OD1-CB 3.22Å; L212-M233 CarbonylContact C-O 3.37Å; L212-M233 WeakPolarHBondContact CA-O 3.45Å; L212-M233 PolarHBondContact N-O 2.99Å; V231-M233 HydrophobicContact CG1-CG 4.05Å; V231-M233 HydrophobicContact CG1-SD 4.43Å; M233-D255 HydrophobicContact CG-CB 4.38Å
234	L	96.7	Very high	94.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.187	C	C	.	.			trans	-129.9	14.2	-178.6	-78	166.7	0	0	0	111.7	I198 L212 I217 M220 L232 N237 I239 D255 L256 N259	I198-L234 HydrophobicContact CD1-CD2 4.1Å; L212-L234 HydrophobicContact CB-CD2 3.71Å; L212-L234 HydrophobicContact CD1-CD2 3.96Å; L212-L234 HydrophobicContact CG-CD2 4.5Å; I217-L234 HydrophobicContact CD1-CD2 3.81Å; M220-L234 HydrophobicContact CE-CD1 3.94Å; M220-L234 HydrophobicContact CG-CD1 4.27Å; L232-L234 HydrophobicContact CD1-CD1 3.83Å; L232-L234 HydrophobicContact CD1-CG 3.93Å; L232-L234 HydrophobicContact CD2-CD1 3.87Å; L232-L234 HydrophobicContact CG-CD1 3.83Å; L232-L234 HydrophobicContact CG-CG 4.2Å; L234-N237 WeakPolarHBondContact O-CB 3.41Å; L234-N237 PolarHBondContact O-ND2 3.43Å; L234-I239 HydrophobicContact CB-CD1 3.85Å; L234-I239 HydrophobicContact CD1-CD1 4.04Å; L234-I239 HydrophobicContact CD2-CD1 4.25Å; L234-I239 HydrophobicContact CG-CD1 4.28Å; L234-D255 CarbonylContact C-O 3.59Å; L234-D255 WeakPolarHBondContact CA-O 3.49Å; L234-D255 PolarHBondContact N-O 3.37Å; L234-L256 HydrophobicContact CB-CD2 3.69Å; L234-L256 HydrophobicContact CD1-CD2 4.11Å; L234-N259 PolarHBondContact O-ND2 3.49Å
235	G	96.2	Very high	94.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.17	C	C	.	.			trans	-59.8	149.4	176.5	0	0	0	0	0	112.9	H213 D214 N237 D255 H257	H213-G235 WeakPolarHBondContact CA-O 3.5Å; H213-G235 PolarHBondContact ND1-O 2.86Å; D214-G235 PolarHBondContact N-O 3.03Å; G235-N237 PolarHBondContact O-ND2 3.2Å; G235-D255 PolarHBondContact N-O 2.84Å; G235-H257 CarbonylContact C-O 3.46Å; G235-H257 WeakPolarHBondContact CA-O 3.23Å
236	K	96.5	Very high	94.5	Very high	85 Å²	85	39.3 Å²	39.3	37%	0.37	19%	0.185	S	C	.	.	S	Bend	trans	56	65.1	-172.1	-64.4	177.8	-165.7	159.3	0	112.5	D214 N215 H257 D258	D214-K236 VanDerWaalsContact CA-O 3.28Å; D214-K236 WeakPolarHBondContact CA-O 3.25Å; D214-K236 HydrophobicContact CB-CB 4.23Å; D214-K236 HydrophobicContact CB-CD 4.48Å; D214-K236 PolarHBondContact N-O 3.32Å; N215-K236 PolarHBondContact N-O 2.86Å; K236-H257 PolarHBondContact N-O 2.92Å; K236-D258 VanDerWaalsContact CA-O 3.32Å; K236-D258 WeakPolarHBondContact CA-O 3.34Å; K236-D258 HydrophobicContact CB-CB 4.4Å; K236-D258 VanDerWaalsContact CE-OD2 3.32Å; K236-D258 WeakPolarHBondContact CE-OD2 3.31Å; K236-D258 HydrophobicContact CG-CB 3.6Å; K236-D258 WeakPolarHBondContact CG-OD2 3.26Å
237	N	97.1	Very high	94.4	Very high	10 Å²	10	45.7 Å²	45.7	5%	0.053	21%	0.209	C	C	.	.	S	Bend	trans	-135.5	-163.7	173.4	-85.5	-78.5	0	0	0	109.2	L212 N215 H216 I217 L234 G235 I239 D258 N259	L212-N237 PolarHBondContact O-ND2 3.05Å; N215-N237 WeakPolarHBondContact CA-OD1 3.43Å; N215-N237 WeakPolarHBondContact CB-OD1 3.41Å; N215-N237 PolarHBondContact O-OD1 2.84Å; H216-N237 PolarHBondContact N-OD1 3.39Å; I217-N237 HydrophobicContact CB-CB 4.38Å; I217-N237 VanDerWaalsContact CB-OD1 3.31Å; I217-N237 WeakPolarHBondContact CB-OD1 3.41Å; I217-N237 WeakPolarHBondContact CG1-OD1 3.4Å; I217-N237 PolarHBondContact N-OD1 3.36Å; L234-N237 WeakPolarHBondContact O-CB 3.41Å; L234-N237 PolarHBondContact O-ND2 3.43Å; G235-N237 PolarHBondContact O-ND2 3.2Å; N237-I239 HydrophobicContact CB-CD1 4.24Å; N237-I239 HydrophobicContact CB-CG1 4.17Å; N237-D258 PolarHBondContact N-O 3.15Å; N237-N259 WeakPolarHBondContact CA-OD1 3.44Å; N237-N259 WeakPolarHBondContact CB-OD1 3.41Å; N237-N259 PolarHBondContact O-OD1 2.86Å
238	R	96.6	Very high	94.6	Very high	111 Å²	111	44 Å²	44	42%	0.419	20%	0.198	S	C	.	.			trans	-117.4	20.4	-177	-57.3	179.8	-174.9	178.6	3.6	111.8	H216 I217 H240 N259	H216-R238 PolarHBondContact CD2-NH2 2.94Å; H216-R238 PolarHBondContact CE1-NH2 2.98Å; H216-R238 VanDerWaalsContact CE1-NH2 3.32Å; H216-R238 PolarHBondContact ND1-NH2 3.31Å; H216-R238 PolarHBondContact NE2-NH2 3.47Å; I217-R238 CarbonylContact O-C 3.47Å; I217-R238 WeakPolarHBondContact O-CA 3.3Å; I217-R238 PolarHBondContact O-N 3.43Å; R238-H240 PolarHBondContact O-N 2.77Å; R238-N259 PolarHBondContact N-OD1 3.36Å
239	I	96.6	Very high	94.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	21%	0.21	C	C	.	.			trans	-63.7	122.1	-171.3	-60.4	166.4	0	0	0	110.2	I217 S218 M220 L234 N237 K241 L256 N259 Q260 I261	I217-I239 PolarHBondContact O-N 3.49Å; S218-I239 WeakPolarHBondContact O-CA 3.4Å; M220-I239 HydrophobicContact CG-CD1 3.93Å; M220-I239 HydrophobicContact CG-CG1 4.38Å; M220-I239 HydrophobicContact CG-CG2 3.92Å; M220-I239 HydrophobicContact SD-CD1 4.48Å; M220-I239 HydrophobicContact SD-CG2 4.04Å; L234-I239 HydrophobicContact CB-CD1 3.85Å; L234-I239 HydrophobicContact CD1-CD1 4.04Å; L234-I239 HydrophobicContact CD2-CD1 4.25Å; L234-I239 HydrophobicContact CG-CD1 4.28Å; N237-I239 HydrophobicContact CB-CD1 4.24Å; N237-I239 HydrophobicContact CB-CG1 4.17Å; I239-K241 WeakPolarHBondContact CG2-O 3.47Å; I239-L256 HydrophobicContact CD1-CD2 3.74Å; I239-N259 HydrophobicContact CB-CB 4.44Å; I239-N259 VanDerWaalsContact CB-OD1 3.24Å; I239-N259 WeakPolarHBondContact CB-OD1 3.43Å; I239-N259 WeakPolarHBondContact CG1-OD1 3.29Å; I239-N259 PolarHBondContact N-OD1 2.81Å; I239-Q260 CarbonylContact O-C 3.16Å; I239-Q260 VanDerWaalsContact O-CA 3.32Å; I239-Q260 WeakPolarHBondContact O-CA 3.27Å; I239-Q260 PolarHBondContact O-N 3.37Å; I239-I261 HydrophobicContact CG2-CD1 4.49Å; I239-I261 HydrophobicContact CG2-CG1 4.25Å; I239-I261 PolarHBondContact O-N 2.99Å
240	H	94.3	Very high	94.4	Very high	93 Å²	93	50.6 Å²	50.6	43%	0.431	22%	0.22	S	C	.	.			trans	-92	-25.2	179.2	-66	-53	0	0	0	113.6	R238 Q260	R238-H240 PolarHBondContact O-N 2.77Å; H240-Q260 PolarHBondContact CE1-OE1 2.98Å; H240-Q260 WeakPolarHBondContact ND1-CB 3.4Å
241	K	94.8	Very high	94.4	Very high	100 Å²	100	46 Å²	46	44%	0.435	20%	0.203	S	C	.	.	S	Bend	trans	-143.6	140.4	-171.5	-163.7	-175.5	-174.3	-172.9	0	111.1	I239 C243 E265	I239-K241 WeakPolarHBondContact CG2-O 3.47Å; K241-C243 PolarHBondContact O-N 3.2Å; K241-E265 WeakPolarHBondContact CE-OE1 3.45Å; K241-E265 WeakPolarHBondContact CE-OE2 3.39Å; K241-E265 IonicContact NZ-OE1 2.97Å; K241-E265 IonicContact NZ-OE2 3.9Å; K241-E265 PolarHBondContact NZ-OE2 3.02Å
242	I	94.6	Very high	94.4	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	20%	0.201	C	C	.	.			trans	-78.9	116.3	167.5	-53.5	178.1	0	0	0	108.4	M220 L245 L256 I261 E265 I267 L278	M220-I242 HydrophobicContact SD-CG2 4.4Å; I242-L245 HydrophobicContact CG2-CD1 3.41Å; I242-L245 VanDerWaalsContact CG2-CD1 3.41Å; I242-L245 HydrophobicContact CG2-CG 4.19Å; I242-L256 HydrophobicContact CD1-CD1 4.33Å; I242-L256 HydrophobicContact CG1-CD1 4.26Å; I242-I261 HydrophobicContact CD1-CD1 4.44Å; I242-I261 HydrophobicContact CD1-CG2 4.29Å; I242-I261 HydrophobicContact CG1-CD1 3.96Å; I242-I261 HydrophobicContact CG1-CG1 4.48Å; I242-I261 HydrophobicContact CG1-CG2 4.06Å; I242-E265 WeakPolarHBondContact CB-O 3.2Å; I242-E265 WeakPolarHBondContact CG2-O 3.23Å; I242-I267 HydrophobicContact CD1-CG2 4.25Å; I242-I267 HydrophobicContact CG2-CG2 4.13Å; I242-L278 HydrophobicContact CD1-CD2 4.12Å
243	C	92.7	Very high	94.4	Very high	21 Å²	21	48.6 Å²	48.6	14%	0.142	22%	0.217	C	C	.	.			trans	-141	172.2	178.9	60.3	0	0	0	0	111.7	N221 K241 L245	N221-C243 PolarHBondContact OD1-SG 3.37Å; K241-C243 PolarHBondContact O-N 3.2Å; C243-L245 PolarHBondContact O-N 3.4Å
244	C	91.1	Very high	94.4	Very high	14 Å²	14	45.7 Å²	45.7	10%	0.095	20%	0.202	C	C	.	.	S	Bend	trans	63.3	12.4	170.3	-59.1	0	0	0	0	116.8	N221 I223 E224	N221-C244 PolarHBondContact OD1-SG 2.91Å; I223-C244 HydrophobicContact CD1-CB 4.34Å; I223-C244 HydrophobicContact CG1-CB 3.84Å; E224-C244 HydrophobicContact CG-CB 3.54Å; E224-C244 PolarHBondContact OE1-SG 3.17Å
245	L	92.4	Very high	94.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	21%	0.206	C	C	.	.			trans	-85.3	-6.3	179.2	-61.2	-176.5	0	0	0	114.5	M220 I223 L232 I242 C243 R247 L248 L254 I267 H269 L270	M220-L245 HydrophobicContact CE-CD1 4.36Å; M220-L245 HydrophobicContact CE-CD2 3.69Å; M220-L245 HydrophobicContact CE-CG 4.11Å; I223-L245 HydrophobicContact CD1-CD2 3.81Å; L232-L245 HydrophobicContact CD2-CD2 4.25Å; I242-L245 HydrophobicContact CG2-CD1 3.41Å; I242-L245 VanDerWaalsContact CG2-CD1 3.41Å; I242-L245 HydrophobicContact CG2-CG 4.19Å; C243-L245 PolarHBondContact O-N 3.4Å; L245-R247 VanDerWaalsContact C-N 3.26Å; L245-R247 PolarHBondContact O-N 3.48Å; L245-R247 VanDerWaalsContact O-N 3.08Å; L245-L248 HydrophobicContact CD2-CD1 3.71Å; L245-L248 WeakPolarHBondContact O-CB 3.27Å; L245-L248 PolarHBondContact O-N 3.32Å; L245-L254 HydrophobicContact CD1-CD2 3.73Å; L245-I267 HydrophobicContact CD1-CG2 4.19Å; L245-H269 VanDerWaalsContact C-NE2 3.35Å; L245-H269 PolarHBondContact O-NE2 3.21Å; L245-L270 HydrophobicContact CD1-CD1 4.03Å
246	E	90	Very high	94.5	Very high	140 Å²	140	46.4 Å²	46.4	65%	0.654	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-36.1	-167.7	-66.9	172.7	-159	0	0	114.9	H269	E246-H269 WeakPolarHBondContact CA-NE2 3.25Å
247	R	89.2	Confident	94.5	Very high	134 Å²	134	43.7 Å²	43.7	51%	0.506	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	3.9	-177.3	-59.1	-177.9	-175.6	157.9	-0.9	114	E224 H225 L245 Y249	E224-R247 WeakPolarHBondContact O-CB 3.39Å; E224-R247 WeakPolarHBondContact O-CD 3.25Å; H225-R247 PolarHBondContact CD2-NH1 2.98Å; H225-R247 VanDerWaalsContact CD2-NH1 3.33Å; H225-R247 PolarHBondContact NE2-NH1 3.25Å; L245-R247 VanDerWaalsContact C-N 3.26Å; L245-R247 PolarHBondContact O-N 3.48Å; L245-R247 VanDerWaalsContact O-N 3.08Å; R247-Y249 VanDerWaalsContact C-N 3.31Å; R247-Y249 VanDerWaalsContact O-CD1 3.24Å; R247-Y249 WeakPolarHBondContact O-CD1 3.5Å; R247-Y249 PolarHBondContact O-N 2.88Å
248	L	92	Very high	94.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	21%	0.211	C	C	.	.			trans	-93.4	47.6	-172.8	-53.3	-171.7	0	0	0	112.5	I223 L226 L229 L245 K250 L251 L270	I223-L248 HydrophobicContact CD1-CD1 4.16Å; I223-L248 HydrophobicContact CG1-CD1 4.26Å; L226-L248 HydrophobicContact CB-CD2 4.07Å; L226-L248 VanDerWaalsContact O-CD2 3.23Å; L226-L248 WeakPolarHBondContact O-CD2 3.34Å; L229-L248 HydrophobicContact CD2-CD1 4.26Å; L245-L248 HydrophobicContact CD2-CD1 3.71Å; L245-L248 WeakPolarHBondContact O-CB 3.27Å; L245-L248 PolarHBondContact O-N 3.32Å; L248-K250 PolarHBondContact O-N 3.38Å; L248-K250 VanDerWaalsContact O-N 3.1Å; L248-L251 HydrophobicContact CB-CB 4.3Å; L248-L251 WeakPolarHBondContact O-CB 3.39Å; L248-L251 PolarHBondContact O-N 3.34Å; L248-L270 HydrophobicContact CB-CD2 4.46Å; L248-L270 WeakPolarHBondContact O-CD2 3.22Å
249	Y	90.5	Very high	94.6	Very high	120 Å²	120	41.9 Å²	41.9	47%	0.471	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-19.5	-171.5	58.3	-88	0	0	0	115.2	R247	R247-Y249 VanDerWaalsContact C-N 3.31Å; R247-Y249 VanDerWaalsContact O-CD1 3.24Å; R247-Y249 WeakPolarHBondContact O-CD1 3.5Å; R247-Y249 PolarHBondContact O-N 2.88Å
250	K	94.1	Very high	94.6	Very high	48 Å²	48	44.7 Å²	44.7	21%	0.209	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	2.1	176.3	-53.9	-176.5	-164.3	141.5	0	114.2	S227 L229 R230 L248 S252	S227-K250 WeakPolarHBondContact O-CE 3.43Å; S227-K250 PolarHBondContact O-NZ 2.92Å; S227-K250 VanDerWaalsContact O-NZ 3.13Å; L229-K250 CarbonylContact O-C 3.58Å; R230-K250 PolarHBondContact NH1-O 2.63Å; L248-K250 PolarHBondContact O-N 3.38Å; L248-K250 VanDerWaalsContact O-N 3.1Å; K250-S252 PolarHBondContact O-N 3.39Å
251	L	95.9	Very high	94.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.186	C	C	.	.			trans	-68	119.7	-174.7	-169	73.6	0	0	0	110	L229 L232 L248 L254 L270 E272 L273	L229-L251 HydrophobicContact CD2-CD1 4.22Å; L229-L251 HydrophobicContact CG-CD1 4.17Å; L229-L251 WeakPolarHBondContact O-CA 3.47Å; L229-L251 PolarHBondContact O-N 3.16Å; L232-L251 HydrophobicContact CB-CD1 3.83Å; L248-L251 HydrophobicContact CB-CB 4.3Å; L248-L251 WeakPolarHBondContact O-CB 3.39Å; L248-L251 PolarHBondContact O-N 3.34Å; L251-L254 HydrophobicContact CD2-CB 3.96Å; L251-L254 HydrophobicContact CD2-CD1 4.27Å; L251-L254 HydrophobicContact CD2-CD2 4.23Å; L251-L254 HydrophobicContact CD2-CG 4.39Å; L251-L270 HydrophobicContact CB-CD2 4.47Å; L251-L270 HydrophobicContact CD2-CD1 4.38Å; L251-E272 CarbonylContact O-C 3.56Å; L251-L273 HydrophobicContact CG-CD1 4.43Å; L251-L273 WeakPolarHBondContact O-CA 3.41Å; L251-L273 PolarHBondContact O-N 3.33Å; L251-L273 VanDerWaalsContact O-N 3.14Å
252	S	96.3	Very high	94.7	Very high	20 Å²	20	43.5 Å²	43.5	14%	0.14	20%	0.195	C	C	.	.			trans	-108.1	-28.9	-174	-178.1	0	0	0	0	112.6	R230 K250 E272 Q274 V275	R230-S252 WeakPolarHBondContact O-CA 3.41Å; R230-S252 PolarHBondContact O-N 2.95Å; K250-S252 PolarHBondContact O-N 3.39Å; S252-E272 WeakPolarHBondContact CA-O 3.37Å; S252-Q274 PolarHBondContact O-N 3.02Å; S252-V275 PolarHBondContact O-N 3.32Å; S252-V275 VanDerWaalsContact O-N 3.12Å
253	I	97.5	Very high	94.6	Very high	63 Å²	63	48.1 Å²	48.1	32%	0.323	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	123	176.2	-57.3	179.8	0	0	0	108.6	R230 V231 L232 V275	R230-I253 PolarHBondContact O-N 2.94Å; V231-I253 HydrophobicContact CG1-CB 4.21Å; V231-I253 HydrophobicContact CG1-CG2 4.35Å; V231-I253 HydrophobicContact CG2-CB 4.27Å; V231-I253 HydrophobicContact CG2-CD1 4.22Å; V231-I253 HydrophobicContact CG2-CG1 4.44Å; L232-I253 PolarHBondContact N-O 3.16Å; I253-V275 HydrophobicContact CG1-CB 4.26Å; I253-V275 HydrophobicContact CG1-CG2 4.38Å; I253-V275 HydrophobicContact CG2-CB 4.31Å
254	L	97.4	Very high	94.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	114.2	172.4	178.8	55.1	0	0	0	109.6	L232 L245 L251 L256 L273 V275 L276 N277	L232-L254 HydrophobicContact CB-CD1 4.1Å; L232-L254 HydrophobicContact CD2-CD1 3.95Å; L232-L254 HydrophobicContact CG-CD1 4.06Å; L245-L254 HydrophobicContact CD1-CD2 3.73Å; L251-L254 HydrophobicContact CD2-CB 3.96Å; L251-L254 HydrophobicContact CD2-CD1 4.27Å; L251-L254 HydrophobicContact CD2-CD2 4.23Å; L251-L254 HydrophobicContact CD2-CG 4.39Å; L254-L256 HydrophobicContact CD1-CD1 3.85Å; L254-L256 HydrophobicContact CD1-CG 3.91Å; L254-L256 HydrophobicContact CD2-CD1 3.88Å; L254-L256 HydrophobicContact CG-CD1 3.81Å; L254-L256 HydrophobicContact CG-CG 4.17Å; L254-L273 HydrophobicContact CB-CD1 3.86Å; L254-V275 PolarHBondContact N-O 2.92Å; L254-L276 HydrophobicContact CB-CD1 4.05Å; L254-L276 HydrophobicContact CD2-CD1 3.92Å; L254-L276 HydrophobicContact CG-CD1 3.98Å; L254-N277 PolarHBondContact O-N 3.42Å
255	D	97.7	Very high	94.7	Very high	15 Å²	15	49.3 Å²	49.3	8%	0.08	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	114.6	178	-179.8	31.7	0	0	0	111.3	L232 M233 L234 G235 H257 N277	L232-D255 PolarHBondContact O-N 2.88Å; M233-D255 HydrophobicContact CG-CB 4.38Å; L234-D255 CarbonylContact C-O 3.59Å; L234-D255 WeakPolarHBondContact CA-O 3.49Å; L234-D255 PolarHBondContact N-O 3.37Å; G235-D255 PolarHBondContact N-O 2.84Å; D255-H257 IonicContact OD1-CE1 2.79Å; D255-H257 IonicContact OD1-CG 3.21Å; D255-H257 PolarHBondContact OD1-N 2.89Å; D255-H257 IonicContact OD1-ND1 3.36Å; D255-H257 PolarHBondContact OD1-ND1 3.35Å; D255-H257 IonicContact OD2-CE1 2.76Å; D255-H257 PolarHBondContact OD2-CE1 2.94Å; D255-H257 IonicContact OD2-ND1 3.56Å; D255-H257 PolarHBondContact OD2-ND1 3.46Å; D255-N277 WeakPolarHBondContact OD1-CB 3.42Å; D255-N277 PolarHBondContact OD1-ND2 2.79Å
256	L	97	Very high	94.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	23%	0.229	C	C	.	.			trans	-130	27.1	-175.7	-74.6	166.2	0	0	0	111.3	M220 L234 I239 I242 L254 N259 I261 N277 L278 N281	M220-L256 HydrophobicContact CE-CD2 4.36Å; M220-L256 HydrophobicContact SD-CD2 4.17Å; L234-L256 HydrophobicContact CB-CD2 3.69Å; L234-L256 HydrophobicContact CD1-CD2 4.11Å; I239-L256 HydrophobicContact CD1-CD2 3.74Å; I242-L256 HydrophobicContact CD1-CD1 4.33Å; I242-L256 HydrophobicContact CG1-CD1 4.26Å; L254-L256 HydrophobicContact CD1-CD1 3.85Å; L254-L256 HydrophobicContact CD1-CG 3.91Å; L254-L256 HydrophobicContact CD2-CD1 3.88Å; L254-L256 HydrophobicContact CG-CD1 3.81Å; L254-L256 HydrophobicContact CG-CG 4.17Å; L256-N259 PolarHBondContact O-ND2 2.81Å; L256-I261 HydrophobicContact CB-CD1 3.96Å; L256-I261 HydrophobicContact CD1-CD1 4.09Å; L256-I261 HydrophobicContact CD2-CD1 4.37Å; L256-I261 HydrophobicContact CG-CD1 4.38Å; L256-N277 CarbonylContact C-O 3.45Å; L256-N277 WeakPolarHBondContact CA-O 3.25Å; L256-N277 PolarHBondContact N-O 2.93Å; L256-L278 HydrophobicContact CB-CD2 3.83Å; L256-L278 HydrophobicContact CD1-CD2 4.07Å; L256-N281 PolarHBondContact O-ND2 3.27Å
257	H	97.6	Very high	94.7	Very high	28 Å²	28	44.7 Å²	44.7	13%	0.13	20%	0.198	C	C	.	.			trans	-63.4	161.9	179.3	70.1	-88.7	0	0	0	114	H213 G235 K236 D255 N259 S279	H213-H257 AromaticContact CE1-CE1 3.53Å; H213-H257 AromaticContact CE1-NE2 3.29Å; H213-H257 PolarHBondContact CE1-NE2 2.94Å; H213-H257 VanDerWaalsContact CE1-NE2 3.29Å; H213-H257 AromaticContact ND1-CE1 3.7Å; H213-H257 AromaticContact ND1-NE2 3.87Å; G235-H257 CarbonylContact C-O 3.46Å; G235-H257 WeakPolarHBondContact CA-O 3.23Å; K236-H257 PolarHBondContact N-O 2.92Å; D255-H257 IonicContact OD1-CE1 2.79Å; D255-H257 IonicContact OD1-CG 3.21Å; D255-H257 PolarHBondContact OD1-N 2.89Å; D255-H257 IonicContact OD1-ND1 3.36Å; D255-H257 PolarHBondContact OD1-ND1 3.35Å; D255-H257 IonicContact OD2-CE1 2.76Å; D255-H257 PolarHBondContact OD2-CE1 2.94Å; D255-H257 IonicContact OD2-ND1 3.56Å; D255-H257 PolarHBondContact OD2-ND1 3.46Å; H257-N259 PolarHBondContact O-N 2.73Å; H257-N259 PolarHBondContact O-ND2 2.74Å; H257-S279 CarbonylContact C-O 3.41Å; H257-S279 WeakPolarHBondContact CA-O 3.43Å; H257-S279 WeakPolarHBondContact CB-O 3.23Å; H257-S279 WeakPolarHBondContact CB-OG 3.47Å
258	D	97.4	Very high	94.7	Very high	75 Å²	75	40.8 Å²	40.8	40%	0.401	19%	0.191	S	C	.	.	S	Bend	trans	47.5	56	176.9	-63.8	-15.2	0	0	0	112.1	K236 N237 S279 G280	K236-D258 VanDerWaalsContact CA-O 3.32Å; K236-D258 WeakPolarHBondContact CA-O 3.34Å; K236-D258 HydrophobicContact CB-CB 4.4Å; K236-D258 VanDerWaalsContact CE-OD2 3.32Å; K236-D258 WeakPolarHBondContact CE-OD2 3.31Å; K236-D258 HydrophobicContact CG-CB 3.6Å; K236-D258 WeakPolarHBondContact CG-OD2 3.26Å; N237-D258 PolarHBondContact N-O 3.15Å; D258-S279 PolarHBondContact N-O 3.28Å; D258-G280 WeakPolarHBondContact CA-O 3.44Å
259	N	97.6	Very high	94.6	Very high	8 Å²	8	43.6 Å²	43.6	4%	0.043	20%	0.204	C	C	.	.	S	Bend	trans	-128.2	-165.6	-180	-90.5	-80.9	0	0	0	109.6	L234 N237 R238 I239 L256 H257 I261 G280 N281	L234-N259 PolarHBondContact O-ND2 3.49Å; N237-N259 WeakPolarHBondContact CA-OD1 3.44Å; N237-N259 WeakPolarHBondContact CB-OD1 3.41Å; N237-N259 PolarHBondContact O-OD1 2.86Å; R238-N259 PolarHBondContact N-OD1 3.36Å; I239-N259 HydrophobicContact CB-CB 4.44Å; I239-N259 VanDerWaalsContact CB-OD1 3.24Å; I239-N259 WeakPolarHBondContact CB-OD1 3.43Å; I239-N259 WeakPolarHBondContact CG1-OD1 3.29Å; I239-N259 PolarHBondContact N-OD1 2.81Å; L256-N259 PolarHBondContact O-ND2 2.81Å; H257-N259 PolarHBondContact O-N 2.73Å; H257-N259 PolarHBondContact O-ND2 2.74Å; N259-I261 HydrophobicContact CB-CD1 4.38Å; N259-I261 HydrophobicContact CB-CG1 4.37Å; N259-G280 PolarHBondContact N-O 3.09Å; N259-N281 WeakPolarHBondContact CA-OD1 3.38Å; N259-N281 WeakPolarHBondContact CB-OD1 3.44Å; N259-N281 PolarHBondContact O-OD1 3.27Å
260	Q	96.5	Very high	94.7	Very high	59 Å²	59	37.9 Å²	37.9	28%	0.276	18%	0.181	S	C	.	.			trans	-123.5	25.1	-174.7	-57.3	-168.4	46.4	0	0	112.6	I239 H240 N281	I239-Q260 CarbonylContact O-C 3.16Å; I239-Q260 VanDerWaalsContact O-CA 3.32Å; I239-Q260 WeakPolarHBondContact O-CA 3.27Å; I239-Q260 PolarHBondContact O-N 3.37Å; H240-Q260 PolarHBondContact CE1-OE1 2.98Å; H240-Q260 WeakPolarHBondContact ND1-CB 3.4Å; Q260-N281 PolarHBondContact N-OD1 3.49Å
261	I	96.6	Very high	94.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.205	C	C	.	.			trans	-68.1	134	-178.5	-58.9	166.2	0	0	0	109.6	I239 I242 L256 N259 K263 L278 N281 R282 I283	I239-I261 HydrophobicContact CG2-CD1 4.49Å; I239-I261 HydrophobicContact CG2-CG1 4.25Å; I239-I261 PolarHBondContact O-N 2.99Å; I242-I261 HydrophobicContact CD1-CD1 4.44Å; I242-I261 HydrophobicContact CD1-CG2 4.29Å; I242-I261 HydrophobicContact CG1-CD1 3.96Å; I242-I261 HydrophobicContact CG1-CG1 4.48Å; I242-I261 HydrophobicContact CG1-CG2 4.06Å; L256-I261 HydrophobicContact CB-CD1 3.96Å; L256-I261 HydrophobicContact CD1-CD1 4.09Å; L256-I261 HydrophobicContact CD2-CD1 4.37Å; L256-I261 HydrophobicContact CG-CD1 4.38Å; N259-I261 HydrophobicContact CB-CD1 4.38Å; N259-I261 HydrophobicContact CB-CG1 4.37Å; I261-K263 WeakPolarHBondContact CG2-O 3.28Å; I261-L278 HydrophobicContact CD1-CD2 3.82Å; I261-N281 HydrophobicContact CB-CB 4.35Å; I261-N281 VanDerWaalsContact CB-OD1 3.28Å; I261-N281 WeakPolarHBondContact CB-OD1 3.28Å; I261-N281 WeakPolarHBondContact CG1-OD1 3.26Å; I261-N281 PolarHBondContact N-OD1 3.41Å; I261-R282 CarbonylContact O-C 3.2Å; I261-R282 WeakPolarHBondContact O-CA 3.35Å; I261-R282 PolarHBondContact O-N 3.38Å; I261-I283 HydrophobicContact CG2-CG1 4.39Å
262	R	94.3	Very high	94.5	Very high	167 Å²	167	48.1 Å²	48.1	63%	0.63	22%	0.222	S	C	*	.			trans	-107	-17.8	-178.7	-57.2	-173.6	-170.4	-174.1	3.8	114.7	R282	R262-R282 HydrophobicContact CG-CB 4.47Å
263	K	93.9	Very high	94.5	Very high	98 Å²	98	47.1 Å²	47.1	43%	0.426	22%	0.215	S	C	.	.	S	Bend	trans	-145.1	149.9	-174.8	-80.9	-177.8	158.7	-83.6	0	110.9	I261 E287	I261-K263 WeakPolarHBondContact CG2-O 3.28Å; K263-E287 IonicContact NZ-OE1 3.82Å; K263-E287 PolarHBondContact NZ-OE1 3.01Å; K263-E287 IonicContact NZ-OE2 3.63Å
264	M	93.3	Very high	94.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	22%	0.221	C	C	.	.			trans	-89.1	111.6	168.1	-70.7	166.3	59.5	0	0	108	I267 L278 I283 V286 E287 N288 L289 L300	M264-I267 HydrophobicContact CB-CD1 4.22Å; M264-I267 HydrophobicContact CE-CD1 4.07Å; M264-L278 HydrophobicContact CG-CD1 3.98Å; M264-L278 HydrophobicContact SD-CD1 4.43Å; M264-I283 HydrophobicContact CG-CD1 4.03Å; M264-I283 HydrophobicContact CG-CG2 4.28Å; M264-I283 HydrophobicContact SD-CG2 4.27Å; M264-V286 HydrophobicContact CE-CG1 4.08Å; M264-V286 HydrophobicContact SD-CG1 4.25Å; M264-E287 VanDerWaalsContact CB-O 3.32Å; M264-E287 WeakPolarHBondContact CB-O 3.33Å; M264-N288 PolarHBondContact O-ND2 3.11Å; M264-L289 HydrophobicContact CE-CD1 4.43Å; M264-L289 HydrophobicContact CE-CD2 3.46Å; M264-L289 VanDerWaalsContact CE-CD2 3.46Å; M264-L289 HydrophobicContact CE-CG 3.82Å; M264-L300 HydrophobicContact SD-CD1 4.49Å; M264-L300 HydrophobicContact SD-CD2 4.09Å
265	E	92.2	Very high	94.4	Very high	60 Å²	60	50.2 Å²	50.2	28%	0.28	23%	0.23	S	C	.	.			trans	-149.3	162.8	179.3	65.2	-175.7	119.3	0	0	110.1	K241 I242 I267	K241-E265 WeakPolarHBondContact CE-OE1 3.45Å; K241-E265 WeakPolarHBondContact CE-OE2 3.39Å; K241-E265 IonicContact NZ-OE1 2.97Å; K241-E265 IonicContact NZ-OE2 3.9Å; K241-E265 PolarHBondContact NZ-OE2 3.02Å; I242-E265 WeakPolarHBondContact CB-O 3.2Å; I242-E265 WeakPolarHBondContact CG2-O 3.23Å; E265-I267 VanDerWaalsContact C-N 3.28Å; E265-I267 PolarHBondContact O-N 3.11Å
266	N	89.8	Confident	94.4	Very high	44 Å²	44	49.5 Å²	49.5	24%	0.235	23%	0.226	C	C	.	.	S	Bend	trans	53.6	38.2	179.7	-156.6	5	0	0	0	114.7	H269	N266-H269 PolarHBondContact O-CE1 3.28Å; N266-H269 VanDerWaalsContact O-CE1 3.3Å; N266-H269 PolarHBondContact OD1-CE1 2.79Å
267	I	92.6	Very high	94.5	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	23%	0.234	C	C	.	.			trans	-123.3	-20.7	176.1	57.3	174.9	0	0	0	114.1	I242 L245 M264 E265 H269 L270 L276 L292	I242-I267 HydrophobicContact CD1-CG2 4.25Å; I242-I267 HydrophobicContact CG2-CG2 4.13Å; L245-I267 HydrophobicContact CD1-CG2 4.19Å; M264-I267 HydrophobicContact CB-CD1 4.22Å; M264-I267 HydrophobicContact CE-CD1 4.07Å; E265-I267 VanDerWaalsContact C-N 3.28Å; E265-I267 PolarHBondContact O-N 3.11Å; I267-H269 PolarHBondContact O-N 3.37Å; I267-H269 VanDerWaalsContact O-N 3.08Å; I267-L270 HydrophobicContact CB-CD1 4.2Å; I267-L270 HydrophobicContact CG2-CD1 4.24Å; I267-L270 WeakPolarHBondContact O-CB 3.33Å; I267-L270 WeakPolarHBondContact O-CG 3.4Å; I267-L270 PolarHBondContact O-N 3.28Å; I267-L276 HydrophobicContact CD1-CD2 3.95Å; I267-L292 HydrophobicContact CD1-CD1 4.18Å; I267-L292 HydrophobicContact CG1-CD1 4.43Å; I267-L292 WeakPolarHBondContact O-CD2 3.5Å
268	S	89.1	Confident	94.4	Very high	52 Å²	52	49.6 Å²	49.6	36%	0.364	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-21.1	-169.8	44.5	0	0	0	0	115.4	Q290 G291	S268-Q290 CarbonylContact C-O 3.29Å; S268-Q290 WeakPolarHBondContact CA-O 3.2Å; S268-Q290 WeakPolarHBondContact CB-O 3.38Å; S268-G291 WeakPolarHBondContact O-CA 3.49Å
269	H	90	Very high	94.4	Very high	58 Å²	58	46.3 Å²	46.3	27%	0.269	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-8.6	176.8	60.1	-75.6	0	0	0	114.3	L245 E246 N266 I267 R271	L245-H269 VanDerWaalsContact C-NE2 3.35Å; L245-H269 PolarHBondContact O-NE2 3.21Å; E246-H269 WeakPolarHBondContact CA-NE2 3.25Å; N266-H269 PolarHBondContact O-CE1 3.28Å; N266-H269 VanDerWaalsContact O-CE1 3.3Å; N266-H269 PolarHBondContact OD1-CE1 2.79Å; I267-H269 PolarHBondContact O-N 3.37Å; I267-H269 VanDerWaalsContact O-N 3.08Å; H269-R271 VanDerWaalsContact C-N 3.31Å; H269-R271 PolarHBondContact O-N 3.25Å
270	L	92.6	Very high	94.4	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.219	C	C	.	.			trans	-81.1	68	-172.7	-57.9	172.9	0	0	0	112.5	L245 L248 L251 I267 E272 L273 L292	L245-L270 HydrophobicContact CD1-CD1 4.03Å; L248-L270 HydrophobicContact CB-CD2 4.46Å; L248-L270 WeakPolarHBondContact O-CD2 3.22Å; L251-L270 HydrophobicContact CB-CD2 4.47Å; L251-L270 HydrophobicContact CD2-CD1 4.38Å; I267-L270 HydrophobicContact CB-CD1 4.2Å; I267-L270 HydrophobicContact CG2-CD1 4.24Å; I267-L270 WeakPolarHBondContact O-CB 3.33Å; I267-L270 WeakPolarHBondContact O-CG 3.4Å; I267-L270 PolarHBondContact O-N 3.28Å; L270-E272 VanDerWaalsContact C-N 3.3Å; L270-E272 PolarHBondContact O-N 2.8Å; L270-L273 HydrophobicContact CB-CB 4.01Å; L270-L273 HydrophobicContact CB-CD2 4.35Å; L270-L273 HydrophobicContact CD1-CD2 4.24Å; L270-L273 WeakPolarHBondContact O-CB 3.36Å; L270-L273 PolarHBondContact O-N 3.15Å; L270-L292 HydrophobicContact CB-CD2 3.94Å; L270-L292 WeakPolarHBondContact O-CD2 3.33Å
271	R	90.9	Very high	94.4	Very high	189 Å²	189	44.6 Å²	44.6	71%	0.713	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.5	-172	-63.1	-178.7	-175.6	-176.2	1.2	115.2	H269 L273 S294	H269-R271 VanDerWaalsContact C-N 3.31Å; H269-R271 PolarHBondContact O-N 3.25Å; R271-L273 VanDerWaalsContact C-N 3.34Å; R271-S294 VanDerWaalsContact O-CB 3.26Å; R271-S294 WeakPolarHBondContact O-CB 3.4Å; R271-S294 PolarHBondContact O-OG 3.09Å
272	E	94.8	Very high	94.4	Very high	74 Å²	74	51 Å²	51	35%	0.346	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.2	176.4	-73.9	-174	-134.5	0	0	113.6	R230 L251 S252 L270 Q274	R230-E272 IonicContact CZ-OE2 3.74Å; R230-E272 IonicContact NH1-OE2 2.75Å; R230-E272 PolarHBondContact NH1-OE2 2.8Å; R230-E272 IonicContact NH2-OE2 3.78Å; R230-E272 PolarHBondContact NH2-OE2 3.42Å; L251-E272 CarbonylContact O-C 3.56Å; S252-E272 WeakPolarHBondContact CA-O 3.37Å; L270-E272 VanDerWaalsContact C-N 3.3Å; L270-E272 PolarHBondContact O-N 2.8Å; E272-Q274 PolarHBondContact O-N 2.93Å
273	L	95.9	Very high	94.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.203	C	C	.	.			trans	-68.3	120.8	-175.4	-168.9	67.6	0	0	0	111.4	L251 L254 L270 R271 L276 L292 S294 L295	L251-L273 HydrophobicContact CG-CD1 4.43Å; L251-L273 WeakPolarHBondContact O-CA 3.41Å; L251-L273 PolarHBondContact O-N 3.33Å; L251-L273 VanDerWaalsContact O-N 3.14Å; L254-L273 HydrophobicContact CB-CD1 3.86Å; L270-L273 HydrophobicContact CB-CB 4.01Å; L270-L273 HydrophobicContact CB-CD2 4.35Å; L270-L273 HydrophobicContact CD1-CD2 4.24Å; L270-L273 WeakPolarHBondContact O-CB 3.36Å; L270-L273 PolarHBondContact O-N 3.15Å; R271-L273 VanDerWaalsContact C-N 3.34Å; L273-L276 HydrophobicContact CD2-CB 4.12Å; L273-L276 HydrophobicContact CD2-CD1 4.49Å; L273-L276 HydrophobicContact CD2-CD2 4.32Å; L273-L292 HydrophobicContact CB-CD2 4.17Å; L273-L292 HydrophobicContact CD2-CD2 3.93Å; L273-S294 CarbonylContact O-C 3.16Å; L273-L295 HydrophobicContact CD2-CD1 4.24Å; L273-L295 HydrophobicContact CG-CD1 4.03Å; L273-L295 WeakPolarHBondContact O-CA 3.44Å; L273-L295 PolarHBondContact O-N 3.14Å; L273-L295 VanDerWaalsContact O-N 3.07Å
274	Q	96.1	Very high	94.5	Very high	96 Å²	96	41 Å²	41	45%	0.449	20%	0.201	S	C	.	.			trans	-107.2	-31.3	-178	-65.6	-179.5	4	0	0	112.9	S252 E272 T296 E297	S252-Q274 PolarHBondContact O-N 3.02Å; E272-Q274 PolarHBondContact O-N 2.93Å; Q274-T296 WeakPolarHBondContact O-CA 3.48Å; Q274-T296 PolarHBondContact O-N 3.34Å; Q274-T296 PolarHBondContact O-OG1 3.04Å; Q274-E297 PolarHBondContact O-N 2.82Å
275	V	97.4	Very high	94.4	Very high	32 Å²	32	42.5 Å²	42.5	19%	0.194	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	122.7	-179.6	-176.8	0	0	0	0	109.4	S252 I253 L254 E297	S252-V275 PolarHBondContact O-N 3.32Å; S252-V275 VanDerWaalsContact O-N 3.12Å; I253-V275 HydrophobicContact CG1-CB 4.26Å; I253-V275 HydrophobicContact CG1-CG2 4.38Å; I253-V275 HydrophobicContact CG2-CB 4.31Å; L254-V275 PolarHBondContact N-O 2.92Å; V275-E297 HydrophobicContact CG1-CB 4.27Å; V275-E297 HydrophobicContact CG1-CG 4.13Å; V275-E297 HydrophobicContact CG2-CB 4.29Å
276	L	97.4	Very high	94.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	115.2	172.9	178.5	55.3	0	0	0	109.6	L254 I267 L273 L278 L295 E297 L298 N299	L254-L276 HydrophobicContact CB-CD1 4.05Å; L254-L276 HydrophobicContact CD2-CD1 3.92Å; L254-L276 HydrophobicContact CG-CD1 3.98Å; I267-L276 HydrophobicContact CD1-CD2 3.95Å; L273-L276 HydrophobicContact CD2-CB 4.12Å; L273-L276 HydrophobicContact CD2-CD1 4.49Å; L273-L276 HydrophobicContact CD2-CD2 4.32Å; L276-L278 HydrophobicContact CD1-CD1 4.05Å; L276-L278 HydrophobicContact CD1-CG 4.02Å; L276-L278 HydrophobicContact CD2-CD1 3.92Å; L276-L278 HydrophobicContact CG-CD1 3.92Å; L276-L278 HydrophobicContact CG-CG 4.2Å; L276-L295 HydrophobicContact CB-CD1 3.81Å; L276-E297 PolarHBondContact N-O 3.49Å; L276-L298 HydrophobicContact CB-CD1 4.06Å; L276-L298 HydrophobicContact CD2-CD1 3.93Å; L276-L298 HydrophobicContact CG-CD1 3.97Å; L276-L298 WeakPolarHBondContact O-CA 2.94Å; L276-N299 PolarHBondContact O-N 3.23Å
277	N	97.7	Very high	94.4	Very high	29 Å²	29	39.9 Å²	39.9	16%	0.155	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119.2	175.2	-175.4	19.8	0	0	0	110.9	L254 D255 L256 S279 N299	L254-N277 PolarHBondContact O-N 3.42Å; D255-N277 WeakPolarHBondContact OD1-CB 3.42Å; D255-N277 PolarHBondContact OD1-ND2 2.79Å; L256-N277 CarbonylContact C-O 3.45Å; L256-N277 WeakPolarHBondContact CA-O 3.25Å; L256-N277 PolarHBondContact N-O 2.93Å; N277-S279 WeakPolarHBondContact OD1-CB 3.35Å; N277-S279 PolarHBondContact OD1-N 3.21Å; N277-S279 PolarHBondContact OD1-OG 2.95Å; N277-N299 HydrophobicContact CB-CB 4.38Å; N277-N299 WeakPolarHBondContact OD1-CB 3.47Å; N277-N299 PolarHBondContact OD1-ND2 2.88Å
278	L	97.2	Very high	94.2	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.			trans	-128.4	20.2	-179.4	-75.5	166	0	0	0	111.1	I242 L256 I261 M264 L276 N281 I283 N299 L300 N303	I242-L278 HydrophobicContact CD1-CD2 4.12Å; L256-L278 HydrophobicContact CB-CD2 3.83Å; L256-L278 HydrophobicContact CD1-CD2 4.07Å; I261-L278 HydrophobicContact CD1-CD2 3.82Å; M264-L278 HydrophobicContact CG-CD1 3.98Å; M264-L278 HydrophobicContact SD-CD1 4.43Å; L276-L278 HydrophobicContact CD1-CD1 4.05Å; L276-L278 HydrophobicContact CD1-CG 4.02Å; L276-L278 HydrophobicContact CD2-CD1 3.92Å; L276-L278 HydrophobicContact CG-CD1 3.92Å; L276-L278 HydrophobicContact CG-CG 4.2Å; L278-N281 WeakPolarHBondContact O-CB 3.47Å; L278-N281 PolarHBondContact O-ND2 2.73Å; L278-I283 HydrophobicContact CB-CD1 3.95Å; L278-I283 HydrophobicContact CD1-CD1 4.08Å; L278-I283 HydrophobicContact CD2-CD1 4.36Å; L278-I283 HydrophobicContact CG-CD1 4.37Å; L278-N299 CarbonylContact C-O 3.56Å; L278-N299 PolarHBondContact N-O 3.31Å; L278-L300 HydrophobicContact CB-CD2 3.76Å; L278-L300 HydrophobicContact CD1-CD2 4.13Å; L278-N303 PolarHBondContact O-ND2 3.26Å
279	S	97.6	Very high	94.1	Very high	7 Å²	7	40.6 Å²	40.6	5%	0.049	20%	0.197	C	C	.	.			trans	-63.2	150.5	-177.7	67.5	0	0	0	0	113.8	H257 D258 N277 N281 N299 Q301	H257-S279 CarbonylContact C-O 3.41Å; H257-S279 WeakPolarHBondContact CA-O 3.43Å; H257-S279 WeakPolarHBondContact CB-O 3.23Å; H257-S279 WeakPolarHBondContact CB-OG 3.47Å; D258-S279 PolarHBondContact N-O 3.28Å; N277-S279 WeakPolarHBondContact OD1-CB 3.35Å; N277-S279 PolarHBondContact OD1-N 3.21Å; N277-S279 PolarHBondContact OD1-OG 2.95Å; S279-N281 PolarHBondContact O-ND2 2.87Å; S279-N299 PolarHBondContact N-O 3.44Å; S279-Q301 CarbonylContact C-O 3.04Å; S279-Q301 WeakPolarHBondContact CA-O 3.47Å; S279-Q301 WeakPolarHBondContact CB-O 3.43Å
280	G	96.3	Very high	93.9	Very high	21 Å²	21	42.6 Å²	42.6	22%	0.216	21%	0.206	C	C	.	.	S	Bend	trans	68.9	33.8	176.9	0	0	0	0	0	113.3	D258 N259 Q301 Y302	D258-G280 WeakPolarHBondContact CA-O 3.44Å; N259-G280 PolarHBondContact N-O 3.09Å; G280-Q301 PolarHBondContact N-O 3.37Å; G280-Y302 CarbonylContact C-O 3.52Å; G280-Y302 WeakPolarHBondContact CA-O 3.47Å; G280-Y302 PolarHBondContact N-O 3.34Å; G280-Y302 VanDerWaalsContact N-O 3.13Å
281	N	97.4	Very high	93.4	Very high	9 Å²	9	44.8 Å²	44.8	5%	0.048	23%	0.229	C	C	.	.	S	Bend	trans	-113.1	-164.1	176.4	-82.1	-82	0	0	0	110.2	L256 N259 Q260 I261 L278 S279 I283 Y302 N303	L256-N281 PolarHBondContact O-ND2 3.27Å; N259-N281 WeakPolarHBondContact CA-OD1 3.38Å; N259-N281 WeakPolarHBondContact CB-OD1 3.44Å; N259-N281 PolarHBondContact O-OD1 3.27Å; Q260-N281 PolarHBondContact N-OD1 3.49Å; I261-N281 HydrophobicContact CB-CB 4.35Å; I261-N281 VanDerWaalsContact CB-OD1 3.28Å; I261-N281 WeakPolarHBondContact CB-OD1 3.28Å; I261-N281 WeakPolarHBondContact CG1-OD1 3.26Å; I261-N281 PolarHBondContact N-OD1 3.41Å; L278-N281 WeakPolarHBondContact O-CB 3.47Å; L278-N281 PolarHBondContact O-ND2 2.73Å; S279-N281 PolarHBondContact O-ND2 2.87Å; N281-I283 HydrophobicContact CB-CD1 4.32Å; N281-I283 HydrophobicContact CB-CG1 4.32Å; N281-Y302 PolarHBondContact N-O 3.01Å; N281-N303 WeakPolarHBondContact CA-OD1 3.37Å; N281-N303 WeakPolarHBondContact CB-OD1 3.24Å; N281-N303 PolarHBondContact O-OD1 2.86Å
282	R	96	Very high	93.4	Very high	136 Å²	136	35.9 Å²	35.9	51%	0.513	20%	0.196	S	C	.	.			trans	-125	34.6	-177.7	-55.1	-173.8	-167.9	176.2	8.5	111.8	I261 R262 N303	I261-R282 CarbonylContact O-C 3.2Å; I261-R282 WeakPolarHBondContact O-CA 3.35Å; I261-R282 PolarHBondContact O-N 3.38Å; R262-R282 HydrophobicContact CG-CB 4.47Å; R282-N303 PolarHBondContact N-OD1 3.22Å
283	I	96.4	Very high	93	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.203	C	C	.	.			trans	-73.1	131.8	-179.1	-60.3	164.2	0	0	0	109.2	I261 M264 L278 N281 S285 L300 N303 C304 I305	I261-I283 HydrophobicContact CG2-CG1 4.39Å; M264-I283 HydrophobicContact CG-CD1 4.03Å; M264-I283 HydrophobicContact CG-CG2 4.28Å; M264-I283 HydrophobicContact SD-CG2 4.27Å; L278-I283 HydrophobicContact CB-CD1 3.95Å; L278-I283 HydrophobicContact CD1-CD1 4.08Å; L278-I283 HydrophobicContact CD2-CD1 4.36Å; L278-I283 HydrophobicContact CG-CD1 4.37Å; N281-I283 HydrophobicContact CB-CD1 4.32Å; N281-I283 HydrophobicContact CB-CG1 4.32Å; I283-S285 VanDerWaalsContact CG2-O 3.27Å; I283-S285 WeakPolarHBondContact CG2-O 3.37Å; I283-L300 HydrophobicContact CD1-CD2 3.99Å; I283-N303 WeakPolarHBondContact CB-OD1 3.36Å; I283-N303 PolarHBondContact N-OD1 3.16Å; I283-C304 CarbonylContact O-C 3.51Å; I283-C304 WeakPolarHBondContact O-CA 3.44Å; I283-C304 PolarHBondContact O-N 2.72Å; I283-I305 HydrophobicContact CG2-CG1 4.26Å; I283-I305 WeakPolarHBondContact O-CG1 3.41Å; I283-I305 PolarHBondContact O-N 2.71Å; I283-I305 VanDerWaalsContact O-N 3.15Å
284	S	93.1	Very high	92.9	Very high	55 Å²	55	37.1 Å²	37.1	39%	0.385	22%	0.22	S	C	.	.			trans	-96.6	-19.6	-177.3	55.2	0	0	0	0	114.7	I305 S306	S284-I305 WeakPolarHBondContact O-CA 3.33Å; S284-S306 PolarHBondContact O-N 2.92Å; S284-S306 VanDerWaalsContact O-N 3.08Å
285	S	92.5	Very high	92.8	Very high	30 Å²	30	32.5 Å²	32.5	21%	0.21	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	140.3	-167.9	42.8	0	0	0	0	109.7	I283	I283-S285 VanDerWaalsContact CG2-O 3.27Å; I283-S285 WeakPolarHBondContact CG2-O 3.37Å
286	V	91.6	Very high	92.8	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	112.9	173.2	-173.3	0	0	0	0	108.3	M264 L289 L300 I305 V307 V308 T309 V311	M264-V286 HydrophobicContact CE-CG1 4.08Å; M264-V286 HydrophobicContact SD-CG1 4.25Å; V286-L289 HydrophobicContact CG1-CD1 3.37Å; V286-L289 HydrophobicContact CG1-CG 4.14Å; V286-L300 HydrophobicContact CG1-CD1 4.41Å; V286-L300 HydrophobicContact CG2-CD1 3.86Å; V286-I305 HydrophobicContact CG2-CD1 3.95Å; V286-I305 HydrophobicContact CG2-CG2 3.94Å; V286-V307 PolarHBondContact N-O 2.99Å; V286-V308 HydrophobicContact CB-CG1 4.25Å; V286-V308 HydrophobicContact CG2-CB 4.42Å; V286-V308 HydrophobicContact CG2-CG1 4.18Å; V286-V308 HydrophobicContact CG2-CG2 4.11Å; V286-T309 PolarHBondContact O-OG1 3.22Å; V286-V311 HydrophobicContact CG1-CG2 4.09Å
287	E	89.8	Confident	92.7	Very high	49 Å²	49	34.6 Å²	34.6	23%	0.229	21%	0.209	C	C	.	.			trans	-146	162.4	-175.8	58.4	179.4	173.4	0	0	111	K263 M264 L289	K263-E287 IonicContact NZ-OE1 3.82Å; K263-E287 PolarHBondContact NZ-OE1 3.01Å; K263-E287 IonicContact NZ-OE2 3.63Å; M264-E287 VanDerWaalsContact CB-O 3.32Å; M264-E287 WeakPolarHBondContact CB-O 3.33Å; E287-L289 VanDerWaalsContact C-N 3.35Å; E287-L289 PolarHBondContact O-N 2.84Å
288	N	87.8	Confident	92.7	Very high	66 Å²	66	33.2 Å²	33.2	35%	0.353	20%	0.202	S	C	.	.			trans	63.6	32	175.9	-56.4	-59.6	0	0	0	114.9	M264 Q290 E310	M264-N288 PolarHBondContact O-ND2 3.11Å; N288-Q290 VanDerWaalsContact C-N 3.32Å; N288-E310 WeakPolarHBondContact CA-OE2 3.4Å; N288-E310 PolarHBondContact N-OE2 3.06Å
289	L	87.9	Confident	92.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	21%	0.206	C	C	.	.			trans	-82.2	-8.5	175.7	-73.8	175.1	0	0	0	113.6	M264 V286 E287 G291 L292 L298 E310 V311 L314	M264-L289 HydrophobicContact CE-CD1 4.43Å; M264-L289 HydrophobicContact CE-CD2 3.46Å; M264-L289 VanDerWaalsContact CE-CD2 3.46Å; M264-L289 HydrophobicContact CE-CG 3.82Å; V286-L289 HydrophobicContact CG1-CD1 3.37Å; V286-L289 HydrophobicContact CG1-CG 4.14Å; E287-L289 VanDerWaalsContact C-N 3.35Å; E287-L289 PolarHBondContact O-N 2.84Å; L289-G291 PolarHBondContact O-N 2.79Å; L289-L292 HydrophobicContact CD2-CD1 3.72Å; L289-L292 WeakPolarHBondContact O-CB 3.33Å; L289-L292 PolarHBondContact O-N 3.1Å; L289-L298 HydrophobicContact CD1-CD2 4.08Å; L289-L298 HydrophobicContact CD2-CD2 4.11Å; L289-E310 HydrophobicContact CB-CB 4.29Å; L289-E310 PolarHBondContact N-OE2 2.93Å; L289-V311 HydrophobicContact CD1-CG2 3.7Å; L289-L314 HydrophobicContact CB-CD1 4.31Å; L289-L314 HydrophobicContact CB-CD2 4.39Å; L289-L314 HydrophobicContact CD1-CD1 3.85Å; L289-L314 HydrophobicContact CD2-CD1 4.27Å; L289-L314 HydrophobicContact CG-CD1 4.39Å
290	Q	84.7	Confident	92.6	Very high	100 Å²	100	33.8 Å²	33.8	47%	0.467	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	134.9	178.9	-54.6	-175.5	19.4	0	0	111.6	S268 N288 E310	S268-Q290 CarbonylContact C-O 3.29Å; S268-Q290 WeakPolarHBondContact CA-O 3.2Å; S268-Q290 WeakPolarHBondContact CB-O 3.38Å; N288-Q290 VanDerWaalsContact C-N 3.32Å; Q290-E310 WeakPolarHBondContact CG-OE1 3.35Å; Q290-E310 PolarHBondContact NE2-OE1 2.98Å
291	G	83.1	Confident	92.6	Very high	47 Å²	47	35.5 Å²	35.5	49%	0.485	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.3	-12.9	176.5	0	0	0	0	0	116.1	S268 L289 G293	S268-G291 WeakPolarHBondContact O-CA 3.49Å; L289-G291 PolarHBondContact O-N 2.79Å; G291-G293 PolarHBondContact O-N 2.9Å
292	L	90.6	Very high	92.6	Very high	1 Å²	1	42 Å²	42	1%	0.005	23%	0.231	C	C	.	.			trans	-76.7	50	176.9	-64.7	178	0	0	0	113.3	I267 L270 L273 L289 S294 L295 L314	I267-L292 HydrophobicContact CD1-CD1 4.18Å; I267-L292 HydrophobicContact CG1-CD1 4.43Å; I267-L292 WeakPolarHBondContact O-CD2 3.5Å; L270-L292 HydrophobicContact CB-CD2 3.94Å; L270-L292 WeakPolarHBondContact O-CD2 3.33Å; L273-L292 HydrophobicContact CB-CD2 4.17Å; L273-L292 HydrophobicContact CD2-CD2 3.93Å; L289-L292 HydrophobicContact CD2-CD1 3.72Å; L289-L292 WeakPolarHBondContact O-CB 3.33Å; L289-L292 PolarHBondContact O-N 3.1Å; L292-S294 PolarHBondContact O-N 2.86Å; L292-S294 VanDerWaalsContact O-N 3.1Å; L292-L295 HydrophobicContact CB-CB 4.18Å; L292-L295 HydrophobicContact CD1-CD2 4.28Å; L292-L295 WeakPolarHBondContact O-CB 3.5Å; L292-L295 PolarHBondContact O-N 3.38Å; L292-L314 HydrophobicContact CB-CD2 3.92Å
293	G	86.3	Confident	92.6	Very high	49 Å²	49	36 Å²	36	51%	0.505	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.8	-170.2	0	0	0	0	0	115.9	G291	G291-G293 PolarHBondContact O-N 2.9Å
294	S	92.9	Very high	92.6	Very high	51 Å²	51	39.5 Å²	39.5	36%	0.357	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	0.2	177.8	-52.5	0	0	0	0	114.2	R271 L273 L292 T296	R271-S294 VanDerWaalsContact O-CB 3.26Å; R271-S294 WeakPolarHBondContact O-CB 3.4Å; R271-S294 PolarHBondContact O-OG 3.09Å; L273-S294 CarbonylContact O-C 3.16Å; L292-S294 PolarHBondContact O-N 2.86Å; L292-S294 VanDerWaalsContact O-N 3.1Å; S294-T296 WeakPolarHBondContact O-CG2 3.32Å; S294-T296 PolarHBondContact O-N 2.99Å
295	L	95.8	Very high	92.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.215	C	C	.	.			trans	-69.9	118.1	-171.7	-168.2	72	0	0	0	111	L273 L276 L292 L298 L314 G316 L317	L273-L295 HydrophobicContact CD2-CD1 4.24Å; L273-L295 HydrophobicContact CG-CD1 4.03Å; L273-L295 WeakPolarHBondContact O-CA 3.44Å; L273-L295 PolarHBondContact O-N 3.14Å; L273-L295 VanDerWaalsContact O-N 3.07Å; L276-L295 HydrophobicContact CB-CD1 3.81Å; L292-L295 HydrophobicContact CB-CB 4.18Å; L292-L295 HydrophobicContact CD1-CD2 4.28Å; L292-L295 WeakPolarHBondContact O-CB 3.5Å; L292-L295 PolarHBondContact O-N 3.38Å; L295-L298 HydrophobicContact CD2-CB 4.13Å; L295-L298 HydrophobicContact CD2-CD1 4.5Å; L295-L298 HydrophobicContact CD2-CD2 4.46Å; L295-L314 HydrophobicContact CD2-CD1 4.02Å; L295-G316 CarbonylContact O-C 3.38Å; L295-L317 HydrophobicContact CD2-CD1 4.33Å; L295-L317 HydrophobicContact CG-CD1 4.27Å; L295-L317 WeakPolarHBondContact O-CA 3.48Å; L295-L317 PolarHBondContact O-N 3.41Å
296	T	95.7	Very high	92.7	Very high	38 Å²	38	37.2 Å²	37.2	23%	0.233	22%	0.217	C	C	.	.			trans	-102.7	-29.2	-178.5	66.8	0	0	0	0	113.3	Q274 S294 Q318 R319	Q274-T296 WeakPolarHBondContact O-CA 3.48Å; Q274-T296 PolarHBondContact O-N 3.34Å; Q274-T296 PolarHBondContact O-OG1 3.04Å; S294-T296 WeakPolarHBondContact O-CG2 3.32Å; S294-T296 PolarHBondContact O-N 2.99Å; T296-Q318 PolarHBondContact O-N 3.17Å; T296-R319 PolarHBondContact O-N 3.17Å
297	E	97.1	Very high	92.7	Very high	37 Å²	37	39.9 Å²	39.9	17%	0.173	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	124.9	-176.7	174.2	168.9	-150	0	0	110.4	Q274 V275 L276 R319 F321	Q274-E297 PolarHBondContact O-N 2.82Å; V275-E297 HydrophobicContact CG1-CB 4.27Å; V275-E297 HydrophobicContact CG1-CG 4.13Å; V275-E297 HydrophobicContact CG2-CB 4.29Å; L276-E297 PolarHBondContact N-O 3.49Å; E297-R319 WeakPolarHBondContact CA-O 3.33Å; E297-R319 VanDerWaalsContact CD-CZ 3.41Å; E297-R319 VanDerWaalsContact CD-NH2 3.34Å; E297-R319 IonicContact OE1-CZ 2.81Å; E297-R319 IonicContact OE1-NH1 2.73Å; E297-R319 PolarHBondContact OE1-NH1 3.35Å; E297-R319 IonicContact OE1-NH2 3.99Å; E297-R319 IonicContact OE2-CZ 3.78Å; E297-R319 IonicContact OE2-NH1 3.73Å; E297-R319 PolarHBondContact OE2-NH1 3.42Å; E297-R319 IonicContact OE2-NH2 2.79Å; E297-R319 PolarHBondContact OE2-NH2 2.81Å; E297-F321 HydrophobicContact CG-CE2 4.17Å
298	L	96.8	Very high	92.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	112.1	174	178.6	55.6	0	0	0	108.9	L276 L289 L295 L300 L317 R319 L320 F321	L276-L298 HydrophobicContact CB-CD1 4.06Å; L276-L298 HydrophobicContact CD2-CD1 3.93Å; L276-L298 HydrophobicContact CG-CD1 3.97Å; L276-L298 WeakPolarHBondContact O-CA 2.94Å; L289-L298 HydrophobicContact CD1-CD2 4.08Å; L289-L298 HydrophobicContact CD2-CD2 4.11Å; L295-L298 HydrophobicContact CD2-CB 4.13Å; L295-L298 HydrophobicContact CD2-CD1 4.5Å; L295-L298 HydrophobicContact CD2-CD2 4.46Å; L298-L300 HydrophobicContact CD1-CD1 4.02Å; L298-L300 HydrophobicContact CD1-CG 4.01Å; L298-L300 HydrophobicContact CD2-CD1 3.81Å; L298-L300 HydrophobicContact CG-CD1 3.75Å; L298-L300 HydrophobicContact CG-CG 4.07Å; L298-L317 HydrophobicContact CB-CD1 3.77Å; L298-R319 PolarHBondContact N-O 3.42Å; L298-L320 HydrophobicContact CB-CD1 4.09Å; L298-L320 HydrophobicContact CD2-CD1 4.01Å; L298-L320 HydrophobicContact CG-CD1 4.04Å; L298-L320 WeakPolarHBondContact O-CA 3.32Å; L298-F321 PolarHBondContact O-N 3.41Å
299	N	97.1	Very high	92.9	Very high	19 Å²	19	37.8 Å²	37.8	10%	0.102	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	117.8	177.1	-172.1	-2.7	0	0	0	111.1	L276 N277 L278 S279 Q301 F321	L276-N299 PolarHBondContact O-N 3.23Å; N277-N299 HydrophobicContact CB-CB 4.38Å; N277-N299 WeakPolarHBondContact OD1-CB 3.47Å; N277-N299 PolarHBondContact OD1-ND2 2.88Å; L278-N299 CarbonylContact C-O 3.56Å; L278-N299 PolarHBondContact N-O 3.31Å; S279-N299 PolarHBondContact N-O 3.44Å; N299-Q301 PolarHBondContact ND2-NE2 3.23Å; N299-Q301 VanDerWaalsContact OD1-CG 3.23Å; N299-Q301 WeakPolarHBondContact OD1-CG 3.3Å; N299-Q301 PolarHBondContact OD1-N 2.8Å; N299-Q301 VanDerWaalsContact OD1-N 3.17Å; N299-F321 HydrophobicContact CB-CB 4.38Å; N299-F321 HydrophobicContact CB-CD2 4Å; N299-F321 WeakPolarHBondContact OD1-CB 3.13Å
300	L	96.6	Very high	92.8	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.232	C	C	.	.			trans	-130.8	16.4	-177	-72.7	166	0	0	0	112	M264 L278 I283 V286 L298 N303 I305 F321 L322 N325	M264-L300 HydrophobicContact SD-CD1 4.49Å; M264-L300 HydrophobicContact SD-CD2 4.09Å; L278-L300 HydrophobicContact CB-CD2 3.76Å; L278-L300 HydrophobicContact CD1-CD2 4.13Å; I283-L300 HydrophobicContact CD1-CD2 3.99Å; V286-L300 HydrophobicContact CG1-CD1 4.41Å; V286-L300 HydrophobicContact CG2-CD1 3.86Å; L298-L300 HydrophobicContact CD1-CD1 4.02Å; L298-L300 HydrophobicContact CD1-CG 4.01Å; L298-L300 HydrophobicContact CD2-CD1 3.81Å; L298-L300 HydrophobicContact CG-CD1 3.75Å; L298-L300 HydrophobicContact CG-CG 4.07Å; L300-N303 PolarHBondContact O-ND2 3.34Å; L300-N303 VanDerWaalsContact O-ND2 3.16Å; L300-I305 HydrophobicContact CB-CD1 3.74Å; L300-I305 HydrophobicContact CD1-CD1 4.02Å; L300-I305 HydrophobicContact CD2-CD1 4.15Å; L300-I305 HydrophobicContact CG-CD1 4.2Å; L300-F321 CarbonylContact C-O 3.58Å; L300-F321 WeakPolarHBondContact CA-O 3.4Å; L300-F321 PolarHBondContact N-O 3.45Å; L300-L322 HydrophobicContact CB-CD2 3.91Å; L300-L322 HydrophobicContact CD1-CD2 4.11Å; L300-N325 PolarHBondContact O-ND2 3.31Å
301	Q	96.2	Very high	93	Very high	58 Å²	58	34.3 Å²	34.3	27%	0.271	21%	0.21	S	C	.	.			trans	-57.4	154.3	177	70.7	-169.5	-15.7	0	0	112.1	S279 G280 N299 N303 F321 S323	S279-Q301 CarbonylContact C-O 3.04Å; S279-Q301 WeakPolarHBondContact CA-O 3.47Å; S279-Q301 WeakPolarHBondContact CB-O 3.43Å; G280-Q301 PolarHBondContact N-O 3.37Å; N299-Q301 PolarHBondContact ND2-NE2 3.23Å; N299-Q301 VanDerWaalsContact OD1-CG 3.23Å; N299-Q301 WeakPolarHBondContact OD1-CG 3.3Å; N299-Q301 PolarHBondContact OD1-N 2.8Å; N299-Q301 VanDerWaalsContact OD1-N 3.17Å; Q301-N303 PolarHBondContact O-ND2 2.94Å; Q301-F321 PolarHBondContact N-O 3.41Å; Q301-S323 CarbonylContact C-O 3.41Å; Q301-S323 WeakPolarHBondContact CA-O 3.39Å
302	Y	96.2	Very high	93.1	Very high	144 Å²	144	34.2 Å²	34.2	57%	0.565	20%	0.199	S	C	*	.	S	Bend	trans	52.3	57.3	-178.8	-57.8	-66.8	0	0	0	112.9	G280 N281 S323 C324	G280-Y302 CarbonylContact C-O 3.52Å; G280-Y302 WeakPolarHBondContact CA-O 3.47Å; G280-Y302 PolarHBondContact N-O 3.34Å; G280-Y302 VanDerWaalsContact N-O 3.13Å; N281-Y302 PolarHBondContact N-O 3.01Å; Y302-S323 PolarHBondContact N-O 3.41Å; Y302-C324 WeakPolarHBondContact CA-O 3.46Å; Y302-C324 HydrophobicContact CD1-CB 3.39Å; Y302-C324 HydrophobicContact CE1-CB 3.53Å; Y302-C324 WeakPolarHBondContact CE1-SG 3.49Å; Y302-C324 HydrophobicContact CG-CB 4.23Å
303	N	96.9	Very high	92.9	Very high	12 Å²	12	40.9 Å²	40.9	6%	0.064	22%	0.224	C	C	.	.	S	Bend	trans	-127.9	-167.8	172.9	-88.6	-88.4	0	0	0	109.4	L278 N281 R282 I283 L300 Q301 I305 C324 N325	L278-N303 PolarHBondContact O-ND2 3.26Å; N281-N303 WeakPolarHBondContact CA-OD1 3.37Å; N281-N303 WeakPolarHBondContact CB-OD1 3.24Å; N281-N303 PolarHBondContact O-OD1 2.86Å; R282-N303 PolarHBondContact N-OD1 3.22Å; I283-N303 WeakPolarHBondContact CB-OD1 3.36Å; I283-N303 PolarHBondContact N-OD1 3.16Å; L300-N303 PolarHBondContact O-ND2 3.34Å; L300-N303 VanDerWaalsContact O-ND2 3.16Å; Q301-N303 PolarHBondContact O-ND2 2.94Å; N303-I305 HydrophobicContact CB-CD1 4.14Å; N303-I305 HydrophobicContact CB-CG1 4.09Å; N303-C324 PolarHBondContact N-O 2.89Å; N303-N325 VanDerWaalsContact CA-OD1 3.29Å; N303-N325 WeakPolarHBondContact CA-OD1 3.35Å; N303-N325 WeakPolarHBondContact CB-OD1 3.32Å; N303-N325 PolarHBondContact N-OD1 3.29Å; N303-N325 PolarHBondContact O-OD1 3.04Å
304	C	95.6	Very high	93.1	Very high	72 Å²	72	38.7 Å²	38.7	49%	0.486	20%	0.2	S	C	.	.			trans	-112.2	25.1	178.9	-57.2	0	0	0	0	112.3	I283 S306 N325	I283-C304 CarbonylContact O-C 3.51Å; I283-C304 WeakPolarHBondContact O-CA 3.44Å; I283-C304 PolarHBondContact O-N 2.72Å; C304-S306 PolarHBondContact O-N 3.29Å; C304-N325 PolarHBondContact N-OD1 2.7Å
305	I	95.7	Very high	92.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.218	C	C	.	.			trans	-66.2	126.9	-170.7	-62.2	164.8	0	0	0	110.1	I283 S284 V286 L300 N303 V307 V308 L322 N325 N326 I327	I283-I305 HydrophobicContact CG2-CG1 4.26Å; I283-I305 WeakPolarHBondContact O-CG1 3.41Å; I283-I305 PolarHBondContact O-N 2.71Å; I283-I305 VanDerWaalsContact O-N 3.15Å; S284-I305 WeakPolarHBondContact O-CA 3.33Å; V286-I305 HydrophobicContact CG2-CD1 3.95Å; V286-I305 HydrophobicContact CG2-CG2 3.94Å; L300-I305 HydrophobicContact CB-CD1 3.74Å; L300-I305 HydrophobicContact CD1-CD1 4.02Å; L300-I305 HydrophobicContact CD2-CD1 4.15Å; L300-I305 HydrophobicContact CG-CD1 4.2Å; N303-I305 HydrophobicContact CB-CD1 4.14Å; N303-I305 HydrophobicContact CB-CG1 4.09Å; I305-V307 WeakPolarHBondContact CG2-O 3.15Å; I305-V308 HydrophobicContact CG2-CG2 4.19Å; I305-L322 HydrophobicContact CD1-CD2 3.86Å; I305-N325 HydrophobicContact CB-CB 4.19Å; I305-N325 VanDerWaalsContact CB-OD1 3.25Å; I305-N325 WeakPolarHBondContact CB-OD1 3.37Å; I305-N325 WeakPolarHBondContact CG1-OD1 3.37Å; I305-N325 PolarHBondContact N-OD1 3.47Å; I305-N326 CarbonylContact O-C 3.14Å; I305-N326 WeakPolarHBondContact O-CA 3.5Å; I305-N326 PolarHBondContact O-N 3.13Å; I305-I327 WeakPolarHBondContact O-CG1 3.48Å; I305-I327 PolarHBondContact O-N 2.86Å
306	S	92.5	Very high	92.4	Very high	38 Å²	38	41.4 Å²	41.4	27%	0.266	23%	0.228	S	C	.	.			trans	-112.2	-20	173.7	61.5	0	0	0	0	113.7	S284 C304 N326 Q332	S284-S306 PolarHBondContact O-N 2.92Å; S284-S306 VanDerWaalsContact O-N 3.08Å; C304-S306 PolarHBondContact O-N 3.29Å; S306-N326 WeakPolarHBondContact CA-O 3.41Å; S306-Q332 WeakPolarHBondContact O-CB 3.24Å; S306-Q332 PolarHBondContact O-NE2 3.32Å; S306-Q332 VanDerWaalsContact O-NE2 3.12Å; S306-Q332 PolarHBondContact O-OE1 3.43Å
307	V	91.9	Very high	92.3	Very high	56 Å²	56	39.6 Å²	39.6	34%	0.339	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	137	-179.5	-174.2	0	0	0	0	110.4	V286 I305 T309 Q332	V286-V307 PolarHBondContact N-O 2.99Å; I305-V307 WeakPolarHBondContact CG2-O 3.15Å; V307-T309 HydrophobicContact CG1-CG2 4.22Å; V307-Q332 HydrophobicContact CG2-CG 4.36Å
308	V	91.6	Very high	92.1	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.7	175	-174.7	0	0	0	0	109.4	V286 I305 V311 L322 I327 Q332 L333 C335 L336	V286-V308 HydrophobicContact CB-CG1 4.25Å; V286-V308 HydrophobicContact CG2-CB 4.42Å; V286-V308 HydrophobicContact CG2-CG1 4.18Å; V286-V308 HydrophobicContact CG2-CG2 4.11Å; I305-V308 HydrophobicContact CG2-CG2 4.19Å; V308-V311 HydrophobicContact CG1-CB 4.24Å; V308-V311 HydrophobicContact CG1-CG2 3.53Å; V308-L322 HydrophobicContact CG2-CD1 3.94Å; V308-L322 HydrophobicContact CG2-CD2 4.45Å; V308-I327 HydrophobicContact CG2-CD1 4.14Å; V308-Q332 PolarHBondContact N-O 3.47Å; V308-Q332 VanDerWaalsContact N-O 3.08Å; V308-L333 HydrophobicContact CB-CD2 4.27Å; V308-L333 HydrophobicContact CG2-CD2 3.81Å; V308-C335 PolarHBondContact O-SG 2.93Å; V308-L336 HydrophobicContact CG1-CD2 4.26Å
309	T	90	Very high	92	Very high	68 Å²	68	46.2 Å²	46.2	42%	0.417	25%	0.245	S	C	.	.			trans	-137.1	166.4	174	48.3	0	0	0	0	111	V286 V307 V311	V286-T309 PolarHBondContact O-OG1 3.22Å; V307-T309 HydrophobicContact CG1-CG2 4.22Å; T309-V311 PolarHBondContact O-N 3.09Å
310	E	86.4	Confident	92	Very high	26 Å²	26	45.4 Å²	45.4	12%	0.121	24%	0.241	C	C	.	.	S	Bend	trans	65.1	-6.9	177.5	-46.9	-159.2	119.4	0	0	116.8	N288 L289 Q290 D312 R313	N288-E310 WeakPolarHBondContact CA-OE2 3.4Å; N288-E310 PolarHBondContact N-OE2 3.06Å; L289-E310 HydrophobicContact CB-CB 4.29Å; L289-E310 PolarHBondContact N-OE2 2.93Å; Q290-E310 WeakPolarHBondContact CG-OE1 3.35Å; Q290-E310 PolarHBondContact NE2-OE1 2.98Å; E310-D312 WeakPolarHBondContact CA-OD1 3.49Å; E310-D312 PolarHBondContact N-OD1 3.03Å; E310-D312 VanDerWaalsContact N-OD1 3.1Å; E310-D312 PolarHBondContact O-N 3.48Å; E310-R313 WeakPolarHBondContact O-CB 3.41Å; E310-R313 PolarHBondContact O-N 3.19Å; E310-R313 IonicContact OE1-CZ 2.62Å; E310-R313 IonicContact OE1-NH1 3.17Å; E310-R313 PolarHBondContact OE1-NH1 2.97Å
311	V	88.3	Confident	92	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-63.2	-27.5	174.1	175.4	0	0	0	0	111.9	V286 L289 V308 T309 R313 L314 L317 L320 L336 I342	V286-V311 HydrophobicContact CG1-CG2 4.09Å; L289-V311 HydrophobicContact CD1-CG2 3.7Å; V308-V311 HydrophobicContact CG1-CB 4.24Å; V308-V311 HydrophobicContact CG1-CG2 3.53Å; T309-V311 PolarHBondContact O-N 3.09Å; V311-R313 PolarHBondContact O-N 3.03Å; V311-L314 PolarHBondContact O-N 3.13Å; V311-L314 VanDerWaalsContact O-N 3.16Å; V311-L317 HydrophobicContact CG1-CD2 3.77Å; V311-L320 HydrophobicContact CG1-CD2 4.03Å; V311-L336 HydrophobicContact CB-CD2 4.01Å; V311-L336 HydrophobicContact CG1-CD2 3.55Å; V311-I342 HydrophobicContact CG1-CD1 3.79Å
312	D	86.2	Confident	91.9	Very high	46 Å²	46	43.7 Å²	43.7	25%	0.246	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-49.3	-33.7	167.9	48.6	-72.4	0	0	0	113.1	E310 L314 C335 E338	E310-D312 WeakPolarHBondContact CA-OD1 3.49Å; E310-D312 PolarHBondContact N-OD1 3.03Å; E310-D312 VanDerWaalsContact N-OD1 3.1Å; E310-D312 PolarHBondContact O-N 3.48Å; D312-L314 VanDerWaalsContact C-N 3.34Å; D312-L314 PolarHBondContact O-N 3.21Å; D312-C335 HydrophobicContact CB-CB 4.29Å; D312-E338 HydrophobicContact CB-CB 4.27Å
313	R	85.9	Confident	91.9	Very high	140 Å²	140	37.3 Å²	37.3	53%	0.528	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-83.4	-9.4	-174.4	-47.3	-171.8	179.8	163.1	0.6	113.5	E310 V311 A315	E310-R313 WeakPolarHBondContact O-CB 3.41Å; E310-R313 PolarHBondContact O-N 3.19Å; E310-R313 IonicContact OE1-CZ 2.62Å; E310-R313 IonicContact OE1-NH1 3.17Å; E310-R313 PolarHBondContact OE1-NH1 2.97Å; V311-R313 PolarHBondContact O-N 3.03Å; R313-A315 PolarHBondContact O-N 3.02Å; R313-A315 VanDerWaalsContact O-N 3.16Å
314	L	89.8	Confident	91.8	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.016	22%	0.22	C	C	.	.			trans	-89.5	76.7	-175.2	-61.7	-178.1	0	0	0	111.6	L289 L292 L295 V311 D312 G316 L317 S341	L289-L314 HydrophobicContact CB-CD1 4.31Å; L289-L314 HydrophobicContact CB-CD2 4.39Å; L289-L314 HydrophobicContact CD1-CD1 3.85Å; L289-L314 HydrophobicContact CD2-CD1 4.27Å; L289-L314 HydrophobicContact CG-CD1 4.39Å; L292-L314 HydrophobicContact CB-CD2 3.92Å; L295-L314 HydrophobicContact CD2-CD1 4.02Å; V311-L314 PolarHBondContact O-N 3.13Å; V311-L314 VanDerWaalsContact O-N 3.16Å; D312-L314 VanDerWaalsContact C-N 3.34Å; D312-L314 PolarHBondContact O-N 3.21Å; L314-G316 PolarHBondContact O-N 3.44Å; L314-L317 HydrophobicContact CB-CB 3.75Å; L314-L317 HydrophobicContact CD1-CB 4.38Å; L314-L317 HydrophobicContact CD1-CD2 4.02Å; L314-L317 PolarHBondContact O-N 2.94Å; L314-S341 PolarHBondContact O-OG 2.71Å
315	A	85	Confident	91.8	Very high	88 Å²	88	35.9 Å²	35.9	73%	0.727	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-21.2	179.1	0	0	0	0	0	114.6	R313 S341	R313-A315 PolarHBondContact O-N 3.02Å; R313-A315 VanDerWaalsContact O-N 3.16Å; A315-S341 WeakPolarHBondContact O-CB 3.46Å
316	G	88.1	Confident	91.8	Very high	21 Å²	21	39.5 Å²	39.5	22%	0.216	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-13.6	175.7	0	0	0	0	0	116.2	L295 L314 Q318	L295-G316 CarbonylContact O-C 3.38Å; L314-G316 PolarHBondContact O-N 3.44Å; G316-Q318 PolarHBondContact O-N 2.86Å
317	L	93.7	Very high	91.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.206	C	C	.	.			trans	-75.5	111.2	-164.3	-173.4	73.2	0	0	0	112.7	L295 L298 V311 L314 L320 S341 I342	L295-L317 HydrophobicContact CD2-CD1 4.33Å; L295-L317 HydrophobicContact CG-CD1 4.27Å; L295-L317 WeakPolarHBondContact O-CA 3.48Å; L295-L317 PolarHBondContact O-N 3.41Å; L298-L317 HydrophobicContact CB-CD1 3.77Å; V311-L317 HydrophobicContact CG1-CD2 3.77Å; L314-L317 HydrophobicContact CB-CB 3.75Å; L314-L317 HydrophobicContact CD1-CB 4.38Å; L314-L317 HydrophobicContact CD1-CD2 4.02Å; L314-L317 PolarHBondContact O-N 2.94Å; L317-L320 HydrophobicContact CD2-CB 4.25Å; L317-L320 HydrophobicContact CD2-CD1 4.49Å; L317-L320 HydrophobicContact CD2-CD2 4.44Å; L317-S341 CarbonylContact O-C 3.57Å; L317-S341 VanDerWaalsContact O-CB 3.23Å; L317-S341 WeakPolarHBondContact O-CB 3.38Å; L317-S341 PolarHBondContact O-OG 3.01Å; L317-I342 HydrophobicContact CD2-CD1 4.33Å; L317-I342 HydrophobicContact CD2-CG1 4.3Å; L317-I342 HydrophobicContact CG-CG1 4.49Å; L317-I342 WeakPolarHBondContact O-CA 3.32Å; L317-I342 PolarHBondContact O-N 2.85Å; L317-I342 VanDerWaalsContact O-N 3.17Å
318	Q	94	Very high	91.8	Very high	103 Å²	103	39.9 Å²	39.9	48%	0.481	21%	0.212	S	C	.	.			trans	-99.7	-30.6	-177.7	-68.2	174.4	17.8	0	0	113.3	T296 G316 S343 E344	T296-Q318 PolarHBondContact O-N 3.17Å; G316-Q318 PolarHBondContact O-N 2.86Å; Q318-S343 WeakPolarHBondContact O-CA 3.49Å; Q318-S343 PolarHBondContact O-N 3.47Å; Q318-S343 PolarHBondContact O-OG 2.9Å; Q318-E344 PolarHBondContact O-N 3.47Å
319	R	95.3	Very high	91.6	Very high	72 Å²	72	41.6 Å²	41.6	27%	0.272	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	119.9	-172.5	-60.5	-174	-75.8	128	1.2	110.8	T296 E297 L298 F321 E344	T296-R319 PolarHBondContact O-N 3.17Å; E297-R319 WeakPolarHBondContact CA-O 3.33Å; E297-R319 VanDerWaalsContact CD-CZ 3.41Å; E297-R319 VanDerWaalsContact CD-NH2 3.34Å; E297-R319 IonicContact OE1-CZ 2.81Å; E297-R319 IonicContact OE1-NH1 2.73Å; E297-R319 PolarHBondContact OE1-NH1 3.35Å; E297-R319 IonicContact OE1-NH2 3.99Å; E297-R319 IonicContact OE2-CZ 3.78Å; E297-R319 IonicContact OE2-NH1 3.73Å; E297-R319 PolarHBondContact OE2-NH1 3.42Å; E297-R319 IonicContact OE2-NH2 2.79Å; E297-R319 PolarHBondContact OE2-NH2 2.81Å; L298-R319 PolarHBondContact N-O 3.42Å; R319-F321 HydrophobicContact CB-CE2 4.02Å; R319-F321 HydrophobicContact CB-CZ 4.16Å; R319-E344 WeakPolarHBondContact CA-O 3.26Å; R319-E344 HydrophobicContact CB-CB 4.43Å; R319-E344 VanDerWaalsContact CD-OE2 3.31Å; R319-E344 WeakPolarHBondContact CD-OE2 3.35Å; R319-E344 HydrophobicContact CG-CB 4Å; R319-E344 HydrophobicContact CG-CG 3.92Å
320	L	95.6	Very high	91.4	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	112.8	-177.9	176.9	57.7	0	0	0	110.6	L298 V311 L317 L322 L336 I342 E344 L345 T346	L298-L320 HydrophobicContact CB-CD1 4.09Å; L298-L320 HydrophobicContact CD2-CD1 4.01Å; L298-L320 HydrophobicContact CG-CD1 4.04Å; L298-L320 WeakPolarHBondContact O-CA 3.32Å; V311-L320 HydrophobicContact CG1-CD2 4.03Å; L317-L320 HydrophobicContact CD2-CB 4.25Å; L317-L320 HydrophobicContact CD2-CD1 4.49Å; L317-L320 HydrophobicContact CD2-CD2 4.44Å; L320-L322 HydrophobicContact CD1-CD1 4.2Å; L320-L322 HydrophobicContact CD1-CG 4.07Å; L320-L322 HydrophobicContact CD2-CD1 3.87Å; L320-L322 HydrophobicContact CG-CD1 3.9Å; L320-L322 HydrophobicContact CG-CG 4.1Å; L320-L336 HydrophobicContact CD2-CD1 4.5Å; L320-L336 HydrophobicContact CD2-CD2 3.8Å; L320-I342 HydrophobicContact CD2-CD1 4.11Å; L320-E344 PolarHBondContact N-O 2.86Å; L320-L345 HydrophobicContact CB-CD1 4.14Å; L320-L345 HydrophobicContact CD2-CD1 4.01Å; L320-L345 HydrophobicContact CG-CD1 4Å; L320-L345 WeakPolarHBondContact O-CA 3.3Å; L320-T346 PolarHBondContact O-N 2.62Å; L320-T346 VanDerWaalsContact O-N 3.14Å
321	F	96.4	Very high	91.5	Very high	23 Å²	23	44.6 Å²	44.6	10%	0.101	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	113	-179.2	-53.9	-77.7	0	0	0	110.6	E297 L298 N299 L300 Q301 R319 T346 M374	E297-F321 HydrophobicContact CG-CE2 4.17Å; L298-F321 PolarHBondContact O-N 3.41Å; N299-F321 HydrophobicContact CB-CB 4.38Å; N299-F321 HydrophobicContact CB-CD2 4Å; N299-F321 WeakPolarHBondContact OD1-CB 3.13Å; L300-F321 CarbonylContact C-O 3.58Å; L300-F321 WeakPolarHBondContact CA-O 3.4Å; L300-F321 PolarHBondContact N-O 3.45Å; Q301-F321 PolarHBondContact N-O 3.41Å; R319-F321 HydrophobicContact CB-CE2 4.02Å; R319-F321 HydrophobicContact CB-CZ 4.16Å; F321-T346 WeakPolarHBondContact CA-OG1 3.18Å; F321-T346 HydrophobicContact CD1-CG2 3.76Å; F321-T346 HydrophobicContact CE1-CG2 4.19Å; F321-M374 HydrophobicContact CE1-SD 4.22Å
322	L	95.5	Very high	91.5	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.			trans	-122.8	15.6	-178.5	-73.5	165.5	0	0	0	112.1	L300 I305 V308 L320 N325 I327 L345 T346 L347 N350	L300-L322 HydrophobicContact CB-CD2 3.91Å; L300-L322 HydrophobicContact CD1-CD2 4.11Å; I305-L322 HydrophobicContact CD1-CD2 3.86Å; V308-L322 HydrophobicContact CG2-CD1 3.94Å; V308-L322 HydrophobicContact CG2-CD2 4.45Å; L320-L322 HydrophobicContact CD1-CD1 4.2Å; L320-L322 HydrophobicContact CD1-CG 4.07Å; L320-L322 HydrophobicContact CD2-CD1 3.87Å; L320-L322 HydrophobicContact CG-CD1 3.9Å; L320-L322 HydrophobicContact CG-CG 4.1Å; L322-N325 WeakPolarHBondContact O-CB 3.33Å; L322-N325 PolarHBondContact O-ND2 2.92Å; L322-I327 HydrophobicContact CB-CD1 4.49Å; L322-I327 HydrophobicContact CD1-CD1 4.42Å; L322-L345 HydrophobicContact CD1-CD1 4.46Å; L322-T346 CarbonylContact C-O 3.07Å; L322-T346 WeakPolarHBondContact CA-O 3.45Å; L322-T346 WeakPolarHBondContact CB-O 3.16Å; L322-T346 PolarHBondContact N-O 2.7Å; L322-T346 PolarHBondContact N-OG1 2.79Å; L322-L347 HydrophobicContact CB-CD2 3.82Å; L322-L347 HydrophobicContact CD1-CD2 3.98Å; L322-N350 PolarHBondContact O-ND2 3.2Å
323	S	95.3	Very high	91.6	Very high	10 Å²	10	45 Å²	45	7%	0.07	24%	0.238	C	C	.	.			trans	-53.5	145.3	179.3	-51.3	0	0	0	0	113.1	Q301 Y302 N325 T346 D348	Q301-S323 CarbonylContact C-O 3.41Å; Q301-S323 WeakPolarHBondContact CA-O 3.39Å; Y302-S323 PolarHBondContact N-O 3.41Å; S323-N325 PolarHBondContact O-N 3.5Å; S323-N325 PolarHBondContact O-ND2 3.27Å; S323-T346 PolarHBondContact N-O 2.81Å; S323-T346 WeakPolarHBondContact OG-CB 3.44Å; S323-T346 PolarHBondContact OG-OG1 2.73Å; S323-D348 CarbonylContact C-O 3.55Å; S323-D348 WeakPolarHBondContact CA-O 3.27Å; S323-D348 VanDerWaalsContact CB-OD1 3.27Å; S323-D348 WeakPolarHBondContact CB-OD1 3.48Å; S323-D348 PolarHBondContact OG-OD1 3.45Å
324	C	95.2	Very high	91.6	Very high	43 Å²	43	41.4 Å²	41.4	29%	0.291	24%	0.238	S	C	.	.	S	Bend	trans	50.8	56	179.5	-61.7	0	0	0	0	113.3	Y302 N303 D348	Y302-C324 WeakPolarHBondContact CA-O 3.46Å; Y302-C324 HydrophobicContact CD1-CB 3.39Å; Y302-C324 HydrophobicContact CE1-CB 3.53Å; Y302-C324 WeakPolarHBondContact CE1-SG 3.49Å; Y302-C324 HydrophobicContact CG-CB 4.23Å; N303-C324 PolarHBondContact N-O 2.89Å; C324-D348 PolarHBondContact N-O 3.16Å
325	N	96.2	Very high	91.4	Very high	11 Å²	11	42.1 Å²	42.1	6%	0.059	24%	0.243	C	C	.	.	S	Bend	trans	-118.3	-171.4	169.8	-84.7	-81	0	0	0	110.4	L300 N303 C304 I305 L322 S323 I327 N350	L300-N325 PolarHBondContact O-ND2 3.31Å; N303-N325 VanDerWaalsContact CA-OD1 3.29Å; N303-N325 WeakPolarHBondContact CA-OD1 3.35Å; N303-N325 WeakPolarHBondContact CB-OD1 3.32Å; N303-N325 PolarHBondContact N-OD1 3.29Å; N303-N325 PolarHBondContact O-OD1 3.04Å; C304-N325 PolarHBondContact N-OD1 2.7Å; I305-N325 HydrophobicContact CB-CB 4.19Å; I305-N325 VanDerWaalsContact CB-OD1 3.25Å; I305-N325 WeakPolarHBondContact CB-OD1 3.37Å; I305-N325 WeakPolarHBondContact CG1-OD1 3.37Å; I305-N325 PolarHBondContact N-OD1 3.47Å; L322-N325 WeakPolarHBondContact O-CB 3.33Å; L322-N325 PolarHBondContact O-ND2 2.92Å; S323-N325 PolarHBondContact O-N 3.5Å; S323-N325 PolarHBondContact O-ND2 3.27Å; N325-I327 HydrophobicContact CB-CG1 4.49Å; N325-N350 VanDerWaalsContact CA-OD1 3.31Å; N325-N350 WeakPolarHBondContact CA-OD1 3.4Å; N325-N350 WeakPolarHBondContact CB-OD1 3.48Å; N325-N350 PolarHBondContact O-OD1 3.49Å
326	N	94.4	Very high	91.5	Very high	75 Å²	75	38 Å²	38	40%	0.401	21%	0.209	S	C	.	.			trans	-113.7	41.7	-173.6	-169.1	46.7	0	0	0	112.2	I305 S306 H328 N350	I305-N326 CarbonylContact O-C 3.14Å; I305-N326 WeakPolarHBondContact O-CA 3.5Å; I305-N326 PolarHBondContact O-N 3.13Å; S306-N326 WeakPolarHBondContact CA-O 3.41Å; N326-H328 PolarHBondContact ND2-NE2 3.05Å; N326-H328 PolarHBondContact O-CD2 3.29Å; N326-H328 PolarHBondContact O-NE2 3.18Å; N326-H328 PolarHBondContact OD1-NE2 3.36Å; N326-N350 PolarHBondContact N-OD1 2.99Å
327	I	94.4	Very high	91.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.218	C	C	.	.			trans	-85.6	122.7	179.7	-56.1	169.2	0	0	0	109.6	I305 V308 L322 N325 Q332 L333 L347 N350 P351 V352	I305-I327 WeakPolarHBondContact O-CG1 3.48Å; I305-I327 PolarHBondContact O-N 2.86Å; V308-I327 HydrophobicContact CG2-CD1 4.14Å; L322-I327 HydrophobicContact CB-CD1 4.49Å; L322-I327 HydrophobicContact CD1-CD1 4.42Å; N325-I327 HydrophobicContact CB-CG1 4.49Å; I327-Q332 HydrophobicContact CG2-CB 4.26Å; I327-L333 HydrophobicContact CD1-CD2 3.93Å; I327-L333 HydrophobicContact CG2-CD1 4.15Å; I327-L333 HydrophobicContact CG2-CD2 4.07Å; I327-L333 HydrophobicContact CG2-CG 3.9Å; I327-L347 HydrophobicContact CD1-CD2 4.05Å; I327-N350 HydrophobicContact CB-CB 4.33Å; I327-N350 WeakPolarHBondContact CB-OD1 3.49Å; I327-N350 WeakPolarHBondContact CG1-OD1 3.4Å; I327-N350 PolarHBondContact N-OD1 3.25Å; I327-N350 VanDerWaalsContact N-OD1 3.09Å; I327-P351 VanDerWaalsContact O-CD 3.28Å; I327-P351 WeakPolarHBondContact O-CD 3.5Å; I327-V352 HydrophobicContact CB-CG1 4.31Å; I327-V352 HydrophobicContact CG2-CG1 4.09Å; I327-V352 WeakPolarHBondContact O-CB 3.33Å; I327-V352 PolarHBondContact O-N 2.95Å
328	H	90.3	Very high	90.9	Very high	102 Å²	102	45.8 Å²	45.8	47%	0.472	25%	0.251	S	S	.	.			trans	-103.9	-36.3	-171.5	-69.3	-88.8	0	0	0	114.1	N326	N326-H328 PolarHBondContact ND2-NE2 3.05Å; N326-H328 PolarHBondContact O-CD2 3.29Å; N326-H328 PolarHBondContact O-NE2 3.18Å; N326-H328 PolarHBondContact OD1-NE2 3.36Å
329	S	88.5	Confident	90.5	Very high	41 Å²	41	41.1 Å²	41.1	29%	0.287	23%	0.229	S	C	.	.			trans	-130.4	154.7	-178.9	-170	0	0	0	0	112.7	D331 Q332	S329-D331 WeakPolarHBondContact CB-OD2 3.22Å; S329-D331 PolarHBondContact O-N 2.85Å; S329-D331 PolarHBondContact OG-N 2.92Å; S329-D331 PolarHBondContact OG-OD2 2.89Å; S329-Q332 WeakPolarHBondContact O-CB 3.42Å; S329-Q332 PolarHBondContact O-N 2.94Å; S329-Q332 VanDerWaalsContact O-N 3.12Å
330	F	86.2	Confident	89.9	Confident	24 Å²	24	45.4 Å²	45.4	11%	0.105	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-63.7	-22	170.3	-69.3	-77	0	0	0	113.3	Q332 L333 A334 V352 W357 Y358 A361 V362	F330-Q332 PolarHBondContact O-N 3.15Å; F330-L333 HydrophobicContact CD1-CD1 4.27Å; F330-L333 CarbonylContact O-C 3.57Å; F330-L333 WeakPolarHBondContact O-CA 3.41Å; F330-L333 WeakPolarHBondContact O-CB 3.3Å; F330-L333 PolarHBondContact O-N 3.32Å; F330-A334 PolarHBondContact O-N 3.08Å; F330-V352 HydrophobicContact CD1-CG2 4.25Å; F330-V352 HydrophobicContact CD2-CG2 3.78Å; F330-V352 HydrophobicContact CE1-CG2 3.91Å; F330-V352 HydrophobicContact CE2-CG2 3.41Å; F330-V352 VanDerWaalsContact CE2-CG2 3.41Å; F330-V352 HydrophobicContact CG-CG2 4.18Å; F330-V352 HydrophobicContact CZ-CG2 3.46Å; F330-V352 VanDerWaalsContact CZ-CG2 3.46Å; F330-W357 AromaticContact CD2-CH2 3.5Å; F330-W357 HydrophobicContact CD2-CH2 3.5Å; F330-W357 HydrophobicContact CD2-CZ2 4.13Å; F330-W357 AromaticContact CD2-CZ3 3.9Å; F330-W357 HydrophobicContact CD2-CZ3 3.9Å; F330-W357 AromaticContact CE2-CH2 3.82Å; F330-W357 HydrophobicContact CE2-CH2 3.82Å; F330-W357 HydrophobicContact CE2-CZ2 4.13Å; F330-W357 HydrophobicContact CE2-CZ3 4.04Å; F330-Y358 HydrophobicContact CE1-CD2 4.29Å; F330-Y358 AromaticContact CZ-CD2 3.78Å; F330-Y358 HydrophobicContact CZ-CD2 3.78Å; F330-Y358 HydrophobicContact CZ-CG 4.49Å; F330-A361 HydrophobicContact CD1-CB 3.92Å; F330-A361 HydrophobicContact CD2-CB 3.9Å; F330-A361 HydrophobicContact CE1-CB 3.54Å; F330-A361 HydrophobicContact CE2-CB 3.5Å; F330-A361 HydrophobicContact CG-CB 4.09Å; F330-A361 HydrophobicContact CZ-CB 3.31Å; F330-V362 HydrophobicContact CE1-CG2 3.8Å; F330-V362 HydrophobicContact CZ-CG2 4.48Å
331	D	87.3	Confident	89.6	Confident	133 Å²	133	46.6 Å²	46.6	71%	0.711	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-61.2	-32.9	172.8	-45.6	-63.3	0	0	0	111.3	S329 L333 A334	S329-D331 WeakPolarHBondContact CB-OD2 3.22Å; S329-D331 PolarHBondContact O-N 2.85Å; S329-D331 PolarHBondContact OG-N 2.92Å; S329-D331 PolarHBondContact OG-OD2 2.89Å; D331-L333 PolarHBondContact O-N 3.26Å; D331-A334 WeakPolarHBondContact O-CB 3.48Å; D331-A334 PolarHBondContact O-N 3.16Å
332	Q	87.6	Confident	89.4	Confident	50 Å²	50	45.6 Å²	45.6	23%	0.234	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-75.8	-4.2	176.7	-58.8	172.4	-51.7	0	0	113.1	S306 V307 V308 I327 S329 F330	S306-Q332 WeakPolarHBondContact O-CB 3.24Å; S306-Q332 PolarHBondContact O-NE2 3.32Å; S306-Q332 VanDerWaalsContact O-NE2 3.12Å; S306-Q332 PolarHBondContact O-OE1 3.43Å; V307-Q332 HydrophobicContact CG2-CG 4.36Å; V308-Q332 PolarHBondContact N-O 3.47Å; V308-Q332 VanDerWaalsContact N-O 3.08Å; I327-Q332 HydrophobicContact CG2-CB 4.26Å; S329-Q332 WeakPolarHBondContact O-CB 3.42Å; S329-Q332 PolarHBondContact O-N 2.94Å; S329-Q332 VanDerWaalsContact O-N 3.12Å; F330-Q332 PolarHBondContact O-N 3.15Å
333	L	88.6	Confident	89.2	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.026	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-117.6	7.7	177.2	-64.2	177	0	0	0	112.2	V308 I327 F330 D331 C335 L336 L347	V308-L333 HydrophobicContact CB-CD2 4.27Å; V308-L333 HydrophobicContact CG2-CD2 3.81Å; I327-L333 HydrophobicContact CD1-CD2 3.93Å; I327-L333 HydrophobicContact CG2-CD1 4.15Å; I327-L333 HydrophobicContact CG2-CD2 4.07Å; I327-L333 HydrophobicContact CG2-CG 3.9Å; F330-L333 HydrophobicContact CD1-CD1 4.27Å; F330-L333 CarbonylContact O-C 3.57Å; F330-L333 WeakPolarHBondContact O-CA 3.41Å; F330-L333 WeakPolarHBondContact O-CB 3.3Å; F330-L333 PolarHBondContact O-N 3.32Å; D331-L333 PolarHBondContact O-N 3.26Å; L333-C335 VanDerWaalsContact C-N 3.26Å; L333-C335 PolarHBondContact O-N 3.23Å; L333-C335 VanDerWaalsContact O-N 3.15Å; L333-L336 HydrophobicContact CB-CD1 4.24Å; L333-L336 HydrophobicContact CB-CG 4.49Å; L333-L336 HydrophobicContact CD2-CD1 3.9Å; L333-L336 VanDerWaalsContact O-CB 3.32Å; L333-L336 WeakPolarHBondContact O-CB 3.34Å; L333-L336 WeakPolarHBondContact O-CG 3.45Å; L333-L336 PolarHBondContact O-N 3.41Å; L333-L347 HydrophobicContact CD1-CD1 3.7Å; L333-L347 HydrophobicContact CD1-CD2 4.11Å; L333-L347 HydrophobicContact CD2-CD2 4.19Å
334	A	85.9	Confident	89.2	Confident	64 Å²	64	48.4 Å²	48.4	53%	0.529	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-56.1	-36.3	-170.6	0	0	0	0	0	113.7	F330 D331 L336 G337	F330-A334 PolarHBondContact O-N 3.08Å; D331-A334 WeakPolarHBondContact O-CB 3.48Å; D331-A334 PolarHBondContact O-N 3.16Å; A334-L336 PolarHBondContact O-N 2.98Å; A334-G337 PolarHBondContact O-N 3.43Å
335	C	87.1	Confident	89.2	Confident	17 Å²	17	46.4 Å²	46.4	12%	0.115	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-59.3	-26.7	176.4	65.2	0	0	0	0	113.7	V308 D312 L333 G337 E338	V308-C335 PolarHBondContact O-SG 2.93Å; D312-C335 HydrophobicContact CB-CB 4.29Å; L333-C335 VanDerWaalsContact C-N 3.26Å; L333-C335 PolarHBondContact O-N 3.23Å; L333-C335 VanDerWaalsContact O-N 3.15Å; C335-G337 PolarHBondContact O-N 3.32Å; C335-E338 PolarHBondContact O-N 3.08Å
336	L	87.1	Confident	89.1	Confident	2 Å²	2	46 Å²	46	1%	0.01	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-66.9	-20.9	177.4	-56	-172.6	0	0	0	112.3	V308 V311 L320 L333 A334 E338 I342 L345 V366	V308-L336 HydrophobicContact CG1-CD2 4.26Å; V311-L336 HydrophobicContact CB-CD2 4.01Å; V311-L336 HydrophobicContact CG1-CD2 3.55Å; L320-L336 HydrophobicContact CD2-CD1 4.5Å; L320-L336 HydrophobicContact CD2-CD2 3.8Å; L333-L336 HydrophobicContact CB-CD1 4.24Å; L333-L336 HydrophobicContact CB-CG 4.49Å; L333-L336 HydrophobicContact CD2-CD1 3.9Å; L333-L336 VanDerWaalsContact O-CB 3.32Å; L333-L336 WeakPolarHBondContact O-CB 3.34Å; L333-L336 WeakPolarHBondContact O-CG 3.45Å; L333-L336 PolarHBondContact O-N 3.41Å; A334-L336 PolarHBondContact O-N 2.98Å; L336-E338 VanDerWaalsContact C-N 3.35Å; L336-I342 HydrophobicContact CD2-CD1 3.94Å; L336-L345 HydrophobicContact CD1-CD1 4.28Å; L336-L345 HydrophobicContact CD1-CD2 4.14Å; L336-V366 HydrophobicContact CB-CG2 3.88Å
337	G	83.1	Confident	89.1	Confident	40 Å²	40	42.5 Å²	42.5	41%	0.412	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-75.9	-19.2	175.9	0	0	0	0	0	114.6	A334 C335 C365	A334-G337 PolarHBondContact O-N 3.43Å; C335-G337 PolarHBondContact O-N 3.32Å; G337-C365 WeakPolarHBondContact CA-O 3.33Å
338	E	85	Confident	89	Confident	145 Å²	145	45.6 Å²	45.6	68%	0.678	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-17.7	174.5	-62.3	-175.3	-176.9	0	0	111.9	D312 C335 L336	D312-E338 HydrophobicContact CB-CB 4.27Å; C335-E338 PolarHBondContact O-N 3.08Å; L336-E338 VanDerWaalsContact C-N 3.35Å
339	S	86.4	Confident	88.9	Confident	5 Å²	5	43.4 Å²	43.4	4%	0.035	26%	0.258	C	S	.	.			trans	-72.5	129.6	177.8	-171.7	0	0	0	0	112.4	S341 I342	S339-S341 PolarHBondContact OG-OG 2.98Å; S339-I342 WeakPolarHBondContact OG-CG1 3.32Å
340	Q	83.1	Confident	89.2	Confident	161 Å²	161	41.5 Å²	41.5	75%	0.752	25%	0.245	S	C	*	.	S	Bend	trans	-104	-10.4	-179	-59	178.2	25.1	0	0	113
341	S	89	Confident	89.5	Confident	28 Å²	28	42.4 Å²	42.4	20%	0.196	25%	0.253	C	S	.	.	S	Bend	trans	-94.9	-28.8	-171.8	43	0	0	0	0	114.1	L314 A315 L317 S339 S343	L314-S341 PolarHBondContact O-OG 2.71Å; A315-S341 WeakPolarHBondContact O-CB 3.46Å; L317-S341 CarbonylContact O-C 3.57Å; L317-S341 VanDerWaalsContact O-CB 3.23Å; L317-S341 WeakPolarHBondContact O-CB 3.38Å; L317-S341 PolarHBondContact O-OG 3.01Å; S339-S341 PolarHBondContact OG-OG 2.98Å; S341-S343 PolarHBondContact O-N 2.88Å
342	I	92.3	Very high	89.7	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	22%	0.219	C	C	.	.			trans	-67.2	121.1	-172	-63.7	170.5	0	0	0	111	V311 L317 L320 L336 S339 L345 V366 L369	V311-I342 HydrophobicContact CG1-CD1 3.79Å; L317-I342 HydrophobicContact CD2-CD1 4.33Å; L317-I342 HydrophobicContact CD2-CG1 4.3Å; L317-I342 HydrophobicContact CG-CG1 4.49Å; L317-I342 WeakPolarHBondContact O-CA 3.32Å; L317-I342 PolarHBondContact O-N 2.85Å; L317-I342 VanDerWaalsContact O-N 3.17Å; L320-I342 HydrophobicContact CD2-CD1 4.11Å; L336-I342 HydrophobicContact CD2-CD1 3.94Å; S339-I342 WeakPolarHBondContact OG-CG1 3.32Å; I342-L345 HydrophobicContact CG2-CB 4.39Å; I342-V366 HydrophobicContact CB-CG1 4.35Å; I342-V366 HydrophobicContact CG2-CG1 4.37Å; I342-L369 HydrophobicContact CG2-CD1 4Å
343	S	91.4	Very high	89.8	Confident	21 Å²	21	35.1 Å²	35.1	15%	0.147	22%	0.22	C	C	.	.			trans	-114.5	-28.3	-177.4	72.9	0	0	0	0	113	Q318 S341 R370 Q371	Q318-S343 WeakPolarHBondContact O-CA 3.49Å; Q318-S343 PolarHBondContact O-N 3.47Å; Q318-S343 PolarHBondContact O-OG 2.9Å; S341-S343 PolarHBondContact O-N 2.88Å; S343-R370 WeakPolarHBondContact O-CA 3.25Å; S343-R370 WeakPolarHBondContact O-CB 3.48Å; S343-R370 PolarHBondContact O-N 3.47Å; S343-Q371 PolarHBondContact O-N 3.42Å
344	E	94.4	Very high	89.8	Confident	48 Å²	48	42 Å²	42	22%	0.224	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.4	174.4	-45.1	-172.5	170.6	0	0	110	Q318 R319 L320 Q371	Q318-E344 PolarHBondContact O-N 3.47Å; R319-E344 WeakPolarHBondContact CA-O 3.26Å; R319-E344 HydrophobicContact CB-CB 4.43Å; R319-E344 VanDerWaalsContact CD-OE2 3.31Å; R319-E344 WeakPolarHBondContact CD-OE2 3.35Å; R319-E344 HydrophobicContact CG-CB 4Å; R319-E344 HydrophobicContact CG-CG 3.92Å; L320-E344 PolarHBondContact N-O 2.86Å; E344-Q371 WeakPolarHBondContact CA-O 3.36Å; E344-Q371 HydrophobicContact CB-CB 4.09Å; E344-Q371 VanDerWaalsContact CD-NE2 3.26Å; E344-Q371 HydrophobicContact CG-CB 3.94Å; E344-Q371 PolarHBondContact OE2-NE2 3.32Å; E344-Q371 VanDerWaalsContact OE2-NE2 3.09Å
345	L	94.6	Very high	89.9	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	140.3	-179.3	178.8	61.7	0	0	0	109.3	L320 L322 L336 I342 L347 V362 V366 L369 Q371 L372 D373	L320-L345 HydrophobicContact CB-CD1 4.14Å; L320-L345 HydrophobicContact CD2-CD1 4.01Å; L320-L345 HydrophobicContact CG-CD1 4Å; L320-L345 WeakPolarHBondContact O-CA 3.3Å; L322-L345 HydrophobicContact CD1-CD1 4.46Å; L336-L345 HydrophobicContact CD1-CD1 4.28Å; L336-L345 HydrophobicContact CD1-CD2 4.14Å; I342-L345 HydrophobicContact CG2-CB 4.39Å; L345-L347 HydrophobicContact CD1-CD2 4.46Å; L345-L347 HydrophobicContact CD1-CG 4.31Å; L345-L347 HydrophobicContact CD2-CD1 4.01Å; L345-L347 HydrophobicContact CD2-CG 4.43Å; L345-L347 HydrophobicContact CG-CD1 4.3Å; L345-L347 HydrophobicContact CG-CG 4.19Å; L345-V362 HydrophobicContact CD2-CG1 3.95Å; L345-V366 HydrophobicContact CD2-CG2 4.27Å; L345-L369 HydrophobicContact CB-CD1 3.6Å; L345-L369 HydrophobicContact CB-CD2 4.09Å; L345-L369 HydrophobicContact CD2-CD2 4.41Å; L345-Q371 PolarHBondContact N-O 3.26Å; L345-L372 HydrophobicContact CB-CD1 4.41Å; L345-L372 HydrophobicContact CG-CD1 4.4Å; L345-L372 VanDerWaalsContact O-CA 3.3Å; L345-L372 WeakPolarHBondContact O-CA 3.35Å; L345-D373 PolarHBondContact O-N 2.89Å
346	T	94.6	Very high	89.7	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.018	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	130.3	168.3	69.3	0	0	0	0	110.5	L320 F321 L322 S323 D373 M374	L320-T346 PolarHBondContact O-N 2.62Å; L320-T346 VanDerWaalsContact O-N 3.14Å; F321-T346 WeakPolarHBondContact CA-OG1 3.18Å; F321-T346 HydrophobicContact CD1-CG2 3.76Å; F321-T346 HydrophobicContact CE1-CG2 4.19Å; L322-T346 CarbonylContact C-O 3.07Å; L322-T346 WeakPolarHBondContact CA-O 3.45Å; L322-T346 WeakPolarHBondContact CB-O 3.16Å; L322-T346 PolarHBondContact N-O 2.7Å; L322-T346 PolarHBondContact N-OG1 2.79Å; S323-T346 PolarHBondContact N-O 2.81Å; S323-T346 WeakPolarHBondContact OG-CB 3.44Å; S323-T346 PolarHBondContact OG-OG1 2.73Å; T346-D373 WeakPolarHBondContact CA-OD1 3.34Å; T346-M374 HydrophobicContact CG2-CG 4.36Å; T346-M374 HydrophobicContact CG2-SD 4.03Å
347	L	93.6	Very high	89.6	Confident	1 Å²	1	55 Å²	55	1%	0.005	31%	0.307	C	S	.	.			trans	-131	5.7	175	-58.3	159.4	0	0	0	111.2	L322 I327 L333 L345 N350 Y358 V362 D373	L322-L347 HydrophobicContact CB-CD2 3.82Å; L322-L347 HydrophobicContact CD1-CD2 3.98Å; I327-L347 HydrophobicContact CD1-CD2 4.05Å; L333-L347 HydrophobicContact CD1-CD1 3.7Å; L333-L347 HydrophobicContact CD1-CD2 4.11Å; L333-L347 HydrophobicContact CD2-CD2 4.19Å; L345-L347 HydrophobicContact CD1-CD2 4.46Å; L345-L347 HydrophobicContact CD1-CG 4.31Å; L345-L347 HydrophobicContact CD2-CD1 4.01Å; L345-L347 HydrophobicContact CD2-CG 4.43Å; L345-L347 HydrophobicContact CG-CD1 4.3Å; L345-L347 HydrophobicContact CG-CG 4.19Å; L347-N350 VanDerWaalsContact O-CB 3.26Å; L347-N350 WeakPolarHBondContact O-CB 3.42Å; L347-N350 PolarHBondContact O-N 2.8Å; L347-N350 VanDerWaalsContact O-N 3.12Å; L347-N350 PolarHBondContact O-ND2 3.16Å; L347-Y358 HydrophobicContact CB-CE2 4.04Å; L347-Y358 WeakPolarHBondContact CB-OH 3.36Å; L347-Y358 HydrophobicContact CD1-CE2 4.04Å; L347-V362 HydrophobicContact CD1-CG2 4.02Å; L347-D373 PolarHBondContact N-OD1 2.94Å
348	D	92.4	Very high	89.9	Confident	65 Å²	65	53.9 Å²	53.9	35%	0.348	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	144.1	175.6	67.6	-70.2	0	0	0	112.4	S323 C324 N350 D373	S323-D348 CarbonylContact C-O 3.55Å; S323-D348 WeakPolarHBondContact CA-O 3.27Å; S323-D348 VanDerWaalsContact CB-OD1 3.27Å; S323-D348 WeakPolarHBondContact CB-OD1 3.48Å; S323-D348 PolarHBondContact OG-OD1 3.45Å; C324-D348 PolarHBondContact N-O 3.16Å; D348-N350 PolarHBondContact O-N 3.11Å; D348-D373 HydrophobicContact CB-CB 4.19Å; D348-D373 PolarHBondContact N-OD1 3.42Å; D348-D373 VanDerWaalsContact N-OD1 3.09Å
349	G	89.7	Confident	90	Very high	55 Å²	55	50.4 Å²	50.4	57%	0.567	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	1.7	-174.7	0	0	0	0	0	115.8
350	N	94.3	Very high	90	Very high	2 Å²	2	52 Å²	52	1%	0.011	28%	0.28	C	S	.	.	S	Bend	trans	-84.1	152.5	164.4	-72.5	-99.1	0	0	0	111.1	L322 N325 N326 I327 L347 D348 V352 A353	L322-N350 PolarHBondContact O-ND2 3.2Å; N325-N350 VanDerWaalsContact CA-OD1 3.31Å; N325-N350 WeakPolarHBondContact CA-OD1 3.4Å; N325-N350 WeakPolarHBondContact CB-OD1 3.48Å; N325-N350 PolarHBondContact O-OD1 3.49Å; N326-N350 PolarHBondContact N-OD1 2.99Å; I327-N350 HydrophobicContact CB-CB 4.33Å; I327-N350 WeakPolarHBondContact CB-OD1 3.49Å; I327-N350 WeakPolarHBondContact CG1-OD1 3.4Å; I327-N350 PolarHBondContact N-OD1 3.25Å; I327-N350 VanDerWaalsContact N-OD1 3.09Å; L347-N350 VanDerWaalsContact O-CB 3.26Å; L347-N350 WeakPolarHBondContact O-CB 3.42Å; L347-N350 PolarHBondContact O-N 2.8Å; L347-N350 VanDerWaalsContact O-N 3.12Å; L347-N350 PolarHBondContact O-ND2 3.16Å; D348-N350 PolarHBondContact O-N 3.11Å; N350-V352 VanDerWaalsContact C-N 3.25Å; N350-V352 HydrophobicContact CB-CG1 3.93Å; N350-V352 PolarHBondContact O-N 3.43Å; N350-A353 WeakPolarHBondContact O-CB 3.36Å; N350-A353 PolarHBondContact O-N 3.37Å
351	P	92.4	Very high	90.1	Very high	42 Å²	42	44.7 Å²	44.7	27%	0.273	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-51	-41	171.3	-27.1	33.1	0	0	0	113.9	I327 A353 L354	I327-P351 VanDerWaalsContact O-CD 3.28Å; I327-P351 WeakPolarHBondContact O-CD 3.5Å; P351-A353 PolarHBondContact O-N 3.04Å; P351-A353 VanDerWaalsContact O-N 3.15Å; P351-L354 WeakPolarHBondContact O-CB 3.41Å; P351-L354 WeakPolarHBondContact O-CG 3.35Å; P351-L354 PolarHBondContact O-N 3.26Å
352	V	91.1	Very high	90.1	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.012	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-60.8	-22.6	177.7	72.5	0	0	0	0	113.7	I327 F330 N350 L354 Y358	I327-V352 HydrophobicContact CB-CG1 4.31Å; I327-V352 HydrophobicContact CG2-CG1 4.09Å; I327-V352 WeakPolarHBondContact O-CB 3.33Å; I327-V352 PolarHBondContact O-N 2.95Å; F330-V352 HydrophobicContact CD1-CG2 4.25Å; F330-V352 HydrophobicContact CD2-CG2 3.78Å; F330-V352 HydrophobicContact CE1-CG2 3.91Å; F330-V352 HydrophobicContact CE2-CG2 3.41Å; F330-V352 VanDerWaalsContact CE2-CG2 3.41Å; F330-V352 HydrophobicContact CG-CG2 4.18Å; F330-V352 HydrophobicContact CZ-CG2 3.46Å; F330-V352 VanDerWaalsContact CZ-CG2 3.46Å; N350-V352 VanDerWaalsContact C-N 3.25Å; N350-V352 HydrophobicContact CB-CG1 3.93Å; N350-V352 PolarHBondContact O-N 3.43Å; V352-L354 VanDerWaalsContact C-N 3.3Å; V352-L354 PolarHBondContact O-N 2.92Å; V352-Y358 WeakPolarHBondContact O-CD2 3.31Å
353	A	89.5	Confident	89.8	Confident	29 Å²	29	44.3 Å²	44.3	24%	0.24	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-81.2	-5.5	177.3	0	0	0	0	0	114	N350 P351 E355 Y358	N350-A353 WeakPolarHBondContact O-CB 3.36Å; N350-A353 PolarHBondContact O-N 3.37Å; P351-A353 PolarHBondContact O-N 3.04Å; P351-A353 VanDerWaalsContact O-N 3.15Å; A353-E355 VanDerWaalsContact C-N 3.34Å; A353-Y358 HydrophobicContact CB-CD2 4.15Å; A353-Y358 HydrophobicContact CB-CE1 4.48Å; A353-Y358 HydrophobicContact CB-CE2 3.99Å; A353-Y358 HydrophobicContact CB-CG 4.47Å
354	L	89.3	Confident	89.4	Confident	149 Å²	149	50.3 Å²	50.3	78%	0.78	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-80.8	-15.6	172.9	-58	175.4	0	0	0	112.6	P351 V352	P351-L354 WeakPolarHBondContact O-CB 3.41Å; P351-L354 WeakPolarHBondContact O-CG 3.35Å; P351-L354 PolarHBondContact O-N 3.26Å; V352-L354 VanDerWaalsContact C-N 3.3Å; V352-L354 PolarHBondContact O-N 2.92Å
355	E	87.1	Confident	88.9	Confident	94 Å²	94	49.9 Å²	49.9	44%	0.439	27%	0.265	S	S	.	.	S	Bend	trans	-70.4	132	-177	-79.8	-60.9	144.4	0	0	112.8	A353 W357 Y358	A353-E355 VanDerWaalsContact C-N 3.34Å; E355-W357 PolarHBondContact O-N 2.9Å; E355-W357 VanDerWaalsContact OE2-CD1 3.28Å; E355-W357 PolarHBondContact OE2-NE1 2.95Å; E355-Y358 WeakPolarHBondContact O-CB 3.32Å; E355-Y358 PolarHBondContact O-N 3.4Å
356	T	84.6	Confident	88.5	Confident	132 Å²	132	50 Å²	50	81%	0.81	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-15.7	-178	56.3	0	0	0	0	114.8
357	W	84.2	Confident	87.8	Confident	130 Å²	130	55.6 Å²	55.6	49%	0.492	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	8.8	179.2	58.5	-72.1	0	0	0	112.8	F330 E355 K359 Q360 A361	F330-W357 AromaticContact CD2-CH2 3.5Å; F330-W357 HydrophobicContact CD2-CH2 3.5Å; F330-W357 HydrophobicContact CD2-CZ2 4.13Å; F330-W357 AromaticContact CD2-CZ3 3.9Å; F330-W357 HydrophobicContact CD2-CZ3 3.9Å; F330-W357 AromaticContact CE2-CH2 3.82Å; F330-W357 HydrophobicContact CE2-CH2 3.82Å; F330-W357 HydrophobicContact CE2-CZ2 4.13Å; F330-W357 HydrophobicContact CE2-CZ3 4.04Å; E355-W357 PolarHBondContact O-N 2.9Å; E355-W357 VanDerWaalsContact OE2-CD1 3.28Å; E355-W357 PolarHBondContact OE2-NE1 2.95Å; W357-K359 PolarHBondContact O-N 2.72Å; W357-Q360 VanDerWaalsContact CA-OE1 3.27Å; W357-Q360 PolarHBondContact O-N 3.14Å; W357-Q360 PolarHBondContact O-OE1 2.86Å; W357-Q360 VanDerWaalsContact O-OE1 3.1Å; W357-A361 HydrophobicContact CE3-CB 3.61Å; W357-A361 HydrophobicContact CZ3-CB 3.58Å; W357-A361 PolarHBondContact O-N 2.93Å
358	Y	89.1	Confident	87.3	Confident	17 Å²	17	60.4 Å²	60.4	7%	0.067	32%	0.317	C	S	.	.	H	α-helix	trans	-54.1	-51.9	-175.4	159	-96.9	0	0	0	113.5	F330 L347 V352 A353 E355 Q360 A361 V362 L372 D373	F330-Y358 HydrophobicContact CE1-CD2 4.29Å; F330-Y358 AromaticContact CZ-CD2 3.78Å; F330-Y358 HydrophobicContact CZ-CD2 3.78Å; F330-Y358 HydrophobicContact CZ-CG 4.49Å; L347-Y358 HydrophobicContact CB-CE2 4.04Å; L347-Y358 WeakPolarHBondContact CB-OH 3.36Å; L347-Y358 HydrophobicContact CD1-CE2 4.04Å; V352-Y358 WeakPolarHBondContact O-CD2 3.31Å; A353-Y358 HydrophobicContact CB-CD2 4.15Å; A353-Y358 HydrophobicContact CB-CE1 4.48Å; A353-Y358 HydrophobicContact CB-CE2 3.99Å; A353-Y358 HydrophobicContact CB-CG 4.47Å; E355-Y358 WeakPolarHBondContact O-CB 3.32Å; E355-Y358 PolarHBondContact O-N 3.4Å; Y358-Q360 PolarHBondContact O-N 3.35Å; Y358-A361 WeakPolarHBondContact O-CB 3.42Å; Y358-A361 PolarHBondContact O-N 2.94Å; Y358-A361 VanDerWaalsContact O-N 3.14Å; Y358-V362 HydrophobicContact CD2-CG2 4.02Å; Y358-V362 HydrophobicContact CE2-CG2 3.6Å; Y358-V362 WeakPolarHBondContact O-CG2 3.27Å; Y358-V362 PolarHBondContact O-N 3.13Å; Y358-L372 HydrophobicContact CE1-CD2 4.12Å; Y358-L372 WeakPolarHBondContact OH-CD1 3.22Å; Y358-D373 VanDerWaalsContact CE1-OD2 3.28Å; Y358-D373 WeakPolarHBondContact CE1-OD2 3.43Å; Y358-D373 PolarHBondContact OH-OD1 2.71Å; Y358-D373 PolarHBondContact OH-OD2 2.71Å
359	K	87.1	Confident	87	Confident	72 Å²	72	57.3 Å²	57.3	31%	0.313	30%	0.3	S	S	.	.	H	α-helix	trans	-60	-38.5	-178.7	-174.9	175.1	-173.1	178.9	0	111.1	W357 L363 L372 D381	W357-K359 PolarHBondContact O-N 2.72Å; K359-L363 HydrophobicContact CG-CD1 4.11Å; K359-L363 WeakPolarHBondContact O-CB 3.48Å; K359-L363 WeakPolarHBondContact O-CD1 3.31Å; K359-L363 WeakPolarHBondContact O-CG 3.47Å; K359-L363 PolarHBondContact O-N 3.49Å; K359-L363 VanDerWaalsContact O-N 3.17Å; K359-L372 HydrophobicContact CG-CD2 4.31Å; K359-D381 IonicContact NZ-OD1 2.76Å; K359-D381 PolarHBondContact NZ-OD1 2.87Å; K359-D381 IonicContact NZ-OD2 3.06Å; K359-D381 PolarHBondContact NZ-OD2 2.79Å
360	Q	85.8	Confident	87	Confident	38 Å²	38	63.1 Å²	63.1	18%	0.178	31%	0.305	C	S	.	.	H	α-helix	trans	-71.6	-37.2	-179.9	-56.5	86.2	-29.8	0	0	111.2	W357 Y358 R364 A385 L388 I389	W357-Q360 VanDerWaalsContact CA-OE1 3.27Å; W357-Q360 PolarHBondContact O-N 3.14Å; W357-Q360 PolarHBondContact O-OE1 2.86Å; W357-Q360 VanDerWaalsContact O-OE1 3.1Å; Y358-Q360 PolarHBondContact O-N 3.35Å; Q360-R364 WeakPolarHBondContact O-CB 3.46Å; Q360-R364 PolarHBondContact O-N 2.76Å; Q360-R364 VanDerWaalsContact O-N 3.07Å; Q360-A385 HydrophobicContact CB-CB 4.09Å; Q360-A385 HydrophobicContact CG-CB 3.89Å; Q360-L388 HydrophobicContact CG-CB 4.42Å; Q360-L388 HydrophobicContact CG-CD1 4.31Å; Q360-I389 HydrophobicContact CB-CD1 4.29Å; Q360-I389 HydrophobicContact CB-CG1 4.2Å
361	A	85.9	Confident	86.9	Confident	7 Å²	7	64 Å²	64	6%	0.058	31%	0.309	C	S	.	.	H	α-helix	trans	-67	-48.8	175.3	0	0	0	0	0	112.3	F330 W357 Y358 L363 R364 C365	F330-A361 HydrophobicContact CD1-CB 3.92Å; F330-A361 HydrophobicContact CD2-CB 3.9Å; F330-A361 HydrophobicContact CE1-CB 3.54Å; F330-A361 HydrophobicContact CE2-CB 3.5Å; F330-A361 HydrophobicContact CG-CB 4.09Å; F330-A361 HydrophobicContact CZ-CB 3.31Å; W357-A361 HydrophobicContact CE3-CB 3.61Å; W357-A361 HydrophobicContact CZ3-CB 3.58Å; W357-A361 PolarHBondContact O-N 2.93Å; Y358-A361 WeakPolarHBondContact O-CB 3.42Å; Y358-A361 PolarHBondContact O-N 2.94Å; Y358-A361 VanDerWaalsContact O-N 3.14Å; A361-L363 VanDerWaalsContact C-N 3.28Å; A361-L363 PolarHBondContact O-N 3.05Å; A361-R364 WeakPolarHBondContact O-CA 3.09Å; A361-R364 WeakPolarHBondContact O-CB 3.41Å; A361-R364 PolarHBondContact O-N 3.12Å; A361-C365 PolarHBondContact O-N 3.09Å; A361-C365 PolarHBondContact O-SG 3.49Å
362	V	88.3	Confident	86.9	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.024	30%	0.298	C	S	.	.	H	α-helix	trans	-57.7	-43.2	176.2	178.4	0	0	0	0	110.9	F330 L345 L347 Y358 R364 C365 V366 L369 L372	F330-V362 HydrophobicContact CE1-CG2 3.8Å; F330-V362 HydrophobicContact CZ-CG2 4.48Å; L345-V362 HydrophobicContact CD2-CG1 3.95Å; L347-V362 HydrophobicContact CD1-CG2 4.02Å; Y358-V362 HydrophobicContact CD2-CG2 4.02Å; Y358-V362 HydrophobicContact CE2-CG2 3.6Å; Y358-V362 WeakPolarHBondContact O-CG2 3.27Å; Y358-V362 PolarHBondContact O-N 3.13Å; V362-R364 VanDerWaalsContact C-N 3.26Å; V362-R364 PolarHBondContact O-N 3.34Å; V362-C365 PolarHBondContact O-N 2.86Å; V362-V366 PolarHBondContact O-N 2.91Å; V362-L369 HydrophobicContact CG1-CD2 3.7Å; V362-L372 HydrophobicContact CB-CD2 3.9Å; V362-L372 HydrophobicContact CG1-CD1 3.86Å; V362-L372 HydrophobicContact CG1-CD2 3.86Å; V362-L372 HydrophobicContact CG1-CG 4.48Å; V362-L372 HydrophobicContact CG2-CD1 4.49Å; V362-L372 HydrophobicContact CG2-CD2 4.22Å
363	L	86.8	Confident	86.9	Confident	18 Å²	18	63.7 Å²	63.7	9%	0.094	31%	0.305	C	S	.	.	H	α-helix	trans	-69	-18.9	176.4	-69.5	172.8	0	0	0	114.3	K359 A361 I377 R382 A385	K359-L363 HydrophobicContact CG-CD1 4.11Å; K359-L363 WeakPolarHBondContact O-CB 3.48Å; K359-L363 WeakPolarHBondContact O-CD1 3.31Å; K359-L363 WeakPolarHBondContact O-CG 3.47Å; K359-L363 PolarHBondContact O-N 3.49Å; K359-L363 VanDerWaalsContact O-N 3.17Å; A361-L363 VanDerWaalsContact C-N 3.28Å; A361-L363 PolarHBondContact O-N 3.05Å; L363-I377 HydrophobicContact CD2-CD1 3.66Å; L363-I377 HydrophobicContact CD2-CG1 4.09Å; L363-I377 HydrophobicContact CD2-CG2 3.72Å; L363-R382 HydrophobicContact CD2-CG 4.43Å; L363-A385 HydrophobicContact CB-CB 4.49Å; L363-A385 HydrophobicContact CD1-CB 3.86Å
364	R	83.6	Confident	86.7	Confident	147 Å²	147	68.1 Å²	68.1	56%	0.555	32%	0.322	S	S	*	.	H	α-helix	trans	-82.2	-34.3	171.6	179.7	177.5	176.7	138.4	0.6	111.7	Q360 A361 V362 I389 E393	Q360-R364 WeakPolarHBondContact O-CB 3.46Å; Q360-R364 PolarHBondContact O-N 2.76Å; Q360-R364 VanDerWaalsContact O-N 3.07Å; A361-R364 WeakPolarHBondContact O-CA 3.09Å; A361-R364 WeakPolarHBondContact O-CB 3.41Å; A361-R364 PolarHBondContact O-N 3.12Å; V362-R364 VanDerWaalsContact C-N 3.26Å; V362-R364 PolarHBondContact O-N 3.34Å; R364-I389 HydrophobicContact CB-CD1 4.14Å; R364-E393 IonicContact CZ-OE1 2.63Å; R364-E393 IonicContact NH1-OE1 3.57Å; R364-E393 PolarHBondContact NH1-OE1 3Å; R364-E393 IonicContact NH2-OE1 3.17Å
365	C	83.9	Confident	86.7	Confident	40 Å²	40	68.2 Å²	68.2	27%	0.27	32%	0.316	S	S	.	.	H	α-helix	trans	-76.8	-62.1	175.7	-61.4	0	0	0	0	111	G337 A361 V362 L367	G337-C365 WeakPolarHBondContact CA-O 3.33Å; A361-C365 PolarHBondContact O-N 3.09Å; A361-C365 PolarHBondContact O-SG 3.49Å; V362-C365 PolarHBondContact O-N 2.86Å; C365-L367 PolarHBondContact O-N 2.72Å
366	V	85.3	Confident	86.7	Confident	3 Å²	3	69.4 Å²	69.4	2%	0.018	32%	0.317	C	S	.	.			trans	-98.5	81.4	-171.1	-165.2	0	0	0	0	110.4	L336 I342 L345 V362 H368 L369	L336-V366 HydrophobicContact CB-CG2 3.88Å; I342-V366 HydrophobicContact CB-CG1 4.35Å; I342-V366 HydrophobicContact CG2-CG1 4.37Å; L345-V366 HydrophobicContact CD2-CG2 4.27Å; V362-V366 PolarHBondContact O-N 2.91Å; V366-H368 PolarHBondContact O-N 3.39Å; V366-L369 HydrophobicContact CB-CB 4.18Å; V366-L369 HydrophobicContact CG1-CB 3.97Å; V366-L369 HydrophobicContact CG1-CD1 4.19Å; V366-L369 VanDerWaalsContact O-CB 3.28Å; V366-L369 WeakPolarHBondContact O-CB 3.29Å; V366-L369 PolarHBondContact O-N 2.96Å
367	L	79.6	Confident	86.8	Confident	121 Å²	121	63.9 Å²	63.9	63%	0.634	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-31.7	-173.3	-60.9	177.1	0	0	0	114.1	C365 L369	C365-L367 PolarHBondContact O-N 2.72Å; L367-L369 VanDerWaalsContact C-N 3.34Å
368	H	82.9	Confident	86.9	Confident	101 Å²	101	61.1 Å²	61.1	47%	0.468	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-3.9	-175.1	-57.2	110	0	0	0	114.2	V366 R370	V366-H368 PolarHBondContact O-N 3.39Å; H368-R370 PolarHBondContact O-N 3.28Å
369	L	87.6	Confident	86.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	30%	0.302	C	S	.	.			trans	-62.6	132.9	-169.9	-163.4	68.8	0	0	0	112.4	I342 L345 V362 V366 L367 Q371 L372 I377 R382	I342-L369 HydrophobicContact CG2-CD1 4Å; L345-L369 HydrophobicContact CB-CD1 3.6Å; L345-L369 HydrophobicContact CB-CD2 4.09Å; L345-L369 HydrophobicContact CD2-CD2 4.41Å; V362-L369 HydrophobicContact CG1-CD2 3.7Å; V366-L369 HydrophobicContact CB-CB 4.18Å; V366-L369 HydrophobicContact CG1-CB 3.97Å; V366-L369 HydrophobicContact CG1-CD1 4.19Å; V366-L369 VanDerWaalsContact O-CB 3.28Å; V366-L369 WeakPolarHBondContact O-CB 3.29Å; V366-L369 PolarHBondContact O-N 2.96Å; L367-L369 VanDerWaalsContact C-N 3.34Å; L369-Q371 WeakPolarHBondContact CG-O 3.35Å; L369-L372 HydrophobicContact CD2-CB 4.01Å; L369-L372 HydrophobicContact CD2-CD1 4.13Å; L369-I377 HydrophobicContact CB-CD1 3.9Å; L369-I377 HydrophobicContact CD2-CD1 3.71Å; L369-I377 HydrophobicContact CG-CD1 3.64Å; L369-R382 PolarHBondContact O-NH2 3.48Å
370	R	88.3	Confident	86.3	Confident	178 Å²	178	66.1 Å²	66.1	67%	0.672	31%	0.308	S	S	*	.			trans	-106.2	-31	179.8	-57.6	-177.1	-179.5	-176.9	-1.1	112.5	S343 H368 R376 I377	S343-R370 WeakPolarHBondContact O-CA 3.25Å; S343-R370 WeakPolarHBondContact O-CB 3.48Å; S343-R370 PolarHBondContact O-N 3.47Å; H368-R370 PolarHBondContact O-N 3.28Å; R370-R376 WeakPolarHBondContact O-CA 3.31Å; R370-I377 PolarHBondContact O-N 3.2Å
371	Q	92.4	Very high	86.1	Confident	21 Å²	21	66.5 Å²	66.5	10%	0.098	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	131.2	-179.3	-172.2	164.5	-89.4	0	0	110.7	S343 E344 L345 L369 K375	S343-Q371 PolarHBondContact O-N 3.42Å; E344-Q371 WeakPolarHBondContact CA-O 3.36Å; E344-Q371 HydrophobicContact CB-CB 4.09Å; E344-Q371 VanDerWaalsContact CD-NE2 3.26Å; E344-Q371 HydrophobicContact CG-CB 3.94Å; E344-Q371 PolarHBondContact OE2-NE2 3.32Å; E344-Q371 VanDerWaalsContact OE2-NE2 3.09Å; L345-Q371 PolarHBondContact N-O 3.26Å; L369-Q371 WeakPolarHBondContact CG-O 3.35Å; Q371-K375 WeakPolarHBondContact CA-O 3.39Å
372	L	92.5	Very high	85.9	Confident	8 Å²	8	70.2 Å²	70.2	4%	0.042	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	127.1	174.7	-178.2	57.9	0	0	0	109.3	L345 Y358 K359 V362 L369 M374 K375 I377	L345-L372 HydrophobicContact CB-CD1 4.41Å; L345-L372 HydrophobicContact CG-CD1 4.4Å; L345-L372 VanDerWaalsContact O-CA 3.3Å; L345-L372 WeakPolarHBondContact O-CA 3.35Å; Y358-L372 HydrophobicContact CE1-CD2 4.12Å; Y358-L372 WeakPolarHBondContact OH-CD1 3.22Å; K359-L372 HydrophobicContact CG-CD2 4.31Å; V362-L372 HydrophobicContact CB-CD2 3.9Å; V362-L372 HydrophobicContact CG1-CD1 3.86Å; V362-L372 HydrophobicContact CG1-CD2 3.86Å; V362-L372 HydrophobicContact CG1-CG 4.48Å; V362-L372 HydrophobicContact CG2-CD1 4.49Å; V362-L372 HydrophobicContact CG2-CD2 4.22Å; L369-L372 HydrophobicContact CD2-CB 4.01Å; L369-L372 HydrophobicContact CD2-CD1 4.13Å; L372-M374 VanDerWaalsContact C-N 3.3Å; L372-M374 PolarHBondContact O-N 3.31Å; L372-K375 PolarHBondContact N-O 2.82Å; L372-K375 WeakPolarHBondContact O-CB 3.48Å; L372-K375 PolarHBondContact O-N 3.39Å; L372-K375 VanDerWaalsContact O-O 3.11Å; L372-I377 HydrophobicContact CB-CD1 3.96Å; L372-I377 HydrophobicContact CB-CG1 4.27Å
373	D	91.1	Very high	85.6	Confident	29 Å²	29	76.7 Å²	76.7	16%	0.155	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	49.6	179	-50.8	-36	0	0	0	112.5	L345 T346 L347 D348 Y358 K375	L345-D373 PolarHBondContact O-N 2.89Å; T346-D373 WeakPolarHBondContact CA-OD1 3.34Å; L347-D373 PolarHBondContact N-OD1 2.94Å; D348-D373 HydrophobicContact CB-CB 4.19Å; D348-D373 PolarHBondContact N-OD1 3.42Å; D348-D373 VanDerWaalsContact N-OD1 3.09Å; Y358-D373 VanDerWaalsContact CE1-OD2 3.28Å; Y358-D373 WeakPolarHBondContact CE1-OD2 3.43Å; Y358-D373 PolarHBondContact OH-OD1 2.71Å; Y358-D373 PolarHBondContact OH-OD2 2.71Å; D373-K375 PolarHBondContact O-N 2.95Å; D373-K375 VanDerWaalsContact O-N 3.08Å
374	M	86.1	Confident	85.3	Confident	122 Å²	122	80.5 Å²	80.5	60%	0.601	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	15.3	-176.1	-53.2	-55.3	-68.5	0	0	115.5	F321 T346 L372	F321-M374 HydrophobicContact CE1-SD 4.22Å; T346-M374 HydrophobicContact CG2-CG 4.36Å; T346-M374 HydrophobicContact CG2-SD 4.03Å; L372-M374 VanDerWaalsContact C-N 3.3Å; L372-M374 PolarHBondContact O-N 3.31Å
375	K	87.5	Confident	85.2	Confident	150 Å²	150	73.8 Å²	73.8	65%	0.652	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.3	175.6	-63.9	161.2	-169.4	160.3	0	110	Q371 L372 D373	Q371-K375 WeakPolarHBondContact CA-O 3.39Å; L372-K375 PolarHBondContact N-O 2.82Å; L372-K375 WeakPolarHBondContact O-CB 3.48Å; L372-K375 PolarHBondContact O-N 3.39Å; L372-K375 VanDerWaalsContact O-O 3.11Å; D373-K375 PolarHBondContact O-N 2.95Å; D373-K375 VanDerWaalsContact O-N 3.08Å
376	R	87.8	Confident	85	Confident	119 Å²	119	73.2 Å²	73.2	45%	0.449	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	137.9	175.7	-70.3	176.3	-179.2	-112.5	-5	110.6	E125 R370	E125-R376 VanDerWaalsContact CD-CZ 3.46Å; E125-R376 IonicContact OE1-CZ 2.66Å; E125-R376 IonicContact OE1-NE 3.29Å; E125-R376 IonicContact OE1-NH1 3.84Å; E125-R376 PolarHBondContact OE1-NH1 3.45Å; E125-R376 WeakPolarHBondContact OE2-CD 3.49Å; E125-R376 IonicContact OE2-CZ 3.34Å; E125-R376 IonicContact OE2-NE 3.5Å; E125-R376 PolarHBondContact OE2-NE 3.22Å; E125-R376 VanDerWaalsContact OE2-NE 3.16Å; E125-R376 IonicContact OE2-NH1 2.7Å; R370-R376 WeakPolarHBondContact O-CA 3.31Å
377	I	87.6	Confident	84.8	Confident	17 Å²	17	77.1 Å²	77.1	9%	0.087	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-87	120.3	177.8	-68.5	154.4	0	0	0	107.8	L363 L369 R370 L372 D381 R382	L363-I377 HydrophobicContact CD2-CD1 3.66Å; L363-I377 HydrophobicContact CD2-CG1 4.09Å; L363-I377 HydrophobicContact CD2-CG2 3.72Å; L369-I377 HydrophobicContact CB-CD1 3.9Å; L369-I377 HydrophobicContact CD2-CD1 3.71Å; L369-I377 HydrophobicContact CG-CD1 3.64Å; R370-I377 PolarHBondContact O-N 3.2Å; L372-I377 HydrophobicContact CB-CD1 3.96Å; L372-I377 HydrophobicContact CB-CG1 4.27Å; I377-D381 HydrophobicContact CG2-CB 4.37Å; I377-R382 HydrophobicContact CG2-CG 3.74Å
378	T	85.2	Confident	84.8	Confident	72 Å²	72	74.7 Å²	74.7	44%	0.442	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-85.5	158	172.8	63.9	0	0	0	0	111.1	E380 D381 R382	T378-E380 PolarHBondContact O-N 2.94Å; T378-D381 PolarHBondContact N-OD2 3.47Å; T378-D381 WeakPolarHBondContact O-CB 3.34Å; T378-D381 PolarHBondContact O-N 3.45Å; T378-D381 VanDerWaalsContact O-N 3.08Å; T378-D381 PolarHBondContact OG1-N 2.78Å; T378-D381 PolarHBondContact OG1-OD2 2.86Å; T378-R382 PolarHBondContact O-N 3.37Å; T378-R382 VanDerWaalsContact O-N 3.12Å
379	D	81.7	Confident	84.6	Confident	100 Å²	100	71.8 Å²	71.8	54%	0.535	34%	0.342	S	S	.	.	H	α-helix	trans	-68.2	-15.6	170.5	-66.7	-52	0	0	0	112.8	R382 R383	D379-R382 WeakPolarHBondContact OD1-CD 3.44Å; D379-R382 IonicContact OD1-CZ 3.54Å; D379-R382 IonicContact OD1-NE 3.16Å; D379-R382 IonicContact OD1-NH1 3.65Å; D379-R382 PolarHBondContact OD1-NH1 2.92Å; D379-R383 WeakPolarHBondContact O-CB 3.33Å; D379-R383 WeakPolarHBondContact O-CG 3.39Å; D379-R383 PolarHBondContact O-N 2.84Å; D379-R383 VanDerWaalsContact O-N 3.11Å; D379-R383 PolarHBondContact O-NE 3.06Å; D379-R383 VanDerWaalsContact O-NE 3.16Å
380	E	81.4	Confident	84.3	Confident	93 Å²	93	80.4 Å²	80.4	44%	0.435	37%	0.374	S	S	.	.	H	α-helix	trans	-69.7	-45.5	166.1	-165.4	62.3	-111.1	0	0	111	T378 R382 R383 M384	T378-E380 PolarHBondContact O-N 2.94Å; E380-R382 VanDerWaalsContact C-N 3.3Å; E380-R382 PolarHBondContact O-N 3.44Å; E380-R383 PolarHBondContact O-N 3.42Å; E380-R383 IonicContact OE1-CZ 2.69Å; E380-R383 IonicContact OE1-NH1 3.31Å; E380-R383 PolarHBondContact OE1-NH1 3.49Å; E380-R383 IonicContact OE1-NH2 2.73Å; E380-R383 IonicContact OE2-CZ 3.53Å; E380-R383 IonicContact OE2-NH1 2.74Å; E380-R383 PolarHBondContact OE2-NH1 3.26Å; E380-R383 IonicContact OE2-NH2 3.16Å; E380-R383 PolarHBondContact OE2-NH2 2.9Å; E380-M384 HydrophobicContact CG-CG 4.41Å; E380-M384 WeakPolarHBondContact O-CB 3.43Å; E380-M384 WeakPolarHBondContact O-CG 3.39Å; E380-M384 PolarHBondContact O-N 2.95Å
381	D	81.9	Confident	84.1	Confident	46 Å²	46	78.4 Å²	78.4	25%	0.246	37%	0.37	C	S	.	.	H	α-helix	trans	-57.9	-42.3	174.3	-70	-66	0	0	0	112.1	K359 I377 T378 A385	K359-D381 IonicContact NZ-OD1 2.76Å; K359-D381 PolarHBondContact NZ-OD1 2.87Å; K359-D381 IonicContact NZ-OD2 3.06Å; K359-D381 PolarHBondContact NZ-OD2 2.79Å; I377-D381 HydrophobicContact CG2-CB 4.37Å; T378-D381 PolarHBondContact N-OD2 3.47Å; T378-D381 WeakPolarHBondContact O-CB 3.34Å; T378-D381 PolarHBondContact O-N 3.45Å; T378-D381 VanDerWaalsContact O-N 3.08Å; T378-D381 PolarHBondContact OG1-N 2.78Å; T378-D381 PolarHBondContact OG1-OD2 2.86Å; D381-A385 WeakPolarHBondContact O-CB 3.17Å; D381-A385 PolarHBondContact O-N 2.83Å
382	R	82.6	Confident	83.5	Confident	86 Å²	86	80.9 Å²	80.9	33%	0.325	38%	0.382	S	S	.	.	H	α-helix	trans	-63.1	-45.2	176.3	-68.3	176.9	176.8	153.7	-7.4	111.6	L363 L369 I377 T378 D379 E380 A385 G386	L363-R382 HydrophobicContact CD2-CG 4.43Å; L369-R382 PolarHBondContact O-NH2 3.48Å; I377-R382 HydrophobicContact CG2-CG 3.74Å; T378-R382 PolarHBondContact O-N 3.37Å; T378-R382 VanDerWaalsContact O-N 3.12Å; D379-R382 WeakPolarHBondContact OD1-CD 3.44Å; D379-R382 IonicContact OD1-CZ 3.54Å; D379-R382 IonicContact OD1-NE 3.16Å; D379-R382 IonicContact OD1-NH1 3.65Å; D379-R382 PolarHBondContact OD1-NH1 2.92Å; E380-R382 VanDerWaalsContact C-N 3.3Å; E380-R382 PolarHBondContact O-N 3.44Å; R382-A385 PolarHBondContact O-N 3.48Å; R382-G386 PolarHBondContact O-N 3.36Å
383	R	81.7	Confident	83	Confident	139 Å²	139	83.7 Å²	83.7	53%	0.525	40%	0.395	S	S	.	.	H	α-helix	trans	-64.3	-45.5	176.6	-77.7	-178.8	-73.3	108.9	-2.8	111.7	D379 E380 G386 V387	D379-R383 WeakPolarHBondContact O-CB 3.33Å; D379-R383 WeakPolarHBondContact O-CG 3.39Å; D379-R383 PolarHBondContact O-N 2.84Å; D379-R383 VanDerWaalsContact O-N 3.11Å; D379-R383 PolarHBondContact O-NE 3.06Å; D379-R383 VanDerWaalsContact O-NE 3.16Å; E380-R383 PolarHBondContact O-N 3.42Å; E380-R383 IonicContact OE1-CZ 2.69Å; E380-R383 IonicContact OE1-NH1 3.31Å; E380-R383 PolarHBondContact OE1-NH1 3.49Å; E380-R383 IonicContact OE1-NH2 2.73Å; E380-R383 IonicContact OE2-CZ 3.53Å; E380-R383 IonicContact OE2-NH1 2.74Å; E380-R383 PolarHBondContact OE2-NH1 3.26Å; E380-R383 IonicContact OE2-NH2 3.16Å; E380-R383 PolarHBondContact OE2-NH2 2.9Å; R383-G386 PolarHBondContact O-N 2.9Å; R383-V387 WeakPolarHBondContact O-CG2 3.4Å; R383-V387 PolarHBondContact O-N 3.11Å
384	M	80.5	Confident	82.7	Confident	98 Å²	98	88.4 Å²	88.4	48%	0.483	42%	0.416	S	S	.	.	H	α-helix	trans	-64	-40.6	177	-73.6	-64.1	-69.8	0	0	112.5	E380 V387 L388	E380-M384 HydrophobicContact CG-CG 4.41Å; E380-M384 WeakPolarHBondContact O-CB 3.43Å; E380-M384 WeakPolarHBondContact O-CG 3.39Å; E380-M384 PolarHBondContact O-N 2.95Å; M384-V387 PolarHBondContact O-N 3.01Å; M384-L388 WeakPolarHBondContact O-CB 3.23Å; M384-L388 VanDerWaalsContact O-CG 3.31Å; M384-L388 WeakPolarHBondContact O-CG 3.28Å; M384-L388 PolarHBondContact O-N 3.14Å
385	A	81.2	Confident	82.7	Confident	6 Å²	6	88.4 Å²	88.4	5%	0.05	41%	0.413	C	S	.	.	H	α-helix	trans	-60.2	-47.3	172.1	0	0	0	0	0	111.5	Q360 L363 D381 R382 V387 L388 I389	Q360-A385 HydrophobicContact CB-CB 4.09Å; Q360-A385 HydrophobicContact CG-CB 3.89Å; L363-A385 HydrophobicContact CB-CB 4.49Å; L363-A385 HydrophobicContact CD1-CB 3.86Å; D381-A385 WeakPolarHBondContact O-CB 3.17Å; D381-A385 PolarHBondContact O-N 2.83Å; R382-A385 PolarHBondContact O-N 3.48Å; A385-V387 PolarHBondContact O-N 3.35Å; A385-L388 PolarHBondContact O-N 2.98Å; A385-I389 WeakPolarHBondContact O-CD1 3.49Å; A385-I389 VanDerWaalsContact O-CG1 3.26Å; A385-I389 WeakPolarHBondContact O-CG1 3.41Å; A385-I389 PolarHBondContact O-N 2.8Å
386	G	79.1	Confident	82.5	Confident	28 Å²	28	87.9 Å²	87.9	29%	0.289	41%	0.41	S	S	.	.	H	α-helix	trans	-59.9	-40.5	175.9	0	0	0	0	0	113.6	R382 R383 R390	R382-G386 PolarHBondContact O-N 3.36Å; R383-G386 PolarHBondContact O-N 2.9Å; G386-R390 VanDerWaalsContact O-CG 3.32Å; G386-R390 WeakPolarHBondContact O-CG 3.48Å; G386-R390 PolarHBondContact O-N 3.47Å
387	V	82.1	Confident	82.2	Confident	85 Å²	85	87.8 Å²	87.8	52%	0.515	41%	0.413	S	S	.	.	H	α-helix	trans	-64.8	-44.4	174.9	169.2	0	0	0	0	111.4	R383 M384 A385 R390 K391	R383-V387 WeakPolarHBondContact O-CG2 3.4Å; R383-V387 PolarHBondContact O-N 3.11Å; M384-V387 PolarHBondContact O-N 3.01Å; A385-V387 PolarHBondContact O-N 3.35Å; V387-R390 PolarHBondContact O-N 3.39Å; V387-K391 WeakPolarHBondContact O-CB 3.27Å; V387-K391 PolarHBondContact O-N 2.98Å
388	L	79.4	Confident	81.9	Confident	71 Å²	71	90.6 Å²	90.6	37%	0.372	43%	0.426	S	S	.	.	H	α-helix	trans	-66.9	-39.2	178.7	-70.3	172.9	0	0	0	112.4	Q360 M384 A385 K391 E392	Q360-L388 HydrophobicContact CG-CB 4.42Å; Q360-L388 HydrophobicContact CG-CD1 4.31Å; M384-L388 WeakPolarHBondContact O-CB 3.23Å; M384-L388 VanDerWaalsContact O-CG 3.31Å; M384-L388 WeakPolarHBondContact O-CG 3.28Å; M384-L388 PolarHBondContact O-N 3.14Å; A385-L388 PolarHBondContact O-N 2.98Å; L388-K391 PolarHBondContact O-N 2.68Å; L388-E392 PolarHBondContact O-N 3.42Å
389	I	79.1	Confident	81.7	Confident	40 Å²	40	90.3 Å²	90.3	21%	0.205	43%	0.427	C	S	.	.	H	α-helix	trans	-61.5	-48.2	173.8	-69	162.5	0	0	0	110.5	Q360 R364 A385 K391 E392 E393	Q360-I389 HydrophobicContact CB-CD1 4.29Å; Q360-I389 HydrophobicContact CB-CG1 4.2Å; R364-I389 HydrophobicContact CB-CD1 4.14Å; A385-I389 WeakPolarHBondContact O-CD1 3.49Å; A385-I389 VanDerWaalsContact O-CG1 3.26Å; A385-I389 WeakPolarHBondContact O-CG1 3.41Å; A385-I389 PolarHBondContact O-N 2.8Å; I389-K391 PolarHBondContact O-N 2.99Å; I389-E392 PolarHBondContact O-N 2.96Å; I389-E393 PolarHBondContact O-N 3.27Å
390	R	81.6	Confident	81.9	Confident	181 Å²	181	91.5 Å²	91.5	68%	0.683	43%	0.429	S	S	*	.	H	α-helix	trans	-58.8	-47.3	176.9	-74	174.4	-177	-175.4	1.7	111.6	G386 V387 E392 E393 E394	G386-R390 VanDerWaalsContact O-CG 3.32Å; G386-R390 WeakPolarHBondContact O-CG 3.48Å; G386-R390 PolarHBondContact O-N 3.47Å; V387-R390 PolarHBondContact O-N 3.39Å; R390-E392 VanDerWaalsContact C-N 3.33Å; R390-E392 PolarHBondContact O-N 3.23Å; R390-E393 PolarHBondContact O-N 2.94Å; R390-E394 WeakPolarHBondContact O-CB 3.48Å; R390-E394 WeakPolarHBondContact O-CG 3.41Å; R390-E394 PolarHBondContact O-N 3.08Å
391	K	84.3	Confident	82.2	Confident	136 Å²	136	92.8 Å²	92.8	59%	0.591	43%	0.433	S	S	*	.	H	α-helix	trans	-59.5	-39.9	178	-175.1	178.6	-179.4	179.8	0	112.6	V387 L388 I389 K395	V387-K391 WeakPolarHBondContact O-CB 3.27Å; V387-K391 PolarHBondContact O-N 2.98Å; L388-K391 PolarHBondContact O-N 2.68Å; I389-K391 PolarHBondContact O-N 2.99Å; K391-K395 VanDerWaalsContact O-CB 3.27Å; K391-K395 WeakPolarHBondContact O-CB 3.48Å; K391-K395 PolarHBondContact O-N 3.05Å
392	E	79.6	Confident	82.4	Confident	72 Å²	72	95.2 Å²	95.2	34%	0.336	44%	0.443	S	S	.	.	H	α-helix	trans	-76.1	-35.5	177.9	-170.3	56.4	-144.2	0	0	112.3	L388 I389 R390 K395 K396	L388-E392 PolarHBondContact O-N 3.42Å; I389-E392 PolarHBondContact O-N 2.96Å; R390-E392 VanDerWaalsContact C-N 3.33Å; R390-E392 PolarHBondContact O-N 3.23Å; E392-K395 PolarHBondContact O-N 3.36Å; E392-K395 IonicContact OE1-NZ 3.32Å; E392-K395 PolarHBondContact OE1-NZ 2.8Å; E392-K395 WeakPolarHBondContact OE2-CD 3.29Å; E392-K395 IonicContact OE2-NZ 3.01Å; E392-K395 PolarHBondContact OE2-NZ 3.46Å; E392-K396 WeakPolarHBondContact O-CB 3.46Å; E392-K396 WeakPolarHBondContact O-CG 3.38Å; E392-K396 PolarHBondContact O-N 3.3Å
393	E	81.6	Confident	82.5	Confident	67 Å²	67	95 Å²	95	31%	0.313	45%	0.451	S	S	.	.	H	α-helix	trans	-65.3	-39.1	171	-76.1	-169.9	-166.3	0	0	112.3	R364 I389 R390 K396 K397	R364-E393 IonicContact CZ-OE1 2.63Å; R364-E393 IonicContact NH1-OE1 3.57Å; R364-E393 PolarHBondContact NH1-OE1 3Å; R364-E393 IonicContact NH2-OE1 3.17Å; I389-E393 PolarHBondContact O-N 3.27Å; R390-E393 PolarHBondContact O-N 2.94Å; E393-K396 PolarHBondContact O-N 2.8Å; E393-K397 WeakPolarHBondContact O-CB 3.33Å; E393-K397 WeakPolarHBondContact O-CD 3.27Å; E393-K397 WeakPolarHBondContact O-CG 3.23Å; E393-K397 PolarHBondContact O-N 2.73Å; E393-K397 IonicContact OE2-NZ 2.78Å; E393-K397 PolarHBondContact OE2-NZ 3.12Å
394	E	85.1	Confident	82.7	Confident	128 Å²	128	92.1 Å²	92.1	60%	0.598	45%	0.446	S	S	*	.	H	α-helix	trans	-63.8	-46.3	172.2	-75.6	174	168.7	0	0	111.4	R390 K396 K397 E398	R390-E394 WeakPolarHBondContact O-CB 3.48Å; R390-E394 WeakPolarHBondContact O-CG 3.41Å; R390-E394 PolarHBondContact O-N 3.08Å; E394-K396 VanDerWaalsContact C-N 3.33Å; E394-K396 PolarHBondContact O-N 3.26Å; E394-K397 PolarHBondContact O-N 3.37Å; E394-E398 WeakPolarHBondContact O-CB 3.39Å; E394-E398 PolarHBondContact O-N 3Å
395	K	86.1	Confident	82.9	Confident	123 Å²	123	92.9 Å²	92.9	54%	0.535	45%	0.447	S	S	.	.	H	α-helix	trans	-59	-40.1	173.8	169.2	165.3	157.1	-89.2	0	112.6	K391 E392 S399	K391-K395 VanDerWaalsContact O-CB 3.27Å; K391-K395 WeakPolarHBondContact O-CB 3.48Å; K391-K395 PolarHBondContact O-N 3.05Å; E392-K395 PolarHBondContact O-N 3.36Å; E392-K395 IonicContact OE1-NZ 3.32Å; E392-K395 PolarHBondContact OE1-NZ 2.8Å; E392-K395 WeakPolarHBondContact OE2-CD 3.29Å; E392-K395 IonicContact OE2-NZ 3.01Å; E392-K395 PolarHBondContact OE2-NZ 3.46Å; K395-S399 VanDerWaalsContact O-CB 3.31Å; K395-S399 WeakPolarHBondContact O-CB 3.38Å; K395-S399 PolarHBondContact O-N 2.65Å
396	K	81.8	Confident	83.2	Confident	138 Å²	138	99.1 Å²	99.1	60%	0.6	47%	0.474	S	S	*	.	H	α-helix	trans	-66.7	-45.6	173.5	-75.7	175.6	179.4	-179.5	0	111.9	E392 E393 E394 E398 S399 H400	E392-K396 WeakPolarHBondContact O-CB 3.46Å; E392-K396 WeakPolarHBondContact O-CG 3.38Å; E392-K396 PolarHBondContact O-N 3.3Å; E393-K396 PolarHBondContact O-N 2.8Å; E394-K396 VanDerWaalsContact C-N 3.33Å; E394-K396 PolarHBondContact O-N 3.26Å; K396-E398 VanDerWaalsContact C-N 3.33Å; K396-E398 PolarHBondContact O-N 2.71Å; K396-S399 PolarHBondContact O-N 3.19Å; K396-H400 WeakPolarHBondContact O-CB 3.41Å; K396-H400 PolarHBondContact O-N 2.83Å
397	K	81.7	Confident	83.6	Confident	118 Å²	118	101.9 Å²	101.9	51%	0.513	48%	0.479	S	S	.	.	H	α-helix	trans	-59.4	-42.4	174.9	-73.6	158.9	-173.8	155.8	0	111.3	E393 E394 H400 K401	E393-K397 WeakPolarHBondContact O-CB 3.33Å; E393-K397 WeakPolarHBondContact O-CD 3.27Å; E393-K397 WeakPolarHBondContact O-CG 3.23Å; E393-K397 PolarHBondContact O-N 2.73Å; E393-K397 IonicContact OE2-NZ 2.78Å; E393-K397 PolarHBondContact OE2-NZ 3.12Å; E394-K397 PolarHBondContact O-N 3.37Å; K397-H400 PolarHBondContact O-N 2.79Å; K397-K401 WeakPolarHBondContact O-CG 3.39Å; K397-K401 PolarHBondContact O-N 3.1Å
398	E	82.9	Confident	83.8	Confident	76 Å²	76	104.9 Å²	104.9	36%	0.355	49%	0.485	S	S	.	.	H	α-helix	trans	-71	-42.9	179.8	-165.7	53.6	-133.2	0	0	112.2	E394 K396 H400 K401 Q402	E394-E398 WeakPolarHBondContact O-CB 3.39Å; E394-E398 PolarHBondContact O-N 3Å; K396-E398 VanDerWaalsContact C-N 3.33Å; K396-E398 PolarHBondContact O-N 2.71Å; E398-H400 VanDerWaalsContact C-N 3.26Å; E398-H400 PolarHBondContact O-N 2.89Å; E398-K401 WeakPolarHBondContact O-CB 3.33Å; E398-K401 PolarHBondContact O-N 3.27Å; E398-K401 WeakPolarHBondContact OE2-CD 3.08Å; E398-K401 WeakPolarHBondContact OE2-CE 3.39Å; E398-K401 IonicContact OE2-NZ 3.3Å; E398-K401 PolarHBondContact OE2-NZ 2.84Å; E398-Q402 WeakPolarHBondContact O-CB 3.43Å; E398-Q402 WeakPolarHBondContact O-CG 3.18Å; E398-Q402 PolarHBondContact O-N 3.21Å
399	S	80.7	Confident	83.7	Confident	66 Å²	66	106.8 Å²	106.8	46%	0.462	49%	0.487	S	S	.	.	H	α-helix	trans	-57.2	-39.8	170.6	-176.7	0	0	0	0	112.2	K395 K396 Q402 T403	K395-S399 VanDerWaalsContact O-CB 3.31Å; K395-S399 WeakPolarHBondContact O-CB 3.38Å; K395-S399 PolarHBondContact O-N 2.65Å; K396-S399 PolarHBondContact O-N 3.19Å; S399-Q402 PolarHBondContact O-N 3.24Å; S399-T403 WeakPolarHBondContact O-CB 3.43Å; S399-T403 PolarHBondContact O-N 3.07Å; S399-T403 PolarHBondContact O-OG1 3.14Å
400	H	84.8	Confident	84.1	Confident	125 Å²	125	112.6 Å²	112.6	58%	0.579	51%	0.507	S	S	*	.	H	α-helix	trans	-67.3	-44.5	175.9	-170.4	70.7	0	0	0	112.1	K396 K397 E398 Q402 T403 I404	K396-H400 WeakPolarHBondContact O-CB 3.41Å; K396-H400 PolarHBondContact O-N 2.83Å; K397-H400 PolarHBondContact O-N 2.79Å; E398-H400 VanDerWaalsContact C-N 3.26Å; E398-H400 PolarHBondContact O-N 2.89Å; H400-Q402 VanDerWaalsContact C-N 3.34Å; H400-Q402 PolarHBondContact O-N 3.36Å; H400-T403 WeakPolarHBondContact O-CB 3.41Å; H400-T403 PolarHBondContact O-N 3.33Å; H400-T403 VanDerWaalsContact O-N 3.17Å; H400-I404 WeakPolarHBondContact O-CG1 3.41Å; H400-I404 PolarHBondContact O-N 3.17Å
401	K	88.9	Confident	84.3	Confident	120 Å²	120	108.2 Å²	108.2	52%	0.522	50%	0.496	S	S	.	.	H	α-helix	trans	-57	-46	171.4	-70.1	-179.5	-151.8	159	0	111.8	K397 E398 T403 I404 H405	K397-K401 WeakPolarHBondContact O-CG 3.39Å; K397-K401 PolarHBondContact O-N 3.1Å; E398-K401 WeakPolarHBondContact O-CB 3.33Å; E398-K401 PolarHBondContact O-N 3.27Å; E398-K401 WeakPolarHBondContact OE2-CD 3.08Å; E398-K401 WeakPolarHBondContact OE2-CE 3.39Å; E398-K401 IonicContact OE2-NZ 3.3Å; E398-K401 PolarHBondContact OE2-NZ 2.84Å; K401-T403 VanDerWaalsContact C-N 3.28Å; K401-T403 PolarHBondContact O-N 2.98Å; K401-I404 PolarHBondContact O-N 3.34Å; K401-H405 WeakPolarHBondContact O-CB 3.44Å; K401-H405 PolarHBondContact O-N 2.67Å
402	Q	84.8	Confident	84.2	Confident	97 Å²	97	104.6 Å²	104.6	45%	0.453	49%	0.492	S	S	.	.	H	α-helix	trans	-62.8	-35.8	177.9	-71.8	176.7	20.2	0	0	111.8	E398 S399 H400 H405 K406	E398-Q402 WeakPolarHBondContact O-CB 3.43Å; E398-Q402 WeakPolarHBondContact O-CG 3.18Å; E398-Q402 PolarHBondContact O-N 3.21Å; S399-Q402 PolarHBondContact O-N 3.24Å; H400-Q402 VanDerWaalsContact C-N 3.34Å; H400-Q402 PolarHBondContact O-N 3.36Å; Q402-H405 PolarHBondContact O-N 2.69Å; Q402-K406 WeakPolarHBondContact O-CB 3.45Å; Q402-K406 VanDerWaalsContact O-CG 3.24Å; Q402-K406 WeakPolarHBondContact O-CG 3.42Å; Q402-K406 PolarHBondContact O-N 3Å
403	T	85	Confident	84.5	Confident	82 Å²	82	105.2 Å²	105.2	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-66.3	-46.6	174.3	-56.4	0	0	0	0	111.1	S399 H400 K401 H405 K406 E407	S399-T403 WeakPolarHBondContact O-CB 3.43Å; S399-T403 PolarHBondContact O-N 3.07Å; S399-T403 PolarHBondContact O-OG1 3.14Å; H400-T403 WeakPolarHBondContact O-CB 3.41Å; H400-T403 PolarHBondContact O-N 3.33Å; H400-T403 VanDerWaalsContact O-N 3.17Å; K401-T403 VanDerWaalsContact C-N 3.28Å; K401-T403 PolarHBondContact O-N 2.98Å; T403-H405 VanDerWaalsContact C-N 3.32Å; T403-H405 PolarHBondContact O-N 2.92Å; T403-K406 PolarHBondContact O-N 3.17Å; T403-E407 WeakPolarHBondContact O-CB 3.28Å; T403-E407 PolarHBondContact O-N 3.3Å
404	I	85.7	Confident	84.6	Confident	78 Å²	78	109.9 Å²	109.9	40%	0.4	51%	0.511	S	S	.	.	H	α-helix	trans	-60.2	-40.8	173.2	-67.8	165.2	0	0	0	111.4	H400 K401 E407 K408	H400-I404 WeakPolarHBondContact O-CG1 3.41Å; H400-I404 PolarHBondContact O-N 3.17Å; K401-I404 PolarHBondContact O-N 3.34Å; I404-E407 PolarHBondContact O-N 3.2Å; I404-K408 HydrophobicContact CG2-CD 4.26Å; I404-K408 WeakPolarHBondContact O-CB 3.18Å; I404-K408 WeakPolarHBondContact O-CG 2.96Å; I404-K408 PolarHBondContact O-N 2.92Å
405	H	85.2	Confident	84.4	Confident	113 Å²	113	107.4 Å²	107.4	52%	0.523	50%	0.502	S	S	.	.	H	α-helix	trans	-69.5	-40.5	179.7	-170	92.1	0	0	0	111.9	K401 Q402 T403 E407 K408 R409	K401-H405 WeakPolarHBondContact O-CB 3.44Å; K401-H405 PolarHBondContact O-N 2.67Å; Q402-H405 PolarHBondContact O-N 2.69Å; T403-H405 VanDerWaalsContact C-N 3.32Å; T403-H405 PolarHBondContact O-N 2.92Å; H405-E407 VanDerWaalsContact C-N 3.33Å; H405-E407 PolarHBondContact O-N 3.02Å; H405-K408 PolarHBondContact O-N 2.96Å; H405-R409 WeakPolarHBondContact O-CB 3.46Å; H405-R409 PolarHBondContact O-N 3.5Å
406	K	87.9	Confident	84.2	Confident	138 Å²	138	104.1 Å²	104.1	60%	0.6	50%	0.498	S	S	*	.	H	α-helix	trans	-60.5	-41.1	171	-76.4	169.7	-178.2	177	0	111.6	Q402 T403 R409 R410	Q402-K406 WeakPolarHBondContact O-CB 3.45Å; Q402-K406 VanDerWaalsContact O-CG 3.24Å; Q402-K406 WeakPolarHBondContact O-CG 3.42Å; Q402-K406 PolarHBondContact O-N 3Å; T403-K406 PolarHBondContact O-N 3.17Å; K406-R409 PolarHBondContact O-N 2.98Å; K406-R410 WeakPolarHBondContact O-CB 3.49Å; K406-R410 PolarHBondContact O-N 3.07Å
407	E	86.4	Confident	84.1	Confident	85 Å²	85	99.6 Å²	99.6	40%	0.397	49%	0.486	S	S	.	.	H	α-helix	trans	-68.7	-43.7	177.8	-173.4	53.5	-144.8	0	0	112.3	T403 I404 H405 R409 R410 L411	T403-E407 WeakPolarHBondContact O-CB 3.28Å; T403-E407 PolarHBondContact O-N 3.3Å; I404-E407 PolarHBondContact O-N 3.2Å; H405-E407 VanDerWaalsContact C-N 3.33Å; H405-E407 PolarHBondContact O-N 3.02Å; E407-R409 VanDerWaalsContact C-N 3.3Å; E407-R409 PolarHBondContact O-N 3.31Å; E407-R410 VanDerWaalsContact CD-NE 3.34Å; E407-R410 WeakPolarHBondContact O-CB 3.45Å; E407-R410 PolarHBondContact O-N 3.44Å; E407-R410 VanDerWaalsContact O-N 3.15Å; E407-R410 IonicContact OE1-CZ 3.34Å; E407-R410 VanDerWaalsContact OE1-CZ 3.28Å; E407-R410 IonicContact OE1-NE 3.64Å; E407-R410 PolarHBondContact OE1-NE 3.48Å; E407-R410 IonicContact OE1-NH2 2.65Å; E407-R410 PolarHBondContact OE1-NH2 3Å; E407-R410 IonicContact OE2-CZ 2.69Å; E407-R410 IonicContact OE2-NE 2.94Å; E407-R410 PolarHBondContact OE2-NE 3.36Å; E407-R410 IonicContact OE2-NH2 3.75Å; E407-R410 PolarHBondContact OE2-NH2 2.81Å; E407-R410 VanDerWaalsContact OE2-NH2 3.08Å; E407-L411 PolarHBondContact O-N 2.98Å
408	K	87	Confident	83.8	Confident	149 Å²	149	98.9 Å²	98.9	65%	0.648	49%	0.485	S	S	*	.	H	α-helix	trans	-59.3	-40.4	171.8	-74.5	-177.7	177.7	-170.7	0	111.8	I404 H405 L411 A412	I404-K408 HydrophobicContact CG2-CD 4.26Å; I404-K408 WeakPolarHBondContact O-CB 3.18Å; I404-K408 WeakPolarHBondContact O-CG 2.96Å; I404-K408 PolarHBondContact O-N 2.92Å; H405-K408 PolarHBondContact O-N 2.96Å; K408-L411 PolarHBondContact O-N 2.91Å; K408-A412 WeakPolarHBondContact O-CB 3.39Å; K408-A412 PolarHBondContact O-N 3.43Å
409	R	76.7	Confident	83.6	Confident	111 Å²	111	102.1 Å²	102.1	42%	0.419	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-42.4	173.9	-172.3	-173.8	-74.6	-149.1	-1.9	111.6	H405 K406 E407 A412 I413 E518	H405-R409 WeakPolarHBondContact O-CB 3.46Å; H405-R409 PolarHBondContact O-N 3.5Å; K406-R409 PolarHBondContact O-N 2.98Å; E407-R409 VanDerWaalsContact C-N 3.3Å; E407-R409 PolarHBondContact O-N 3.31Å; R409-A412 PolarHBondContact O-N 2.89Å; R409-I413 HydrophobicContact CG-CD1 4.01Å; R409-I413 VanDerWaalsContact O-CG1 3.32Å; R409-I413 WeakPolarHBondContact O-CG1 3.44Å; R409-I413 PolarHBondContact O-N 3.29Å; R409-E518 IonicContact CZ-OE1 2.89Å; R409-E518 VanDerWaalsContact NH1-CD 3.3Å; R409-E518 IonicContact NH1-OE1 2.67Å; R409-E518 PolarHBondContact NH1-OE1 2.85Å; R409-E518 IonicContact NH1-OE2 2.65Å; R409-E518 PolarHBondContact NH1-OE2 3.2Å; R409-E518 VanDerWaalsContact NH1-OE2 3.16Å; R409-E518 IonicContact NH2-OE1 3.66Å; R409-E518 PolarHBondContact NH2-OE1 3.26Å
410	R	88.2	Confident	82.8	Confident	161 Å²	161	103.8 Å²	103.8	61%	0.608	50%	0.496	S	S	*	.	H	α-helix	trans	-59.3	-46.1	175.1	-174.1	175.6	76.8	146.5	0.4	111.6	K406 E407 I413 R414	K406-R410 WeakPolarHBondContact O-CB 3.49Å; K406-R410 PolarHBondContact O-N 3.07Å; E407-R410 VanDerWaalsContact CD-NE 3.34Å; E407-R410 WeakPolarHBondContact O-CB 3.45Å; E407-R410 PolarHBondContact O-N 3.44Å; E407-R410 VanDerWaalsContact O-N 3.15Å; E407-R410 IonicContact OE1-CZ 3.34Å; E407-R410 VanDerWaalsContact OE1-CZ 3.28Å; E407-R410 IonicContact OE1-NE 3.64Å; E407-R410 PolarHBondContact OE1-NE 3.48Å; E407-R410 IonicContact OE1-NH2 2.65Å; E407-R410 PolarHBondContact OE1-NH2 3Å; E407-R410 IonicContact OE2-CZ 2.69Å; E407-R410 IonicContact OE2-NE 2.94Å; E407-R410 PolarHBondContact OE2-NE 3.36Å; E407-R410 IonicContact OE2-NH2 3.75Å; E407-R410 PolarHBondContact OE2-NH2 2.81Å; E407-R410 VanDerWaalsContact OE2-NH2 3.08Å; R410-I413 PolarHBondContact O-N 3.32Å; R410-R414 WeakPolarHBondContact O-CB 3.43Å; R410-R414 PolarHBondContact O-N 2.78Å
411	L	85	Confident	82.3	Confident	89 Å²	89	103.8 Å²	103.8	47%	0.466	50%	0.496	S	S	.	.	H	α-helix	trans	-66.7	-41.5	178	-172.6	62.7	0	0	0	112	E407 K408 I413 R414 N415	E407-L411 PolarHBondContact O-N 2.98Å; K408-L411 PolarHBondContact O-N 2.91Å; L411-I413 PolarHBondContact O-N 2.86Å; L411-R414 PolarHBondContact O-N 3.28Å; L411-N415 VanDerWaalsContact O-CG 3.23Å; L411-N415 PolarHBondContact O-N 3.39Å; L411-N415 PolarHBondContact O-OD1 3.48Å
412	A	83.7	Confident	81.3	Confident	60 Å²	60	99.7 Å²	99.7	50%	0.496	49%	0.489	S	S	.	.	H	α-helix	trans	-61	-44	175.5	0	0	0	0	0	112.4	K408 R409 N415 A416	K408-A412 WeakPolarHBondContact O-CB 3.39Å; K408-A412 PolarHBondContact O-N 3.43Å; R409-A412 PolarHBondContact O-N 2.89Å; A412-N415 PolarHBondContact O-N 3.1Å; A412-A416 WeakPolarHBondContact O-CB 3.39Å; A412-A416 PolarHBondContact O-N 3.47Å
413	I	84.6	Confident	80.6	Confident	85 Å²	85	98.9 Å²	98.9	44%	0.436	49%	0.49	S	S	.	.	H	α-helix	trans	-62.5	-43.6	174.7	-68.5	163.2	0	0	0	110.6	R409 R410 L411 N415 A416 A417	R409-I413 HydrophobicContact CG-CD1 4.01Å; R409-I413 VanDerWaalsContact O-CG1 3.32Å; R409-I413 WeakPolarHBondContact O-CG1 3.44Å; R409-I413 PolarHBondContact O-N 3.29Å; R410-I413 PolarHBondContact O-N 3.32Å; L411-I413 PolarHBondContact O-N 2.86Å; I413-N415 PolarHBondContact O-N 3.16Å; I413-A416 PolarHBondContact O-N 3.2Å; I413-A417 WeakPolarHBondContact O-CB 3.42Å; I413-A417 PolarHBondContact O-N 2.94Å
414	R	83.8	Confident	79.4	Confident	166 Å²	166	99.6 Å²	99.6	63%	0.626	49%	0.486	S	S	*	.	H	α-helix	trans	-61.1	-44	177.6	-171.4	-179.8	-172.2	177.8	3.2	112	R410 L411 A417 Q418	R410-R414 WeakPolarHBondContact O-CB 3.43Å; R410-R414 PolarHBondContact O-N 2.78Å; L411-R414 PolarHBondContact O-N 3.28Å; R414-A417 PolarHBondContact O-N 3.19Å; R414-Q418 WeakPolarHBondContact O-CG 3.48Å; R414-Q418 PolarHBondContact O-N 3.33Å
415	N	82.4	Confident	78.3	Confident	76 Å²	76	99.1 Å²	99.1	41%	0.406	49%	0.493	S	S	.	.	H	α-helix	trans	-66.6	-40.1	178.8	-67.2	5	0	0	0	111.4	L411 A412 I413 Q418 Q419	L411-N415 VanDerWaalsContact O-CG 3.23Å; L411-N415 PolarHBondContact O-N 3.39Å; L411-N415 PolarHBondContact O-OD1 3.48Å; A412-N415 PolarHBondContact O-N 3.1Å; I413-N415 PolarHBondContact O-N 3.16Å; N415-Q418 PolarHBondContact O-N 3.17Å; N415-Q419 WeakPolarHBondContact O-CG 3.47Å; N415-Q419 PolarHBondContact O-N 3.04Å
416	A	80.1	Confident	77.1	Confident	54 Å²	54	99.1 Å²	99.1	45%	0.446	51%	0.505	S	S	.	.	H	α-helix	trans	-64.5	-39.4	174.1	0	0	0	0	0	112.2	A412 I413 Q419 W420	A412-A416 WeakPolarHBondContact O-CB 3.39Å; A412-A416 PolarHBondContact O-N 3.47Å; I413-A416 PolarHBondContact O-N 3.2Å; A416-Q419 PolarHBondContact O-N 3.25Å; A416-W420 WeakPolarHBondContact O-CB 3.49Å; A416-W420 PolarHBondContact O-N 3.04Å
417	A	79.8	Confident	75.5	Confident	43 Å²	43	98.9 Å²	98.9	36%	0.355	51%	0.51	S	S	.	.	H	α-helix	trans	-63.4	-44.2	174	0	0	0	0	0	111.8	I413 R414 Q419 W420 E421	I413-A417 WeakPolarHBondContact O-CB 3.42Å; I413-A417 PolarHBondContact O-N 2.94Å; R414-A417 PolarHBondContact O-N 3.19Å; A417-Q419 PolarHBondContact O-N 3.46Å; A417-W420 CarbonylContact O-C 3.54Å; A417-W420 WeakPolarHBondContact O-CB 3.47Å; A417-W420 PolarHBondContact O-N 3.1Å; A417-W420 VanDerWaalsContact O-N 3.16Å; A417-E421 WeakPolarHBondContact O-CG 3.33Å; A417-E421 PolarHBondContact O-N 3.15Å
418	Q	76.1	Confident	73.4	Confident	102 Å²	102	100.7 Å²	100.7	48%	0.477	52%	0.518	S	S	.	.	H	α-helix	trans	-66	-34.8	175.9	-71.8	-175.7	-52.6	0	0	113	R414 N415 E421 G422	R414-Q418 WeakPolarHBondContact O-CG 3.48Å; R414-Q418 PolarHBondContact O-N 3.33Å; N415-Q418 PolarHBondContact O-N 3.17Å; Q418-E421 PolarHBondContact O-N 2.82Å; Q418-G422 PolarHBondContact O-N 3.05Å
419	Q	78.4	Confident	71.3	Confident	144 Å²	144	101.3 Å²	101.3	67%	0.673	53%	0.528	S	S	*	.	H	α-helix	trans	-65.7	-39.5	171.2	-74.6	175.3	-15.6	0	0	111.6	N415 A416 A417 G422 V423	N415-Q419 WeakPolarHBondContact O-CG 3.47Å; N415-Q419 PolarHBondContact O-N 3.04Å; A416-Q419 PolarHBondContact O-N 3.25Å; A417-Q419 PolarHBondContact O-N 3.46Å; Q419-G422 PolarHBondContact O-N 2.83Å; Q419-V423 WeakPolarHBondContact O-CG2 3.41Å; Q419-V423 PolarHBondContact O-N 3.13Å
420	W	65.1	Low	69.6	Low	102 Å²	102	101 Å²	101	39%	0.386	54%	0.54	S	S	.	.	H	α-helix	trans	-66.3	-41.6	174	178.5	-108.2	0	0	0	112.5	A416 A417 V423 K424	A416-W420 WeakPolarHBondContact O-CB 3.49Å; A416-W420 PolarHBondContact O-N 3.04Å; A417-W420 CarbonylContact O-C 3.54Å; A417-W420 WeakPolarHBondContact O-CB 3.47Å; A417-W420 PolarHBondContact O-N 3.1Å; A417-W420 VanDerWaalsContact O-N 3.16Å; W420-V423 PolarHBondContact O-N 2.93Å; W420-K424 VanDerWaalsContact O-CB 3.25Å; W420-K424 WeakPolarHBondContact O-CB 3.37Å; W420-K424 PolarHBondContact O-N 3.09Å
421	E	74.3	Confident	67.3	Low	124 Å²	124	99.5 Å²	99.5	58%	0.579	55%	0.551	S	S	*	*	H	α-helix	trans	-60.6	-43.4	172.8	-73.8	173.8	157.5	0	0	111.7	A417 Q418 K424 A425	A417-E421 WeakPolarHBondContact O-CG 3.33Å; A417-E421 PolarHBondContact O-N 3.15Å; Q418-E421 PolarHBondContact O-N 2.82Å; E421-K424 PolarHBondContact O-N 3.33Å; E421-A425 WeakPolarHBondContact O-CB 3.42Å; E421-A425 PolarHBondContact O-N 3.22Å
422	G	68.1	Low	65.1	Low	35 Å²	35	101.4 Å²	101.4	36%	0.361	57%	0.567	S	S	.	*	H	α-helix	trans	-62.2	-46.6	174.4	0	0	0	0	0	112.9	Q418 Q419 K424 A425 C426	Q418-G422 PolarHBondContact O-N 3.05Å; Q419-G422 PolarHBondContact O-N 2.83Å; G422-K424 VanDerWaalsContact C-N 3.33Å; G422-K424 PolarHBondContact O-N 3.04Å; G422-A425 PolarHBondContact O-N 3.11Å; G422-C426 PolarHBondContact O-N 2.68Å; G422-C426 PolarHBondContact O-SG 2.78Å; G422-C426 VanDerWaalsContact O-SG 3.38Å
423	V	69.4	Low	62.7	Low	79 Å²	79	106.8 Å²	106.8	48%	0.479	59%	0.587	S	S	.	*	H	α-helix	trans	-64	-38.1	175.7	169.6	0	0	0	0	111.6	Q419 W420 C426 L427	Q419-V423 WeakPolarHBondContact O-CG2 3.41Å; Q419-V423 PolarHBondContact O-N 3.13Å; W420-V423 PolarHBondContact O-N 2.93Å; V423-C426 PolarHBondContact O-N 2.85Å; V423-L427 HydrophobicContact CG1-CD1 3.99Å; V423-L427 WeakPolarHBondContact O-CG 3.25Å; V423-L427 PolarHBondContact O-N 3.48Å
424	K	59.3	Low	60.2	Low	98 Å²	98	106.5 Å²	106.5	43%	0.426	61%	0.605	S	S	.	*	H	α-helix	trans	-63.5	-44.9	174.1	-177.6	178.2	179	-77.1	0	111.5	W420 E421 G422 C426 L427 E428	W420-K424 VanDerWaalsContact O-CB 3.25Å; W420-K424 WeakPolarHBondContact O-CB 3.37Å; W420-K424 PolarHBondContact O-N 3.09Å; E421-K424 PolarHBondContact O-N 3.33Å; G422-K424 VanDerWaalsContact C-N 3.33Å; G422-K424 PolarHBondContact O-N 3.04Å; K424-C426 VanDerWaalsContact C-N 3.27Å; K424-C426 PolarHBondContact O-N 3.18Å; K424-L427 PolarHBondContact O-N 3.49Å; K424-E428 VanDerWaalsContact CE-OE1 3.3Å; K424-E428 WeakPolarHBondContact CE-OE1 3.37Å; K424-E428 VanDerWaalsContact NZ-CD 3.31Å; K424-E428 IonicContact NZ-OE1 2.93Å; K424-E428 PolarHBondContact NZ-OE1 2.97Å; K424-E428 IonicContact NZ-OE2 2.75Å; K424-E428 PolarHBondContact NZ-OE2 3.5Å; K424-E428 PolarHBondContact O-N 2.94Å
425	A	63.8	Low	57.7	Low	67 Å²	67	103.6 Å²	103.6	55%	0.554	61%	0.61	S	S	*	*	H	α-helix	trans	-63.6	-31.3	175.9	0	0	0	0	0	112.6	E421 G422 L427	E421-A425 WeakPolarHBondContact O-CB 3.42Å; E421-A425 PolarHBondContact O-N 3.22Å; G422-A425 PolarHBondContact O-N 3.11Å; A425-L427 VanDerWaalsContact C-N 3.29Å; A425-L427 PolarHBondContact O-N 2.84Å
426	C	59.3	Low	55.4	Low	114 Å²	114	107.8 Å²	107.8	77%	0.77	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-10.2	171.2	-66.4	0	0	0	0	114.5	G422 V423 K424	G422-C426 PolarHBondContact O-N 2.68Å; G422-C426 PolarHBondContact O-SG 2.78Å; G422-C426 VanDerWaalsContact O-SG 3.38Å; V423-C426 PolarHBondContact O-N 2.85Å; K424-C426 VanDerWaalsContact C-N 3.27Å; K424-C426 PolarHBondContact O-N 3.18Å
427	L	53.7	Low	53	Low	133 Å²	133	112 Å²	112	70%	0.696	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-19.8	176.7	-72.7	166.1	0	0	0	113	V423 K424 A425 L429	V423-L427 HydrophobicContact CG1-CD1 3.99Å; V423-L427 WeakPolarHBondContact O-CG 3.25Å; V423-L427 PolarHBondContact O-N 3.48Å; K424-L427 PolarHBondContact O-N 3.49Å; A425-L427 VanDerWaalsContact C-N 3.29Å; A425-L427 PolarHBondContact O-N 2.84Å; L427-L429 PolarHBondContact O-N 3.32Å
428	E	42.9	Very low	50.6	Low	123 Å²	123	117.6 Å²	117.6	58%	0.575	66%	0.659	S	S	*	*	S	Bend	trans	-83.9	91.2	172.2	-73.5	177.2	174.6	0	0	110.1	K424	K424-E428 VanDerWaalsContact CE-OE1 3.3Å; K424-E428 WeakPolarHBondContact CE-OE1 3.37Å; K424-E428 VanDerWaalsContact NZ-CD 3.31Å; K424-E428 IonicContact NZ-OE1 2.93Å; K424-E428 PolarHBondContact NZ-OE1 2.97Å; K424-E428 IonicContact NZ-OE2 2.75Å; K424-E428 PolarHBondContact NZ-OE2 3.5Å; K424-E428 PolarHBondContact O-N 2.94Å
429	L	43.5	Very low	48.3	Very low	161 Å²	161	117.1 Å²	117.1	84%	0.843	67%	0.672	S	S	*	*			trans	-59.4	141.8	169.9	-73.6	170.6	0	0	0	110.9	L427	L427-L429 PolarHBondContact O-N 3.32Å
430	P	40.8	Very low	46.1	Very low	104 Å²	104	115.7 Å²	115.7	68%	0.675	68%	0.679	S	S	*	*			trans	-64	137	175.8	27.7	-34.3	0	0	0	110.3	T432	P430-T432 PolarHBondContact O-N 2.65Å; P430-T432 VanDerWaalsContact O-N 3.11Å
431	P	40.1	Very low	45.5	Very low	131 Å²	131	116.3 Å²	116.3	85%	0.851	70%	0.696	S	S	*	*			trans	-71.6	108.9	-173.8	27.6	-34.4	0	0	0	111.7	N433	P431-N433 PolarHBondContact O-N 3.42Å
432	T	37.8	Very low	43.2	Very low	128 Å²	128	118.1 Å²	118.1	79%	0.785	70%	0.704	S	S	*	*			trans	-76.9	109.2	166.8	52.2	0	0	0	0	110.5	P430	P430-T432 PolarHBondContact O-N 2.65Å; P430-T432 VanDerWaalsContact O-N 3.11Å
433	N	33.2	Very low	41.2	Very low	174 Å²	174	123 Å²	123	93%	0.93	72%	0.722	S	S	*	*			trans	-165.8	149.9	143.8	-102	-20.6	0	0	0	110.1	P431	P431-N433 PolarHBondContact O-N 3.42Å
434	G	33.4	Very low	39.3	Very low	78 Å²	78	124.6 Å²	124.6	80%	0.804	74%	0.737	S	S	*	*			trans	-156.5	152.1	-179.2	0	0	0	0	0	113.8
435	S	30.8	Very low	38.6	Very low	106 Å²	106	125.8 Å²	125.8	74%	0.741	75%	0.754	S	S	*	*			trans	-154	120.1	168.7	48.6	0	0	0	0	105.4
436	K	33.3	Very low	37	Very low	163 Å²	163	126.6 Å²	126.6	71%	0.709	76%	0.761	S	S	*	*				54.1	122.6	80.2	-77.8	177.1	143.1	-74.9	0	111.6
437	E	30.3	Very low	35.5	Very low	144 Å²	144	130 Å²	130	67%	0.673	77%	0.765	S	S	*	*			cis	-142.2	163.5	-4.1	-107.7	137.5	163.7	0	0	107
438	D	28.1	Very low	34.7	Very low	159 Å²	159	128.5 Å²	128.5	85%	0.85	77%	0.766	S	S	*	*				-175.9	169.1	77.4	-122.3	-38	0	0	0	114.1
439	A	28.6	Very low	34.9	Very low	92 Å²	92	128.1 Å²	128.1	76%	0.76	77%	0.774	S	S	*	*			trans	55.9	103.8	158.3	0	0	0	0	0	121.8
440	S	32.1	Very low	34.2	Very low	115 Å²	115	124.5 Å²	124.5	80%	0.804	77%	0.767	S	S	*	*			trans	-70.7	174.2	151.2	-63.6	0	0	0	0	111.3
441	P	52.6	Low	33.9	Very low	114 Å²	114	127.9 Å²	127.9	74%	0.74	77%	0.774	S	S	*	*			cis	-151.1	-167.3	28.2	44.5	-22.1	0	0	0	119
442	E	25.8	Very low	33.3	Very low	163 Å²	163	128.2 Å²	128.2	76%	0.762	77%	0.774	S	S	*	*			trans	93.3	121.7	153.4	-79.9	-170.2	-164.4	0	0	122.8
443	N	26.9	Very low	33	Very low	136 Å²	136	130 Å²	130	73%	0.727	78%	0.779	S	S	*	*			trans	73.9	108.8	137.9	-62.9	-33.8	0	0	0	122.8
444	S	28.8	Very low	32.7	Very low	113 Å²	113	124.7 Å²	124.7	79%	0.79	77%	0.765	S	S	*	*			trans	-41.3	169.7	144.6	-51	0	0	0	0	114.5
445	P	45.4	Very low	32.4	Very low	123 Å²	123	130 Å²	130	80%	0.799	77%	0.774	S	S	*	*			cis	-143.2	-174.2	22.9	43	-22.7	0	0	0	117.4
446	A	30.4	Very low	32.2	Very low	84 Å²	84	127.9 Å²	127.9	69%	0.694	77%	0.769	S	S	*	*			trans	-78.6	163.1	170.4	0	0	0	0	0	112.9
447	H	27.3	Very low	32	Very low	185 Å²	185	128.7 Å²	128.7	86%	0.856	78%	0.775	S	S	*	*			trans	-159.3	125.6	139.1	-112.2	-70.2	0	0	0	113.8
448	S	35.7	Very low	31.7	Very low	102 Å²	102	128.7 Å²	128.7	71%	0.713	78%	0.775	S	S	*	*			trans	-94.7	176	145.9	-34.9	0	0	0	0	107.3
449	P	47.7	Very low	31.5	Very low	116 Å²	116	126.6 Å²	126.6	75%	0.753	77%	0.768	S	S	*	*			cis	-150.3	-173	34.5	43.5	-22.1	0	0	0	117.5
450	A	27.9	Very low	31.4	Very low	84 Å²	84	127 Å²	127	69%	0.694	77%	0.765	S	S	*	*			trans	67.6	154.5	151.5	0	0	0	0	0	118.9
451	Q	35.3	Very low	31.6	Very low	175 Å²	175	126.9 Å²	126.9	82%	0.818	76%	0.762	S	S	*	*			cis	-165.5	153.6	-20.9	-110.4	-177.7	0.5	0	0	107.6
452	T	27.9	Very low	30.2	Very low	138 Å²	138	130 Å²	130	85%	0.847	77%	0.767	S	S	*	*			trans	166.9	160	131.3	35.5	0	0	0	0	114.4
453	N	30.7	Very low	30.3	Very low	165 Å²	165	130.9 Å²	130.9	88%	0.882	77%	0.771	S	S	*	*			trans	-57	167.3	177.6	-44.5	-35.4	0	0	0	114.1
454	G	26.4	Very low	30.5	Very low	63 Å²	63	130.7 Å²	130.7	65%	0.649	78%	0.777	S	S	*	*			cis	150.5	166	-1	0	0	0	0	0	112.2
455	L	27.9	Very low	30.2	Very low	191 Å²	191	136.6 Å²	136.6	100%	1	78%	0.782	S	S	*	*			trans	69.1	143.4	-177.6	-55.2	164.8	0	0	0	115.7
456	G	27.7	Very low	29.2	Very low	61 Å²	61	142.2 Å²	142.2	63%	0.629	79%	0.787	S	S	*	*			cis	172.8	166	-9.4	0	0	0	0	0	113.2
457	Q	28	Very low	29	Very low	180 Å²	180	145.7 Å²	145.7	84%	0.841	79%	0.793	S	S	*	*			trans	66	150.1	165.7	-71.2	-171.1	-71.7	0	0	117.8
458	E	24.3	Very low	29	Very low	143 Å²	143	142.2 Å²	142.2	67%	0.668	79%	0.789	S	S	*	*			cis	-171.8	172.1	-22.5	-126.8	-172.3	-95.1	0	0	108.1
459	T	24.3	Very low	29.1	Very low	115 Å²	115	143.4 Å²	143.4	71%	0.706	79%	0.794	S	S	*	*			cis	-145.2	-175.7	-5.1	-29.3	0	0	0	0	107.7
460	S	26.9	Very low	28	Very low	100 Å²	100	141 Å²	141	70%	0.699	79%	0.791	S	S	*	*			trans	-144.6	143.1	160	178.7	0	0	0	0	110.5
461	P	35.2	Very low	28	Very low	114 Å²	114	143.3 Å²	143.3	74%	0.74	80%	0.802	S	S	*	*			trans	-118.3	115	155.4	14.9	6	0	0	0	110.6
462	E	23.7	Very low	27.4	Very low	180 Å²	180	138.4 Å²	138.4	84%	0.841	80%	0.798	S	S	*	*				93	108.5	79.2	-85.4	-159.7	129.2	0	0	114.3
463	E	26.9	Very low	28.1	Very low	181 Å²	181	137.6 Å²	137.6	85%	0.846	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-83.8	133	153.4	-66.6	-178.1	118.9	0	0	109.8
464	P	30.9	Very low	27.8	Very low	131 Å²	131	139 Å²	139	85%	0.851	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.8	127.4	166.4	30.1	-31.9	0	0	0	111
465	R	23.4	Very low	27.8	Very low	237 Å²	237	147 Å²	147	89%	0.894	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-79.4	165.4	-177.4	-69.5	177.7	175	163.7	-0.8	113.5
466	R	25.2	Very low	28.3	Very low	242 Å²	242	143.4 Å²	143.4	91%	0.913	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-50.2	143.6	166.2	-63.2	-179.5	179.2	-172.4	-0	112.2
467	I	24.9	Very low	28.3	Very low	157 Å²	157	146 Å²	146	81%	0.805	80%	0.804	S	S	*	*			trans	-129.6	145.3	153.1	-62.1	-178.7	0	0	0	108.5
468	S	28.8	Very low	28.2	Very low	111 Å²	111	141 Å²	141	78%	0.776	80%	0.8	S	S	*	*			trans	-151.2	132.7	166.4	-51.8	0	0	0	0	109.2
469	P	36.9	Very low	28.2	Very low	127 Å²	127	137.8 Å²	137.8	83%	0.825	81%	0.806	S	S	*	*			trans	-120.1	172	144.8	19.6	-0.2	0	0	0	110.5
470	G	24.6	Very low	28.4	Very low	66 Å²	66	138.5 Å²	138.5	68%	0.68	81%	0.81	S	S	*	*			trans	-120.2	-148.1	-175.2	0	0	0	0	0	114.5
471	S	27.1	Very low	28.3	Very low	133 Å²	133	141.5 Å²	141.5	93%	0.93	81%	0.813	S	S	*	*			trans	75.5	143.6	-170.4	73.7	0	0	0	0	115.8
472	G	23.2	Very low	27.8	Very low	71 Å²	71	141.5 Å²	141.5	73%	0.732	81%	0.807	S	S	*	*			trans	-118.2	-144.2	173.8	0	0	0	0	0	109.7
473	P	42.3	Very low	27.8	Very low	122 Å²	122	142.7 Å²	142.7	79%	0.792	80%	0.803	S	S	*	*			cis	-125.9	178.2	6.5	42.7	-29.6	0	0	0	114.1
474	E	25.1	Very low	27.7	Very low	193 Å²	193	139.3 Å²	139.3	90%	0.902	79%	0.791	S	S	*	*				-169.8	172.3	129.5	-111.5	176.1	-171.3	0	0	114.4
475	R	26.6	Very low	27.3	Very low	232 Å²	232	143.3 Å²	143.3	88%	0.875	79%	0.789	S	S	*	*			trans	-146.5	174.1	-179.7	-108.8	-172.2	177.2	-175.6	0.7	107
476	P	38.8	Very low	27.3	Very low	116 Å²	116	137.1 Å²	137.1	75%	0.753	78%	0.777	S	S	*	*			cis	-121.4	-147.4	11	44.1	-27.8	0	0	0	110.5
477	S	26.8	Very low	27.2	Very low	115 Å²	115	132.5 Å²	132.5	80%	0.804	77%	0.771	S	S	*	*			cis	-162.9	154.8	-1.2	38.2	0	0	0	0	106.8
478	G	26.2	Very low	27.2	Very low	74 Å²	74	130.6 Å²	130.6	76%	0.763	77%	0.772	S	S	*	*			cis	-152.8	174.7	-2.1	0	0	0	0	0	108.7
479	G	24.2	Very low	27	Very low	77 Å²	77	136.7 Å²	136.7	79%	0.794	78%	0.778	S	S	*	*				72.6	116.5	93.3	0	0	0	0	0	112.5
480	T	27.9	Very low	27.2	Very low	130 Å²	130	135.3 Å²	135.3	80%	0.798	77%	0.769	S	S	*	*			cis	-154.3	152.9	14.8	45.8	0	0	0	0	113
481	E	25.6	Very low	27.1	Very low	163 Å²	163	139.8 Å²	139.8	76%	0.762	78%	0.777	S	S	*	*				23.7	152.6	129.1	-53.3	-156.1	158.7	0	0	122.4
482	N	25.3	Very low	27.1	Very low	113 Å²	113	138.9 Å²	138.9	60%	0.604	77%	0.77	S	S	*	*			cis	-155.7	150.7	3.4	-130.9	-41.5	0	0	0	114.8
483	R	24.1	Very low	27.8	Very low	205 Å²	205	140.7 Å²	140.7	77%	0.774	77%	0.769	S	S	*	*			trans	21.6	128.7	146	-80.3	177.1	157	-146.3	-2.6	125.1
484	L	24.1	Very low	27	Very low	110 Å²	110	146.2 Å²	146.2	58%	0.576	77%	0.774	S	S	*	*				81.4	127.7	122.3	-67	170.7	0	0	0	124
485	R	22.7	Very low	27.2	Very low	215 Å²	215	144 Å²	144	81%	0.811	77%	0.769	S	S	*	*			trans	70.2	153.9	137	-68	179.4	177.4	-179	-0.8	118
486	T	22.9	Very low	27.8	Very low	107 Å²	107	138.2 Å²	138.2	66%	0.656	76%	0.761	S	S	*	*			cis	-159.3	149.3	-5.6	7.7	0	0	0	0	112.1
487	N	22.8	Very low	27.1	Very low	146 Å²	146	141 Å²	141	78%	0.781	76%	0.762	S	S	*	*			trans	57.4	160.8	143.3	-65.8	-1.2	0	0	0	123.8
488	S	25.4	Very low	27.2	Very low	117 Å²	117	142.7 Å²	142.7	82%	0.818	76%	0.761	S	S	*	*			trans	87.4	113	158.9	-10.9	0	0	0	0	119.9
489	R	24.6	Very low	27.5	Very low	239 Å²	239	144.4 Å²	144.4	90%	0.902	76%	0.756	S	S	*	*			trans	-86.5	-170.1	149	-55.1	176.3	168.6	176.6	-4.7	108.4
490	P	41	Very low	27.6	Very low	98 Å²	98	148.4 Å²	148.4	64%	0.636	75%	0.754	S	S	*	*			cis	-136.2	167.9	-7	39.4	-21.8	0	0	0	116.3
491	N	23.5	Very low	27.6	Very low	160 Å²	160	148.7 Å²	148.7	86%	0.856	76%	0.756	S	S	*	*				170.5	160.6	116.2	-86.9	-30.9	0	0	0	114.1
492	S	25.5	Very low	27.5	Very low	113 Å²	113	143.9 Å²	143.9	79%	0.79	75%	0.75	S	S	*	*			trans	-111.2	-176.2	176.7	-140.4	0	0	0	0	108.7
493	P	38.2	Very low	27.6	Very low	109 Å²	109	145.1 Å²	145.1	71%	0.708	77%	0.768	S	S	*	*			cis	-147.1	-170.9	18.5	38.1	-13.6	0	0	0	118.4
494	R	25	Very low	27.8	Very low	238 Å²	238	138.6 Å²	138.6	90%	0.898	77%	0.765	S	S	*	*			trans	97.9	86.7	157.7	-66.4	179.1	175.5	172	-1.2	120.7
495	D	30.2	Very low	27.9	Very low	148 Å²	148	141.2 Å²	141.2	79%	0.791	78%	0.779	S	S	*	*				-41.5	162	127.2	-79.8	-64.8	0	0	0	113.7
496	P	38.1	Very low	28.4	Very low	109 Å²	109	137.9 Å²	137.9	71%	0.708	78%	0.782	S	S	*	*				-159.8	173.3	50.4	41.3	-18	0	0	0	122.2
497	K	24.8	Very low	28.9	Very low	176 Å²	176	141 Å²	141	77%	0.765	79%	0.789	S	S	*	*			trans	127	118.7	144.5	-66.1	-147	174.7	-177	0	113.8
498	L	29.5	Very low	29.3	Very low	150 Å²	150	139.6 Å²	139.6	79%	0.785	79%	0.791	S	S	*	*				69.7	138.6	64.2	-62.9	171.1	0	0	0	111.1
499	V	31.4	Very low	29.8	Very low	110 Å²	110	140.5 Å²	140.5	67%	0.667	79%	0.786	S	S	*	*			cis	-155.5	174.9	24.3	79.1	0	0	0	0	109.3
500	E	27.8	Very low	30.3	Very low	160 Å²	160	133.7 Å²	133.7	75%	0.748	78%	0.775	S	S	*	*			cis	-147.5	-85.9	14.9	-164.4	126.4	-120.3	0	0	116.3
501	T	26.8	Very low	30.4	Very low	136 Å²	136	132 Å²	132	83%	0.834	76%	0.76	S	S	*	*			trans	-146.3	167.5	-156.4	45.1	0	0	0	0	114.9
502	G	23.9	Very low	31.2	Very low	63 Å²	63	127.2 Å²	127.2	65%	0.649	74%	0.739	S	S	*	*			cis	166.8	-164.1	-8.6	0	0	0	0	0	115.6
503	S	26.7	Very low	31.9	Very low	138 Å²	138	128.7 Å²	128.7	97%	0.965	74%	0.738	S	S	*	*			trans	66.9	133.1	-170.2	-62.1	0	0	0	0	115.4
504	G	28.1	Very low	32.4	Very low	69 Å²	69	124.3 Å²	124.3	71%	0.711	71%	0.71	S	S	*	*			cis	165.7	73.5	-2.2	0	0	0	0	0	113
505	N	27.3	Very low	33.9	Very low	164 Å²	164	121.4 Å²	121.4	88%	0.877	71%	0.707	S	S	*	*			trans	-153.7	132.9	166.7	-103.5	-32.7	0	0	0	109.6	Q507	N505-Q507 PolarHBondContact O-N 3.16Å
506	V	33.7	Very low	35.5	Very low	145 Å²	145	118 Å²	118	88%	0.879	69%	0.688	S	S	*	*			trans	-72	116.9	176.3	179.3	0	0	0	0	108.3	S508	V506-S508 PolarHBondContact O-N 2.85Å
507	Q	33.3	Very low	37.5	Very low	173 Å²	173	113.2 Å²	113.2	81%	0.808	66%	0.658	S	S	*	*			trans	-66.7	122.3	175.2	-71.7	179.7	-17.6	0	0	109.4	N505 L509	N505-Q507 PolarHBondContact O-N 3.16Å; Q507-L509 PolarHBondContact O-N 2.64Å
508	S	31.2	Very low	40.2	Very low	117 Å²	117	107.2 Å²	107.2	82%	0.818	63%	0.632	S	S	*	*			trans	-63.6	106.5	174.2	-176.7	0	0	0	0	109.5	V506 S510	V506-S508 PolarHBondContact O-N 2.85Å; S508-S510 PolarHBondContact O-N 3.31Å
509	L	36.1	Very low	42.8	Very low	136 Å²	136	102.7 Å²	102.7	71%	0.712	61%	0.609	S	S	*	*			trans	-70.3	117.9	172.1	-75.7	170.9	0	0	0	108.3	Q507 L511 T543	Q507-L509 PolarHBondContact O-N 2.64Å; L509-L511 PolarHBondContact O-N 3.03Å; L509-L511 VanDerWaalsContact O-N 3.09Å; L509-T543 HydrophobicContact CD1-CG2 4.38Å
510	S	34.3	Very low	45	Very low	95 Å²	95	101.5 Å²	101.5	66%	0.664	60%	0.598	S	S	*	*			trans	-60.7	111.5	-168.1	-160.7	0	0	0	0	112.5	S508 S512	S508-S510 PolarHBondContact O-N 3.31Å; S510-S512 PolarHBondContact O-N 3.02Å; S510-S512 WeakPolarHBondContact OG-CB 3.43Å
511	L	43.7	Very low	47.6	Very low	64 Å²	64	96.9 Å²	96.9	34%	0.335	59%	0.594	S	S	.	*			trans	-78.4	48.2	164.7	-71.9	165	0	0	0	110.1	L509 D513 L519 W539	L509-L511 PolarHBondContact O-N 3.03Å; L509-L511 VanDerWaalsContact O-N 3.09Å; L511-D513 VanDerWaalsContact C-N 3.33Å; L511-D513 PolarHBondContact O-N 2.64Å; L511-L519 HydrophobicContact CD1-CB 4.37Å; L511-W539 HydrophobicContact CD1-CH2 4.41Å; L511-W539 HydrophobicContact CD2-CH2 4.04Å
512	S	38.9	Very low	50.4	Low	58 Å²	58	94 Å²	94	41%	0.406	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.7	-37.3	-164.8	35.6	0	0	0	0	114.4	S510 H515	S510-S512 PolarHBondContact O-N 3.02Å; S510-S512 WeakPolarHBondContact OG-CB 3.43Å; S512-H515 PolarHBondContact O-CE1 2.83Å
513	D	40.3	Very low	53.5	Low	144 Å²	144	92 Å²	92	77%	0.77	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	11.2	-165.8	-53.1	-67.1	0	0	0	114	L511	L511-D513 VanDerWaalsContact C-N 3.33Å; L511-D513 PolarHBondContact O-N 2.64Å
514	S	48.4	Very low	56.4	Low	17 Å²	17	85.4 Å²	85.4	12%	0.119	50%	0.503	C	S	.	.			trans	-143.6	87	172.1	64.9	0	0	0	0	111.7	L516 A517	S514-L516 PolarHBondContact O-N 2.91Å; S514-A517 PolarHBondContact O-N 3.21Å
515	H	56.7	Low	59.3	Low	178 Å²	178	85.3 Å²	85.3	82%	0.824	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	9.9	179.4	-54.5	-30.5	0	0	0	115.5	S512	S512-H515 PolarHBondContact O-CE1 2.83Å
516	L	65.5	Low	62.2	Low	75 Å²	75	77.5 Å²	77.5	39%	0.393	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-1.4	-173	-62.8	-175.9	0	0	0	113.3	S514 F527 A531	S514-L516 PolarHBondContact O-N 2.91Å; L516-F527 WeakPolarHBondContact CB-O 3.26Å; L516-F527 PolarHBondContact O-N 2.95Å; L516-A531 HydrophobicContact CB-CB 4.04Å; L516-A531 VanDerWaalsContact O-CB 3.23Å; L516-A531 WeakPolarHBondContact O-CB 3.13Å
517	A	79.3	Confident	64.7	Low	10 Å²	10	72.9 Å²	72.9	8%	0.083	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.1	175.3	0	0	0	0	0	110.6	S514 R525 L526 A534	S514-A517 PolarHBondContact O-N 3.21Å; A517-R525 WeakPolarHBondContact CA-O 3.32Å; A517-L526 HydrophobicContact CB-CD2 3.82Å; A517-A534 HydrophobicContact CB-CB 3.58Å
518	E	81.4	Confident	66.9	Low	50 Å²	50	65.6 Å²	65.6	23%	0.234	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	123.9	179.5	177.4	167.2	-112.2	0	0	109.7	R409 R525 F527	R409-E518 IonicContact CZ-OE1 2.89Å; R409-E518 VanDerWaalsContact NH1-CD 3.3Å; R409-E518 IonicContact NH1-OE1 2.67Å; R409-E518 PolarHBondContact NH1-OE1 2.85Å; R409-E518 IonicContact NH1-OE2 2.65Å; R409-E518 PolarHBondContact NH1-OE2 3.2Å; R409-E518 VanDerWaalsContact NH1-OE2 3.16Å; R409-E518 IonicContact NH2-OE1 3.66Å; R409-E518 PolarHBondContact NH2-OE1 3.26Å; E518-R525 PolarHBondContact N-O 3.14Å; E518-R525 PolarHBondContact O-N 2.88Å; E518-R525 IonicContact OE2-NH1 2.71Å; E518-F527 HydrophobicContact CB-CE2 4.3Å
519	L	83.3	Confident	69	Low	54 Å²	54	65.6 Å²	65.6	28%	0.283	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.6	169	179	65	0	0	0	108.6	L511 L524 W539 V547	L511-L519 HydrophobicContact CD1-CB 4.37Å; L519-L524 HydrophobicContact CD1-CB 4.37Å; L519-W539 HydrophobicContact CD2-CZ3 4.13Å; L519-V547 HydrophobicContact CD1-CG2 3.83Å
520	D	79.3	Confident	70.7	Confident	85 Å²	85	60.5 Å²	60.5	46%	0.455	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	100.5	179.5	-176.9	22.7	0	0	0	109.2	D522 T523 R525	D520-D522 PolarHBondContact O-N 3.1Å; D520-D522 VanDerWaalsContact O-N 3.13Å; D520-T523 PolarHBondContact N-O 3.42Å; D520-T523 WeakPolarHBondContact O-CB 3.35Å; D520-T523 PolarHBondContact O-N 2.88Å; D520-R525 VanDerWaalsContact CB-NH1 3.29Å; D520-R525 IonicContact OD2-CZ 2.64Å; D520-R525 IonicContact OD2-NH1 3.85Å; D520-R525 PolarHBondContact OD2-NH1 3.44Å; D520-R525 IonicContact OD2-NH2 2.64Å; D520-R525 PolarHBondContact OD2-NH2 2.95Å
521	G	82.3	Confident	72.9	Confident	64 Å²	64	56 Å²	56	66%	0.66	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	-110.9	-172.3	0	0	0	0	0	112.1
522	D	85.3	Confident	74.6	Confident	74 Å²	74	53.8 Å²	53.8	40%	0.396	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-0.8	178.5	70.8	-13.4	0	0	0	113.4	D520 A546 V547 T548 V549	D520-D522 PolarHBondContact O-N 3.1Å; D520-D522 VanDerWaalsContact O-N 3.13Å; D522-A546 WeakPolarHBondContact CA-O 3.35Å; D522-A546 WeakPolarHBondContact CB-O 3.38Å; D522-V547 CarbonylContact O-C 3.46Å; D522-V547 WeakPolarHBondContact O-CA 3.49Å; D522-T548 HydrophobicContact CB-CG2 4.16Å; D522-T548 VanDerWaalsContact CB-OG1 3.3Å; D522-T548 WeakPolarHBondContact CB-OG1 3.45Å; D522-T548 PolarHBondContact O-N 2.99Å; D522-T548 PolarHBondContact O-OG1 2.95Å; D522-T548 PolarHBondContact OD2-OG1 3.4Å; D522-V549 PolarHBondContact O-N 2.99Å
523	T	87.5	Confident	76.4	Confident	21 Å²	21	56.1 Å²	56.1	13%	0.129	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	114.2	-170.7	-62.8	0	0	0	0	111	D520 R525 V549	D520-T523 PolarHBondContact N-O 3.42Å; D520-T523 WeakPolarHBondContact O-CB 3.35Å; D520-T523 PolarHBondContact O-N 2.88Å; T523-R525 HydrophobicContact CG2-CG 3.93Å; T523-V549 WeakPolarHBondContact CA-O 3.48Å; T523-V549 HydrophobicContact CG2-CB 4.1Å; T523-V549 HydrophobicContact CG2-CG1 4.17Å
524	L	88.6	Confident	78.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	117	173.4	176.8	61.8	0	0	0	110.2	L519 L526 L535 W539 V547 V549 I550 A551 F571	L519-L524 HydrophobicContact CD1-CB 4.37Å; L524-L526 HydrophobicContact CD1-CD2 4.17Å; L524-L526 HydrophobicContact CD2-CD2 4.43Å; L524-L526 HydrophobicContact CG-CD2 4.1Å; L524-L526 HydrophobicContact CG-CG 4.4Å; L524-L535 HydrophobicContact CD2-CD2 4.1Å; L524-W539 HydrophobicContact CD1-CH2 3.7Å; L524-W539 HydrophobicContact CD1-CZ2 3.93Å; L524-W539 HydrophobicContact CD2-CH2 4.47Å; L524-W539 HydrophobicContact CD2-CZ2 4.08Å; L524-V547 HydrophobicContact CB-CG1 3.9Å; L524-V547 HydrophobicContact CB-CG2 4.36Å; L524-V549 PolarHBondContact N-O 3.32Å; L524-I550 HydrophobicContact CB-CG1 4.23Å; L524-I550 HydrophobicContact CD2-CG1 4.4Å; L524-I550 CarbonylContact O-C 3.28Å; L524-I550 WeakPolarHBondContact O-CA 3.3Å; L524-A551 PolarHBondContact O-N 2.86Å; L524-F571 HydrophobicContact CD2-CE1 4.25Å; L524-F571 HydrophobicContact CD2-CE2 4.26Å; L524-F571 HydrophobicContact CD2-CZ 3.75Å
525	R	89.1	Confident	79.4	Confident	68 Å²	68	48.8 Å²	48.8	26%	0.257	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.6	-179.8	-52.8	-170.2	-173.8	112.9	10.6	110.6	A517 E518 D520 T523 F527 A551	A517-R525 WeakPolarHBondContact CA-O 3.32Å; E518-R525 PolarHBondContact N-O 3.14Å; E518-R525 PolarHBondContact O-N 2.88Å; E518-R525 IonicContact OE2-NH1 2.71Å; D520-R525 VanDerWaalsContact CB-NH1 3.29Å; D520-R525 IonicContact OD2-CZ 2.64Å; D520-R525 IonicContact OD2-NH1 3.85Å; D520-R525 PolarHBondContact OD2-NH1 3.44Å; D520-R525 IonicContact OD2-NH2 2.64Å; D520-R525 PolarHBondContact OD2-NH2 2.95Å; T523-R525 HydrophobicContact CG2-CG 3.93Å; R525-F527 HydrophobicContact CB-CD2 4.49Å; R525-F527 HydrophobicContact CB-CE2 3.65Å; R525-F527 HydrophobicContact CB-CZ 4.05Å; R525-A551 WeakPolarHBondContact CA-O 3.47Å; R525-A551 HydrophobicContact CG-CB 4.33Å
526	L	88.4	Confident	80.1	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.9	-174.5	-58.6	177.4	0	0	0	109.6	A517 L524 A531 A534 L535 I550 A551 F552 R553 I555	A517-L526 HydrophobicContact CB-CD2 3.82Å; L524-L526 HydrophobicContact CD1-CD2 4.17Å; L524-L526 HydrophobicContact CD2-CD2 4.43Å; L524-L526 HydrophobicContact CG-CD2 4.1Å; L524-L526 HydrophobicContact CG-CG 4.4Å; L526-A531 HydrophobicContact CB-CB 3.73Å; L526-A531 HydrophobicContact CD2-CB 4.13Å; L526-A531 HydrophobicContact CG-CB 4.49Å; L526-A534 HydrophobicContact CD2-CB 4.27Å; L526-L535 HydrophobicContact CD1-CD1 3.68Å; L526-L535 HydrophobicContact CD1-CD2 3.9Å; L526-L535 HydrophobicContact CD1-CG 3.69Å; L526-I550 HydrophobicContact CD1-CG2 4.05Å; L526-A551 PolarHBondContact N-O 3.39Å; L526-F552 HydrophobicContact CB-CD1 4.44Å; L526-F552 HydrophobicContact CD1-CD1 3.99Å; L526-F552 HydrophobicContact CD1-CE1 3.67Å; L526-F552 HydrophobicContact CD1-CZ 4.37Å; L526-R553 PolarHBondContact O-N 2.85Å; L526-I555 HydrophobicContact CB-CD1 4Å
527	F	84.9	Confident	80.4	Confident	48 Å²	48	46.3 Å²	46.3	21%	0.211	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	110.7	-171.4	-60.7	-95.7	0	0	0	111.3	L516 E518 R525 R553 F554	L516-F527 WeakPolarHBondContact CB-O 3.26Å; L516-F527 PolarHBondContact O-N 2.95Å; E518-F527 HydrophobicContact CB-CE2 4.3Å; R525-F527 HydrophobicContact CB-CD2 4.49Å; R525-F527 HydrophobicContact CB-CE2 3.65Å; R525-F527 HydrophobicContact CB-CZ 4.05Å; F527-R553 WeakPolarHBondContact CA-O 3.45Å; F527-R553 HydrophobicContact CD1-CB 4.03Å; F527-R553 HydrophobicContact CE1-CB 4.4Å; F527-R553 HydrophobicContact CE1-CG 4.49Å; F527-F554 HydrophobicContact CD1-CD2 4.31Å; F527-F554 HydrophobicContact CD1-CE2 4.16Å
528	G	79.8	Confident	80	Confident	20 Å²	20	49.8 Å²	49.8	21%	0.206	29%	0.289	C	S	.	.	S	Bend	trans	72.5	165.2	179.5	0	0	0	0	0	114.6	G530 A531 R553 F554 I555	G528-G530 VanDerWaalsContact C-N 3.33Å; G528-G530 PolarHBondContact O-N 3.41Å; G528-A531 WeakPolarHBondContact O-CB 3.48Å; G528-A531 PolarHBondContact O-N 3.04Å; G528-R553 PolarHBondContact N-O 2.95Å; G528-F554 WeakPolarHBondContact CA-O 3.28Å; G528-I555 VanDerWaalsContact C-CG1 3.49Å; G528-I555 WeakPolarHBondContact O-CD1 3.47Å; G528-I555 WeakPolarHBondContact O-CG1 3.45Å
529	L	74.9	Confident	80	Confident	116 Å²	116	49.8 Å²	49.8	61%	0.607	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-57.5	-39.6	-165.2	-171.3	67.2	0	0	0	114.1	A531 L532 A559	L529-A531 PolarHBondContact O-N 3.2Å; L529-A531 VanDerWaalsContact O-N 3.15Å; L529-L532 HydrophobicContact CD1-CD1 3.91Å; L529-L532 WeakPolarHBondContact O-CB 3.18Å; L529-L532 PolarHBondContact O-N 2.87Å; L529-L532 VanDerWaalsContact O-N 3.09Å; L529-A559 HydrophobicContact CD1-CB 3.66Å
530	G	72.4	Confident	79.6	Confident	30 Å²	30	49.3 Å²	49.3	31%	0.309	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-63.7	-16.1	178.3	0	0	0	0	0	114.6	G528 L532 E533	G528-G530 VanDerWaalsContact C-N 3.33Å; G528-G530 PolarHBondContact O-N 3.41Å; G530-L532 PolarHBondContact O-N 3.44Å; G530-E533 PolarHBondContact O-N 2.93Å
531	A	80.8	Confident	79.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-67.4	-22.2	173.1	0	0	0	0	0	112.9	L516 L526 G528 L529 E533 A534 I555	L516-A531 HydrophobicContact CB-CB 4.04Å; L516-A531 VanDerWaalsContact O-CB 3.23Å; L516-A531 WeakPolarHBondContact O-CB 3.13Å; L526-A531 HydrophobicContact CB-CB 3.73Å; L526-A531 HydrophobicContact CD2-CB 4.13Å; L526-A531 HydrophobicContact CG-CB 4.49Å; G528-A531 WeakPolarHBondContact O-CB 3.48Å; G528-A531 PolarHBondContact O-N 3.04Å; L529-A531 PolarHBondContact O-N 3.2Å; L529-A531 VanDerWaalsContact O-N 3.15Å; A531-E533 PolarHBondContact O-N 3.01Å; A531-A534 VanDerWaalsContact O-CB 3.24Å; A531-A534 WeakPolarHBondContact O-CB 3.33Å; A531-A534 PolarHBondContact O-N 3.27Å; A531-I555 HydrophobicContact CB-CD1 4.35Å
532	L	80	Confident	79.3	Confident	17 Å²	17	56.3 Å²	56.3	9%	0.089	32%	0.316	C	S	.	.	H	α-helix	trans	-64.6	-28.2	177.9	-63.5	-179.4	0	0	0	112.3	L529 G530 A534 L535 E536 F552 I555 A559 T563	L529-L532 HydrophobicContact CD1-CD1 3.91Å; L529-L532 WeakPolarHBondContact O-CB 3.18Å; L529-L532 PolarHBondContact O-N 2.87Å; L529-L532 VanDerWaalsContact O-N 3.09Å; G530-L532 PolarHBondContact O-N 3.44Å; L532-A534 PolarHBondContact O-N 2.73Å; L532-L535 HydrophobicContact CD2-CD1 4.09Å; L532-L535 WeakPolarHBondContact O-CB 3.42Å; L532-L535 PolarHBondContact O-N 3.07Å; L532-E536 PolarHBondContact O-N 3.06Å; L532-F552 HydrophobicContact CD2-CD1 4.32Å; L532-F552 HydrophobicContact CD2-CE1 3.91Å; L532-I555 HydrophobicContact CD1-CG2 4.13Å; L532-I555 HydrophobicContact CD2-CD1 4.39Å; L532-I555 HydrophobicContact CD2-CG2 4.34Å; L532-I555 HydrophobicContact CG-CG2 4.33Å; L532-A559 HydrophobicContact CD1-CB 4.23Å; L532-A559 WeakPolarHBondContact CD1-O 3.02Å; L532-T563 HydrophobicContact CD2-CG2 4.49Å
533	E	76	Confident	79.1	Confident	107 Å²	107	54.5 Å²	54.5	50%	0.5	31%	0.308	S	S	.	.	H	α-helix	trans	-60.2	-28.5	170.3	-62	-178.3	-178.8	0	0	112.7	G530 A531 L535 E536 R537	G530-E533 PolarHBondContact O-N 2.93Å; A531-E533 PolarHBondContact O-N 3.01Å; E533-L535 PolarHBondContact O-N 3.4Å; E533-E536 CarbonylContact O-C 3.48Å; E533-E536 WeakPolarHBondContact O-CA 3.44Å; E533-E536 WeakPolarHBondContact O-CB 3.44Å; E533-E536 PolarHBondContact O-N 2.98Å; E533-R537 WeakPolarHBondContact O-CG 3.34Å; E533-R537 PolarHBondContact O-N 3.06Å; E533-R537 IonicContact OE2-CZ 3.21Å; E533-R537 VanDerWaalsContact OE2-CZ 3.3Å; E533-R537 IonicContact OE2-NH1 2.72Å; E533-R537 PolarHBondContact OE2-NH1 3.24Å; E533-R537 IonicContact OE2-NH2 3.78Å; E533-R537 PolarHBondContact OE2-NH2 3.12Å
534	A	75.8	Confident	78.8	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-67.5	-27	175.7	0	0	0	0	0	111.6	A517 L526 A531 L532 E536 W539	A517-A534 HydrophobicContact CB-CB 3.58Å; L526-A534 HydrophobicContact CD2-CB 4.27Å; A531-A534 VanDerWaalsContact O-CB 3.24Å; A531-A534 WeakPolarHBondContact O-CB 3.33Å; A531-A534 PolarHBondContact O-N 3.27Å; L532-A534 PolarHBondContact O-N 2.73Å; A534-E536 VanDerWaalsContact C-N 3.33Å; A534-W539 PolarHBondContact O-NE1 3Å
535	L	76.3	Confident	78.4	Confident	7 Å²	7	55 Å²	55	4%	0.037	32%	0.316	C	S	.	.	H	α-helix	trans	-73.2	-24.6	167.7	-62.9	174	0	0	0	112.1	L524 L526 L532 E533 I550 F552 I567 K570 F571	L524-L535 HydrophobicContact CD2-CD2 4.1Å; L526-L535 HydrophobicContact CD1-CD1 3.68Å; L526-L535 HydrophobicContact CD1-CD2 3.9Å; L526-L535 HydrophobicContact CD1-CG 3.69Å; L532-L535 HydrophobicContact CD2-CD1 4.09Å; L532-L535 WeakPolarHBondContact O-CB 3.42Å; L532-L535 PolarHBondContact O-N 3.07Å; E533-L535 PolarHBondContact O-N 3.4Å; L535-I550 HydrophobicContact CD2-CD1 4.43Å; L535-F552 HydrophobicContact CD1-CE1 3.9Å; L535-F552 HydrophobicContact CD1-CZ 4.12Å; L535-I567 HydrophobicContact CD1-CD1 3.89Å; L535-I567 HydrophobicContact CD1-CG1 4.05Å; L535-I567 HydrophobicContact CD2-CG1 4.34Å; L535-K570 WeakPolarHBondContact O-CD 3.21Å; L535-K570 WeakPolarHBondContact O-CE 3.46Å; L535-K570 PolarHBondContact O-NZ 3.2Å; L535-F571 HydrophobicContact CD2-CE2 3.69Å; L535-F571 HydrophobicContact CD2-CZ 4.39Å
536	E	70.9	Confident	78.2	Confident	99 Å²	99	54 Å²	54	46%	0.463	32%	0.322	S	S	.	.	H	α-helix	trans	-83.6	-28	177.9	-63.5	-91.6	97.8	0	0	112.5	L532 E533 A534 R566 K570	L532-E536 PolarHBondContact O-N 3.06Å; E533-E536 CarbonylContact O-C 3.48Å; E533-E536 WeakPolarHBondContact O-CA 3.44Å; E533-E536 WeakPolarHBondContact O-CB 3.44Å; E533-E536 PolarHBondContact O-N 2.98Å; A534-E536 VanDerWaalsContact C-N 3.33Å; E536-R566 VanDerWaalsContact CD-NH1 3.34Å; E536-R566 IonicContact OE1-CZ 3.15Å; E536-R566 IonicContact OE1-NH1 2.71Å; E536-R566 PolarHBondContact OE1-NH1 3.23Å; E536-R566 IonicContact OE2-NH1 2.72Å; E536-R566 PolarHBondContact OE2-NH1 2.98Å; E536-K570 PolarHBondContact O-NZ 3.02Å
537	R	72.7	Confident	78.1	Confident	102 Å²	102	54 Å²	54	39%	0.385	32%	0.322	S	S	.	.	S	Bend	trans	-60.9	159.4	174.1	-74.7	174.7	178	87.8	10.1	113.5	E533 K570	E533-R537 WeakPolarHBondContact O-CG 3.34Å; E533-R537 PolarHBondContact O-N 3.06Å; E533-R537 IonicContact OE2-CZ 3.21Å; E533-R537 VanDerWaalsContact OE2-CZ 3.3Å; E533-R537 IonicContact OE2-NH1 2.72Å; E533-R537 PolarHBondContact OE2-NH1 3.24Å; E533-R537 IonicContact OE2-NH2 3.78Å; E533-R537 PolarHBondContact OE2-NH2 3.12Å; R537-K570 PolarHBondContact O-NZ 2.73Å
538	G	70.5	Confident	78.2	Confident	82 Å²	82	53.5 Å²	53.5	85%	0.845	32%	0.324	S	S	*	.			trans	-88.8	105.2	-179.5	0	0	0	0	0	112.3
539	W	80.1	Confident	78.7	Confident	51 Å²	51	53.3 Å²	53.3	19%	0.193	32%	0.318	C	S	.	.			trans	-82.1	145.2	176.8	-66.9	78.6	0	0	0	111.4	L511 L519 L524 A534 A544 F571	L511-W539 HydrophobicContact CD1-CH2 4.41Å; L511-W539 HydrophobicContact CD2-CH2 4.04Å; L519-W539 HydrophobicContact CD2-CZ3 4.13Å; L524-W539 HydrophobicContact CD1-CH2 3.7Å; L524-W539 HydrophobicContact CD1-CZ2 3.93Å; L524-W539 HydrophobicContact CD2-CH2 4.47Å; L524-W539 HydrophobicContact CD2-CZ2 4.08Å; A534-W539 PolarHBondContact O-NE1 3Å; W539-A544 HydrophobicContact CB-CB 3.9Å; W539-F571 AromaticContact CD1-CZ 3.75Å; W539-F571 HydrophobicContact CD2-CE1 4.19Å; W539-F571 HydrophobicContact CD2-CZ 4.17Å; W539-F571 AromaticContact CE2-CZ 3.95Å; W539-F571 HydrophobicContact CG-CE1 4.14Å; W539-F571 HydrophobicContact CG-CZ 4.07Å; W539-F571 AromaticContact NE1-CZ 3.68Å
540	G	75.3	Confident	79.4	Confident	43 Å²	43	47.8 Å²	47.8	44%	0.443	29%	0.289	S	S	.	.			trans	-66.5	142.3	172.1	0	0	0	0	0	111	Q542 T543 A544	G540-Q542 PolarHBondContact O-N 3.42Å; G540-Q542 VanDerWaalsContact O-N 3.14Å; G540-T543 PolarHBondContact N-OG1 3.25Å; G540-T543 PolarHBondContact O-N 3.1Å; G540-T543 PolarHBondContact O-OG1 2.88Å; G540-A544 WeakPolarHBondContact O-CB 3.49Å; G540-A544 PolarHBondContact O-N 3.16Å
541	V	78.6	Confident	80.3	Confident	127 Å²	127	46.8 Å²	46.8	77%	0.77	28%	0.278	S	S	*	.	H	α-helix	trans	-53.6	-40.2	-172.5	-177.7	0	0	0	0	112.7	G545	V541-G545 PolarHBondContact O-N 3.23Å
542	Q	77.8	Confident	80.8	Confident	170 Å²	170	46.8 Å²	46.8	79%	0.794	28%	0.278	S	S	*	.	H	α-helix	trans	-69.1	-45.1	178.7	-58.1	-61.3	-11	0	0	112.4	G540 G545 A546	G540-Q542 PolarHBondContact O-N 3.42Å; G540-Q542 VanDerWaalsContact O-N 3.14Å; Q542-G545 PolarHBondContact O-N 3.33Å; Q542-A546 WeakPolarHBondContact O-CB 3.47Å; Q542-A546 PolarHBondContact O-N 3.1Å
543	T	80.5	Confident	81.2	Confident	36 Å²	36	50.1 Å²	50.1	22%	0.221	29%	0.289	C	S	.	.	H	α-helix	trans	-66.1	-38.7	175.9	44.1	0	0	0	0	112.1	L509 G540 G545 A546 V547	L509-T543 HydrophobicContact CD1-CG2 4.38Å; G540-T543 PolarHBondContact N-OG1 3.25Å; G540-T543 PolarHBondContact O-N 3.1Å; G540-T543 PolarHBondContact O-OG1 2.88Å; T543-G545 VanDerWaalsContact C-N 3.35Å; T543-A546 PolarHBondContact O-N 3.28Å; T543-V547 PolarHBondContact O-N 3.32Å
544	A	81.1	Confident	81.5	Confident	8 Å²	8	48 Å²	48	7%	0.066	28%	0.279	C	S	.	.	H	α-helix	trans	-69.8	-31.9	177.9	0	0	0	0	0	112.7	W539 G540 K570 F571	W539-A544 HydrophobicContact CB-CB 3.9Å; G540-A544 WeakPolarHBondContact O-CB 3.49Å; G540-A544 PolarHBondContact O-N 3.16Å; A544-K570 WeakPolarHBondContact CB-O 3.34Å; A544-F571 HydrophobicContact CB-CD1 4.36Å; A544-F571 HydrophobicContact CB-CE1 4.47Å
545	G	80.6	Confident	81.8	Confident	22 Å²	22	48.1 Å²	48.1	23%	0.227	28%	0.279	C	S	.	.	H	α-helix	trans	-75.3	-20.7	171.1	0	0	0	0	0	114.2	V541 Q542 T543 N573	V541-G545 PolarHBondContact O-N 3.23Å; Q542-G545 PolarHBondContact O-N 3.33Å; T543-G545 VanDerWaalsContact C-N 3.35Å; G545-N573 PolarHBondContact O-ND2 3.02Å
546	A	84.1	Confident	82.2	Confident	48 Å²	48	50.9 Å²	50.9	40%	0.397	29%	0.294	S	S	.	.	H	α-helix	trans	-80.6	-21.6	177.1	0	0	0	0	0	113.7	D522 Q542 T543 T548	D522-A546 WeakPolarHBondContact CA-O 3.35Å; D522-A546 WeakPolarHBondContact CB-O 3.38Å; Q542-A546 WeakPolarHBondContact O-CB 3.47Å; Q542-A546 PolarHBondContact O-N 3.1Å; T543-A546 PolarHBondContact O-N 3.28Å; A546-T548 PolarHBondContact O-N 3.31Å
547	V	86.7	Confident	82.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.272	C	S	.	.			trans	-74.6	116.3	179	-176.3	0	0	0	0	111.1	L519 D522 L524 T543 V549 I550 F571	L519-V547 HydrophobicContact CD1-CG2 3.83Å; D522-V547 CarbonylContact O-C 3.46Å; D522-V547 WeakPolarHBondContact O-CA 3.49Å; L524-V547 HydrophobicContact CB-CG1 3.9Å; L524-V547 HydrophobicContact CB-CG2 4.36Å; T543-V547 PolarHBondContact O-N 3.32Å; V547-V549 WeakPolarHBondContact CG1-O 3.43Å; V547-I550 HydrophobicContact CG1-CG1 3.89Å; V547-F571 HydrophobicContact CB-CD1 3.68Å; V547-F571 HydrophobicContact CB-CE1 4.2Å; V547-F571 HydrophobicContact CB-CG 4.43Å; V547-F571 HydrophobicContact CG1-CD1 4.14Å; V547-F571 HydrophobicContact CG2-CD1 3.82Å; V547-F571 HydrophobicContact CG2-CE1 3.83Å
548	T	87.3	Confident	83.3	Confident	38 Å²	38	45.2 Å²	45.2	23%	0.233	27%	0.274	C	S	.	.			trans	-106.5	-28	174.7	60.5	0	0	0	0	111.6	D522 A546 S575 H576	D522-T548 HydrophobicContact CB-CG2 4.16Å; D522-T548 VanDerWaalsContact CB-OG1 3.3Å; D522-T548 WeakPolarHBondContact CB-OG1 3.45Å; D522-T548 PolarHBondContact O-N 2.99Å; D522-T548 PolarHBondContact O-OG1 2.95Å; D522-T548 PolarHBondContact OD2-OG1 3.4Å; A546-T548 PolarHBondContact O-N 3.31Å; T548-S575 PolarHBondContact O-N 2.66Å; T548-S575 PolarHBondContact O-OG 2.97Å; T548-H576 PolarHBondContact O-N 3.14Å; T548-H576 VanDerWaalsContact O-N 3.14Å
549	V	89.9	Confident	83.7	Confident	16 Å²	16	43 Å²	43	10%	0.097	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.7	-177	-169	0	0	0	0	110.7	D522 T523 L524 V547 H576 I578	D522-V549 PolarHBondContact O-N 2.99Å; T523-V549 WeakPolarHBondContact CA-O 3.48Å; T523-V549 HydrophobicContact CG2-CB 4.1Å; T523-V549 HydrophobicContact CG2-CG1 4.17Å; L524-V549 PolarHBondContact N-O 3.32Å; V547-V549 WeakPolarHBondContact CG1-O 3.43Å; V549-H576 WeakPolarHBondContact CA-O 3.31Å; V549-H576 HydrophobicContact CB-CB 4.38Å; V549-H576 HydrophobicContact CG1-CB 4.06Å; V549-H576 HydrophobicContact CG2-CB 4.06Å; V549-I578 HydrophobicContact CG1-CD1 3.71Å; V549-I578 HydrophobicContact CG1-CG1 4.01Å
550	I	91.1	Very high	83.9	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.5	166	-62.4	167.5	0	0	0	109.6	L524 L526 L535 V547 F552 I567 F571 L574 H576 L577 I578	L524-I550 HydrophobicContact CB-CG1 4.23Å; L524-I550 HydrophobicContact CD2-CG1 4.4Å; L524-I550 CarbonylContact O-C 3.28Å; L524-I550 WeakPolarHBondContact O-CA 3.3Å; L526-I550 HydrophobicContact CD1-CG2 4.05Å; L535-I550 HydrophobicContact CD2-CD1 4.43Å; V547-I550 HydrophobicContact CG1-CG1 3.89Å; I550-F552 HydrophobicContact CG2-CD2 4.3Å; I550-F552 HydrophobicContact CG2-CE1 4.47Å; I550-F552 HydrophobicContact CG2-CE2 3.77Å; I550-F552 HydrophobicContact CG2-CZ 3.87Å; I550-I567 HydrophobicContact CD1-CG2 3.62Å; I550-F571 HydrophobicContact CD1-CD2 3.81Å; I550-F571 HydrophobicContact CD1-CE2 4.27Å; I550-F571 HydrophobicContact CD1-CG 4.24Å; I550-L574 HydrophobicContact CB-CD1 4.15Å; I550-L574 HydrophobicContact CD1-CD1 3.75Å; I550-L574 HydrophobicContact CD1-CD2 4.24Å; I550-L574 HydrophobicContact CG1-CD1 3.69Å; I550-H576 PolarHBondContact N-O 2.57Å; I550-H576 VanDerWaalsContact N-O 3.1Å; I550-L577 HydrophobicContact CB-CD2 3.85Å; I550-L577 HydrophobicContact CG2-CD2 4.48Å; I550-L577 WeakPolarHBondContact O-CA 3.48Å; I550-I578 PolarHBondContact O-N 3.34Å
551	A	90.8	Very high	84.3	Confident	8 Å²	8	38.5 Å²	38.5	7%	0.066	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	116.4	-179.2	0	0	0	0	0	111.7	L524 R525 L526 I578	L524-A551 PolarHBondContact O-N 2.86Å; R525-A551 WeakPolarHBondContact CA-O 3.47Å; R525-A551 HydrophobicContact CG-CB 4.33Å; L526-A551 PolarHBondContact N-O 3.39Å; A551-I578 WeakPolarHBondContact CA-O 3.47Å; A551-I578 HydrophobicContact CB-CB 3.9Å; A551-I578 HydrophobicContact CB-CD1 4.47Å; A551-I578 HydrophobicContact CB-CG2 4.39Å
552	F	90.5	Very high	84.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	128	175	-61.2	-86.9	0	0	0	110.4	L526 L532 L535 I550 I555 I560 I567 L577 I578 F579 L580 T582	L526-F552 HydrophobicContact CB-CD1 4.44Å; L526-F552 HydrophobicContact CD1-CD1 3.99Å; L526-F552 HydrophobicContact CD1-CE1 3.67Å; L526-F552 HydrophobicContact CD1-CZ 4.37Å; L532-F552 HydrophobicContact CD2-CD1 4.32Å; L532-F552 HydrophobicContact CD2-CE1 3.91Å; L535-F552 HydrophobicContact CD1-CE1 3.9Å; L535-F552 HydrophobicContact CD1-CZ 4.12Å; I550-F552 HydrophobicContact CG2-CD2 4.3Å; I550-F552 HydrophobicContact CG2-CE1 4.47Å; I550-F552 HydrophobicContact CG2-CE2 3.77Å; I550-F552 HydrophobicContact CG2-CZ 3.87Å; F552-I555 HydrophobicContact CD1-CD1 4.02Å; F552-I560 HydrophobicContact CB-CD1 3.81Å; F552-I560 HydrophobicContact CD1-CD1 3.66Å; F552-I560 HydrophobicContact CD1-CG1 4.03Å; F552-I560 HydrophobicContact CD1-CG2 4.11Å; F552-I560 HydrophobicContact CD2-CD1 4.2Å; F552-I560 HydrophobicContact CD2-CG2 4.5Å; F552-I560 HydrophobicContact CE1-CD1 4.24Å; F552-I560 HydrophobicContact CE1-CG1 4.24Å; F552-I560 HydrophobicContact CE1-CG2 3.57Å; F552-I560 HydrophobicContact CE2-CG2 4.01Å; F552-I560 HydrophobicContact CG-CD1 3.64Å; F552-I560 HydrophobicContact CG-CG1 4.48Å; F552-I560 HydrophobicContact CZ-CG2 3.52Å; F552-I567 HydrophobicContact CZ-CD1 3.83Å; F552-L577 HydrophobicContact CE2-CD2 4.18Å; F552-I578 PolarHBondContact N-O 2.85Å; F552-F579 HydrophobicContact CB-CD1 4.31Å; F552-F579 HydrophobicContact CD2-CD1 4.01Å; F552-F579 AromaticContact CD2-CE1 3.62Å; F552-F579 HydrophobicContact CD2-CE1 3.62Å; F552-F579 HydrophobicContact CD2-CZ 4.15Å; F552-F579 HydrophobicContact CE2-CE1 4.06Å; F552-F579 HydrophobicContact CE2-CZ 4.28Å; F552-F579 HydrophobicContact CG-CD1 4.48Å; F552-F579 HydrophobicContact CG-CE1 4.34Å; F552-L580 PolarHBondContact O-N 3.43Å; F552-T582 HydrophobicContact CB-CG2 4.01Å
553	R	88.1	Confident	84.6	Confident	88 Å²	88	27.1 Å²	27.1	33%	0.332	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.4	179.5	-60.4	-173.2	60.9	130.9	8.1	110.6	L526 F527 G528 I555 L580	L526-R553 PolarHBondContact O-N 2.85Å; F527-R553 WeakPolarHBondContact CA-O 3.45Å; F527-R553 HydrophobicContact CD1-CB 4.03Å; F527-R553 HydrophobicContact CE1-CB 4.4Å; F527-R553 HydrophobicContact CE1-CG 4.49Å; G528-R553 PolarHBondContact N-O 2.95Å; R553-I555 VanDerWaalsContact C-N 3.33Å; R553-I555 PolarHBondContact O-N 3.08Å; R553-L580 WeakPolarHBondContact CA-O 3.48Å; R553-L580 HydrophobicContact CG-CB 4.41Å; R553-L580 HydrophobicContact CG-CD2 4.25Å; R553-L580 VanDerWaalsContact NH2-CD2 3.31Å
554	F	82	Confident	84.8	Confident	63 Å²	63	25.4 Å²	25.4	28%	0.276	15%	0.15	S	C	.	.	S	Bend	trans	60.5	36.3	178.6	-39	-77.3	0	0	0	113.8	F527 G528 L580 E581	F527-F554 HydrophobicContact CD1-CD2 4.31Å; F527-F554 HydrophobicContact CD1-CE2 4.16Å; G528-F554 WeakPolarHBondContact CA-O 3.28Å; F554-L580 PolarHBondContact N-O 2.78Å; F554-E581 WeakPolarHBondContact CA-O 3.35Å; F554-E581 HydrophobicContact CD1-CB 4.03Å; F554-E581 WeakPolarHBondContact CD1-OE2 3.33Å; F554-E581 HydrophobicContact CE1-CB 4.48Å; F554-E581 WeakPolarHBondContact CE1-OE1 3.48Å; F554-E581 WeakPolarHBondContact CE1-OE2 3.1Å; F554-E581 PolarHBondContact N-O 3.45Å
555	I	83.5	Confident	84.7	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.01	17%	0.167	C	C	.	.			trans	-126.8	117.5	-178.3	-60.4	164.5	0	0	0	108.9	L526 G528 A531 L532 F552 R553 F557 I560 T582	L526-I555 HydrophobicContact CB-CD1 4Å; G528-I555 VanDerWaalsContact C-CG1 3.49Å; G528-I555 WeakPolarHBondContact O-CD1 3.47Å; G528-I555 WeakPolarHBondContact O-CG1 3.45Å; A531-I555 HydrophobicContact CB-CD1 4.35Å; L532-I555 HydrophobicContact CD1-CG2 4.13Å; L532-I555 HydrophobicContact CD2-CD1 4.39Å; L532-I555 HydrophobicContact CD2-CG2 4.34Å; L532-I555 HydrophobicContact CG-CG2 4.33Å; F552-I555 HydrophobicContact CD1-CD1 4.02Å; R553-I555 VanDerWaalsContact C-N 3.33Å; R553-I555 PolarHBondContact O-N 3.08Å; I555-F557 PolarHBondContact O-N 2.89Å; I555-I560 HydrophobicContact CB-CD1 4.29Å; I555-I560 HydrophobicContact CB-CG1 4.38Å; I555-I560 HydrophobicContact CG2-CD1 4.04Å; I555-I560 HydrophobicContact CG2-CG1 3.59Å; I555-T582 WeakPolarHBondContact O-CA 3.39Å; I555-T582 VanDerWaalsContact O-CB 3.27Å; I555-T582 WeakPolarHBondContact O-CB 3.27Å; I555-T582 VanDerWaalsContact O-CG2 3.25Å; I555-T582 WeakPolarHBondContact O-CG2 3.37Å
556	N	83.5	Confident	84.7	Confident	66 Å²	66	33.7 Å²	33.7	35%	0.353	18%	0.181	S	C	.	.			trans	-54	124.3	175.6	-77.4	-45.6	0	0	0	110.8	D558 A559	N556-D558 PolarHBondContact O-N 2.95Å; N556-D558 VanDerWaalsContact O-N 3.15Å; N556-A559 WeakPolarHBondContact O-CB 3.16Å; N556-A559 PolarHBondContact O-N 3.49Å
557	F	84.7	Confident	84.7	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-54.5	-38.7	-173.2	-177.3	-90.8	0	0	0	113.4	I555 A559 I560 V561 F579 T582 I584 Q589 A592 L593	I555-F557 PolarHBondContact O-N 2.89Å; F557-A559 PolarHBondContact O-N 3.41Å; F557-I560 WeakPolarHBondContact O-CA 3.5Å; F557-I560 VanDerWaalsContact O-CB 3.3Å; F557-I560 WeakPolarHBondContact O-CB 3.41Å; F557-I560 PolarHBondContact O-N 3.08Å; F557-V561 HydrophobicContact CD1-CG2 3.89Å; F557-V561 HydrophobicContact CE1-CG2 3.58Å; F557-V561 HydrophobicContact CZ-CG2 4.38Å; F557-V561 PolarHBondContact O-N 2.71Å; F557-V561 VanDerWaalsContact O-N 3.15Å; F557-F579 HydrophobicContact CD2-CD1 4.05Å; F557-F579 AromaticContact CD2-CE1 3.91Å; F557-F579 HydrophobicContact CD2-CE1 3.91Å; F557-F579 HydrophobicContact CE2-CD1 4.23Å; F557-F579 AromaticContact CE2-CE1 3.78Å; F557-F579 HydrophobicContact CE2-CE1 3.78Å; F557-F579 HydrophobicContact CE2-CZ 4.11Å; F557-T582 WeakPolarHBondContact CB-O 3.49Å; F557-T582 PolarHBondContact N-O 3.39Å; F557-I584 HydrophobicContact CB-CG1 3.72Å; F557-I584 HydrophobicContact CD2-CD1 3.58Å; F557-I584 HydrophobicContact CD2-CG1 3.58Å; F557-I584 HydrophobicContact CE2-CD1 3.98Å; F557-I584 HydrophobicContact CE2-CG1 4.34Å; F557-I584 HydrophobicContact CG-CD1 4.25Å; F557-I584 HydrophobicContact CG-CG1 3.72Å; F557-Q589 HydrophobicContact CD1-CB 3.95Å; F557-Q589 HydrophobicContact CD1-CG 4.42Å; F557-Q589 HydrophobicContact CE1-CB 3.9Å; F557-Q589 WeakPolarHBondContact CE1-O 3.49Å; F557-Q589 WeakPolarHBondContact CZ-O 3.32Å; F557-A592 HydrophobicContact CE1-CB 3.93Å; F557-A592 HydrophobicContact CZ-CB 4.11Å; F557-L593 HydrophobicContact CE2-CD2 3.96Å; F557-L593 HydrophobicContact CE2-CG 4.47Å; F557-L593 HydrophobicContact CZ-CD2 4.04Å; F557-L593 HydrophobicContact CZ-CG 4.23Å
558	D	82	Confident	84.3	Confident	80 Å²	80	34.3 Å²	34.3	43%	0.428	17%	0.173	S	C	.	.	H	α-helix	trans	-63.1	-24.1	-179.6	-57.5	-17.4	0	0	0	112.8	N556 P562 Q589 Y714	N556-D558 PolarHBondContact O-N 2.95Å; N556-D558 VanDerWaalsContact O-N 3.15Å; D558-P562 WeakPolarHBondContact O-CD 3.49Å; D558-Q589 PolarHBondContact OD1-NE2 2.98Å; D558-Y714 VanDerWaalsContact CG-OH 3.32Å; D558-Y714 PolarHBondContact OD1-OH 3.35Å
559	A	80.8	Confident	83.9	Confident	34 Å²	34	38.5 Å²	38.5	28%	0.281	20%	0.199	S	C	.	.	H	α-helix	trans	-82.6	-19.4	171.6	0	0	0	0	0	113.1	L529 L532 N556 F557	L529-A559 HydrophobicContact CD1-CB 3.66Å; L532-A559 HydrophobicContact CD1-CB 4.23Å; L532-A559 WeakPolarHBondContact CD1-O 3.02Å; N556-A559 WeakPolarHBondContact O-CB 3.16Å; N556-A559 PolarHBondContact O-N 3.49Å; F557-A559 PolarHBondContact O-N 3.41Å
560	I	83.8	Confident	83.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-76	-36.6	172.6	-51.5	173.9	0	0	0	110.1	F552 I555 F557 T563 L564 F579 T582	F552-I560 HydrophobicContact CB-CD1 3.81Å; F552-I560 HydrophobicContact CD1-CD1 3.66Å; F552-I560 HydrophobicContact CD1-CG1 4.03Å; F552-I560 HydrophobicContact CD1-CG2 4.11Å; F552-I560 HydrophobicContact CD2-CD1 4.2Å; F552-I560 HydrophobicContact CD2-CG2 4.5Å; F552-I560 HydrophobicContact CE1-CD1 4.24Å; F552-I560 HydrophobicContact CE1-CG1 4.24Å; F552-I560 HydrophobicContact CE1-CG2 3.57Å; F552-I560 HydrophobicContact CE2-CG2 4.01Å; F552-I560 HydrophobicContact CG-CD1 3.64Å; F552-I560 HydrophobicContact CG-CG1 4.48Å; F552-I560 HydrophobicContact CZ-CG2 3.52Å; I555-I560 HydrophobicContact CB-CD1 4.29Å; I555-I560 HydrophobicContact CB-CG1 4.38Å; I555-I560 HydrophobicContact CG2-CD1 4.04Å; I555-I560 HydrophobicContact CG2-CG1 3.59Å; F557-I560 WeakPolarHBondContact O-CA 3.5Å; F557-I560 VanDerWaalsContact O-CB 3.3Å; F557-I560 WeakPolarHBondContact O-CB 3.41Å; F557-I560 PolarHBondContact O-N 3.08Å; I560-T563 WeakPolarHBondContact O-CA 3.35Å; I560-T563 WeakPolarHBondContact O-CB 3.33Å; I560-T563 PolarHBondContact O-N 3Å; I560-T563 PolarHBondContact O-OG1 2.93Å; I560-L564 HydrophobicContact CG2-CD2 3.82Å; I560-L564 HydrophobicContact CG2-CG 4.33Å; I560-L564 PolarHBondContact O-N 3.49Å; I560-F579 HydrophobicContact CD1-CD1 4.17Å; I560-F579 HydrophobicContact CD1-CE1 3.97Å; I560-T582 HydrophobicContact CD1-CG2 4.18Å
561	V	83.4	Confident	83.2	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-47.2	-49	-174	174.1	0	0	0	0	114.1	F557 T563 L564 A592 Y714	F557-V561 HydrophobicContact CD1-CG2 3.89Å; F557-V561 HydrophobicContact CE1-CG2 3.58Å; F557-V561 HydrophobicContact CZ-CG2 4.38Å; F557-V561 PolarHBondContact O-N 2.71Å; F557-V561 VanDerWaalsContact O-N 3.15Å; V561-T563 PolarHBondContact O-N 2.63Å; V561-T563 VanDerWaalsContact O-N 3.14Å; V561-L564 HydrophobicContact CG2-CD1 4.47Å; V561-L564 PolarHBondContact O-N 3.38Å; V561-L564 VanDerWaalsContact O-N 3.17Å; V561-A592 HydrophobicContact CG1-CB 4.1Å; V561-A592 HydrophobicContact CG2-CB 3.68Å; V561-Y714 HydrophobicContact CG1-CD1 4.34Å; V561-Y714 HydrophobicContact CG2-CD1 4.11Å; V561-Y714 HydrophobicContact CG2-CE1 4.22Å
562	P	81.8	Confident	82.8	Confident	44 Å²	44	43.7 Å²	43.7	29%	0.286	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-60.6	-24.4	178.8	-23	33.7	0	0	0	114.5	D558 D718	D558-P562 WeakPolarHBondContact O-CD 3.49Å; P562-D718 WeakPolarHBondContact CG-OD2 3.46Å
563	T	80.7	Confident	82.5	Confident	13 Å²	13	48.2 Å²	48.2	8%	0.08	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-84.7	-25.1	179.9	74.5	0	0	0	0	113.1	L532 I560 V561 P565 R566 I567	L532-T563 HydrophobicContact CD2-CG2 4.49Å; I560-T563 WeakPolarHBondContact O-CA 3.35Å; I560-T563 WeakPolarHBondContact O-CB 3.33Å; I560-T563 PolarHBondContact O-N 3Å; I560-T563 PolarHBondContact O-OG1 2.93Å; V561-T563 PolarHBondContact O-N 2.63Å; V561-T563 VanDerWaalsContact O-N 3.14Å; T563-P565 VanDerWaalsContact C-CD 3.49Å; T563-R566 WeakPolarHBondContact O-CA 3.44Å; T563-R566 WeakPolarHBondContact O-CB 3.36Å; T563-R566 PolarHBondContact O-N 3.19Å; T563-I567 WeakPolarHBondContact O-CG1 3.33Å; T563-I567 PolarHBondContact O-N 3.48Å; T563-I567 VanDerWaalsContact O-N 3.1Å
564	L	83.9	Confident	82.4	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-52.4	-42.7	-172.8	-64.9	178.1	0	0	0	114.4	I560 V561 R566 I567 A592 L593 Q595 V596	I560-L564 HydrophobicContact CG2-CD2 3.82Å; I560-L564 HydrophobicContact CG2-CG 4.33Å; I560-L564 PolarHBondContact O-N 3.49Å; V561-L564 HydrophobicContact CG2-CD1 4.47Å; V561-L564 PolarHBondContact O-N 3.38Å; V561-L564 VanDerWaalsContact O-N 3.17Å; L564-R566 VanDerWaalsContact C-N 3.32Å; L564-R566 PolarHBondContact O-N 3.18Å; L564-I567 HydrophobicContact CD2-CD1 4.2Å; L564-A592 HydrophobicContact CD1-CB 4.02Å; L564-L593 HydrophobicContact CD1-CD2 4.46Å; L564-Q595 HydrophobicContact CB-CB 4.36Å; L564-V596 HydrophobicContact CB-CG2 3.94Å; L564-V596 HydrophobicContact CD2-CG2 3.95Å; L564-V596 HydrophobicContact CG-CG2 4.41Å
565	P	80.2	Confident	82.7	Confident	66 Å²	66	42.5 Å²	42.5	43%	0.429	23%	0.231	S	C	.	.	H	α-helix	trans	-66.2	-32.2	176.6	-20.5	33.6	0	0	0	113.4	T563 Q595	T563-P565 VanDerWaalsContact C-CD 3.49Å; P565-Q595 HydrophobicContact CG-CB 4.33Å
566	R	80.5	Confident	83	Confident	138 Å²	138	43.7 Å²	43.7	52%	0.521	24%	0.236	S	C	.	.	H	α-helix	trans	-77.2	-32.9	-177.1	-57.9	-179.2	-177.8	-178.9	1.3	111.8	E536 T563 L564 R568 V569 K570	E536-R566 VanDerWaalsContact CD-NH1 3.34Å; E536-R566 IonicContact OE1-CZ 3.15Å; E536-R566 IonicContact OE1-NH1 2.71Å; E536-R566 PolarHBondContact OE1-NH1 3.23Å; E536-R566 IonicContact OE2-NH1 2.72Å; E536-R566 PolarHBondContact OE2-NH1 2.98Å; T563-R566 WeakPolarHBondContact O-CA 3.44Å; T563-R566 WeakPolarHBondContact O-CB 3.36Å; T563-R566 PolarHBondContact O-N 3.19Å; L564-R566 VanDerWaalsContact C-N 3.32Å; L564-R566 PolarHBondContact O-N 3.18Å; R566-R568 PolarHBondContact O-N 3.48Å; R566-V569 WeakPolarHBondContact O-CB 3.18Å; R566-V569 PolarHBondContact O-N 2.99Å; R566-V569 VanDerWaalsContact O-N 3.14Å; R566-K570 PolarHBondContact O-N 3.39Å
567	I	83.9	Confident	83.3	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.015	22%	0.219	C	C	.	.	H	α-helix	trans	-53.2	-50	-177.1	-73.7	173.1	0	0	0	111.9	L535 I550 F552 T563 L564 V569 K570 F571 L574	L535-I567 HydrophobicContact CD1-CD1 3.89Å; L535-I567 HydrophobicContact CD1-CG1 4.05Å; L535-I567 HydrophobicContact CD2-CG1 4.34Å; I550-I567 HydrophobicContact CD1-CG2 3.62Å; F552-I567 HydrophobicContact CZ-CD1 3.83Å; T563-I567 WeakPolarHBondContact O-CG1 3.33Å; T563-I567 PolarHBondContact O-N 3.48Å; T563-I567 VanDerWaalsContact O-N 3.1Å; L564-I567 HydrophobicContact CD2-CD1 4.2Å; I567-V569 VanDerWaalsContact C-N 3.27Å; I567-V569 PolarHBondContact O-N 3.4Å; I567-K570 PolarHBondContact O-N 3.11Å; I567-K570 VanDerWaalsContact O-N 3.1Å; I567-F571 HydrophobicContact CG2-CD2 4.3Å; I567-F571 PolarHBondContact O-N 3.35Å; I567-L574 HydrophobicContact CG2-CD2 3.58Å
568	R	77.3	Confident	83.6	Confident	58 Å²	58	42.1 Å²	42.1	22%	0.219	23%	0.228	C	C	.	.	H	α-helix	trans	-72.2	-18.6	-176	-168.2	50.5	176	-111.1	34.6	114	R566 F571 P572 L574 R597 R598	R566-R568 PolarHBondContact O-N 3.48Å; R568-F571 WeakPolarHBondContact CD-O 3.18Å; R568-P572 VanDerWaalsContact CZ-O 3.27Å; R568-P572 PolarHBondContact NE-O 3.29Å; R568-P572 PolarHBondContact NH2-O 2.88Å; R568-L574 PolarHBondContact NH1-O 2.8Å; R568-L574 PolarHBondContact NH2-O 3.45Å; R568-R597 PolarHBondContact NH1-O 3.34Å; R568-R598 PolarHBondContact NH1-O 3.49Å
569	V	80	Confident	84	Confident	127 Å²	127	38.3 Å²	38.3	77%	0.77	21%	0.207	S	C	*	.	H	α-helix	trans	-73.1	-32.7	171.6	-177.2	0	0	0	0	110.8	R566 I567	R566-V569 WeakPolarHBondContact O-CB 3.18Å; R566-V569 PolarHBondContact O-N 2.99Å; R566-V569 VanDerWaalsContact O-N 3.14Å; I567-V569 VanDerWaalsContact C-N 3.27Å; I567-V569 PolarHBondContact O-N 3.4Å
570	K	80.9	Confident	84.3	Confident	65 Å²	65	37.1 Å²	37.1	28%	0.283	20%	0.196	S	C	.	.	H	α-helix	trans	-87.5	-40.8	179.3	-69.7	-170.6	170.3	-167.2	0	113.6	L535 E536 R537 A544 R566 I567 P572	L535-K570 WeakPolarHBondContact O-CD 3.21Å; L535-K570 WeakPolarHBondContact O-CE 3.46Å; L535-K570 PolarHBondContact O-NZ 3.2Å; E536-K570 PolarHBondContact O-NZ 3.02Å; R537-K570 PolarHBondContact O-NZ 2.73Å; A544-K570 WeakPolarHBondContact CB-O 3.34Å; R566-K570 PolarHBondContact O-N 3.39Å; I567-K570 PolarHBondContact O-N 3.11Å; I567-K570 VanDerWaalsContact O-N 3.1Å; K570-P572 WeakPolarHBondContact O-CD 3.36Å
571	F	85.6	Confident	84.2	Confident	1 Å²	1	40.2 Å²	40.2	0%	0.004	21%	0.211	C	C	.	.			trans	-113.4	82.1	-175.9	-57.3	-73.6	0	0	0	109.7	L524 L535 W539 A544 V547 I550 I567 R568 N573 L574	L524-F571 HydrophobicContact CD2-CE1 4.25Å; L524-F571 HydrophobicContact CD2-CE2 4.26Å; L524-F571 HydrophobicContact CD2-CZ 3.75Å; L535-F571 HydrophobicContact CD2-CE2 3.69Å; L535-F571 HydrophobicContact CD2-CZ 4.39Å; W539-F571 AromaticContact CD1-CZ 3.75Å; W539-F571 HydrophobicContact CD2-CE1 4.19Å; W539-F571 HydrophobicContact CD2-CZ 4.17Å; W539-F571 AromaticContact CE2-CZ 3.95Å; W539-F571 HydrophobicContact CG-CE1 4.14Å; W539-F571 HydrophobicContact CG-CZ 4.07Å; W539-F571 AromaticContact NE1-CZ 3.68Å; A544-F571 HydrophobicContact CB-CD1 4.36Å; A544-F571 HydrophobicContact CB-CE1 4.47Å; V547-F571 HydrophobicContact CB-CD1 3.68Å; V547-F571 HydrophobicContact CB-CE1 4.2Å; V547-F571 HydrophobicContact CB-CG 4.43Å; V547-F571 HydrophobicContact CG1-CD1 4.14Å; V547-F571 HydrophobicContact CG2-CD1 3.82Å; V547-F571 HydrophobicContact CG2-CE1 3.83Å; I550-F571 HydrophobicContact CD1-CD2 3.81Å; I550-F571 HydrophobicContact CD1-CE2 4.27Å; I550-F571 HydrophobicContact CD1-CG 4.24Å; I567-F571 HydrophobicContact CG2-CD2 4.3Å; I567-F571 PolarHBondContact O-N 3.35Å; R568-F571 WeakPolarHBondContact CD-O 3.18Å; F571-N573 PolarHBondContact O-N 2.91Å; F571-L574 HydrophobicContact CB-CB 4.36Å; F571-L574 WeakPolarHBondContact O-CB 3.33Å; F571-L574 PolarHBondContact O-N 3.09Å
572	P	80.9	Confident	84.2	Confident	66 Å²	66	40.2 Å²	40.2	43%	0.429	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.4	-170	26.6	-35.9	0	0	0	113.2	R568 K570	R568-P572 VanDerWaalsContact CZ-O 3.27Å; R568-P572 PolarHBondContact NE-O 3.29Å; R568-P572 PolarHBondContact NH2-O 2.88Å; K570-P572 WeakPolarHBondContact O-CD 3.36Å
573	N	85.2	Confident	84.3	Confident	95 Å²	95	41.8 Å²	41.8	51%	0.508	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	6.8	-175.9	-66.9	-15.3	0	0	0	114	G545 F571 S575	G545-N573 PolarHBondContact O-ND2 3.02Å; F571-N573 PolarHBondContact O-N 2.91Å; N573-S575 PolarHBondContact O-N 3.08Å
574	L	86.2	Confident	84.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.213	C	C	.	.			trans	-55.1	125.3	175.7	-175.7	72	0	0	0	111.5	I550 I567 R568 F571 H576 L577 V596	I550-L574 HydrophobicContact CB-CD1 4.15Å; I550-L574 HydrophobicContact CD1-CD1 3.75Å; I550-L574 HydrophobicContact CD1-CD2 4.24Å; I550-L574 HydrophobicContact CG1-CD1 3.69Å; I567-L574 HydrophobicContact CG2-CD2 3.58Å; R568-L574 PolarHBondContact NH1-O 2.8Å; R568-L574 PolarHBondContact NH2-O 3.45Å; F571-L574 HydrophobicContact CB-CB 4.36Å; F571-L574 WeakPolarHBondContact O-CB 3.33Å; F571-L574 PolarHBondContact O-N 3.09Å; L574-H576 WeakPolarHBondContact CD1-O 3.32Å; L574-L577 HydrophobicContact CD1-CD2 4.24Å; L574-L577 HydrophobicContact CD2-CD2 4.04Å; L574-L577 HydrophobicContact CD2-CG 4.46Å; L574-V596 HydrophobicContact CD2-CG1 4.21Å
575	S	86.9	Confident	84.3	Confident	31 Å²	31	43.5 Å²	43.5	22%	0.217	23%	0.229	C	C	.	.			trans	-123.3	-24.3	177.3	60.6	0	0	0	0	112.6	T548 N573 L599 D600 Q601	T548-S575 PolarHBondContact O-N 2.66Å; T548-S575 PolarHBondContact O-OG 2.97Å; N573-S575 PolarHBondContact O-N 3.08Å; S575-L599 WeakPolarHBondContact O-CD1 3.34Å; S575-D600 WeakPolarHBondContact CB-OD2 3.26Å; S575-D600 PolarHBondContact O-N 2.93Å; S575-Q601 PolarHBondContact O-N 3.01Å
576	H	90	Very high	84.2	Confident	27 Å²	27	48.7 Å²	48.7	13%	0.125	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	134.4	-174.3	-170.8	-168.9	0	0	0	112.9	T548 V549 I550 L574 Q601 T603	T548-H576 PolarHBondContact O-N 3.14Å; T548-H576 VanDerWaalsContact O-N 3.14Å; V549-H576 WeakPolarHBondContact CA-O 3.31Å; V549-H576 HydrophobicContact CB-CB 4.38Å; V549-H576 HydrophobicContact CG1-CB 4.06Å; V549-H576 HydrophobicContact CG2-CB 4.06Å; I550-H576 PolarHBondContact N-O 2.57Å; I550-H576 VanDerWaalsContact N-O 3.1Å; L574-H576 WeakPolarHBondContact CD1-O 3.32Å; H576-Q601 WeakPolarHBondContact CA-O 3.32Å; H576-Q601 HydrophobicContact CB-CB 4.11Å; H576-Q601 PolarHBondContact CD2-O 2.93Å; H576-T603 PolarHBondContact NE2-OG1 3.18Å
577	L	90.9	Very high	84.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	135.6	168	-71.3	179.3	0	0	0	111	I550 F552 L574 F579 V596 L599 Q601 L602 T603	I550-L577 HydrophobicContact CB-CD2 3.85Å; I550-L577 HydrophobicContact CG2-CD2 4.48Å; I550-L577 WeakPolarHBondContact O-CA 3.48Å; F552-L577 HydrophobicContact CE2-CD2 4.18Å; L574-L577 HydrophobicContact CD1-CD2 4.24Å; L574-L577 HydrophobicContact CD2-CD2 4.04Å; L574-L577 HydrophobicContact CD2-CG 4.46Å; L577-F579 HydrophobicContact CB-CD2 4.47Å; L577-F579 HydrophobicContact CB-CE2 3.7Å; L577-F579 HydrophobicContact CB-CZ 4.28Å; L577-F579 HydrophobicContact CD1-CE2 4.24Å; L577-F579 HydrophobicContact CD1-CZ 4.18Å; L577-V596 HydrophobicContact CD1-CG1 4.29Å; L577-V596 HydrophobicContact CD1-CG2 4.17Å; L577-L599 HydrophobicContact CB-CD1 4.17Å; L577-L599 HydrophobicContact CB-CD2 4.44Å; L577-L599 HydrophobicContact CD1-CD1 4.12Å; L577-L599 HydrophobicContact CD1-CD2 4.24Å; L577-L599 HydrophobicContact CG-CD1 3.74Å; L577-L599 HydrophobicContact CG-CD2 4.47Å; L577-Q601 PolarHBondContact N-O 2.85Å; L577-L602 HydrophobicContact CB-CD1 4.18Å; L577-T603 PolarHBondContact O-N 3.09Å
578	I	90.2	Very high	83.8	Confident	35 Å²	35	47 Å²	47	18%	0.179	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	130.4	178.1	-54.5	178.3	0	0	0	109.4	V549 I550 A551 F552 T603	V549-I578 HydrophobicContact CG1-CD1 3.71Å; V549-I578 HydrophobicContact CG1-CG1 4.01Å; I550-I578 PolarHBondContact O-N 3.34Å; A551-I578 WeakPolarHBondContact CA-O 3.47Å; A551-I578 HydrophobicContact CB-CB 3.9Å; A551-I578 HydrophobicContact CB-CD1 4.47Å; A551-I578 HydrophobicContact CB-CG2 4.39Å; F552-I578 PolarHBondContact N-O 2.85Å; I578-T603 CarbonylContact C-O 3.58Å; I578-T603 WeakPolarHBondContact CA-O 3.34Å; I578-T603 HydrophobicContact CG2-CG2 4.36Å
579	F	91.1	Very high	84	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	120.4	-179.9	-65.4	-85.2	0	0	0	110	F552 F557 I560 L577 T582 I584 L593 L602 T603 I604 H605 N609	F552-F579 HydrophobicContact CB-CD1 4.31Å; F552-F579 HydrophobicContact CD2-CD1 4.01Å; F552-F579 AromaticContact CD2-CE1 3.62Å; F552-F579 HydrophobicContact CD2-CE1 3.62Å; F552-F579 HydrophobicContact CD2-CZ 4.15Å; F552-F579 HydrophobicContact CE2-CE1 4.06Å; F552-F579 HydrophobicContact CE2-CZ 4.28Å; F552-F579 HydrophobicContact CG-CD1 4.48Å; F552-F579 HydrophobicContact CG-CE1 4.34Å; F557-F579 HydrophobicContact CD2-CD1 4.05Å; F557-F579 AromaticContact CD2-CE1 3.91Å; F557-F579 HydrophobicContact CD2-CE1 3.91Å; F557-F579 HydrophobicContact CE2-CD1 4.23Å; F557-F579 AromaticContact CE2-CE1 3.78Å; F557-F579 HydrophobicContact CE2-CE1 3.78Å; F557-F579 HydrophobicContact CE2-CZ 4.11Å; I560-F579 HydrophobicContact CD1-CD1 4.17Å; I560-F579 HydrophobicContact CD1-CE1 3.97Å; L577-F579 HydrophobicContact CB-CD2 4.47Å; L577-F579 HydrophobicContact CB-CE2 3.7Å; L577-F579 HydrophobicContact CB-CZ 4.28Å; L577-F579 HydrophobicContact CD1-CE2 4.24Å; L577-F579 HydrophobicContact CD1-CZ 4.18Å; F579-T582 HydrophobicContact CB-CG2 4.33Å; F579-T582 HydrophobicContact CD1-CG2 4.18Å; F579-I584 HydrophobicContact CB-CD1 4.19Å; F579-I584 HydrophobicContact CD1-CD1 4.45Å; F579-I584 HydrophobicContact CG-CD1 4.3Å; F579-L593 HydrophobicContact CE2-CD2 3.72Å; F579-L593 HydrophobicContact CZ-CD2 3.53Å; F579-L602 HydrophobicContact CD2-CD1 3.84Å; F579-L602 HydrophobicContact CE2-CD1 3.67Å; F579-T603 PolarHBondContact N-O 3.29Å; F579-I604 HydrophobicContact CB-CG1 4.33Å; F579-I604 HydrophobicContact CD2-CG1 4.22Å; F579-H605 PolarHBondContact O-N 3.29Å; F579-N609 PolarHBondContact O-ND2 2.67Å
580	L	86.9	Confident	84.1	Confident	10 Å²	10	38.5 Å²	38.5	5%	0.052	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	128.8	179.6	173.2	68.3	0	0	0	109.7	F552 R553 F554 T582 H605 E607	F552-L580 PolarHBondContact O-N 3.43Å; R553-L580 WeakPolarHBondContact CA-O 3.48Å; R553-L580 HydrophobicContact CG-CB 4.41Å; R553-L580 HydrophobicContact CG-CD2 4.25Å; R553-L580 VanDerWaalsContact NH2-CD2 3.31Å; F554-L580 PolarHBondContact N-O 2.78Å; L580-T582 VanDerWaalsContact C-N 3.25Å; L580-T582 WeakPolarHBondContact O-CG2 3.41Å; L580-T582 PolarHBondContact O-N 3.13Å; L580-H605 HydrophobicContact CB-CB 4.29Å; L580-H605 HydrophobicContact CD1-CB 3.46Å; L580-H605 VanDerWaalsContact CD1-CB 3.46Å; L580-H605 HydrophobicContact CG-CB 4.48Å; L580-E607 HydrophobicContact CD1-CB 3.62Å
581	E	82	Confident	84	Confident	65 Å²	65	35.4 Å²	35.4	30%	0.304	19%	0.186	S	C	.	.	S	Bend	trans	51.4	47	-177.2	-62.6	179.6	-110.4	0	0	112.5	F554 E607	F554-E581 WeakPolarHBondContact CA-O 3.35Å; F554-E581 HydrophobicContact CD1-CB 4.03Å; F554-E581 WeakPolarHBondContact CD1-OE2 3.33Å; F554-E581 HydrophobicContact CE1-CB 4.48Å; F554-E581 WeakPolarHBondContact CE1-OE1 3.48Å; F554-E581 WeakPolarHBondContact CE1-OE2 3.1Å; F554-E581 PolarHBondContact N-O 3.45Å; E581-E607 PolarHBondContact N-O 3.03Å
582	T	83.4	Confident	83.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.185	C	C	.	.			trans	-105.9	5.2	-177.5	49.6	0	0	0	0	113.6	F552 I555 F557 I560 F579 L580 I584 N609	F552-T582 HydrophobicContact CB-CG2 4.01Å; I555-T582 WeakPolarHBondContact O-CA 3.39Å; I555-T582 VanDerWaalsContact O-CB 3.27Å; I555-T582 WeakPolarHBondContact O-CB 3.27Å; I555-T582 VanDerWaalsContact O-CG2 3.25Å; I555-T582 WeakPolarHBondContact O-CG2 3.37Å; F557-T582 WeakPolarHBondContact CB-O 3.49Å; F557-T582 PolarHBondContact N-O 3.39Å; I560-T582 HydrophobicContact CD1-CG2 4.18Å; F579-T582 HydrophobicContact CB-CG2 4.33Å; F579-T582 HydrophobicContact CD1-CG2 4.18Å; L580-T582 VanDerWaalsContact C-N 3.25Å; L580-T582 WeakPolarHBondContact O-CG2 3.41Å; L580-T582 PolarHBondContact O-N 3.13Å; T582-I584 VanDerWaalsContact C-N 3.26Å; T582-I584 PolarHBondContact O-N 2.82Å; T582-N609 PolarHBondContact N-OD1 3.43Å; T582-N609 PolarHBondContact OG1-ND2 3.34Å; T582-N609 PolarHBondContact OG1-OD1 2.7Å
583	N	83.6	Confident	83.8	Confident	78 Å²	78	32.2 Å²	32.2	42%	0.417	17%	0.165	S	C	.	.			trans	57.3	33.3	176	-162	14.3	0	0	0	114.3	S585 G608 N609	N583-S585 PolarHBondContact O-N 3.07Å; N583-S585 VanDerWaalsContact O-N 3.16Å; N583-G608 WeakPolarHBondContact CA-O 3.4Å; N583-G608 PolarHBondContact N-O 3.02Å; N583-N609 PolarHBondContact N-OD1 3.3Å
584	I	83.4	Confident	83.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.147	C	C	.	.			trans	-72.4	110.7	173	-49.4	168.5	0	0	0	107.6	F557 F579 T582 Q589 L590 I604 N609 P610 V611	F557-I584 HydrophobicContact CB-CG1 3.72Å; F557-I584 HydrophobicContact CD2-CD1 3.58Å; F557-I584 HydrophobicContact CD2-CG1 3.58Å; F557-I584 HydrophobicContact CE2-CD1 3.98Å; F557-I584 HydrophobicContact CE2-CG1 4.34Å; F557-I584 HydrophobicContact CG-CD1 4.25Å; F557-I584 HydrophobicContact CG-CG1 3.72Å; F579-I584 HydrophobicContact CB-CD1 4.19Å; F579-I584 HydrophobicContact CD1-CD1 4.45Å; F579-I584 HydrophobicContact CG-CD1 4.3Å; T582-I584 VanDerWaalsContact C-N 3.26Å; T582-I584 PolarHBondContact O-N 2.82Å; I584-Q589 HydrophobicContact CG2-CB 4.04Å; I584-L590 HydrophobicContact CD1-CD2 4.45Å; I584-L590 HydrophobicContact CG2-CD2 3.84Å; I584-L590 HydrophobicContact CG2-CG 4.27Å; I584-I604 HydrophobicContact CD1-CD1 4.4Å; I584-I604 HydrophobicContact CD1-CG2 4.12Å; I584-N609 HydrophobicContact CB-CB 4.34Å; I584-N609 WeakPolarHBondContact CG1-OD1 3.48Å; I584-N609 PolarHBondContact N-OD1 2.84Å; I584-N609 VanDerWaalsContact N-OD1 3.08Å; I584-N609 CarbonylContact O-C 3.57Å; I584-N609 VanDerWaalsContact O-C 3.29Å; I584-P610 VanDerWaalsContact O-CD 3.29Å; I584-P610 WeakPolarHBondContact O-CD 3.26Å; I584-P610 VanDerWaalsContact O-N 3.13Å; I584-V611 HydrophobicContact CB-CB 4.49Å; I584-V611 HydrophobicContact CB-CG1 3.89Å; I584-V611 HydrophobicContact CG2-CB 4.03Å; I584-V611 HydrophobicContact CG2-CG1 3.63Å; I584-V611 HydrophobicContact CG2-CG2 4.45Å; I584-V611 WeakPolarHBondContact O-CB 3.2Å; I584-V611 PolarHBondContact O-N 3.49Å
585	S	80.9	Confident	83	Confident	48 Å²	48	31 Å²	31	34%	0.336	16%	0.159	S	C	.	.			trans	-119.8	-22	-170.9	53.3	0	0	0	0	113.5	N583	N583-S585 PolarHBondContact O-N 3.07Å; N583-S585 VanDerWaalsContact O-N 3.16Å
586	R	78.1	Confident	82.5	Confident	175 Å²	175	29.6 Å²	29.6	66%	0.66	15%	0.149	S	C	*	.	S	Bend	trans	-122.1	135	-174.5	-56.2	177.5	-178.8	171	-0.8	110.9	P588 Q589	R586-P588 VanDerWaalsContact C-CD 3.49Å; R586-P588 VanDerWaalsContact C-N 3.33Å; R586-Q589 HydrophobicContact CB-CG 4.41Å; R586-Q589 WeakPolarHBondContact O-CB 3.31Å; R586-Q589 PolarHBondContact O-N 2.99Å
587	L	77.7	Confident	81.8	Confident	38 Å²	38	35.5 Å²	35.5	20%	0.199	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-49.8	-44	178.3	-66.3	174.5	0	0	0	113.7	Q589 L590 V611 L614 W617 F620	L587-Q589 VanDerWaalsContact C-N 3.26Å; L587-Q589 PolarHBondContact O-N 2.97Å; L587-L590 HydrophobicContact CD2-CD1 4.27Å; L587-L590 VanDerWaalsContact O-CB 3.31Å; L587-L590 WeakPolarHBondContact O-CB 3.43Å; L587-L590 PolarHBondContact O-N 3.42Å; L587-L590 VanDerWaalsContact O-N 3.13Å; L587-V611 HydrophobicContact CD2-CG2 3.87Å; L587-L614 HydrophobicContact CD2-CB 4.44Å; L587-L614 HydrophobicContact CD2-CD1 4.11Å; L587-L614 HydrophobicContact CG-CD1 3.92Å; L587-W617 HydrophobicContact CD2-CB 3.7Å; L587-F620 HydrophobicContact CB-CD1 4.31Å; L587-F620 HydrophobicContact CD2-CB 4.48Å; L587-F620 WeakPolarHBondContact O-CE1 3.12Å
588	P	78.8	Confident	80.9	Confident	67 Å²	67	44.5 Å²	44.5	44%	0.435	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-61.9	-24.2	180	-26.1	37.1	0	0	0	115.5	R586 L590 A591 Y714	R586-P588 VanDerWaalsContact C-CD 3.49Å; R586-P588 VanDerWaalsContact C-N 3.33Å; P588-L590 PolarHBondContact O-N 2.93Å; P588-A591 WeakPolarHBondContact O-CB 3.4Å; P588-A591 PolarHBondContact O-N 3.15Å; P588-Y714 HydrophobicContact CB-CD2 4.36Å; P588-Y714 WeakPolarHBondContact O-CD2 3.45Å
589	Q	80.8	Confident	80.5	Confident	5 Å²	5	43 Å²	43	2%	0.023	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-57.9	-38.7	175.4	-73.2	172.3	-63.1	0	0	110.9	F557 D558 I584 R586 L587 A591 A592 Y714	F557-Q589 HydrophobicContact CD1-CB 3.95Å; F557-Q589 HydrophobicContact CD1-CG 4.42Å; F557-Q589 HydrophobicContact CE1-CB 3.9Å; F557-Q589 WeakPolarHBondContact CE1-O 3.49Å; F557-Q589 WeakPolarHBondContact CZ-O 3.32Å; D558-Q589 PolarHBondContact OD1-NE2 2.98Å; I584-Q589 HydrophobicContact CG2-CB 4.04Å; R586-Q589 HydrophobicContact CB-CG 4.41Å; R586-Q589 WeakPolarHBondContact O-CB 3.31Å; R586-Q589 PolarHBondContact O-N 2.99Å; L587-Q589 VanDerWaalsContact C-N 3.26Å; L587-Q589 PolarHBondContact O-N 2.97Å; Q589-A591 PolarHBondContact O-N 3.49Å; Q589-A591 VanDerWaalsContact O-N 3.09Å; Q589-A592 VanDerWaalsContact O-CB 3.27Å; Q589-A592 WeakPolarHBondContact O-CB 3.38Å; Q589-A592 PolarHBondContact O-N 3.04Å; Q589-Y714 HydrophobicContact CB-CE2 4.3Å; Q589-Y714 HydrophobicContact CG-CD2 4.21Å; Q589-Y714 HydrophobicContact CG-CE2 3.54Å
590	L	82.1	Confident	80.1	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-60.5	-22.5	178.8	-58.7	170	0	0	0	113.1	I584 L587 P588 A592 L593 I604 V611 W617 F620 I621	I584-L590 HydrophobicContact CD1-CD2 4.45Å; I584-L590 HydrophobicContact CG2-CD2 3.84Å; I584-L590 HydrophobicContact CG2-CG 4.27Å; L587-L590 HydrophobicContact CD2-CD1 4.27Å; L587-L590 VanDerWaalsContact O-CB 3.31Å; L587-L590 WeakPolarHBondContact O-CB 3.43Å; L587-L590 PolarHBondContact O-N 3.42Å; L587-L590 VanDerWaalsContact O-N 3.13Å; P588-L590 PolarHBondContact O-N 2.93Å; L590-A592 VanDerWaalsContact C-N 3.27Å; L590-A592 PolarHBondContact O-N 2.98Å; L590-L593 WeakPolarHBondContact O-CB 3.19Å; L590-L593 WeakPolarHBondContact O-CG 3.27Å; L590-L593 PolarHBondContact O-N 3.14Å; L590-I604 HydrophobicContact CD2-CD1 3.43Å; L590-I604 VanDerWaalsContact CD2-CD1 3.43Å; L590-V611 HydrophobicContact CD1-CG1 4.5Å; L590-V611 HydrophobicContact CD1-CG2 3.71Å; L590-V611 HydrophobicContact CD2-CG1 4.41Å; L590-V611 HydrophobicContact CG-CG2 4.34Å; L590-W617 HydrophobicContact CD1-CB 4.47Å; L590-F620 HydrophobicContact CB-CD1 4.28Å; L590-F620 HydrophobicContact CB-CE1 4.28Å; L590-F620 HydrophobicContact CD1-CD1 4.41Å; L590-I621 HydrophobicContact CB-CG1 4.1Å; L590-I621 HydrophobicContact CD1-CD1 3.95Å; L590-I621 HydrophobicContact CD1-CG1 3.84Å; L590-I621 HydrophobicContact CD2-CD1 4.04Å; L590-I621 HydrophobicContact CG-CD1 4.4Å; L590-I621 HydrophobicContact CG-CG1 4.38Å
591	A	78.6	Confident	80.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-73	-17.9	176.7	0	0	0	0	0	113.6	P588 Q589 L593 A594 F620 R624 F712	P588-A591 WeakPolarHBondContact O-CB 3.4Å; P588-A591 PolarHBondContact O-N 3.15Å; Q589-A591 PolarHBondContact O-N 3.49Å; Q589-A591 VanDerWaalsContact O-N 3.09Å; A591-L593 PolarHBondContact O-N 3.24Å; A591-A594 VanDerWaalsContact O-CB 3.28Å; A591-A594 WeakPolarHBondContact O-CB 3.49Å; A591-A594 PolarHBondContact O-N 3.12Å; A591-A594 VanDerWaalsContact O-N 3.14Å; A591-F620 HydrophobicContact CB-CE1 4.31Å; A591-F620 HydrophobicContact CB-CZ 4.35Å; A591-R624 HydrophobicContact CB-CG 3.95Å; A591-F712 WeakPolarHBondContact CB-O 3.49Å
592	A	80.3	Confident	80.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-61.2	-29.5	170.8	0	0	0	0	0	112.1	F557 V561 L564 Q589 L590 A594 Q595 Y714	F557-A592 HydrophobicContact CE1-CB 3.93Å; F557-A592 HydrophobicContact CZ-CB 4.11Å; V561-A592 HydrophobicContact CG1-CB 4.1Å; V561-A592 HydrophobicContact CG2-CB 3.68Å; L564-A592 HydrophobicContact CD1-CB 4.02Å; Q589-A592 VanDerWaalsContact O-CB 3.27Å; Q589-A592 WeakPolarHBondContact O-CB 3.38Å; Q589-A592 PolarHBondContact O-N 3.04Å; L590-A592 VanDerWaalsContact C-N 3.27Å; L590-A592 PolarHBondContact O-N 2.98Å; A592-A594 PolarHBondContact O-N 3.11Å; A592-A594 VanDerWaalsContact O-N 3.09Å; A592-Q595 VanDerWaalsContact O-CB 3.31Å; A592-Q595 WeakPolarHBondContact O-CB 3.48Å; A592-Q595 VanDerWaalsContact O-CG 3.26Å; A592-Q595 WeakPolarHBondContact O-CG 3.36Å; A592-Q595 PolarHBondContact O-N 3.45Å; A592-Y714 HydrophobicContact CB-CD1 4.23Å; A592-Y714 HydrophobicContact CB-CG 4.41Å
593	L	82.8	Confident	80.7	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-60.2	-20.9	176.4	-59.5	177	0	0	0	112.7	F557 L564 F579 L590 A591 Q595 V596 L602 L625	F557-L593 HydrophobicContact CE2-CD2 3.96Å; F557-L593 HydrophobicContact CE2-CG 4.47Å; F557-L593 HydrophobicContact CZ-CD2 4.04Å; F557-L593 HydrophobicContact CZ-CG 4.23Å; L564-L593 HydrophobicContact CD1-CD2 4.46Å; F579-L593 HydrophobicContact CE2-CD2 3.72Å; F579-L593 HydrophobicContact CZ-CD2 3.53Å; L590-L593 WeakPolarHBondContact O-CB 3.19Å; L590-L593 WeakPolarHBondContact O-CG 3.27Å; L590-L593 PolarHBondContact O-N 3.14Å; A591-L593 PolarHBondContact O-N 3.24Å; L593-Q595 PolarHBondContact O-N 3.22Å; L593-Q595 VanDerWaalsContact O-N 3.13Å; L593-V596 PolarHBondContact O-N 3.46Å; L593-L602 HydrophobicContact CD1-CD1 3.97Å; L593-L602 HydrophobicContact CD1-CD2 3.67Å; L593-L602 HydrophobicContact CD1-CG 4.5Å; L593-L625 HydrophobicContact CB-CD1 4.18Å; L593-L625 HydrophobicContact CB-CD2 4.42Å
594	A	77.3	Confident	80.9	Confident	14 Å²	14	42.5 Å²	42.5	12%	0.116	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-66.2	-11	175.6	0	0	0	0	0	113.9	A591 A592 V596 R624 L625 F628	A591-A594 VanDerWaalsContact O-CB 3.28Å; A591-A594 WeakPolarHBondContact O-CB 3.49Å; A591-A594 PolarHBondContact O-N 3.12Å; A591-A594 VanDerWaalsContact O-N 3.14Å; A592-A594 PolarHBondContact O-N 3.11Å; A592-A594 VanDerWaalsContact O-N 3.09Å; A594-V596 VanDerWaalsContact C-N 3.3Å; A594-R624 VanDerWaalsContact CB-CZ 3.42Å; A594-R624 VanDerWaalsContact CB-NH1 3.33Å; A594-L625 HydrophobicContact CB-CD2 3.74Å; A594-F628 WeakPolarHBondContact O-CE2 3.49Å
595	Q	77.3	Confident	81	Confident	56 Å²	56	45.7 Å²	45.7	26%	0.262	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-73.4	-23.6	171.3	-59.8	172.6	20.7	0	0	111.7	L564 P565 A592 L593 R597	L564-Q595 HydrophobicContact CB-CB 4.36Å; P565-Q595 HydrophobicContact CG-CB 4.33Å; A592-Q595 VanDerWaalsContact O-CB 3.31Å; A592-Q595 WeakPolarHBondContact O-CB 3.48Å; A592-Q595 VanDerWaalsContact O-CG 3.26Å; A592-Q595 WeakPolarHBondContact O-CG 3.36Å; A592-Q595 PolarHBondContact O-N 3.45Å; L593-Q595 PolarHBondContact O-N 3.22Å; L593-Q595 VanDerWaalsContact O-N 3.13Å; Q595-R597 PolarHBondContact O-N 3.19Å
596	V	77.2	Confident	81	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	22%	0.219	C	C	.	.	S	Bend	trans	-88.6	97.2	177.5	-172.7	0	0	0	0	109.8	L564 L574 L577 L593 A594	L564-V596 HydrophobicContact CB-CG2 3.94Å; L564-V596 HydrophobicContact CD2-CG2 3.95Å; L564-V596 HydrophobicContact CG-CG2 4.41Å; L574-V596 HydrophobicContact CD2-CG1 4.21Å; L577-V596 HydrophobicContact CD1-CG1 4.29Å; L577-V596 HydrophobicContact CD1-CG2 4.17Å; L593-V596 PolarHBondContact O-N 3.46Å; A594-V596 VanDerWaalsContact C-N 3.3Å
597	R	73.8	Confident	81	Confident	150 Å²	150	44.8 Å²	44.8	57%	0.566	22%	0.215	S	C	*	.			trans	-70	141.7	179.5	-60.1	179.1	-179.8	172.7	-0.4	111.3	R568 Q595 F628 E671	R568-R597 PolarHBondContact NH1-O 3.34Å; Q595-R597 PolarHBondContact O-N 3.19Å; R597-F628 HydrophobicContact CB-CE1 3.97Å; R597-F628 HydrophobicContact CB-CZ 4.24Å; R597-F628 HydrophobicContact CG-CE1 3.96Å; R597-F628 HydrophobicContact CG-CZ 3.92Å; R597-E671 IonicContact NH2-OE1 2.71Å
598	R	73	Confident	80.6	Confident	189 Å²	189	45 Å²	45	71%	0.713	23%	0.225	S	C	*	.	S	Bend	trans	58.1	63.7	178.3	-60	-177.7	179.5	-179.2	-1	113.6	R568	R568-R598 PolarHBondContact NH1-O 3.49Å
599	L	80.6	Confident	80.8	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.016	21%	0.205	C	C	.	.			trans	-101	115.4	172.6	-172.1	72.8	0	0	0	109.3	S575 L577 Q601 L602 L630	S575-L599 WeakPolarHBondContact O-CD1 3.34Å; L577-L599 HydrophobicContact CB-CD1 4.17Å; L577-L599 HydrophobicContact CB-CD2 4.44Å; L577-L599 HydrophobicContact CD1-CD1 4.12Å; L577-L599 HydrophobicContact CD1-CD2 4.24Å; L577-L599 HydrophobicContact CG-CD1 3.74Å; L577-L599 HydrophobicContact CG-CD2 4.47Å; L599-Q601 WeakPolarHBondContact CD1-O 3.39Å; L599-Q601 WeakPolarHBondContact CG-O 3.48Å; L599-L602 HydrophobicContact CD2-CB 4.17Å; L599-L602 HydrophobicContact CD2-CD1 4.24Å; L599-L630 HydrophobicContact CD2-CD1 4.41Å; L599-L630 HydrophobicContact CG-CD1 4.34Å; L599-L630 WeakPolarHBondContact O-CD1 3.4Å
600	D	83.2	Confident	80.8	Confident	55 Å²	55	45 Å²	45	29%	0.294	23%	0.226	S	C	.	.			trans	-85.2	-29.5	-177.2	-58.8	-57.1	0	0	0	112.3	S575 Q631 K632	S575-D600 WeakPolarHBondContact CB-OD2 3.26Å; S575-D600 PolarHBondContact O-N 2.93Å; D600-Q631 WeakPolarHBondContact O-CB 3.21Å; D600-Q631 PolarHBondContact O-N 3.02Å; D600-K632 PolarHBondContact O-N 3.08Å
601	Q	87.3	Confident	80.8	Confident	66 Å²	66	44.9 Å²	44.9	31%	0.308	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	147.9	179.8	-58.1	-168.3	38	0	0	112.6	S575 H576 L577 L599 K632	S575-Q601 PolarHBondContact O-N 3.01Å; H576-Q601 WeakPolarHBondContact CA-O 3.32Å; H576-Q601 HydrophobicContact CB-CB 4.11Å; H576-Q601 PolarHBondContact CD2-O 2.93Å; L577-Q601 PolarHBondContact N-O 2.85Å; L599-Q601 WeakPolarHBondContact CD1-O 3.39Å; L599-Q601 WeakPolarHBondContact CG-O 3.48Å; Q601-K632 WeakPolarHBondContact CA-O 3.4Å; Q601-K632 HydrophobicContact CG-CB 4.13Å; Q601-K632 HydrophobicContact CG-CG 4.39Å
602	L	89.4	Confident	80.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	129.1	176.6	178.2	63.8	0	0	0	110.4	L577 F579 L593 L599 I604 I621 L625 L630 K632 I633 N634	L577-L602 HydrophobicContact CB-CD1 4.18Å; F579-L602 HydrophobicContact CD2-CD1 3.84Å; F579-L602 HydrophobicContact CE2-CD1 3.67Å; L593-L602 HydrophobicContact CD1-CD1 3.97Å; L593-L602 HydrophobicContact CD1-CD2 3.67Å; L593-L602 HydrophobicContact CD1-CG 4.5Å; L599-L602 HydrophobicContact CD2-CB 4.17Å; L599-L602 HydrophobicContact CD2-CD1 4.24Å; L602-I604 HydrophobicContact CD1-CG1 4.36Å; L602-I604 HydrophobicContact CD2-CD1 4.28Å; L602-I604 HydrophobicContact CG-CG1 4.33Å; L602-I621 HydrophobicContact CD2-CD1 3.89Å; L602-I621 HydrophobicContact CD2-CG2 3.9Å; L602-L625 HydrophobicContact CD2-CD1 4.43Å; L602-L630 HydrophobicContact CB-CD1 4.05Å; L602-L630 HydrophobicContact CB-CD2 4.41Å; L602-K632 PolarHBondContact N-O 3.19Å; L602-I633 CarbonylContact O-C 3.6Å; L602-I633 VanDerWaalsContact O-CA 3.29Å; L602-I633 WeakPolarHBondContact O-CA 3.23Å; L602-N634 PolarHBondContact O-N 2.75Å
603	T	88.2	Confident	80.8	Confident	23 Å²	23	51 Å²	51	14%	0.141	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.5	171.7	-57.4	0	0	0	0	110.2	H576 L577 I578 F579 N634	H576-T603 PolarHBondContact NE2-OG1 3.18Å; L577-T603 PolarHBondContact O-N 3.09Å; I578-T603 CarbonylContact C-O 3.58Å; I578-T603 WeakPolarHBondContact CA-O 3.34Å; I578-T603 HydrophobicContact CG2-CG2 4.36Å; F579-T603 PolarHBondContact N-O 3.29Å; T603-N634 WeakPolarHBondContact CA-OD1 3.49Å
604	I	88.4	Confident	80.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	106.9	170	-57.4	171.7	0	0	0	106.5	F579 I584 L590 L602 N609 V612 W617 I621 N634	F579-I604 HydrophobicContact CB-CG1 4.33Å; F579-I604 HydrophobicContact CD2-CG1 4.22Å; I584-I604 HydrophobicContact CD1-CD1 4.4Å; I584-I604 HydrophobicContact CD1-CG2 4.12Å; L590-I604 HydrophobicContact CD2-CD1 3.43Å; L590-I604 VanDerWaalsContact CD2-CD1 3.43Å; L602-I604 HydrophobicContact CD1-CG1 4.36Å; L602-I604 HydrophobicContact CD2-CD1 4.28Å; L602-I604 HydrophobicContact CG-CG1 4.33Å; I604-N609 HydrophobicContact CG2-CB 3.88Å; I604-V612 HydrophobicContact CB-CG2 4.31Å; I604-V612 HydrophobicContact CG2-CG2 3.65Å; I604-W617 HydrophobicContact CD1-CZ3 4.18Å; I604-I621 HydrophobicContact CD1-CD1 3.87Å; I604-N634 PolarHBondContact N-OD1 3.03Å; I604-N634 PolarHBondContact O-ND2 3.31Å; I604-N634 PolarHBondContact O-OD1 2.92Å
605	H	84.9	Confident	80.8	Confident	66 Å²	66	58.4 Å²	58.4	31%	0.306	32%	0.318	S	S	.	.			trans	-68.6	142.9	178.4	-72.4	-101.2	0	0	0	110.3	F579 L580 E607 N609	F579-H605 PolarHBondContact O-N 3.29Å; L580-H605 HydrophobicContact CB-CB 4.29Å; L580-H605 HydrophobicContact CD1-CB 3.46Å; L580-H605 VanDerWaalsContact CD1-CB 3.46Å; L580-H605 HydrophobicContact CG-CB 4.48Å; H605-E607 PolarHBondContact O-N 3.42Å; H605-N609 WeakPolarHBondContact O-CB 3.44Å; H605-N609 PolarHBondContact O-ND2 3.22Å
606	P	81.1	Confident	81	Confident	84 Å²	84	59.9 Å²	59.9	55%	0.545	33%	0.328	S	S	.	.	S	Bend	trans	-65.4	-29.4	176.9	27.8	-34.6	0	0	0	112.1	G608 N609 V612	P606-G608 PolarHBondContact O-N 3.12Å; P606-G608 VanDerWaalsContact O-N 3.11Å; P606-N609 PolarHBondContact O-N 2.91Å; P606-V612 HydrophobicContact CB-CB 4.39Å; P606-V612 HydrophobicContact CB-CG1 4.05Å
607	E	77.3	Confident	81.4	Confident	121 Å²	121	61.2 Å²	61.2	57%	0.565	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	110.5	173.8	-73.8	156.7	-148.8	0	0	110.7	L580 E581 H605 N609	L580-E607 HydrophobicContact CD1-CB 3.62Å; E581-E607 PolarHBondContact N-O 3.03Å; H605-E607 PolarHBondContact O-N 3.42Å; E607-N609 VanDerWaalsContact C-N 3.32Å; E607-N609 PolarHBondContact O-N 3.37Å
608	G	69.8	Low	82	Confident	41 Å²	41	55.8 Å²	55.8	42%	0.423	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	22.4	179	0	0	0	0	0	115.9	N583 P606	N583-G608 WeakPolarHBondContact CA-O 3.4Å; N583-G608 PolarHBondContact N-O 3.02Å; P606-G608 PolarHBondContact O-N 3.12Å; P606-G608 VanDerWaalsContact O-N 3.11Å
609	N	83.8	Confident	82.5	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.011	29%	0.29	C	S	.	.			trans	-131.8	87.2	170	-64.6	-61.5	0	0	0	111.4	F579 T582 N583 I584 I604 H605 P606 E607 V611 V612	F579-N609 PolarHBondContact O-ND2 2.67Å; T582-N609 PolarHBondContact N-OD1 3.43Å; T582-N609 PolarHBondContact OG1-ND2 3.34Å; T582-N609 PolarHBondContact OG1-OD1 2.7Å; N583-N609 PolarHBondContact N-OD1 3.3Å; I584-N609 HydrophobicContact CB-CB 4.34Å; I584-N609 WeakPolarHBondContact CG1-OD1 3.48Å; I584-N609 PolarHBondContact N-OD1 2.84Å; I584-N609 VanDerWaalsContact N-OD1 3.08Å; I584-N609 CarbonylContact O-C 3.57Å; I584-N609 VanDerWaalsContact O-C 3.29Å; I604-N609 HydrophobicContact CG2-CB 3.88Å; H605-N609 WeakPolarHBondContact O-CB 3.44Å; H605-N609 PolarHBondContact O-ND2 3.22Å; P606-N609 PolarHBondContact O-N 2.91Å; E607-N609 VanDerWaalsContact C-N 3.32Å; E607-N609 PolarHBondContact O-N 3.37Å; N609-V611 PolarHBondContact O-N 3.31Å; N609-V612 HydrophobicContact CB-CG2 4.29Å; N609-V612 PolarHBondContact O-N 3.36Å; N609-V612 VanDerWaalsContact O-N 3.14Å
610	P	80.9	Confident	82.6	Confident	70 Å²	70	48.7 Å²	48.7	46%	0.455	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-53.1	-25.5	-177.3	-28.4	35.2	0	0	0	115.5	I584 V612 S613	I584-P610 VanDerWaalsContact O-CD 3.29Å; I584-P610 WeakPolarHBondContact O-CD 3.26Å; I584-P610 VanDerWaalsContact O-N 3.13Å; P610-V612 PolarHBondContact O-N 3.17Å; P610-V612 VanDerWaalsContact O-N 3.11Å; P610-S613 WeakPolarHBondContact O-CB 3.34Å; P610-S613 PolarHBondContact O-N 3.29Å; P610-S613 PolarHBondContact O-OG 2.81Å
611	V	81.6	Confident	82.7	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-56.6	-28	179.2	78.1	0	0	0	0	113.4	I584 L587 L590 N609 S613 L614 W617	I584-V611 HydrophobicContact CB-CB 4.49Å; I584-V611 HydrophobicContact CB-CG1 3.89Å; I584-V611 HydrophobicContact CG2-CB 4.03Å; I584-V611 HydrophobicContact CG2-CG1 3.63Å; I584-V611 HydrophobicContact CG2-CG2 4.45Å; I584-V611 WeakPolarHBondContact O-CB 3.2Å; I584-V611 PolarHBondContact O-N 3.49Å; L587-V611 HydrophobicContact CD2-CG2 3.87Å; L590-V611 HydrophobicContact CD1-CG1 4.5Å; L590-V611 HydrophobicContact CD1-CG2 3.71Å; L590-V611 HydrophobicContact CD2-CG1 4.41Å; L590-V611 HydrophobicContact CG-CG2 4.34Å; N609-V611 PolarHBondContact O-N 3.31Å; V611-S613 PolarHBondContact O-N 3.18Å; V611-L614 HydrophobicContact CG2-CD1 4.18Å; V611-L614 WeakPolarHBondContact O-CB 3.35Å; V611-L614 PolarHBondContact O-N 3.2Å; V611-L614 VanDerWaalsContact O-N 3.09Å; V611-W617 HydrophobicContact CG2-CB 4.31Å; V611-W617 WeakPolarHBondContact O-CB 3.37Å
612	V	80.9	Confident	82.6	Confident	30 Å²	30	43.3 Å²	43.3	18%	0.182	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-66.9	-18.7	-179.8	-176.8	0	0	0	0	112.1	I604 P606 N609 P610 W617	I604-V612 HydrophobicContact CB-CG2 4.31Å; I604-V612 HydrophobicContact CG2-CG2 3.65Å; P606-V612 HydrophobicContact CB-CB 4.39Å; P606-V612 HydrophobicContact CB-CG1 4.05Å; N609-V612 HydrophobicContact CB-CG2 4.29Å; N609-V612 PolarHBondContact O-N 3.36Å; N609-V612 VanDerWaalsContact O-N 3.14Å; P610-V612 PolarHBondContact O-N 3.17Å; P610-V612 VanDerWaalsContact O-N 3.11Å; V612-W617 HydrophobicContact CG1-CZ2 4Å; V612-W617 VanDerWaalsContact O-CD1 3.24Å; V612-W617 PolarHBondContact O-NE1 2.97Å
613	S	77.9	Confident	82.2	Confident	100 Å²	100	43.4 Å²	43.4	70%	0.699	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-77.3	-19.6	173.8	70.3	0	0	0	0	114	P610 V611 A615	P610-S613 WeakPolarHBondContact O-CB 3.34Å; P610-S613 PolarHBondContact O-N 3.29Å; P610-S613 PolarHBondContact O-OG 2.81Å; V611-S613 PolarHBondContact O-N 3.18Å; S613-A615 PolarHBondContact O-N 3.3Å
614	L	80.6	Confident	81.7	Confident	69 Å²	69	43.4 Å²	43.4	36%	0.361	26%	0.261	S	S	.	.	S	Bend	trans	-81	109.3	-174.2	-57	178.3	0	0	0	110.4	L587 V611 L616 W617	L587-L614 HydrophobicContact CD2-CB 4.44Å; L587-L614 HydrophobicContact CD2-CD1 4.11Å; L587-L614 HydrophobicContact CG-CD1 3.92Å; V611-L614 HydrophobicContact CG2-CD1 4.18Å; V611-L614 WeakPolarHBondContact O-CB 3.35Å; V611-L614 PolarHBondContact O-N 3.2Å; V611-L614 VanDerWaalsContact O-N 3.09Å; L614-L616 PolarHBondContact O-N 3.49Å; L614-W617 WeakPolarHBondContact O-CB 3.47Å; L614-W617 PolarHBondContact O-N 2.98Å
615	A	78.6	Confident	81.1	Confident	101 Å²	101	43.6 Å²	43.6	84%	0.835	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-22.1	-171.7	0	0	0	0	0	116.7	S613	S613-A615 PolarHBondContact O-N 3.3Å
616	L	82.2	Confident	80.4	Confident	87 Å²	87	44.6 Å²	44.6	46%	0.455	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-2.1	178.1	-57.2	179.1	0	0	0	115.1	L614 R618 S619 F620 F650	L614-L616 PolarHBondContact O-N 3.49Å; L616-R618 PolarHBondContact O-N 3.13Å; L616-S619 PolarHBondContact O-N 3.21Å; L616-F620 PolarHBondContact O-N 2.76Å; L616-F650 HydrophobicContact CB-CE2 4.49Å; L616-F650 HydrophobicContact CB-CZ 4.06Å; L616-F650 HydrophobicContact CD1-CZ 4.44Å
617	W	85.9	Confident	79.6	Confident	28 Å²	28	45.2 Å²	45.2	11%	0.106	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-46.4	-170.9	80.6	-98.3	0	0	0	113.4	L587 L590 I604 V611 V612 L614 S619 F620 I621 I633	L587-W617 HydrophobicContact CD2-CB 3.7Å; L590-W617 HydrophobicContact CD1-CB 4.47Å; I604-W617 HydrophobicContact CD1-CZ3 4.18Å; V611-W617 HydrophobicContact CG2-CB 4.31Å; V611-W617 WeakPolarHBondContact O-CB 3.37Å; V612-W617 HydrophobicContact CG1-CZ2 4Å; V612-W617 VanDerWaalsContact O-CD1 3.24Å; V612-W617 PolarHBondContact O-NE1 2.97Å; L614-W617 WeakPolarHBondContact O-CB 3.47Å; L614-W617 PolarHBondContact O-N 2.98Å; W617-S619 PolarHBondContact O-N 3.06Å; W617-F620 PolarHBondContact O-N 2.69Å; W617-I621 HydrophobicContact CE3-CD1 3.53Å; W617-I621 HydrophobicContact CE3-CG1 4.43Å; W617-I621 HydrophobicContact CZ3-CD1 3.57Å; W617-I621 WeakPolarHBondContact O-CG1 3.31Å; W617-I621 PolarHBondContact O-N 2.56Å; W617-I621 VanDerWaalsContact O-N 3.07Å; W617-I633 HydrophobicContact CH2-CG2 3.69Å; W617-I633 HydrophobicContact CZ3-CG2 3.8Å
618	R	86.1	Confident	79.1	Confident	37 Å²	37	41.2 Å²	41.2	14%	0.14	24%	0.24	C	C	.	.	H	α-helix	trans	-59.6	-47.5	177	176.5	176.5	162.5	96.4	2.3	110.4	L616 F620 I621 I622 I633 Q636 E637 D642	L616-R618 PolarHBondContact O-N 3.13Å; R618-F620 PolarHBondContact O-N 3.46Å; R618-I621 PolarHBondContact O-N 3.34Å; R618-I622 HydrophobicContact CG-CD1 3.79Å; R618-I622 VanDerWaalsContact O-CG1 3.27Å; R618-I622 WeakPolarHBondContact O-CG1 3.44Å; R618-I622 PolarHBondContact O-N 2.82Å; R618-I633 HydrophobicContact CG-CD1 4.44Å; R618-Q636 VanDerWaalsContact NH1-CB 3.34Å; R618-Q636 PolarHBondContact NH1-O 3.09Å; R618-E637 PolarHBondContact NH2-O 3.4Å; R618-D642 IonicContact NH2-OD1 2.7Å; R618-D642 IonicContact NH2-OD2 2.74Å; R618-D642 PolarHBondContact NH2-OD2 3.22Å
619	S	83.1	Confident	79.1	Confident	34 Å²	34	45.3 Å²	45.3	24%	0.238	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-37.3	178.5	-53	0	0	0	0	112.7	L616 W617 I622 Y623 A646	L616-S619 PolarHBondContact O-N 3.21Å; W617-S619 PolarHBondContact O-N 3.06Å; S619-I622 PolarHBondContact O-N 3.25Å; S619-Y623 WeakPolarHBondContact O-CB 3.25Å; S619-Y623 PolarHBondContact O-N 3.01Å; S619-A646 WeakPolarHBondContact O-CB 3.32Å
620	F	83.8	Confident	78.9	Confident	8 Å²	8	45.8 Å²	45.8	4%	0.035	26%	0.255	C	S	.	.	H	α-helix	trans	-65.1	-43.1	175.9	-178.5	-101.3	0	0	0	112	L587 L590 A591 L616 W617 R618 Y623 R624 F650 F712	L587-F620 HydrophobicContact CB-CD1 4.31Å; L587-F620 HydrophobicContact CD2-CB 4.48Å; L587-F620 WeakPolarHBondContact O-CE1 3.12Å; L590-F620 HydrophobicContact CB-CD1 4.28Å; L590-F620 HydrophobicContact CB-CE1 4.28Å; L590-F620 HydrophobicContact CD1-CD1 4.41Å; A591-F620 HydrophobicContact CB-CE1 4.31Å; A591-F620 HydrophobicContact CB-CZ 4.35Å; L616-F620 PolarHBondContact O-N 2.76Å; W617-F620 PolarHBondContact O-N 2.69Å; R618-F620 PolarHBondContact O-N 3.46Å; F620-Y623 PolarHBondContact O-N 3.12Å; F620-R624 VanDerWaalsContact O-CB 3.27Å; F620-R624 WeakPolarHBondContact O-CB 3.33Å; F620-R624 PolarHBondContact O-N 2.92Å; F620-F650 HydrophobicContact CB-CE1 4.42Å; F620-F650 HydrophobicContact CB-CE2 3.89Å; F620-F650 HydrophobicContact CB-CZ 3.79Å; F620-F650 HydrophobicContact CD2-CD1 4.03Å; F620-F650 AromaticContact CD2-CE1 3.74Å; F620-F650 HydrophobicContact CD2-CE1 3.74Å; F620-F650 HydrophobicContact CD2-CE2 4.48Å; F620-F650 AromaticContact CD2-CZ 3.98Å; F620-F650 HydrophobicContact CD2-CZ 3.98Å; F620-F650 HydrophobicContact CG-CZ 4.38Å; F620-F712 HydrophobicContact CE2-CB 4.48Å; F620-F712 HydrophobicContact CE2-CD1 4.18Å; F620-F712 HydrophobicContact CE2-CG 4.27Å; F620-F712 HydrophobicContact CZ-CB 4.22Å; F620-F712 HydrophobicContact CZ-CG 4.49Å
621	I	84.6	Confident	79	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-47.6	174.6	-67.3	-179.6	0	0	0	110.8	L590 L602 I604 W617 R618 Y623 R624 L625 L630 I633	L590-I621 HydrophobicContact CB-CG1 4.1Å; L590-I621 HydrophobicContact CD1-CD1 3.95Å; L590-I621 HydrophobicContact CD1-CG1 3.84Å; L590-I621 HydrophobicContact CD2-CD1 4.04Å; L590-I621 HydrophobicContact CG-CD1 4.4Å; L590-I621 HydrophobicContact CG-CG1 4.38Å; L602-I621 HydrophobicContact CD2-CD1 3.89Å; L602-I621 HydrophobicContact CD2-CG2 3.9Å; I604-I621 HydrophobicContact CD1-CD1 3.87Å; W617-I621 HydrophobicContact CE3-CD1 3.53Å; W617-I621 HydrophobicContact CE3-CG1 4.43Å; W617-I621 HydrophobicContact CZ3-CD1 3.57Å; W617-I621 WeakPolarHBondContact O-CG1 3.31Å; W617-I621 PolarHBondContact O-N 2.56Å; W617-I621 VanDerWaalsContact O-N 3.07Å; R618-I621 PolarHBondContact O-N 3.34Å; I621-Y623 PolarHBondContact O-N 2.98Å; I621-R624 PolarHBondContact O-N 2.83Å; I621-L625 HydrophobicContact CG2-CD1 3.79Å; I621-L625 HydrophobicContact CG2-CG 4.2Å; I621-L625 WeakPolarHBondContact O-CB 3.28Å; I621-L625 PolarHBondContact O-N 2.82Å; I621-L630 HydrophobicContact CG2-CD2 3.83Å; I621-I633 HydrophobicContact CB-CD1 4.43Å; I621-I633 HydrophobicContact CG2-CD1 3.9Å
622	I	84.5	Confident	79.2	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-58.6	-48.2	-180	-68.8	168.8	0	0	0	110.2	R618 S619 R624 Y626 I633 V638 D642 V643 A646	R618-I622 HydrophobicContact CG-CD1 3.79Å; R618-I622 VanDerWaalsContact O-CG1 3.27Å; R618-I622 WeakPolarHBondContact O-CG1 3.44Å; R618-I622 PolarHBondContact O-N 2.82Å; S619-I622 PolarHBondContact O-N 3.25Å; I622-R624 PolarHBondContact O-N 3.46Å; I622-Y626 WeakPolarHBondContact O-CA 3.42Å; I622-Y626 WeakPolarHBondContact O-CB 3.24Å; I622-Y626 PolarHBondContact O-N 3.25Å; I622-I633 HydrophobicContact CD1-CD1 4.11Å; I622-I633 HydrophobicContact CG1-CD1 3.53Å; I622-V638 HydrophobicContact CD1-CG1 3.98Å; I622-V638 HydrophobicContact CD1-CG2 4.42Å; I622-V638 HydrophobicContact CG1-CG1 3.99Å; I622-V638 HydrophobicContact CG1-CG2 4.39Å; I622-V638 HydrophobicContact CG2-CG1 4.17Å; I622-D642 HydrophobicContact CD1-CB 3.83Å; I622-V643 HydrophobicContact CG2-CB 4.36Å; I622-V643 HydrophobicContact CG2-CG2 3.82Å; I622-A646 HydrophobicContact CB-CB 4.13Å; I622-A646 HydrophobicContact CG2-CB 3.89Å
623	Y	83.1	Confident	79.4	Confident	2 Å²	2	49 Å²	49	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-58.3	-47.3	174.7	175.4	-107.1	0	0	0	112.7	S619 F620 I621 E647 F650 R709 F712	S619-Y623 WeakPolarHBondContact O-CB 3.25Å; S619-Y623 PolarHBondContact O-N 3.01Å; F620-Y623 PolarHBondContact O-N 3.12Å; I621-Y623 PolarHBondContact O-N 2.98Å; Y623-E647 VanDerWaalsContact CD2-OE2 3.23Å; Y623-E647 WeakPolarHBondContact CD2-OE2 3.13Å; Y623-E647 WeakPolarHBondContact CE2-OE1 3.49Å; Y623-E647 VanDerWaalsContact CE2-OE2 3.27Å; Y623-E647 WeakPolarHBondContact CE2-OE2 3.39Å; Y623-F650 HydrophobicContact CD1-CB 3.44Å; Y623-F650 VanDerWaalsContact CD1-CB 3.44Å; Y623-F650 HydrophobicContact CD1-CG 4.21Å; Y623-F650 HydrophobicContact CD2-CB 3.72Å; Y623-F650 HydrophobicContact CE1-CB 3.77Å; Y623-F650 HydrophobicContact CE2-CB 4.03Å; Y623-F650 HydrophobicContact CG-CB 3.4Å; Y623-F650 VanDerWaalsContact CG-CB 3.4Å; Y623-F650 HydrophobicContact CG-CG 4.27Å; Y623-F650 PolarHBondContact OH-O 2.95Å; Y623-R709 HydrophobicContact CD1-CG 4.46Å; Y623-R709 HydrophobicContact CE1-CG 3.82Å; Y623-R709 HydrophobicContact CE2-CG 3.93Å; Y623-R709 WeakPolarHBondContact O-CD 3.2Å; Y623-F712 HydrophobicContact CE1-CD2 4.19Å; Y623-F712 AromaticContact CE1-CE2 3.91Å; Y623-F712 HydrophobicContact CE1-CE2 3.91Å
624	R	77.4	Confident	79.7	Confident	23 Å²	23	46.8 Å²	46.8	9%	0.087	24%	0.242	C	C	.	.	H	α-helix	trans	-76.7	-31.2	-172.2	-174.6	61	-170.3	91.5	-7.8	113.7	A591 A594 F620 I621 I622 H627 R709	A591-R624 HydrophobicContact CB-CG 3.95Å; A594-R624 VanDerWaalsContact CB-CZ 3.42Å; A594-R624 VanDerWaalsContact CB-NH1 3.33Å; F620-R624 VanDerWaalsContact O-CB 3.27Å; F620-R624 WeakPolarHBondContact O-CB 3.33Å; F620-R624 PolarHBondContact O-N 2.92Å; I621-R624 PolarHBondContact O-N 2.83Å; I622-R624 PolarHBondContact O-N 3.46Å; R624-H627 PolarHBondContact O-CE1 2.8Å; R624-H627 VanDerWaalsContact O-CE1 3.26Å; R624-H627 PolarHBondContact O-ND1 2.87Å; R624-R709 VanDerWaalsContact CD-O 3.26Å; R624-R709 WeakPolarHBondContact CD-O 3.47Å; R624-R709 VanDerWaalsContact CZ-O 3.28Å; R624-R709 PolarHBondContact NE-O 2.79Å
625	L	75.3	Confident	79.5	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-104.5	0.8	-177.7	-57.3	-171.2	0	0	0	113.9	L593 A594 L602 I621 H627 F628 L630	L593-L625 HydrophobicContact CB-CD1 4.18Å; L593-L625 HydrophobicContact CB-CD2 4.42Å; A594-L625 HydrophobicContact CB-CD2 3.74Å; L602-L625 HydrophobicContact CD2-CD1 4.43Å; I621-L625 HydrophobicContact CG2-CD1 3.79Å; I621-L625 HydrophobicContact CG2-CG 4.2Å; I621-L625 WeakPolarHBondContact O-CB 3.28Å; I621-L625 PolarHBondContact O-N 2.82Å; L625-H627 PolarHBondContact O-N 2.87Å; L625-F628 HydrophobicContact CD2-CD2 4.37Å; L625-F628 PolarHBondContact O-N 3.24Å; L625-L630 HydrophobicContact CB-CD2 4.33Å; L625-L630 HydrophobicContact CD1-CD2 4.03Å
626	Y	69.6	Low	79.8	Confident	87 Å²	87	47.1 Å²	47.1	34%	0.341	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-41	-48.9	-179.9	176.2	-126.7	0	0	0	114	I622 F628 N629 V643	I622-Y626 WeakPolarHBondContact O-CA 3.42Å; I622-Y626 WeakPolarHBondContact O-CB 3.24Å; I622-Y626 PolarHBondContact O-N 3.25Å; Y626-F628 PolarHBondContact O-N 3.12Å; Y626-N629 PolarHBondContact O-N 3.24Å; Y626-V643 HydrophobicContact CD2-CG1 3.67Å; Y626-V643 HydrophobicContact CD2-CG2 4.09Å; Y626-V643 HydrophobicContact CE2-CG1 3.51Å; Y626-V643 HydrophobicContact CE2-CG2 4.21Å; Y626-V643 HydrophobicContact CG-CG1 4.39Å
627	H	65.2	Low	79.9	Confident	98 Å²	98	48.8 Å²	48.8	45%	0.454	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-58.5	-2	176.9	67.5	-44	0	0	0	117.4	R624 L625	R624-H627 PolarHBondContact O-CE1 2.8Å; R624-H627 VanDerWaalsContact O-CE1 3.26Å; R624-H627 PolarHBondContact O-ND1 2.87Å; L625-H627 PolarHBondContact O-N 2.87Å
628	F	66.8	Low	79.9	Confident	36 Å²	36	49.1 Å²	49.1	16%	0.158	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-111.9	5.3	173.4	-61.4	-44.9	0	0	0	114.5	A594 R597 L625 Y626 L630	A594-F628 WeakPolarHBondContact O-CE2 3.49Å; R597-F628 HydrophobicContact CB-CE1 3.97Å; R597-F628 HydrophobicContact CB-CZ 4.24Å; R597-F628 HydrophobicContact CG-CE1 3.96Å; R597-F628 HydrophobicContact CG-CZ 3.92Å; L625-F628 HydrophobicContact CD2-CD2 4.37Å; L625-F628 PolarHBondContact O-N 3.24Å; Y626-F628 PolarHBondContact O-N 3.12Å; F628-L630 VanDerWaalsContact C-N 3.29Å; F628-L630 PolarHBondContact O-N 2.95Å
629	N	69.2	Low	79.9	Confident	127 Å²	127	50.4 Å²	50.4	68%	0.679	26%	0.262	S	S	*	.			trans	55	39.3	178.3	-60.6	-17.8	0	0	0	114	Y626 Q631	Y626-N629 PolarHBondContact O-N 3.24Å; N629-Q631 WeakPolarHBondContact O-CG 3.43Å; N629-Q631 PolarHBondContact O-N 2.95Å; N629-Q631 VanDerWaalsContact O-N 3.1Å
630	L	80.6	Confident	79.9	Confident	13 Å²	13	54.3 Å²	54.3	7%	0.068	28%	0.278	C	S	.	.			trans	-54.7	112	179	-177.5	65	0	0	0	110.9	L599 L602 I621 L625 F628 I633 V638	L599-L630 HydrophobicContact CD2-CD1 4.41Å; L599-L630 HydrophobicContact CG-CD1 4.34Å; L599-L630 WeakPolarHBondContact O-CD1 3.4Å; L602-L630 HydrophobicContact CB-CD1 4.05Å; L602-L630 HydrophobicContact CB-CD2 4.41Å; I621-L630 HydrophobicContact CG2-CD2 3.83Å; L625-L630 HydrophobicContact CB-CD2 4.33Å; L625-L630 HydrophobicContact CD1-CD2 4.03Å; F628-L630 VanDerWaalsContact C-N 3.29Å; F628-L630 PolarHBondContact O-N 2.95Å; L630-I633 HydrophobicContact CD2-CD1 3.82Å; L630-I633 HydrophobicContact CD2-CG1 3.69Å; L630-I633 HydrophobicContact CG-CG1 4.12Å; L630-V638 WeakPolarHBondContact O-CB 3.39Å; L630-V638 WeakPolarHBondContact O-CG2 3.27Å
631	Q	82.6	Confident	79.9	Confident	109 Å²	109	60 Å²	60	51%	0.509	31%	0.308	S	S	.	.			trans	-84.9	-38.3	-168.1	-54.2	-178.8	22.3	0	0	112.7	D600 N629 E637 V638	D600-Q631 WeakPolarHBondContact O-CB 3.21Å; D600-Q631 PolarHBondContact O-N 3.02Å; N629-Q631 WeakPolarHBondContact O-CG 3.43Å; N629-Q631 PolarHBondContact O-N 2.95Å; N629-Q631 VanDerWaalsContact O-N 3.1Å; Q631-E637 CarbonylContact O-C 3.54Å; Q631-E637 WeakPolarHBondContact O-CA 3.44Å; Q631-V638 PolarHBondContact O-N 3.05Å
632	K	85.1	Confident	79.9	Confident	58 Å²	58	62.1 Å²	62.1	25%	0.252	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136.1	-178	-47.3	-161.8	-171.5	-145	0	112.2	D600 Q601 L602 Q636 E637	D600-K632 PolarHBondContact O-N 3.08Å; Q601-K632 WeakPolarHBondContact CA-O 3.4Å; Q601-K632 HydrophobicContact CG-CB 4.13Å; Q601-K632 HydrophobicContact CG-CG 4.39Å; L602-K632 PolarHBondContact N-O 3.19Å; K632-Q636 WeakPolarHBondContact CA-O 3.48Å; K632-E637 HydrophobicContact CD-CG 4.17Å; K632-E637 WeakPolarHBondContact CE-OE1 3.23Å; K632-E637 HydrophobicContact CG-CG 4.3Å; K632-E637 IonicContact NZ-OE1 3.54Å; K632-E637 PolarHBondContact NZ-OE1 3.13Å
633	I	85.7	Confident	79.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	121.4	172.6	-59.9	171.6	0	0	0	107.9	L602 W617 R618 I621 I622 L630 G635 Q636 V638	L602-I633 CarbonylContact O-C 3.6Å; L602-I633 VanDerWaalsContact O-CA 3.29Å; L602-I633 WeakPolarHBondContact O-CA 3.23Å; W617-I633 HydrophobicContact CH2-CG2 3.69Å; W617-I633 HydrophobicContact CZ3-CG2 3.8Å; R618-I633 HydrophobicContact CG-CD1 4.44Å; I621-I633 HydrophobicContact CB-CD1 4.43Å; I621-I633 HydrophobicContact CG2-CD1 3.9Å; I622-I633 HydrophobicContact CD1-CD1 4.11Å; I622-I633 HydrophobicContact CG1-CD1 3.53Å; L630-I633 HydrophobicContact CD2-CD1 3.82Å; L630-I633 HydrophobicContact CD2-CG1 3.69Å; L630-I633 HydrophobicContact CG-CG1 4.12Å; I633-G635 PolarHBondContact O-N 3.43Å; I633-Q636 PolarHBondContact N-O 2.86Å; I633-Q636 WeakPolarHBondContact O-CB 3.29Å; I633-Q636 PolarHBondContact O-N 3.14Å; I633-V638 HydrophobicContact CD1-CG2 3.79Å; I633-V638 HydrophobicContact CG1-CG2 3.8Å
634	N	83.6	Confident	79.7	Confident	53 Å²	53	67.7 Å²	67.7	28%	0.283	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	40.2	-175.8	-70.6	17.8	0	0	0	113.2	L602 T603 I604 Q636	L602-N634 PolarHBondContact O-N 2.75Å; T603-N634 WeakPolarHBondContact CA-OD1 3.49Å; I604-N634 PolarHBondContact N-OD1 3.03Å; I604-N634 PolarHBondContact O-ND2 3.31Å; I604-N634 PolarHBondContact O-OD1 2.92Å; N634-Q636 PolarHBondContact O-N 3.1Å; N634-Q636 VanDerWaalsContact O-N 3.12Å
635	G	77.3	Confident	80	Confident	57 Å²	57	69 Å²	69	59%	0.588	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	-15.1	-177.3	0	0	0	0	0	115.4	I633	I633-G635 PolarHBondContact O-N 3.43Å
636	Q	83.6	Confident	80.4	Confident	119 Å²	119	68.8 Å²	68.8	56%	0.556	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	128	172.6	-66.8	176.2	-12.2	0	0	110.5	R618 K632 I633 N634	R618-Q636 VanDerWaalsContact NH1-CB 3.34Å; R618-Q636 PolarHBondContact NH1-O 3.09Å; K632-Q636 WeakPolarHBondContact CA-O 3.48Å; I633-Q636 PolarHBondContact N-O 2.86Å; I633-Q636 WeakPolarHBondContact O-CB 3.29Å; I633-Q636 PolarHBondContact O-N 3.14Å; N634-Q636 PolarHBondContact O-N 3.1Å; N634-Q636 VanDerWaalsContact O-N 3.12Å
637	E	85.5	Confident	80.9	Confident	123 Å²	123	67.5 Å²	67.5	58%	0.575	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65	151.1	177.2	-51.4	-166	150.6	0	0	111.4	R618 Q631 K632	R618-E637 PolarHBondContact NH2-O 3.4Å; Q631-E637 CarbonylContact O-C 3.54Å; Q631-E637 WeakPolarHBondContact O-CA 3.44Å; K632-E637 HydrophobicContact CD-CG 4.17Å; K632-E637 WeakPolarHBondContact CE-OE1 3.23Å; K632-E637 HydrophobicContact CG-CG 4.3Å; K632-E637 IonicContact NZ-OE1 3.54Å; K632-E637 PolarHBondContact NZ-OE1 3.13Å
638	V	86	Confident	81.6	Confident	34 Å²	34	72.8 Å²	72.8	21%	0.206	38%	0.377	C	S	.	.			trans	-98.5	110.4	178.7	178.7	0	0	0	0	108.6	I622 L630 Q631 I633 V643	I622-V638 HydrophobicContact CD1-CG1 3.98Å; I622-V638 HydrophobicContact CD1-CG2 4.42Å; I622-V638 HydrophobicContact CG1-CG1 3.99Å; I622-V638 HydrophobicContact CG1-CG2 4.39Å; I622-V638 HydrophobicContact CG2-CG1 4.17Å; L630-V638 WeakPolarHBondContact O-CB 3.39Å; L630-V638 WeakPolarHBondContact O-CG2 3.27Å; Q631-V638 PolarHBondContact O-N 3.05Å; I633-V638 HydrophobicContact CD1-CG2 3.79Å; I633-V638 HydrophobicContact CG1-CG2 3.8Å; V638-V643 HydrophobicContact CG1-CG2 4.23Å
639	T	86.2	Confident	82.1	Confident	64 Å²	64	74.5 Å²	74.5	39%	0.393	39%	0.39	S	S	.	.			trans	-88	157.9	-179.3	71	0	0	0	0	111.5	N641 D642 V643	T639-N641 PolarHBondContact O-N 3.41Å; T639-N641 PolarHBondContact OG1-N 3.39Å; T639-D642 WeakPolarHBondContact CB-OD2 3.44Å; T639-D642 PolarHBondContact N-OD2 3Å; T639-D642 WeakPolarHBondContact O-CB 3.42Å; T639-D642 PolarHBondContact O-N 3.39Å; T639-D642 VanDerWaalsContact OG1-CG 3.25Å; T639-D642 PolarHBondContact OG1-N 3.11Å; T639-D642 VanDerWaalsContact OG1-N 3.13Å; T639-D642 PolarHBondContact OG1-OD2 2.87Å; T639-V643 PolarHBondContact O-N 3.08Å; T639-V643 VanDerWaalsContact O-N 3.14Å
640	M	81.9	Confident	82.5	Confident	117 Å²	117	69 Å²	69	58%	0.576	36%	0.361	S	S	*	.	H	α-helix	trans	-60	-27.2	171.5	-170.9	60.7	72.4	0	0	112.1	V643 I644	M640-V643 PolarHBondContact O-N 3.26Å; M640-V643 HydrophobicContact SD-CB 4.29Å; M640-V643 HydrophobicContact SD-CG1 4.35Å; M640-I644 HydrophobicContact CG-CD1 4.1Å; M640-I644 WeakPolarHBondContact O-CD1 3.23Å; M640-I644 VanDerWaalsContact O-CG1 3.27Å; M640-I644 WeakPolarHBondContact O-CG1 3.39Å; M640-I644 PolarHBondContact O-N 3.08Å
641	N	83.8	Confident	82.2	Confident	126 Å²	126	69 Å²	69	67%	0.674	36%	0.364	S	S	*	.	H	α-helix	trans	-68.1	-39.5	174	-65.6	-21.7	0	0	0	111.7	T639 V643 I644 A645	T639-N641 PolarHBondContact O-N 3.41Å; T639-N641 PolarHBondContact OG1-N 3.39Å; N641-V643 VanDerWaalsContact C-N 3.33Å; N641-I644 PolarHBondContact O-N 3.37Å; N641-A645 WeakPolarHBondContact O-CB 3.35Å; N641-A645 PolarHBondContact O-N 3.39Å
642	D	84.3	Confident	81.6	Confident	48 Å²	48	67.9 Å²	67.9	26%	0.257	36%	0.364	S	S	.	.	H	α-helix	trans	-63.3	-40.1	173.6	-59.8	-66.9	0	0	0	111.3	R618 I622 T639 A645 A646	R618-D642 IonicContact NH2-OD1 2.7Å; R618-D642 IonicContact NH2-OD2 2.74Å; R618-D642 PolarHBondContact NH2-OD2 3.22Å; I622-D642 HydrophobicContact CD1-CB 3.83Å; T639-D642 WeakPolarHBondContact CB-OD2 3.44Å; T639-D642 PolarHBondContact N-OD2 3Å; T639-D642 WeakPolarHBondContact O-CB 3.42Å; T639-D642 PolarHBondContact O-N 3.39Å; T639-D642 VanDerWaalsContact OG1-CG 3.25Å; T639-D642 PolarHBondContact OG1-N 3.11Å; T639-D642 VanDerWaalsContact OG1-N 3.13Å; T639-D642 PolarHBondContact OG1-OD2 2.87Å; D642-A645 PolarHBondContact O-N 3.07Å; D642-A646 VanDerWaalsContact O-CB 3.25Å; D642-A646 WeakPolarHBondContact O-CB 3.43Å; D642-A646 PolarHBondContact O-N 3.23Å
643	V	82.6	Confident	80.8	Confident	20 Å²	20	69.1 Å²	69.1	12%	0.121	37%	0.373	C	S	.	.	H	α-helix	trans	-60.8	-49.1	175	173.5	0	0	0	0	111	I622 Y626 V638 T639 M640 N641 A645 A646 E647	I622-V643 HydrophobicContact CG2-CB 4.36Å; I622-V643 HydrophobicContact CG2-CG2 3.82Å; Y626-V643 HydrophobicContact CD2-CG1 3.67Å; Y626-V643 HydrophobicContact CD2-CG2 4.09Å; Y626-V643 HydrophobicContact CE2-CG1 3.51Å; Y626-V643 HydrophobicContact CE2-CG2 4.21Å; Y626-V643 HydrophobicContact CG-CG1 4.39Å; V638-V643 HydrophobicContact CG1-CG2 4.23Å; T639-V643 PolarHBondContact O-N 3.08Å; T639-V643 VanDerWaalsContact O-N 3.14Å; M640-V643 PolarHBondContact O-N 3.26Å; M640-V643 HydrophobicContact SD-CB 4.29Å; M640-V643 HydrophobicContact SD-CG1 4.35Å; N641-V643 VanDerWaalsContact C-N 3.33Å; V643-A645 VanDerWaalsContact C-N 3.33Å; V643-A645 PolarHBondContact O-N 2.9Å; V643-A646 PolarHBondContact O-N 3.3Å; V643-E647 WeakPolarHBondContact O-CB 3.49Å; V643-E647 PolarHBondContact O-N 2.9Å
644	I	81.9	Confident	79.9	Confident	104 Å²	104	69 Å²	69	53%	0.533	37%	0.373	S	S	.	.	H	α-helix	trans	-63.7	-39	179.1	-67.8	163.2	0	0	0	111.1	M640 N641 R648	M640-I644 HydrophobicContact CG-CD1 4.1Å; M640-I644 WeakPolarHBondContact O-CD1 3.23Å; M640-I644 VanDerWaalsContact O-CG1 3.27Å; M640-I644 WeakPolarHBondContact O-CG1 3.39Å; M640-I644 PolarHBondContact O-N 3.08Å; N641-I644 PolarHBondContact O-N 3.37Å; I644-R648 WeakPolarHBondContact O-CB 3.43Å; I644-R648 PolarHBondContact O-N 3.15Å
645	A	82.4	Confident	78.9	Confident	51 Å²	51	72.2 Å²	72.2	42%	0.421	39%	0.386	S	S	.	.	H	α-helix	trans	-65.8	-43.3	175	0	0	0	0	0	112.2	N641 D642 V643 R648 V649	N641-A645 WeakPolarHBondContact O-CB 3.35Å; N641-A645 PolarHBondContact O-N 3.39Å; D642-A645 PolarHBondContact O-N 3.07Å; V643-A645 VanDerWaalsContact C-N 3.33Å; V643-A645 PolarHBondContact O-N 2.9Å; A645-R648 PolarHBondContact O-N 3.49Å; A645-V649 WeakPolarHBondContact O-CG2 3.22Å; A645-V649 PolarHBondContact O-N 3.03Å
646	A	84.4	Confident	78.3	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-63.4	-44.5	176.3	0	0	0	0	0	112.2	S619 I622 D642 V643 V649 F650	S619-A646 WeakPolarHBondContact O-CB 3.32Å; I622-A646 HydrophobicContact CB-CB 4.13Å; I622-A646 HydrophobicContact CG2-CB 3.89Å; D642-A646 VanDerWaalsContact O-CB 3.25Å; D642-A646 WeakPolarHBondContact O-CB 3.43Å; D642-A646 PolarHBondContact O-N 3.23Å; V643-A646 PolarHBondContact O-N 3.3Å; A646-V649 PolarHBondContact O-N 3.07Å; A646-F650 PolarHBondContact O-N 3.49Å
647	E	81.1	Confident	77.4	Confident	60 Å²	60	69.1 Å²	69.1	28%	0.28	36%	0.362	S	S	.	.	H	α-helix	trans	-65.5	-37.5	177.3	-166.5	62.5	-141.8	0	0	111.8	Y623 V643 V649 G651 R709	Y623-E647 VanDerWaalsContact CD2-OE2 3.23Å; Y623-E647 WeakPolarHBondContact CD2-OE2 3.13Å; Y623-E647 WeakPolarHBondContact CE2-OE1 3.49Å; Y623-E647 VanDerWaalsContact CE2-OE2 3.27Å; Y623-E647 WeakPolarHBondContact CE2-OE2 3.39Å; V643-E647 WeakPolarHBondContact O-CB 3.49Å; V643-E647 PolarHBondContact O-N 2.9Å; E647-V649 VanDerWaalsContact C-N 3.32Å; E647-V649 PolarHBondContact O-N 3.44Å; E647-G651 WeakPolarHBondContact O-CA 3.13Å; E647-G651 PolarHBondContact O-N 2.88Å; E647-G651 WeakPolarHBondContact OE1-CA 3.36Å; E647-R709 IonicContact OE1-NH2 3.28Å; E647-R709 IonicContact OE2-CZ 3.16Å; E647-R709 IonicContact OE2-NE 3.21Å; E647-R709 IonicContact OE2-NH2 2.88Å; E647-R709 PolarHBondContact OE2-NH2 3.36Å
648	R	79.3	Confident	76.2	Confident	208 Å²	208	64.6 Å²	64.6	79%	0.785	35%	0.346	S	S	*	.	H	α-helix	trans	-61.4	-38.8	175.6	-174.4	176.6	-179.8	179.4	0.1	112.7	I644 A645 T652	I644-R648 WeakPolarHBondContact O-CB 3.43Å; I644-R648 PolarHBondContact O-N 3.15Å; A645-R648 PolarHBondContact O-N 3.49Å; R648-T652 PolarHBondContact O-OG1 3.38Å; R648-T652 VanDerWaalsContact O-OG1 3.1Å
649	V	76.6	Confident	74.9	Confident	72 Å²	72	66.9 Å²	66.9	44%	0.436	36%	0.36	S	S	.	.	H	α-helix	trans	-78.1	-54.4	178.7	175.1	0	0	0	0	111.2	A645 A646 E647	A645-V649 WeakPolarHBondContact O-CG2 3.22Å; A645-V649 PolarHBondContact O-N 3.03Å; A646-V649 PolarHBondContact O-N 3.07Å; E647-V649 VanDerWaalsContact C-N 3.32Å; E647-V649 PolarHBondContact O-N 3.44Å
650	F	79	Confident	73.6	Confident	12 Å²	12	69.9 Å²	69.9	5%	0.053	37%	0.369	C	S	.	.	H	α-helix	trans	-95.5	-21.7	-168.8	-70	-70.8	0	0	0	114.8	L616 F620 Y623 A646 L653 G654	L616-F650 HydrophobicContact CB-CE2 4.49Å; L616-F650 HydrophobicContact CB-CZ 4.06Å; L616-F650 HydrophobicContact CD1-CZ 4.44Å; F620-F650 HydrophobicContact CB-CE1 4.42Å; F620-F650 HydrophobicContact CB-CE2 3.89Å; F620-F650 HydrophobicContact CB-CZ 3.79Å; F620-F650 HydrophobicContact CD2-CD1 4.03Å; F620-F650 AromaticContact CD2-CE1 3.74Å; F620-F650 HydrophobicContact CD2-CE1 3.74Å; F620-F650 HydrophobicContact CD2-CE2 4.48Å; F620-F650 AromaticContact CD2-CZ 3.98Å; F620-F650 HydrophobicContact CD2-CZ 3.98Å; F620-F650 HydrophobicContact CG-CZ 4.38Å; Y623-F650 HydrophobicContact CD1-CB 3.44Å; Y623-F650 VanDerWaalsContact CD1-CB 3.44Å; Y623-F650 HydrophobicContact CD1-CG 4.21Å; Y623-F650 HydrophobicContact CD2-CB 3.72Å; Y623-F650 HydrophobicContact CE1-CB 3.77Å; Y623-F650 HydrophobicContact CE2-CB 4.03Å; Y623-F650 HydrophobicContact CG-CB 3.4Å; Y623-F650 VanDerWaalsContact CG-CB 3.4Å; Y623-F650 HydrophobicContact CG-CG 4.27Å; Y623-F650 PolarHBondContact OH-O 2.95Å; A646-F650 PolarHBondContact O-N 3.49Å; F650-L653 HydrophobicContact CD1-CD2 4.01Å; F650-L653 HydrophobicContact CE1-CD2 4.35Å; F650-L653 PolarHBondContact O-N 2.96Å; F650-G654 PolarHBondContact O-N 2.87Å
651	G	73.7	Confident	72.5	Confident	13 Å²	13	66 Å²	66	13%	0.134	35%	0.353	C	S	.	.	H	α-helix	trans	-63	-42.7	172.4	0	0	0	0	0	111.7	E647 G654 H655	E647-G651 WeakPolarHBondContact O-CA 3.13Å; E647-G651 PolarHBondContact O-N 2.88Å; E647-G651 WeakPolarHBondContact OE1-CA 3.36Å; G651-G654 PolarHBondContact O-N 3.21Å; G651-H655 WeakPolarHBondContact O-CB 3.31Å; G651-H655 PolarHBondContact O-N 2.74Å
652	T	69.5	Low	71.2	Confident	85 Å²	85	62.9 Å²	62.9	52%	0.521	34%	0.339	S	S	.	.	H	α-helix	trans	-59.1	-48.8	172.2	-48.2	0	0	0	0	111.3	R648 G654 H655 I656	R648-T652 PolarHBondContact O-OG1 3.38Å; R648-T652 VanDerWaalsContact O-OG1 3.1Å; T652-G654 PolarHBondContact O-N 2.83Å; T652-H655 PolarHBondContact O-N 2.91Å; T652-I656 HydrophobicContact CG2-CD1 4.23Å; T652-I656 WeakPolarHBondContact O-CG1 3.46Å; T652-I656 PolarHBondContact O-N 3.14Å
653	L	68.5	Low	69.8	Low	84 Å²	84	69.4 Å²	69.4	44%	0.44	36%	0.36	S	S	.	.	H	α-helix	trans	-62.8	-41.7	177.8	-174.2	68.3	0	0	0	112.2	F650 H655 I656 A657 F712	F650-L653 HydrophobicContact CD1-CD2 4.01Å; F650-L653 HydrophobicContact CE1-CD2 4.35Å; F650-L653 PolarHBondContact O-N 2.96Å; L653-H655 VanDerWaalsContact C-N 3.32Å; L653-H655 PolarHBondContact O-N 3.02Å; L653-I656 PolarHBondContact O-N 3.09Å; L653-A657 VanDerWaalsContact O-CB 3.3Å; L653-A657 WeakPolarHBondContact O-CB 3.14Å; L653-A657 PolarHBondContact O-N 3.1Å; L653-F712 HydrophobicContact CD2-CE1 4.07Å; L653-F712 HydrophobicContact CD2-CZ 4.03Å; L653-F712 HydrophobicContact CG-CE1 4.47Å; L653-F712 HydrophobicContact CG-CZ 4.09Å
654	G	67.1	Low	68.2	Low	0 Å²	0	72.9 Å²	72.9	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-69.2	-26.6	177.3	0	0	0	0	0	113.6	F650 G651 T652 A658 S708	F650-G654 PolarHBondContact O-N 2.87Å; G651-G654 PolarHBondContact O-N 3.21Å; T652-G654 PolarHBondContact O-N 2.83Å; G654-A658 WeakPolarHBondContact O-CB 3.23Å; G654-A658 PolarHBondContact O-N 2.83Å; G654-S708 WeakPolarHBondContact O-CB 3.4Å
655	H	62.3	Low	66.9	Low	119 Å²	119	75.2 Å²	75.2	55%	0.551	39%	0.386	S	S	*	.	H	α-helix	trans	-72.8	-47.4	171.3	-171	54.7	0	0	0	111.3	G651 T652 L653 A657 A658 T659	G651-H655 WeakPolarHBondContact O-CB 3.31Å; G651-H655 PolarHBondContact O-N 2.74Å; T652-H655 PolarHBondContact O-N 2.91Å; L653-H655 VanDerWaalsContact C-N 3.32Å; L653-H655 PolarHBondContact O-N 3.02Å; H655-A657 PolarHBondContact O-N 2.83Å; H655-A658 WeakPolarHBondContact O-CA 3.22Å; H655-A658 WeakPolarHBondContact O-CB 3.23Å; H655-A658 PolarHBondContact O-N 2.91Å; H655-T659 PolarHBondContact O-N 2.99Å
656	I	63.8	Low	65.7	Low	86 Å²	86	74 Å²	74	44%	0.441	37%	0.373	S	S	.	.	H	α-helix	trans	-60.7	-45	175.1	-64.7	165.2	0	0	0	110.4	T652 L653 A658 T659 E660	T652-I656 HydrophobicContact CG2-CD1 4.23Å; T652-I656 WeakPolarHBondContact O-CG1 3.46Å; T652-I656 PolarHBondContact O-N 3.14Å; L653-I656 PolarHBondContact O-N 3.09Å; I656-A658 PolarHBondContact O-N 3.04Å; I656-T659 PolarHBondContact O-N 3.22Å; I656-T659 VanDerWaalsContact O-N 3.13Å; I656-T659 PolarHBondContact O-OG1 3.39Å; I656-E660 HydrophobicContact CG2-CG 4.1Å; I656-E660 WeakPolarHBondContact O-CG 3.48Å; I656-E660 PolarHBondContact O-N 3.08Å
657	A	64.9	Low	64.3	Low	25 Å²	25	76.8 Å²	76.8	21%	0.207	39%	0.387	C	S	.	.	H	α-helix	trans	-57.8	-34.3	174.2	0	0	0	0	0	112.1	L653 H655 T661 L711	L653-A657 VanDerWaalsContact O-CB 3.3Å; L653-A657 WeakPolarHBondContact O-CB 3.14Å; L653-A657 PolarHBondContact O-N 3.1Å; H655-A657 PolarHBondContact O-N 2.83Å; A657-T661 WeakPolarHBondContact O-CB 3.43Å; A657-T661 PolarHBondContact O-N 2.98Å; A657-T661 VanDerWaalsContact O-N 3.15Å; A657-T661 PolarHBondContact O-OG1 2.95Å; A657-L711 HydrophobicContact CB-CD1 3.94Å
658	A	61.1	Low	63	Low	28 Å²	28	79.9 Å²	79.9	23%	0.231	41%	0.405	C	S	.	.	H	α-helix	trans	-77.6	-25.7	178.1	0	0	0	0	0	114.1	G654 H655 I656 L711	G654-A658 WeakPolarHBondContact O-CB 3.23Å; G654-A658 PolarHBondContact O-N 2.83Å; H655-A658 WeakPolarHBondContact O-CA 3.22Å; H655-A658 WeakPolarHBondContact O-CB 3.23Å; H655-A658 PolarHBondContact O-N 2.91Å; I656-A658 PolarHBondContact O-N 3.04Å; A658-L711 HydrophobicContact CB-CD1 3.73Å
659	T	59.1	Low	61.8	Low	82 Å²	82	72.3 Å²	72.3	50%	0.503	38%	0.38	S	S	.	.	H	α-helix	trans	-80.8	-39.7	173.2	59.7	0	0	0	0	112.1	H655 I656	H655-T659 PolarHBondContact O-N 2.99Å; I656-T659 PolarHBondContact O-N 3.22Å; I656-T659 VanDerWaalsContact O-N 3.13Å; I656-T659 PolarHBondContact O-OG1 3.39Å
660	E	58.3	Low	60.8	Low	127 Å²	127	69.8 Å²	69.8	59%	0.593	36%	0.364	S	S	*	.	H	α-helix	trans	-86.3	-17.3	-174.6	-55.5	-43.9	111.7	0	0	114.2	I656 P662	I656-E660 HydrophobicContact CG2-CG 4.1Å; I656-E660 WeakPolarHBondContact O-CG 3.48Å; I656-E660 PolarHBondContact O-N 3.08Å; E660-P662 WeakPolarHBondContact O-CD 3.46Å
661	T	59	Low	59.6	Low	36 Å²	36	74.1 Å²	74.1	22%	0.221	38%	0.384	C	S	.	.	S	Bend	trans	-74.7	126.4	-179.3	-65.3	0	0	0	0	112	A657 R663 R665 L666 L711	A657-T661 WeakPolarHBondContact O-CB 3.43Å; A657-T661 PolarHBondContact O-N 2.98Å; A657-T661 VanDerWaalsContact O-N 3.15Å; A657-T661 PolarHBondContact O-OG1 2.95Å; T661-R663 PolarHBondContact O-N 2.75Å; T661-R665 HydrophobicContact CG2-CB 4.05Å; T661-R665 HydrophobicContact CG2-CG 4.42Å; T661-L666 HydrophobicContact CG2-CD1 4.36Å; T661-L666 HydrophobicContact CG2-CG 3.95Å; T661-L711 HydrophobicContact CG2-CD2 4.14Å
662	P	56.8	Low	58.3	Low	61 Å²	61	79.3 Å²	79.3	40%	0.396	41%	0.405	S	S	.	.			trans	-58	137.8	176.1	-27.5	36.2	0	0	0	113.8	E660 C664 R665 L666	E660-P662 WeakPolarHBondContact O-CD 3.46Å; P662-C664 PolarHBondContact O-N 2.79Å; P662-C664 VanDerWaalsContact O-N 3.1Å; P662-R665 WeakPolarHBondContact O-CB 3.08Å; P662-R665 PolarHBondContact O-N 3.17Å; P662-L666 PolarHBondContact O-N 3.19Å; P662-L666 VanDerWaalsContact O-N 3.13Å
663	R	53.4	Low	57	Low	185 Å²	185	78.7 Å²	78.7	70%	0.698	40%	0.404	S	S	*	.	H	α-helix	trans	-51.6	-37.9	-175.3	-64.3	-179.6	-178.9	172	0.3	114.1	T661 L666 L667	T661-R663 PolarHBondContact O-N 2.75Å; R663-L666 WeakPolarHBondContact O-CB 3.46Å; R663-L666 PolarHBondContact O-N 3.44Å; R663-L667 PolarHBondContact O-N 3.19Å; R663-L667 VanDerWaalsContact O-N 3.15Å
664	C	49.6	Very low	56.2	Low	92 Å²	92	79.8 Å²	79.8	62%	0.622	40%	0.403	S	S	*	.	H	α-helix	trans	-65.2	-35.9	176.9	53.2	0	0	0	0	113	P662 L668	P662-C664 PolarHBondContact O-N 2.79Å; P662-C664 VanDerWaalsContact O-N 3.1Å; C664-L668 WeakPolarHBondContact O-CG 3.19Å; C664-L668 PolarHBondContact O-N 3.24Å
665	R	54.1	Low	55.5	Low	153 Å²	153	83.8 Å²	83.8	58%	0.577	42%	0.42	S	S	*	.	H	α-helix	trans	-76	-36.8	177.6	-164.7	62.4	168.3	-177.3	-1.5	111.5	T661 P662 L667 L668 L669	T661-R665 HydrophobicContact CG2-CB 4.05Å; T661-R665 HydrophobicContact CG2-CG 4.42Å; P662-R665 WeakPolarHBondContact O-CB 3.08Å; P662-R665 PolarHBondContact O-N 3.17Å; R665-L667 VanDerWaalsContact C-N 3.33Å; R665-L667 PolarHBondContact O-N 2.9Å; R665-L668 PolarHBondContact O-N 2.95Å; R665-L668 VanDerWaalsContact O-N 3.11Å; R665-L669 HydrophobicContact CG-CD1 4.26Å; R665-L669 WeakPolarHBondContact O-CG 3.29Å; R665-L669 PolarHBondContact O-N 3.48Å
666	L	57.6	Low	54.8	Low	27 Å²	27	86.2 Å²	86.2	14%	0.141	42%	0.424	C	S	.	.	H	α-helix	trans	-55.4	-44.6	170.4	-100.4	160.2	0	0	0	112.3	T661 P662 R663 L668 L669 L670 L707 L711	T661-L666 HydrophobicContact CG2-CD1 4.36Å; T661-L666 HydrophobicContact CG2-CG 3.95Å; P662-L666 PolarHBondContact O-N 3.19Å; P662-L666 VanDerWaalsContact O-N 3.13Å; R663-L666 WeakPolarHBondContact O-CB 3.46Å; R663-L666 PolarHBondContact O-N 3.44Å; L666-L668 PolarHBondContact O-N 3.46Å; L666-L669 PolarHBondContact O-N 3.27Å; L666-L670 WeakPolarHBondContact O-CG 3.35Å; L666-L707 HydrophobicContact CD2-CD2 3.77Å; L666-L707 HydrophobicContact CD2-CG 4.48Å; L666-L711 HydrophobicContact CD2-CD2 3.77Å; L666-L711 HydrophobicContact CG-CD2 4.17Å
667	L	54.9	Low	54	Low	57 Å²	57	88.5 Å²	88.5	30%	0.298	43%	0.433	S	S	.	.	H	α-helix	trans	-66.1	-21	176.8	-78.3	163.3	0	0	0	114.5	R663 R665 L678	R663-L667 PolarHBondContact O-N 3.19Å; R663-L667 VanDerWaalsContact O-N 3.15Å; R665-L667 VanDerWaalsContact C-N 3.33Å; R665-L667 PolarHBondContact O-N 2.9Å; L667-L678 HydrophobicContact CD2-CD2 3.81Å; L667-L678 HydrophobicContact CD2-CG 4.38Å
668	L	53.9	Low	53.4	Low	126 Å²	126	88.7 Å²	88.7	66%	0.66	43%	0.43	S	S	*	.	H	α-helix	trans	-89	-18.2	175.6	-67.9	169.8	0	0	0	113.3	C664 R665 L666	C664-L668 WeakPolarHBondContact O-CG 3.19Å; C664-L668 PolarHBondContact O-N 3.24Å; R665-L668 PolarHBondContact O-N 2.95Å; R665-L668 VanDerWaalsContact O-N 3.11Å; L666-L668 PolarHBondContact O-N 3.46Å
669	L	54.6	Low	53	Low	49 Å²	49	91.2 Å²	91.2	26%	0.257	44%	0.437	S	S	.	.	H	α-helix	trans	-93.9	-4.8	-178.8	-69.9	168.7	0	0	0	113.6	R665 L666 L711	R665-L669 HydrophobicContact CG-CD1 4.26Å; R665-L669 WeakPolarHBondContact O-CG 3.29Å; R665-L669 PolarHBondContact O-N 3.48Å; L666-L669 PolarHBondContact O-N 3.27Å; L669-L711 HydrophobicContact CD1-CD2 3.93Å
670	L	55.2	Low	52.5	Low	19 Å²	19	94.7 Å²	94.7	10%	0.099	45%	0.446	C	S	.	.	S	Bend	trans	-95.1	135	-179.1	-72.4	167.5	0	0	0	111.8	L666 R674 L678 L707	L666-L670 WeakPolarHBondContact O-CG 3.35Å; L670-R674 HydrophobicContact CB-CB 4.31Å; L670-R674 HydrophobicContact CD2-CB 4.24Å; L670-L678 HydrophobicContact CD1-CD2 3.61Å; L670-L707 HydrophobicContact CD2-CD1 4.34Å
671	E	53.6	Low	52.2	Low	103 Å²	103	93.8 Å²	93.8	48%	0.481	44%	0.444	S	S	.	.			trans	-51.8	146	168.6	-72.8	-175.1	149.9	0	0	111	R597 S673 R674 K675	R597-E671 IonicContact NH2-OE1 2.71Å; E671-S673 PolarHBondContact O-N 3.13Å; E671-S673 VanDerWaalsContact O-N 3.08Å; E671-R674 WeakPolarHBondContact O-CA 3.37Å; E671-R674 WeakPolarHBondContact O-CB 3.28Å; E671-R674 PolarHBondContact O-N 3.07Å; E671-K675 PolarHBondContact O-N 3.2Å
672	E	46.4	Very low	51.8	Low	122 Å²	122	98 Å²	98	57%	0.57	47%	0.465	S	S	*	.	H	α-helix	trans	-61.5	-26.4	-169.4	-164.6	169.1	-114.5	0	0	114.3	R676	E672-R676 WeakPolarHBondContact O-CG 3.5Å; E672-R676 PolarHBondContact O-N 2.88Å; E672-R676 VanDerWaalsContact O-N 3.12Å; E672-R676 IonicContact OE2-NH2 3.52Å
673	S	43.2	Very low	51.4	Low	72 Å²	72	101.6 Å²	101.6	50%	0.503	48%	0.476	S	S	.	.	H	α-helix	trans	-61.6	-46.6	169.2	52.7	0	0	0	0	112.5	E671 Q677	E671-S673 PolarHBondContact O-N 3.13Å; E671-S673 VanDerWaalsContact O-N 3.08Å; S673-Q677 PolarHBondContact O-N 2.91Å
674	R	51.9	Low	50.9	Low	107 Å²	107	94.9 Å²	94.9	40%	0.404	47%	0.465	S	S	.	.	H	α-helix	trans	-74.1	-34	177.9	-60.2	-176.5	-173.6	-174.1	1.2	111.7	L670 E671 Q677 L678	L670-R674 HydrophobicContact CB-CB 4.31Å; L670-R674 HydrophobicContact CD2-CB 4.24Å; E671-R674 WeakPolarHBondContact O-CA 3.37Å; E671-R674 WeakPolarHBondContact O-CB 3.28Å; E671-R674 PolarHBondContact O-N 3.07Å; R674-Q677 PolarHBondContact O-N 2.82Å; R674-L678 WeakPolarHBondContact O-CB 3.38Å; R674-L678 PolarHBondContact O-N 3.42Å
675	K	51.3	Low	50.3	Low	84 Å²	84	102.2 Å²	102.2	37%	0.365	48%	0.48	S	S	.	.	H	α-helix	trans	-55.5	-49.9	171.5	-175.2	179.4	175.5	-175.3	0	110.6	E671 Q677 L678 Q679	E671-K675 PolarHBondContact O-N 3.2Å; K675-Q677 PolarHBondContact O-N 2.95Å; K675-L678 PolarHBondContact O-N 3.45Å; K675-Q679 WeakPolarHBondContact O-CB 3.48Å; K675-Q679 PolarHBondContact O-N 2.92Å
676	R	47.4	Very low	49.7	Very low	170 Å²	170	98.3 Å²	98.3	64%	0.642	49%	0.488	S	S	*	.	H	α-helix	trans	-62.2	-40.5	175.3	-67.5	176.7	-160.1	-159.7	5.8	112.7	E672 Q679 F680	E672-R676 WeakPolarHBondContact O-CG 3.5Å; E672-R676 PolarHBondContact O-N 2.88Å; E672-R676 VanDerWaalsContact O-N 3.12Å; E672-R676 IonicContact OE2-NH2 3.52Å; R676-Q679 PolarHBondContact O-N 3.25Å; R676-F680 VanDerWaalsContact O-CB 3.28Å; R676-F680 WeakPolarHBondContact O-CB 3.41Å; R676-F680 PolarHBondContact O-N 3.31Å
677	Q	48.1	Very low	49	Very low	133 Å²	133	108.9 Å²	108.9	62%	0.621	53%	0.526	S	S	*	.	H	α-helix	trans	-71	-37.8	-179.4	-166.6	168.2	1.7	0	0	113	S673 R674 K675 L681	S673-Q677 PolarHBondContact O-N 2.91Å; R674-Q677 PolarHBondContact O-N 2.82Å; K675-Q677 PolarHBondContact O-N 2.95Å; Q677-L681 WeakPolarHBondContact O-CG 3.3Å; Q677-L681 PolarHBondContact O-N 2.94Å; Q677-L681 VanDerWaalsContact O-N 3.15Å
678	L	52.4	Low	48	Very low	29 Å²	29	118.3 Å²	118.3	15%	0.152	56%	0.557	C	S	.	*	H	α-helix	trans	-68.9	-40.9	172.2	-178.6	59.5	0	0	0	111.4	L667 L670 R674 K675 L681 L682 L703	L667-L678 HydrophobicContact CD2-CD2 3.81Å; L667-L678 HydrophobicContact CD2-CG 4.38Å; L670-L678 HydrophobicContact CD1-CD2 3.61Å; R674-L678 WeakPolarHBondContact O-CB 3.38Å; R674-L678 PolarHBondContact O-N 3.42Å; K675-L678 PolarHBondContact O-N 3.45Å; L678-L681 PolarHBondContact O-N 2.98Å; L678-L682 HydrophobicContact CD1-CD1 4.35Å; L678-L682 HydrophobicContact CG-CD1 4.05Å; L678-L682 VanDerWaalsContact O-CG 3.28Å; L678-L682 WeakPolarHBondContact O-CG 3.48Å; L678-L682 PolarHBondContact O-N 3.16Å; L678-L703 HydrophobicContact CD1-CD1 3.94Å; L678-L703 HydrophobicContact CD1-CD2 4.46Å
679	Q	51.7	Low	47.1	Very low	81 Å²	81	117.2 Å²	117.2	38%	0.379	57%	0.566	S	S	.	*	H	α-helix	trans	-63.5	-41.6	175.7	-174.7	166.5	-2	0	0	111.8	K675 R676 L681 L682 E683	K675-Q679 WeakPolarHBondContact O-CB 3.48Å; K675-Q679 PolarHBondContact O-N 2.92Å; R676-Q679 PolarHBondContact O-N 3.25Å; Q679-L681 VanDerWaalsContact C-N 3.32Å; Q679-L681 PolarHBondContact O-N 2.93Å; Q679-L682 PolarHBondContact O-N 3.34Å; Q679-E683 HydrophobicContact CG-CG 4.32Å; Q679-E683 WeakPolarHBondContact CG-OE1 3.32Å; Q679-E683 PolarHBondContact NE2-OE1 3.12Å; Q679-E683 WeakPolarHBondContact O-CB 3.42Å; Q679-E683 WeakPolarHBondContact O-CG 3.16Å; Q679-E683 PolarHBondContact O-N 3.4Å
680	F	49.1	Very low	46.6	Very low	155 Å²	155	118.4 Å²	118.4	68%	0.68	59%	0.591	S	S	*	*	H	α-helix	trans	-61	-37.1	172.9	-175.7	-95.6	0	0	0	112.9	R676 L682 G684	R676-F680 VanDerWaalsContact O-CB 3.28Å; R676-F680 WeakPolarHBondContact O-CB 3.41Å; R676-F680 PolarHBondContact O-N 3.31Å; F680-L682 VanDerWaalsContact C-N 3.33Å; F680-G684 VanDerWaalsContact O-CA 3.28Å; F680-G684 WeakPolarHBondContact O-CA 3.28Å; F680-G684 PolarHBondContact O-N 3.35Å
681	L	52.3	Low	45.5	Very low	108 Å²	108	124 Å²	124	57%	0.565	62%	0.62	S	S	*	*	H	α-helix	trans	-70	-27.1	173	-72	167.6	0	0	0	113.2	Q677 L678 Q679	Q677-L681 WeakPolarHBondContact O-CG 3.3Å; Q677-L681 PolarHBondContact O-N 2.94Å; Q677-L681 VanDerWaalsContact O-N 3.15Å; L678-L681 PolarHBondContact O-N 2.98Å; Q679-L681 VanDerWaalsContact C-N 3.32Å; Q679-L681 PolarHBondContact O-N 2.93Å
682	L	50.5	Low	44.7	Very low	124 Å²	124	121 Å²	121	65%	0.649	61%	0.611	S	S	*	*	H	α-helix	trans	-86.2	-35.2	-179.9	-71.1	166.5	0	0	0	113.2	L678 Q679 F680	L678-L682 HydrophobicContact CD1-CD1 4.35Å; L678-L682 HydrophobicContact CG-CD1 4.05Å; L678-L682 VanDerWaalsContact O-CG 3.28Å; L678-L682 WeakPolarHBondContact O-CG 3.48Å; L678-L682 PolarHBondContact O-N 3.16Å; Q679-L682 PolarHBondContact O-N 3.34Å; F680-L682 VanDerWaalsContact C-N 3.33Å
683	E	48.4	Very low	44.3	Very low	137 Å²	137	120.4 Å²	120.4	64%	0.64	62%	0.617	S	S	*	*	H	α-helix	trans	-84.8	-21.1	177.1	-67	169.4	-178.5	0	0	111.8	Q679 R685	Q679-E683 HydrophobicContact CG-CG 4.32Å; Q679-E683 WeakPolarHBondContact CG-OE1 3.32Å; Q679-E683 PolarHBondContact NE2-OE1 3.12Å; Q679-E683 WeakPolarHBondContact O-CB 3.42Å; Q679-E683 WeakPolarHBondContact O-CG 3.16Å; Q679-E683 PolarHBondContact O-N 3.4Å; E683-R685 PolarHBondContact O-N 3.18Å; E683-R685 VanDerWaalsContact O-N 3.07Å
684	G	42.1	Very low	43.8	Very low	45 Å²	45	122.3 Å²	122.3	46%	0.464	62%	0.618	S	S	.	*	S	Bend	trans	-78.3	25.6	-164.1	0	0	0	0	0	119.6	F680	F680-G684 VanDerWaalsContact O-CA 3.28Å; F680-G684 WeakPolarHBondContact O-CA 3.28Å; F680-G684 PolarHBondContact O-N 3.35Å
685	R	37.2	Very low	43.1	Very low	245 Å²	245	121.4 Å²	121.4	93%	0.925	62%	0.619	S	S	*	*			trans	176.8	125.2	153.5	-102.7	164.4	-161.4	-136.2	5.1	112.9	E683	E683-R685 PolarHBondContact O-N 3.18Å; E683-R685 VanDerWaalsContact O-N 3.07Å
686	G	41.1	Very low	42.6	Very low	72 Å²	72	122 Å²	122	74%	0.742	63%	0.625	S	S	*	*			trans	-84.7	163.5	174.5	0	0	0	0	0	115.1
687	R	43.5	Very low	42.3	Very low	249 Å²	249	120.4 Å²	120.4	94%	0.94	62%	0.619	S	S	*	*			trans	67.3	79.3	169.4	-58.2	-175	-176.7	-116.5	3	117.8
688	R	33.1	Very low	41.6	Very low	254 Å²	254	117.6 Å²	117.6	96%	0.958	61%	0.608	S	S	*	*				-157.8	160.9	119.7	-104.5	165.6	-162.5	-164.7	4	109.8
689	A	36.4	Very low	40.9	Very low	103 Å²	103	120.1 Å²	120.1	85%	0.851	62%	0.622	S	S	*	*	S	Bend	trans	-87.9	144.5	-174.3	0	0	0	0	0	111.8
690	G	42.7	Very low	40.4	Very low	75 Å²	75	118.3 Å²	118.3	77%	0.773	63%	0.625	S	S	*	*			trans	65.3	73	162.9	0	0	0	0	0	116.3
691	L	34	Very low	39.8	Very low	135 Å²	135	118.1 Å²	118.1	71%	0.707	62%	0.624	S	S	*	*			trans	-68.3	138.4	161.9	-65.3	173.7	0	0	0	110.1	E695	L691-E695 VanDerWaalsContact CA-OE2 3.25Å; L691-E695 WeakPolarHBondContact CA-OE2 3.26Å; L691-E695 WeakPolarHBondContact CD2-OE2 3.49Å
692	S	36.2	Very low	39.1	Very low	42 Å²	42	119.8 Å²	119.8	29%	0.294	63%	0.633	S	S	.	*			trans	-81.8	161.8	-175	104.1	0	0	0	0	112.6	E694 E695 L696	S692-E694 PolarHBondContact O-N 3Å; S692-E694 VanDerWaalsContact O-N 3.11Å; S692-E694 WeakPolarHBondContact OG-CB 3.46Å; S692-E694 PolarHBondContact OG-N 3.24Å; S692-E695 PolarHBondContact N-OE2 2.99Å; S692-E695 PolarHBondContact O-N 3.1Å; S692-L696 PolarHBondContact O-N 2.95Å
693	P	36.7	Very low	38.8	Very low	109 Å²	109	117.1 Å²	117.1	71%	0.708	62%	0.619	S	S	*	*	H	α-helix	trans	-57.1	-22.2	171.4	-24.3	35.1	0	0	0	114	R697	P693-R697 PolarHBondContact O-N 3.46Å
694	E	34.4	Very low	38.3	Very low	111 Å²	111	112.3 Å²	112.3	52%	0.519	61%	0.606	S	S	.	*	H	α-helix	trans	-81.3	-32.7	-179.5	-52.2	-160	86.5	0	0	112.5	S692 L696 R697 D698	S692-E694 PolarHBondContact O-N 3Å; S692-E694 VanDerWaalsContact O-N 3.11Å; S692-E694 WeakPolarHBondContact OG-CB 3.46Å; S692-E694 PolarHBondContact OG-N 3.24Å; E694-L696 VanDerWaalsContact C-N 3.29Å; E694-L696 PolarHBondContact O-N 3.06Å; E694-R697 WeakPolarHBondContact O-CA 3.45Å; E694-R697 WeakPolarHBondContact O-CB 3.45Å; E694-R697 PolarHBondContact O-N 2.79Å; E694-R697 IonicContact OE1-CZ 3.16Å; E694-R697 IonicContact OE1-NH1 3.31Å; E694-R697 PolarHBondContact OE1-NH1 2.94Å; E694-R697 IonicContact OE1-NH2 2.71Å; E694-R697 PolarHBondContact OE1-NH2 3.31Å; E694-D698 PolarHBondContact O-N 2.95Å; E694-D698 VanDerWaalsContact O-N 3.09Å
695	E	36.2	Very low	38.5	Very low	89 Å²	89	115.9 Å²	115.9	42%	0.416	61%	0.611	S	S	.	*	H	α-helix	trans	-70.6	-29.8	174.4	-64.2	173	118	0	0	111.2	L691 S692 R697 N699	L691-E695 VanDerWaalsContact CA-OE2 3.25Å; L691-E695 WeakPolarHBondContact CA-OE2 3.26Å; L691-E695 WeakPolarHBondContact CD2-OE2 3.49Å; S692-E695 PolarHBondContact N-OE2 2.99Å; S692-E695 PolarHBondContact O-N 3.1Å; E695-R697 VanDerWaalsContact C-N 3.33Å; E695-N699 WeakPolarHBondContact O-CB 3.38Å; E695-N699 PolarHBondContact O-N 3.46Å; E695-N699 VanDerWaalsContact O-N 3.09Å; E695-N699 PolarHBondContact O-ND2 3Å
696	L	40.8	Very low	39	Very low	95 Å²	95	105.7 Å²	105.7	50%	0.497	58%	0.582	S	S	.	*	H	α-helix	trans	-64.8	-36.1	165.3	-89.4	156.5	0	0	0	112.2	S692 E694 G700	S692-L696 PolarHBondContact O-N 2.95Å; E694-L696 VanDerWaalsContact C-N 3.29Å; E694-L696 PolarHBondContact O-N 3.06Å; L696-G700 PolarHBondContact O-N 3.2Å
697	R	40.6	Very low	39.6	Very low	137 Å²	137	103.8 Å²	103.8	52%	0.517	56%	0.555	S	S	.	*	H	α-helix	trans	-67.1	-37.5	-180	-153.8	-178.6	68.1	-132	-5.1	112.3	P693 E694 E695	P693-R697 PolarHBondContact O-N 3.46Å; E694-R697 WeakPolarHBondContact O-CA 3.45Å; E694-R697 WeakPolarHBondContact O-CB 3.45Å; E694-R697 PolarHBondContact O-N 2.79Å; E694-R697 IonicContact OE1-CZ 3.16Å; E694-R697 IonicContact OE1-NH1 3.31Å; E694-R697 PolarHBondContact OE1-NH1 2.94Å; E694-R697 IonicContact OE1-NH2 2.71Å; E694-R697 PolarHBondContact OE1-NH2 3.31Å; E695-R697 VanDerWaalsContact C-N 3.33Å
698	D	34.3	Very low	40.2	Very low	74 Å²	74	92.9 Å²	92.9	40%	0.396	52%	0.517	S	S	.	.	H	α-helix	trans	-81.8	-33.2	175.9	-78.4	-25.7	0	0	0	113.4	E694 G700 K701	E694-D698 PolarHBondContact O-N 2.95Å; E694-D698 VanDerWaalsContact O-N 3.09Å; D698-G700 PolarHBondContact O-N 3.21Å; D698-K701 WeakPolarHBondContact O-CB 3.38Å; D698-K701 PolarHBondContact O-N 2.9Å; D698-K701 WeakPolarHBondContact OD1-CD 3.01Å; D698-K701 WeakPolarHBondContact OD1-CE 3.31Å; D698-K701 IonicContact OD1-NZ 3.08Å; D698-K701 PolarHBondContact OD1-NZ 2.84Å
699	N	36.6	Very low	41.7	Very low	82 Å²	82	81.7 Å²	81.7	44%	0.439	48%	0.475	S	S	.	.	H	α-helix	trans	-63.9	-27.3	167.2	-77.9	-62.5	0	0	0	112.5	E695 K701 L702 L703	E695-N699 WeakPolarHBondContact O-CB 3.38Å; E695-N699 PolarHBondContact O-N 3.46Å; E695-N699 VanDerWaalsContact O-N 3.09Å; E695-N699 PolarHBondContact O-ND2 3Å; N699-K701 PolarHBondContact O-N 2.77Å; N699-L702 PolarHBondContact O-N 3.23Å; N699-L702 VanDerWaalsContact O-N 3.15Å; N699-L703 PolarHBondContact O-N 3.36Å
700	G	41.9	Very low	42.5	Very low	44 Å²	44	77.5 Å²	77.5	45%	0.454	44%	0.44	S	S	.	.	H	α-helix	trans	-59.3	-30	168.7	0	0	0	0	0	114	L696 D698	L696-G700 PolarHBondContact O-N 3.2Å; D698-G700 PolarHBondContact O-N 3.21Å
701	K	37.8	Very low	43.3	Very low	150 Å²	150	75.1 Å²	75.1	65%	0.652	41%	0.409	S	S	*	.	H	α-helix	trans	-71.5	-36.9	173.7	-60.8	171.4	177.9	164.4	0	111.9	D698 N699 L703 G704	D698-K701 WeakPolarHBondContact O-CB 3.38Å; D698-K701 PolarHBondContact O-N 2.9Å; D698-K701 WeakPolarHBondContact OD1-CD 3.01Å; D698-K701 WeakPolarHBondContact OD1-CE 3.31Å; D698-K701 IonicContact OD1-NZ 3.08Å; D698-K701 PolarHBondContact OD1-NZ 2.84Å; N699-K701 PolarHBondContact O-N 2.77Å; K701-L703 VanDerWaalsContact C-N 3.31Å; K701-L703 PolarHBondContact O-N 3Å; K701-G704 PolarHBondContact O-N 3.14Å; K701-G704 VanDerWaalsContact O-N 3.16Å
702	L	37.5	Very low	44.6	Very low	144 Å²	144	70.7 Å²	70.7	75%	0.754	39%	0.385	S	S	*	.	H	α-helix	trans	-69	-23.9	-180	-88.7	157.5	0	0	0	113.8	N699	N699-L702 PolarHBondContact O-N 3.23Å; N699-L702 VanDerWaalsContact O-N 3.15Å
703	L	42.2	Very low	45.7	Very low	67 Å²	67	72 Å²	72	35%	0.351	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-10.9	172.4	-79.1	147.9	0	0	0	113.7	L678 N699 K701 L707	L678-L703 HydrophobicContact CD1-CD1 3.94Å; L678-L703 HydrophobicContact CD1-CD2 4.46Å; N699-L703 PolarHBondContact O-N 3.36Å; K701-L703 VanDerWaalsContact C-N 3.31Å; K701-L703 PolarHBondContact O-N 3Å; L703-L707 HydrophobicContact CB-CD1 3.98Å; L703-L707 HydrophobicContact CD1-CD1 4.41Å; L703-L707 HydrophobicContact CD2-CD1 4.19Å; L703-L707 HydrophobicContact CG-CD1 4.42Å
704	G	40	Very low	46.8	Very low	36 Å²	36	68.7 Å²	68.7	37%	0.371	36%	0.362	S	S	.	.			trans	71	172.1	166.2	0	0	0	0	0	116.8	K701 G706 L707	K701-G704 PolarHBondContact O-N 3.14Å; K701-G704 VanDerWaalsContact O-N 3.16Å; G704-G706 PolarHBondContact O-N 2.78Å; G704-L707 PolarHBondContact O-N 2.96Å
705	E	44.5	Very low	47.8	Very low	120 Å²	120	68 Å²	68	56%	0.561	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	1.3	-178.7	-46.5	176.6	-174.1	0	0	115	R709	E705-R709 WeakPolarHBondContact O-CG 2.8Å; E705-R709 PolarHBondContact O-NH1 3.39Å; E705-R709 VanDerWaalsContact O-NH1 3.12Å; E705-R709 IonicContact OE2-CZ 3.82Å; E705-R709 VanDerWaalsContact OE2-CZ 3.29Å; E705-R709 IonicContact OE2-NH1 2.72Å; E705-R709 PolarHBondContact OE2-NH1 3.48Å; E705-R709 IonicContact OE2-NH2 2.71Å; E705-R709 PolarHBondContact OE2-NH2 2.97Å
706	G	48.4	Very low	48.2	Very low	32 Å²	32	65.3 Å²	65.3	33%	0.33	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-14.9	175.4	0	0	0	0	0	113.6	G704 A710	G704-G706 PolarHBondContact O-N 2.78Å; G706-A710 VanDerWaalsContact O-CB 3.25Å; G706-A710 WeakPolarHBondContact O-CB 3.39Å; G706-A710 PolarHBondContact O-N 2.78Å
707	L	53.3	Low	48.3	Very low	31 Å²	31	72.1 Å²	72.1	16%	0.162	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-43	-173.8	-164	142.5	0	0	0	112.4	L666 L670 L703 G704 R709 A710 L711	L666-L707 HydrophobicContact CD2-CD2 3.77Å; L666-L707 HydrophobicContact CD2-CG 4.48Å; L670-L707 HydrophobicContact CD2-CD1 4.34Å; L703-L707 HydrophobicContact CB-CD1 3.98Å; L703-L707 HydrophobicContact CD1-CD1 4.41Å; L703-L707 HydrophobicContact CD2-CD1 4.19Å; L703-L707 HydrophobicContact CG-CD1 4.42Å; G704-L707 PolarHBondContact O-N 2.96Å; L707-R709 VanDerWaalsContact C-N 3.35Å; L707-R709 PolarHBondContact O-N 3.49Å; L707-A710 PolarHBondContact O-N 2.88Å; L707-A710 VanDerWaalsContact O-N 3.17Å; L707-L711 PolarHBondContact O-N 3.33Å
708	S	56.8	Low	48	Very low	21 Å²	21	71.4 Å²	71.4	15%	0.147	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-45.2	169.2	48.3	0	0	0	0	111.9	G654 A710 L711	G654-S708 WeakPolarHBondContact O-CB 3.4Å; S708-A710 VanDerWaalsContact C-N 3.29Å; S708-A710 PolarHBondContact O-N 2.95Å; S708-L711 PolarHBondContact O-N 2.84Å
709	R	63.3	Low	47.8	Very low	19 Å²	19	73 Å²	73	7%	0.072	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-23.2	176.5	-64.7	-179	-172.3	121.2	-6.1	113.3	Y623 R624 E647 E705 L707	Y623-R709 HydrophobicContact CD1-CG 4.46Å; Y623-R709 HydrophobicContact CE1-CG 3.82Å; Y623-R709 HydrophobicContact CE2-CG 3.93Å; Y623-R709 WeakPolarHBondContact O-CD 3.2Å; R624-R709 VanDerWaalsContact CD-O 3.26Å; R624-R709 WeakPolarHBondContact CD-O 3.47Å; R624-R709 VanDerWaalsContact CZ-O 3.28Å; R624-R709 PolarHBondContact NE-O 2.79Å; E647-R709 IonicContact OE1-NH2 3.28Å; E647-R709 IonicContact OE2-CZ 3.16Å; E647-R709 IonicContact OE2-NE 3.21Å; E647-R709 IonicContact OE2-NH2 2.88Å; E647-R709 PolarHBondContact OE2-NH2 3.36Å; E705-R709 WeakPolarHBondContact O-CG 2.8Å; E705-R709 PolarHBondContact O-NH1 3.39Å; E705-R709 VanDerWaalsContact O-NH1 3.12Å; E705-R709 IonicContact OE2-CZ 3.82Å; E705-R709 VanDerWaalsContact OE2-CZ 3.29Å; E705-R709 IonicContact OE2-NH1 2.72Å; E705-R709 PolarHBondContact OE2-NH1 3.48Å; E705-R709 IonicContact OE2-NH2 2.71Å; E705-R709 PolarHBondContact OE2-NH2 2.97Å; L707-R709 VanDerWaalsContact C-N 3.35Å; L707-R709 PolarHBondContact O-N 3.49Å
710	A	54.7	Low	47.6	Very low	15 Å²	15	76.8 Å²	76.8	12%	0.124	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-24.9	179.4	0	0	0	0	0	114.1	G706 L707 S708 F712 N713	G706-A710 VanDerWaalsContact O-CB 3.25Å; G706-A710 WeakPolarHBondContact O-CB 3.39Å; G706-A710 PolarHBondContact O-N 2.78Å; L707-A710 PolarHBondContact O-N 2.88Å; L707-A710 VanDerWaalsContact O-N 3.17Å; S708-A710 VanDerWaalsContact C-N 3.29Å; S708-A710 PolarHBondContact O-N 2.95Å; A710-F712 PolarHBondContact O-N 3.23Å; A710-N713 WeakPolarHBondContact O-CB 3.14Å; A710-N713 PolarHBondContact O-N 2.98Å
711	L	59.5	Low	47.3	Very low	25 Å²	25	79 Å²	79	13%	0.131	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-27.1	-179.1	-73.5	164.1	0	0	0	113.5	A657 A658 T661 L666 L669 L707 S708 N713	A657-L711 HydrophobicContact CB-CD1 3.94Å; A658-L711 HydrophobicContact CB-CD1 3.73Å; T661-L711 HydrophobicContact CG2-CD2 4.14Å; L666-L711 HydrophobicContact CD2-CD2 3.77Å; L666-L711 HydrophobicContact CG-CD2 4.17Å; L669-L711 HydrophobicContact CD1-CD2 3.93Å; L707-L711 PolarHBondContact O-N 3.33Å; S708-L711 PolarHBondContact O-N 2.84Å; L711-N713 PolarHBondContact O-N 3.44Å; L711-N713 VanDerWaalsContact O-N 3.16Å
712	F	59.9	Low	47	Very low	42 Å²	42	81.6 Å²	81.6	18%	0.184	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	23.9	177.1	-57.6	-78.2	0	0	0	113.8	A591 F620 Y623 L653 A710	A591-F712 WeakPolarHBondContact CB-O 3.49Å; F620-F712 HydrophobicContact CE2-CB 4.48Å; F620-F712 HydrophobicContact CE2-CD1 4.18Å; F620-F712 HydrophobicContact CE2-CG 4.27Å; F620-F712 HydrophobicContact CZ-CB 4.22Å; F620-F712 HydrophobicContact CZ-CG 4.49Å; Y623-F712 HydrophobicContact CE1-CD2 4.19Å; Y623-F712 AromaticContact CE1-CE2 3.91Å; Y623-F712 HydrophobicContact CE1-CE2 3.91Å; L653-F712 HydrophobicContact CD2-CE1 4.07Å; L653-F712 HydrophobicContact CD2-CZ 4.03Å; L653-F712 HydrophobicContact CG-CE1 4.47Å; L653-F712 HydrophobicContact CG-CZ 4.09Å; A710-F712 PolarHBondContact O-N 3.23Å
713	N	60.9	Low	46.5	Very low	68 Å²	68	80.1 Å²	80.1	36%	0.364	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-68.4	136.4	-177.2	-161.8	21.3	0	0	0	112	A710 L711	A710-N713 WeakPolarHBondContact O-CB 3.14Å; A710-N713 PolarHBondContact O-N 2.98Å; L711-N713 PolarHBondContact O-N 3.44Å; L711-N713 VanDerWaalsContact O-N 3.16Å
714	Y	58	Low	46.6	Very low	40 Å²	40	82.2 Å²	82.2	16%	0.157	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-86.4	122.7	177.5	-168.5	-102.1	0	0	0	110	D558 V561 P588 Q589 A592 S716	D558-Y714 VanDerWaalsContact CG-OH 3.32Å; D558-Y714 PolarHBondContact OD1-OH 3.35Å; V561-Y714 HydrophobicContact CG1-CD1 4.34Å; V561-Y714 HydrophobicContact CG2-CD1 4.11Å; V561-Y714 HydrophobicContact CG2-CE1 4.22Å; P588-Y714 HydrophobicContact CB-CD2 4.36Å; P588-Y714 WeakPolarHBondContact O-CD2 3.45Å; Q589-Y714 HydrophobicContact CB-CE2 4.3Å; Q589-Y714 HydrophobicContact CG-CD2 4.21Å; Q589-Y714 HydrophobicContact CG-CE2 3.54Å; A592-Y714 HydrophobicContact CB-CD1 4.23Å; A592-Y714 HydrophobicContact CB-CG 4.41Å; Y714-S716 PolarHBondContact O-N 3.08Å
715	P	55.4	Low	46.4	Very low	97 Å²	97	89.1 Å²	89.1	63%	0.63	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-70.7	124.4	179	28.5	-32.9	0	0	0	110.3
716	S	46	Very low	45.9	Very low	32 Å²	32	92.8 Å²	92.8	22%	0.224	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-62.6	146.4	158.7	-171.7	0	0	0	0	108.9	Y714 D718	Y714-S716 PolarHBondContact O-N 3.08Å; S716-D718 PolarHBondContact O-N 3.24Å
717	R	42.5	Very low	45.3	Very low	239 Å²	239	93.6 Å²	93.6	90%	0.902	52%	0.515	S	S	*	.	S	Bend	trans	-72.4	-18	179.3	-154	168.7	-177.6	172.8	-1.6	112.3	C719	R717-C719 VanDerWaalsContact C-N 3.29Å; R717-C719 PolarHBondContact O-N 2.98Å; R717-C719 VanDerWaalsContact O-N 3.13Å
718	D	33.3	Very low	44.7	Very low	121 Å²	121	98.8 Å²	98.8	65%	0.647	55%	0.549	S	S	*	.			trans	-88.9	51.4	-176.9	-51.4	-41.7	0	0	0	112.9	P562 S716	P562-D718 WeakPolarHBondContact CG-OD2 3.46Å; S716-D718 PolarHBondContact O-N 3.24Å
719	C	30.5	Very low	44.2	Very low	107 Å²	107	103.1 Å²	103.1	72%	0.723	57%	0.574	S	S	*	*			trans	-117.2	40.8	170.3	-73.3	0	0	0	0	111.2	R717	R717-C719 VanDerWaalsContact C-N 3.29Å; R717-C719 PolarHBondContact O-N 2.98Å; R717-C719 VanDerWaalsContact O-N 3.13Å
720	N	34	Very low	43.2	Very low	162 Å²	162	107 Å²	107	87%	0.866	59%	0.593	S	S	*	*			trans	-145.1	89.3	174.9	-93.9	-18.7	0	0	0	110
721	A	33.7	Very low	43	Very low	92 Å²	92	109.9 Å²	109.9	76%	0.76	61%	0.612	S	S	*	*			trans	-147.1	125	163	0	0	0	0	0	107.2
722	E	31.5	Very low	42.6	Very low	204 Å²	204	112.8 Å²	112.8	95%	0.953	63%	0.634	S	S	*	*	S	Bend	trans	65.1	126.9	-172.2	-54.6	170.3	-159.2	0	0	113.1
723	S	27.4	Very low	42.2	Very low	112 Å²	112	117.3 Å²	117.3	78%	0.783	66%	0.656	S	S	*	*			cis	-120.9	166	12.3	58.8	0	0	0	0	113.5
724	P	45.5	Very low	41.7	Very low	111 Å²	111	121.2 Å²	121.2	72%	0.721	67%	0.666	S	S	*	*			trans	-94.2	-178.8	-176.6	40.2	-37.9	0	0	0	114.1
725	E	36.1	Very low	41.4	Very low	182 Å²	182	121.9 Å²	121.9	85%	0.85	68%	0.68	S	S	*	*			trans	67.9	100.4	165.2	-60.6	-177.2	173.7	0	0	118.3
726	E	33.4	Very low	41.6	Very low	197 Å²	197	119.6 Å²	119.6	92%	0.921	67%	0.668	S	S	*	*				174.9	153.2	114.8	-94.4	-174.8	161.5	0	0	112.2
727	G	35.3	Very low	41.9	Very low	48 Å²	48	124.3 Å²	124.3	50%	0.495	69%	0.689	S	S	.	*			trans	68.3	68.3	157.1	0	0	0	0	0	119.5	V729 E730	G727-V729 PolarHBondContact O-N 2.96Å; G727-E730 PolarHBondContact O-N 3.24Å
728	T	40.5	Very low	42.6	Very low	141 Å²	141	117.9 Å²	117.9	87%	0.865	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	6.9	176	46.2	0	0	0	0	116.4
729	V	46	Very low	43.8	Very low	111 Å²	111	117.7 Å²	117.7	67%	0.673	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	-42.9	177.6	-177.7	0	0	0	0	111.5	G727 S731 S732	G727-V729 PolarHBondContact O-N 2.96Å; V729-S731 PolarHBondContact O-N 3.21Å; V729-S732 PolarHBondContact O-N 2.96Å
730	E	44	Very low	45.3	Very low	101 Å²	101	119.2 Å²	119.2	47%	0.472	66%	0.663	S	S	.	*	H	α-helix	trans	-65.1	-22.9	179.5	-74.6	-162.9	-144.3	0	0	113.7	G727 S732 E733 R734	G727-E730 PolarHBondContact O-N 3.24Å; E730-S732 VanDerWaalsContact C-N 3.28Å; E730-S732 PolarHBondContact O-N 2.79Å; E730-E733 PolarHBondContact O-N 2.81Å; E730-R734 VanDerWaalsContact O-CB 3.25Å; E730-R734 WeakPolarHBondContact O-CB 3.4Å; E730-R734 VanDerWaalsContact O-CG 3.22Å; E730-R734 WeakPolarHBondContact O-CG 3.08Å; E730-R734 PolarHBondContact O-N 2.82Å; E730-R734 IonicContact OE2-CZ 3.12Å; E730-R734 IonicContact OE2-NE 2.86Å; E730-R734 PolarHBondContact OE2-NE 2.85Å; E730-R734 IonicContact OE2-NH2 2.64Å; E730-R734 PolarHBondContact OE2-NH2 3.32Å
731	S	49.7	Very low	46.4	Very low	76 Å²	76	118.1 Å²	118.1	53%	0.531	65%	0.648	S	S	.	*	H	α-helix	trans	-61.8	-34.4	-178.5	59.3	0	0	0	0	113	V729 A735	V729-S731 PolarHBondContact O-N 3.21Å; S731-A735 VanDerWaalsContact O-CB 3.22Å; S731-A735 WeakPolarHBondContact O-CB 3.48Å; S731-A735 PolarHBondContact O-N 2.97Å
732	S	50.8	Low	47.6	Very low	86 Å²	86	118.4 Å²	118.4	60%	0.601	64%	0.636	S	S	*	*	H	α-helix	trans	-72.1	-47.6	177.7	-168.6	0	0	0	0	111.6	V729 E730 A735 A736	V729-S732 PolarHBondContact O-N 2.96Å; E730-S732 VanDerWaalsContact C-N 3.28Å; E730-S732 PolarHBondContact O-N 2.79Å; S732-A735 PolarHBondContact O-N 3.13Å; S732-A736 WeakPolarHBondContact O-CB 3.12Å; S732-A736 PolarHBondContact O-N 3.02Å
733	E	51.7	Low	49	Very low	137 Å²	137	114.2 Å²	114.2	64%	0.64	62%	0.616	S	S	*	*	H	α-helix	trans	-68.4	-39	179.4	-63.1	-171.8	161.3	0	0	112	E730 A736 M737	E730-E733 PolarHBondContact O-N 2.81Å; E733-A736 PolarHBondContact O-N 3.28Å; E733-M737 WeakPolarHBondContact O-CB 3.36Å; E733-M737 PolarHBondContact O-N 2.97Å
734	R	51.4	Low	50.6	Low	150 Å²	150	112.1 Å²	112.1	57%	0.566	59%	0.594	S	S	*	*	H	α-helix	trans	-63.7	-39.4	171.3	-70	176.6	-175	-162.5	4.1	111.3	E730 I738	E730-R734 VanDerWaalsContact O-CB 3.25Å; E730-R734 WeakPolarHBondContact O-CB 3.4Å; E730-R734 VanDerWaalsContact O-CG 3.22Å; E730-R734 WeakPolarHBondContact O-CG 3.08Å; E730-R734 PolarHBondContact O-N 2.82Å; E730-R734 IonicContact OE2-CZ 3.12Å; E730-R734 IonicContact OE2-NE 2.86Å; E730-R734 PolarHBondContact OE2-NE 2.85Å; E730-R734 IonicContact OE2-NH2 2.64Å; E730-R734 PolarHBondContact OE2-NH2 3.32Å; R734-I738 VanDerWaalsContact O-CB 3.32Å; R734-I738 WeakPolarHBondContact O-CB 3.27Å; R734-I738 WeakPolarHBondContact O-CD1 3.46Å; R734-I738 WeakPolarHBondContact O-CG1 3.16Å; R734-I738 PolarHBondContact O-N 2.91Å
735	A	51.8	Low	51.3	Low	54 Å²	54	110.1 Å²	110.1	45%	0.446	58%	0.577	S	S	.	*	H	α-helix	trans	-64	-48.4	175.2	0	0	0	0	0	111.8	S731 S732 M737 I738 E739	S731-A735 VanDerWaalsContact O-CB 3.22Å; S731-A735 WeakPolarHBondContact O-CB 3.48Å; S731-A735 PolarHBondContact O-N 2.97Å; S732-A735 PolarHBondContact O-N 3.13Å; A735-M737 PolarHBondContact O-N 2.82Å; A735-I738 PolarHBondContact O-N 3.32Å; A735-E739 WeakPolarHBondContact O-CB 3.46Å; A735-E739 PolarHBondContact O-N 2.93Å
736	A	58.1	Low	52.5	Low	48 Å²	48	106.1 Å²	106.1	40%	0.397	57%	0.565	S	S	.	*	H	α-helix	trans	-62.5	-38.9	176.9	0	0	0	0	0	112.6	S732 E733 E739 Q740	S732-A736 WeakPolarHBondContact O-CB 3.12Å; S732-A736 PolarHBondContact O-N 3.02Å; E733-A736 PolarHBondContact O-N 3.28Å; A736-E739 PolarHBondContact O-N 3.38Å; A736-Q740 WeakPolarHBondContact O-CB 3.47Å; A736-Q740 WeakPolarHBondContact O-CG 3.21Å; A736-Q740 PolarHBondContact O-N 2.97Å
737	M	52.7	Low	54	Low	131 Å²	131	102.2 Å²	102.2	65%	0.645	55%	0.545	S	S	*	.	H	α-helix	trans	-67.4	-40.6	175.2	-173.8	-175	-64.4	0	0	112	E733 A735 E739 Y741	E733-M737 WeakPolarHBondContact O-CB 3.36Å; E733-M737 PolarHBondContact O-N 2.97Å; A735-M737 PolarHBondContact O-N 2.82Å; M737-E739 VanDerWaalsContact C-N 3.34Å; M737-Y741 WeakPolarHBondContact O-CB 3.39Å; M737-Y741 PolarHBondContact O-N 3.28Å
738	I	57.6	Low	55	Low	104 Å²	104	106.9 Å²	106.9	53%	0.533	55%	0.547	S	S	.	.	H	α-helix	trans	-65.2	-39.8	174	-71.4	166.9	0	0	0	110.4	R734 A735 Y741 L742	R734-I738 VanDerWaalsContact O-CB 3.32Å; R734-I738 WeakPolarHBondContact O-CB 3.27Å; R734-I738 WeakPolarHBondContact O-CD1 3.46Å; R734-I738 WeakPolarHBondContact O-CG1 3.16Å; R734-I738 PolarHBondContact O-N 2.91Å; A735-I738 PolarHBondContact O-N 3.32Å; I738-Y741 PolarHBondContact O-N 3.33Å; I738-L742 HydrophobicContact CG2-CD1 3.87Å; I738-L742 HydrophobicContact CG2-CG 4.45Å; I738-L742 WeakPolarHBondContact O-CB 3.34Å; I738-L742 VanDerWaalsContact O-CG 3.23Å; I738-L742 WeakPolarHBondContact O-CG 3.46Å; I738-L742 PolarHBondContact O-N 2.91Å
739	E	57.6	Low	55.7	Low	118 Å²	118	103 Å²	103	55%	0.551	53%	0.529	S	S	*	.	H	α-helix	trans	-67.9	-46	177.4	-176.4	161.7	-157.4	0	0	112	A735 A736 M737 Y741 L742 Q743	A735-E739 WeakPolarHBondContact O-CB 3.46Å; A735-E739 PolarHBondContact O-N 2.93Å; A736-E739 PolarHBondContact O-N 3.38Å; M737-E739 VanDerWaalsContact C-N 3.34Å; E739-Y741 VanDerWaalsContact C-N 3.33Å; E739-Y741 PolarHBondContact O-N 3.37Å; E739-L742 PolarHBondContact O-N 3.01Å; E739-Q743 WeakPolarHBondContact O-CB 3.39Å; E739-Q743 VanDerWaalsContact O-CG 3.28Å; E739-Q743 WeakPolarHBondContact O-CG 3.28Å; E739-Q743 PolarHBondContact O-N 3.2Å
740	Q	62.6	Low	56.4	Low	138 Å²	138	100.9 Å²	100.9	65%	0.645	52%	0.52	S	S	*	.	H	α-helix	trans	-59.6	-41.9	171.6	-76.8	-174.5	-9.2	0	0	112.2	A736 Q743 E744	A736-Q740 WeakPolarHBondContact O-CB 3.47Å; A736-Q740 WeakPolarHBondContact O-CG 3.21Å; A736-Q740 PolarHBondContact O-N 2.97Å; Q740-Q743 PolarHBondContact O-N 2.9Å; Q740-E744 WeakPolarHBondContact O-CB 3.16Å; Q740-E744 PolarHBondContact O-N 2.86Å
741	Y	57.8	Low	57.3	Low	140 Å²	140	99 Å²	99	55%	0.549	51%	0.513	S	S	.	.	H	α-helix	trans	-64.3	-40.8	176.9	-178.2	-98	0	0	0	112	M737 I738 E739 L745	M737-Y741 WeakPolarHBondContact O-CB 3.39Å; M737-Y741 PolarHBondContact O-N 3.28Å; I738-Y741 PolarHBondContact O-N 3.33Å; E739-Y741 VanDerWaalsContact C-N 3.33Å; E739-Y741 PolarHBondContact O-N 3.37Å; Y741-L745 HydrophobicContact CE1-CD1 3.83Å; Y741-L745 VanDerWaalsContact O-CB 3.23Å; Y741-L745 WeakPolarHBondContact O-CB 3.38Å; Y741-L745 PolarHBondContact O-N 2.74Å
742	L	58	Low	57.9	Low	98 Å²	98	100 Å²	100	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-65.9	-43.5	174.1	-75.5	166.7	0	0	0	111.8	I738 E739 L745 V746	I738-L742 HydrophobicContact CG2-CD1 3.87Å; I738-L742 HydrophobicContact CG2-CG 4.45Å; I738-L742 WeakPolarHBondContact O-CB 3.34Å; I738-L742 VanDerWaalsContact O-CG 3.23Å; I738-L742 WeakPolarHBondContact O-CG 3.46Å; I738-L742 PolarHBondContact O-N 2.91Å; E739-L742 PolarHBondContact O-N 3.01Å; L742-L745 PolarHBondContact O-N 3.25Å; L742-V746 WeakPolarHBondContact O-CB 3.21Å; L742-V746 VanDerWaalsContact O-CG2 3.29Å; L742-V746 WeakPolarHBondContact O-CG2 3.22Å; L742-V746 PolarHBondContact O-N 2.99Å
743	Q	60.4	Low	58.4	Low	115 Å²	115	100.7 Å²	100.7	54%	0.537	51%	0.513	S	S	.	.	H	α-helix	trans	-61.1	-45.9	176	-72.8	175.4	13	0	0	111.4	E739 Q740 V746 K747	E739-Q743 WeakPolarHBondContact O-CB 3.39Å; E739-Q743 VanDerWaalsContact O-CG 3.28Å; E739-Q743 WeakPolarHBondContact O-CG 3.28Å; E739-Q743 PolarHBondContact O-N 3.2Å; Q740-Q743 PolarHBondContact O-N 2.9Å; Q743-V746 PolarHBondContact O-N 3.14Å; Q743-K747 WeakPolarHBondContact O-CB 3.27Å; Q743-K747 PolarHBondContact O-N 3.41Å
744	E	62	Low	59.2	Low	69 Å²	69	99.7 Å²	99.7	32%	0.322	51%	0.511	S	S	.	.	H	α-helix	trans	-67.2	-35.9	177.2	176.5	63.5	-177.4	0	0	112.3	Q740 K747 R748	Q740-E744 WeakPolarHBondContact O-CB 3.16Å; Q740-E744 PolarHBondContact O-N 2.86Å; E744-K747 PolarHBondContact O-N 3.29Å; E744-R748 WeakPolarHBondContact O-CB 3.32Å; E744-R748 VanDerWaalsContact O-CG 3.24Å; E744-R748 WeakPolarHBondContact O-CG 3.41Å; E744-R748 PolarHBondContact O-N 3.01Å; E744-R748 IonicContact OE1-CZ 3.58Å; E744-R748 IonicContact OE1-NE 3.67Å; E744-R748 PolarHBondContact OE1-NE 3Å; E744-R748 IonicContact OE1-NH2 3.69Å; E744-R748 PolarHBondContact OE1-NH2 2.74Å
745	L	59.9	Low	60	Low	68 Å²	68	99 Å²	99	36%	0.356	51%	0.512	S	S	.	.	H	α-helix	trans	-70.2	-42	176.4	-163.5	155.9	0	0	0	111.4	Y741 L742 R748 A749	Y741-L745 HydrophobicContact CE1-CD1 3.83Å; Y741-L745 VanDerWaalsContact O-CB 3.23Å; Y741-L745 WeakPolarHBondContact O-CB 3.38Å; Y741-L745 PolarHBondContact O-N 2.74Å; L742-L745 PolarHBondContact O-N 3.25Å; L745-R748 PolarHBondContact O-N 3.05Å; L745-A749 WeakPolarHBondContact O-CB 3.33Å; L745-A749 PolarHBondContact O-N 3.46Å
746	V	61.2	Low	60.6	Low	99 Å²	99	98.1 Å²	98.1	60%	0.6	51%	0.508	S	S	*	.	H	α-helix	trans	-62.1	-43.6	171.8	168.6	0	0	0	0	111	L742 Q743 A749 S750	L742-V746 WeakPolarHBondContact O-CB 3.21Å; L742-V746 VanDerWaalsContact O-CG2 3.29Å; L742-V746 WeakPolarHBondContact O-CG2 3.22Å; L742-V746 PolarHBondContact O-N 2.99Å; Q743-V746 PolarHBondContact O-N 3.14Å; V746-A749 PolarHBondContact O-N 3.15Å; V746-S750 WeakPolarHBondContact O-CB 3.2Å; V746-S750 PolarHBondContact O-N 3.03Å
747	K	64.5	Low	60.9	Low	114 Å²	114	100.1 Å²	100.1	50%	0.496	51%	0.509	S	S	.	.	H	α-helix	trans	-60.8	-46.9	175.8	-177.1	-177.2	173.2	-167.4	0	111.6	Q743 E744 A749 S750 D751	Q743-K747 WeakPolarHBondContact O-CB 3.27Å; Q743-K747 PolarHBondContact O-N 3.41Å; E744-K747 PolarHBondContact O-N 3.29Å; K747-A749 VanDerWaalsContact C-N 3.35Å; K747-A749 PolarHBondContact O-N 2.92Å; K747-S750 WeakPolarHBondContact O-CB 3.35Å; K747-S750 PolarHBondContact O-N 2.78Å; K747-D751 WeakPolarHBondContact O-CB 3.25Å; K747-D751 PolarHBondContact O-N 3.3Å
748	R	57.7	Low	61.8	Low	147 Å²	147	96.1 Å²	96.1	56%	0.555	50%	0.497	S	S	*	.	H	α-helix	trans	-60.8	-40.9	175.4	-74.9	173.2	-170.3	-175.6	8.3	112.7	E744 L745 T752	E744-R748 WeakPolarHBondContact O-CB 3.32Å; E744-R748 VanDerWaalsContact O-CG 3.24Å; E744-R748 WeakPolarHBondContact O-CG 3.41Å; E744-R748 PolarHBondContact O-N 3.01Å; E744-R748 IonicContact OE1-CZ 3.58Å; E744-R748 IonicContact OE1-NE 3.67Å; E744-R748 PolarHBondContact OE1-NE 3Å; E744-R748 IonicContact OE1-NH2 3.69Å; E744-R748 PolarHBondContact OE1-NH2 2.74Å; L745-R748 PolarHBondContact O-N 3.05Å; R748-T752 VanDerWaalsContact O-CB 3.25Å; R748-T752 WeakPolarHBondContact O-CB 3.29Å; R748-T752 PolarHBondContact O-N 3.37Å; R748-T752 PolarHBondContact O-OG1 3.2Å
749	A	53.3	Low	62.3	Low	58 Å²	58	96.1 Å²	96.1	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-63.5	-44.9	175.5	0	0	0	0	0	111.2	L745 V746 K747 T752 N753	L745-A749 WeakPolarHBondContact O-CB 3.33Å; L745-A749 PolarHBondContact O-N 3.46Å; V746-A749 PolarHBondContact O-N 3.15Å; K747-A749 VanDerWaalsContact C-N 3.35Å; K747-A749 PolarHBondContact O-N 2.92Å; A749-T752 PolarHBondContact O-N 3.44Å; A749-N753 PolarHBondContact O-N 2.91Å
750	S	61.2	Low	62.9	Low	68 Å²	68	97.7 Å²	97.7	48%	0.476	51%	0.505	S	S	.	.	H	α-helix	trans	-60.8	-52.9	175.6	-174.6	0	0	0	0	112.1	V746 K747 T752 N753 L754	V746-S750 WeakPolarHBondContact O-CB 3.2Å; V746-S750 PolarHBondContact O-N 3.03Å; K747-S750 WeakPolarHBondContact O-CB 3.35Å; K747-S750 PolarHBondContact O-N 2.78Å; S750-T752 VanDerWaalsContact C-N 3.26Å; S750-T752 PolarHBondContact O-N 3.48Å; S750-N753 PolarHBondContact O-N 3.46Å; S750-L754 WeakPolarHBondContact O-CB 3.26Å; S750-L754 PolarHBondContact O-N 3.02Å
751	D	63.2	Low	63.4	Low	62 Å²	62	98.1 Å²	98.1	33%	0.332	50%	0.504	S	S	.	.	H	α-helix	trans	-58.2	-38	178.2	-76.3	-4.6	0	0	0	112.2	K747 L754 K755	K747-D751 WeakPolarHBondContact O-CB 3.25Å; K747-D751 PolarHBondContact O-N 3.3Å; D751-L754 PolarHBondContact O-N 2.92Å; D751-K755 WeakPolarHBondContact O-CB 3.33Å; D751-K755 VanDerWaalsContact O-CD 3.28Å; D751-K755 WeakPolarHBondContact O-CD 3.48Å; D751-K755 WeakPolarHBondContact O-CG 3.36Å; D751-K755 PolarHBondContact O-N 2.86Å
752	T	61.7	Low	64.2	Low	96 Å²	96	95.9 Å²	95.9	59%	0.589	50%	0.502	S	S	*	.	H	α-helix	trans	-70.4	-41.6	178.6	-56.8	0	0	0	0	111.1	R748 A749 S750 K755 G756	R748-T752 VanDerWaalsContact O-CB 3.25Å; R748-T752 WeakPolarHBondContact O-CB 3.29Å; R748-T752 PolarHBondContact O-N 3.37Å; R748-T752 PolarHBondContact O-OG1 3.2Å; A749-T752 PolarHBondContact O-N 3.44Å; S750-T752 VanDerWaalsContact C-N 3.26Å; S750-T752 PolarHBondContact O-N 3.48Å; T752-K755 PolarHBondContact O-N 2.94Å; T752-G756 PolarHBondContact O-N 2.8Å
753	N	61.3	Low	64.9	Low	101 Å²	101	98.5 Å²	98.5	54%	0.54	51%	0.505	S	S	.	.	H	α-helix	trans	-64.1	-41.9	172.5	-173.2	72.2	0	0	0	111.8	A749 S750 K755 G756 E757	A749-N753 PolarHBondContact O-N 2.91Å; S750-N753 PolarHBondContact O-N 3.46Å; N753-K755 PolarHBondContact O-N 3.47Å; N753-G756 CarbonylContact O-C 3.6Å; N753-G756 WeakPolarHBondContact O-CA 3.34Å; N753-G756 PolarHBondContact O-N 3.47Å; N753-G756 VanDerWaalsContact O-N 3.13Å; N753-E757 PolarHBondContact O-N 2.8Å
754	L	68.3	Low	65.6	Low	115 Å²	115	96.9 Å²	96.9	60%	0.602	50%	0.504	S	S	*	.	H	α-helix	trans	-63.1	-42.4	179.1	-150.2	84.5	0	0	0	111.7	S750 D751 G756 E757 A758	S750-L754 WeakPolarHBondContact O-CB 3.26Å; S750-L754 PolarHBondContact O-N 3.02Å; D751-L754 PolarHBondContact O-N 2.92Å; L754-G756 VanDerWaalsContact C-N 3.34Å; L754-E757 PolarHBondContact O-N 3.29Å; L754-A758 WeakPolarHBondContact O-CB 3.13Å; L754-A758 PolarHBondContact O-N 2.81Å
755	K	68.8	Low	66.1	Low	137 Å²	137	95.9 Å²	95.9	60%	0.596	51%	0.505	S	S	*	.	H	α-helix	trans	-63.6	-39.4	172.2	-72.1	160.7	-168.8	160.8	0	111.5	D751 T752 N753 A758 L759	D751-K755 WeakPolarHBondContact O-CB 3.33Å; D751-K755 VanDerWaalsContact O-CD 3.28Å; D751-K755 WeakPolarHBondContact O-CD 3.48Å; D751-K755 WeakPolarHBondContact O-CG 3.36Å; D751-K755 PolarHBondContact O-N 2.86Å; T752-K755 PolarHBondContact O-N 2.94Å; N753-K755 PolarHBondContact O-N 3.47Å; K755-A758 PolarHBondContact O-N 2.93Å; K755-L759 WeakPolarHBondContact O-CB 3.3Å; K755-L759 PolarHBondContact O-N 2.89Å
756	G	64.6	Low	66.7	Low	35 Å²	35	96.2 Å²	96.2	36%	0.361	51%	0.505	S	S	.	.	H	α-helix	trans	-59.2	-51.2	173.2	0	0	0	0	0	112.6	T752 N753 L754 L759 H760	T752-G756 PolarHBondContact O-N 2.8Å; N753-G756 CarbonylContact O-C 3.6Å; N753-G756 WeakPolarHBondContact O-CA 3.34Å; N753-G756 PolarHBondContact O-N 3.47Å; N753-G756 VanDerWaalsContact O-N 3.13Å; L754-G756 VanDerWaalsContact C-N 3.34Å; G756-L759 PolarHBondContact O-N 3.48Å; G756-H760 WeakPolarHBondContact O-CB 3.2Å; G756-H760 PolarHBondContact O-N 3.23Å
757	E	65.1	Low	67.2	Low	89 Å²	89	97.3 Å²	97.3	42%	0.416	50%	0.502	S	S	.	.	H	α-helix	trans	-62.1	-43.7	175.7	-87.3	-160.4	-150.4	0	0	113.1	N753 L754 L759 H760 K761	N753-E757 PolarHBondContact O-N 2.8Å; L754-E757 PolarHBondContact O-N 3.29Å; E757-L759 VanDerWaalsContact C-N 3.33Å; E757-L759 PolarHBondContact O-N 3.43Å; E757-H760 PolarHBondContact O-N 3.08Å; E757-H760 VanDerWaalsContact O-N 3.17Å; E757-K761 WeakPolarHBondContact O-CB 3.34Å; E757-K761 VanDerWaalsContact O-CG 3.31Å; E757-K761 WeakPolarHBondContact O-CG 3.13Å; E757-K761 PolarHBondContact O-N 2.93Å; E757-K761 WeakPolarHBondContact OE2-CE 3.38Å; E757-K761 IonicContact OE2-NZ 3.81Å; E757-K761 PolarHBondContact OE2-NZ 3.06Å
758	A	70.3	Confident	67.6	Low	47 Å²	47	93.6 Å²	93.6	39%	0.388	49%	0.493	S	S	.	.	H	α-helix	trans	-60.8	-44.6	178	0	0	0	0	0	111	L754 K755 H760 K761 L762	L754-A758 WeakPolarHBondContact O-CB 3.13Å; L754-A758 PolarHBondContact O-N 2.81Å; K755-A758 PolarHBondContact O-N 2.93Å; A758-H760 VanDerWaalsContact C-N 3.35Å; A758-H760 PolarHBondContact O-N 3.32Å; A758-K761 PolarHBondContact O-N 3.04Å; A758-L762 WeakPolarHBondContact O-CB 3.47Å; A758-L762 VanDerWaalsContact O-CG 3.32Å; A758-L762 WeakPolarHBondContact O-CG 3.32Å; A758-L762 PolarHBondContact O-N 3.44Å
759	L	69.8	Low	68.5	Low	105 Å²	105	91.2 Å²	91.2	55%	0.55	49%	0.488	S	S	.	.	H	α-helix	trans	-61.2	-42.8	172.9	-173.6	67.3	0	0	0	111.3	K755 G756 E757 K761 L762 W763	K755-L759 WeakPolarHBondContact O-CB 3.3Å; K755-L759 PolarHBondContact O-N 2.89Å; G756-L759 PolarHBondContact O-N 3.48Å; E757-L759 VanDerWaalsContact C-N 3.33Å; E757-L759 PolarHBondContact O-N 3.43Å; L759-K761 VanDerWaalsContact C-N 3.29Å; L759-K761 PolarHBondContact O-N 2.93Å; L759-L762 PolarHBondContact O-N 2.98Å; L759-W763 VanDerWaalsContact O-CB 3.26Å; L759-W763 WeakPolarHBondContact O-CB 3.18Å; L759-W763 PolarHBondContact O-N 3.11Å
760	H	68.9	Low	69.4	Low	151 Å²	151	91.9 Å²	91.9	70%	0.699	48%	0.482	S	S	*	.	H	α-helix	trans	-66	-28.6	179.2	-127.6	-55.9	0	0	0	113.7	G756 E757 A758 P764	G756-H760 WeakPolarHBondContact O-CB 3.2Å; G756-H760 PolarHBondContact O-N 3.23Å; E757-H760 PolarHBondContact O-N 3.08Å; E757-H760 VanDerWaalsContact O-N 3.17Å; A758-H760 VanDerWaalsContact C-N 3.35Å; A758-H760 PolarHBondContact O-N 3.32Å; H760-P764 WeakPolarHBondContact O-CD 3.21Å
761	K	74.5	Confident	70	Confident	146 Å²	146	91.9 Å²	91.9	64%	0.635	48%	0.479	S	S	*	.	H	α-helix	trans	-80.4	-34.2	174.8	-71.2	163.7	-173.1	164.7	0	112.5	E757 A758 L759	E757-K761 WeakPolarHBondContact O-CB 3.34Å; E757-K761 VanDerWaalsContact O-CG 3.31Å; E757-K761 WeakPolarHBondContact O-CG 3.13Å; E757-K761 PolarHBondContact O-N 2.93Å; E757-K761 WeakPolarHBondContact OE2-CE 3.38Å; E757-K761 IonicContact OE2-NZ 3.81Å; E757-K761 PolarHBondContact OE2-NZ 3.06Å; A758-K761 PolarHBondContact O-N 3.04Å; L759-K761 VanDerWaalsContact C-N 3.29Å; L759-K761 PolarHBondContact O-N 2.93Å
762	L	72.9	Confident	70.5	Confident	94 Å²	94	95.5 Å²	95.5	49%	0.492	49%	0.488	S	S	.	.	H	α-helix	trans	-80.6	-29.5	176.8	-71.3	165.8	0	0	0	113.2	A758 L759 S765 M766	A758-L762 WeakPolarHBondContact O-CB 3.47Å; A758-L762 VanDerWaalsContact O-CG 3.32Å; A758-L762 WeakPolarHBondContact O-CG 3.32Å; A758-L762 PolarHBondContact O-N 3.44Å; L759-L762 PolarHBondContact O-N 2.98Å; L762-S765 PolarHBondContact O-N 2.96Å; L762-S765 VanDerWaalsContact O-N 3.07Å; L762-S765 PolarHBondContact O-OG 3.35Å; L762-M766 HydrophobicContact CB-SD 4.2Å; L762-M766 WeakPolarHBondContact O-CG 3.32Å; L762-M766 PolarHBondContact O-N 3.34Å
763	W	74.4	Confident	71	Confident	153 Å²	153	94.1 Å²	94.1	58%	0.58	48%	0.477	S	S	*	.	H	α-helix	trans	-53.1	-43.8	-175.9	-179.6	-101.3	0	0	0	114.2	L759 S765 F767	L759-W763 VanDerWaalsContact O-CB 3.26Å; L759-W763 WeakPolarHBondContact O-CB 3.18Å; L759-W763 PolarHBondContact O-N 3.11Å; W763-S765 PolarHBondContact O-N 3.33Å; W763-F767 VanDerWaalsContact O-CB 3.23Å; W763-F767 WeakPolarHBondContact O-CB 3.48Å; W763-F767 PolarHBondContact O-N 2.83Å
764	P	75.1	Confident	71.3	Confident	80 Å²	80	91.5 Å²	91.5	52%	0.519	47%	0.467	S	S	.	.	H	α-helix	trans	-66.5	-35.1	177.1	-21	34.5	0	0	0	113.7	H760 A768	H760-P764 WeakPolarHBondContact O-CD 3.21Å; P764-A768 VanDerWaalsContact O-CB 3.23Å; P764-A768 WeakPolarHBondContact O-CB 3.47Å; P764-A768 PolarHBondContact O-N 2.96Å
765	S	72.2	Confident	71.3	Confident	48 Å²	48	90.2 Å²	90.2	34%	0.336	46%	0.463	S	S	.	.	H	α-helix	trans	-75.1	-42.7	177.8	69.5	0	0	0	0	111.2	L762 W763 F767 A768 E769	L762-S765 PolarHBondContact O-N 2.96Å; L762-S765 VanDerWaalsContact O-N 3.07Å; L762-S765 PolarHBondContact O-OG 3.35Å; W763-S765 PolarHBondContact O-N 3.33Å; S765-F767 VanDerWaalsContact C-N 3.33Å; S765-F767 PolarHBondContact O-N 3.31Å; S765-A768 CarbonylContact O-C 3.59Å; S765-A768 PolarHBondContact O-N 3.28Å; S765-E769 WeakPolarHBondContact O-CB 3.25Å; S765-E769 WeakPolarHBondContact O-CG 3.47Å; S765-E769 PolarHBondContact O-N 3.36Å
766	M	71.6	Confident	71.2	Confident	75 Å²	75	88.1 Å²	88.1	37%	0.369	46%	0.458	S	S	.	.	H	α-helix	trans	-59.2	-43.5	173.5	-68.6	178.4	69.7	0	0	111.5	L762 E769 M770	L762-M766 HydrophobicContact CB-SD 4.2Å; L762-M766 WeakPolarHBondContact O-CG 3.32Å; L762-M766 PolarHBondContact O-N 3.34Å; M766-E769 PolarHBondContact O-N 3.36Å; M766-M770 WeakPolarHBondContact O-CB 3.16Å; M766-M770 VanDerWaalsContact O-CG 3.29Å; M766-M770 WeakPolarHBondContact O-CG 3.42Å; M766-M770 PolarHBondContact O-N 2.89Å
767	F	72.1	Confident	71.1	Confident	122 Å²	122	91.4 Å²	91.4	54%	0.535	46%	0.464	S	S	.	.	H	α-helix	trans	-65.5	-42.3	175.2	-176.5	-100.1	0	0	0	111.9	W763 S765 E769 M770 V771	W763-F767 VanDerWaalsContact O-CB 3.23Å; W763-F767 WeakPolarHBondContact O-CB 3.48Å; W763-F767 PolarHBondContact O-N 2.83Å; S765-F767 VanDerWaalsContact C-N 3.33Å; S765-F767 PolarHBondContact O-N 3.31Å; F767-E769 VanDerWaalsContact C-N 3.32Å; F767-E769 PolarHBondContact O-N 2.86Å; F767-M770 PolarHBondContact O-N 3.11Å; F767-V771 HydrophobicContact CD1-CG2 4.27Å; F767-V771 HydrophobicContact CE1-CG2 3.93Å; F767-V771 HydrophobicContact CE2-CG2 4.28Å; F767-V771 HydrophobicContact CZ-CG2 3.93Å; F767-V771 WeakPolarHBondContact O-CB 3.31Å; F767-V771 VanDerWaalsContact O-CG2 3.28Å; F767-V771 WeakPolarHBondContact O-CG2 3.39Å; F767-V771 PolarHBondContact O-N 3.36Å
768	A	72.8	Confident	70.9	Confident	37 Å²	37	93.1 Å²	93.1	31%	0.306	47%	0.473	S	S	.	.	H	α-helix	trans	-67.9	-28.9	176.1	0	0	0	0	0	113.3	P764 S765 R772	P764-A768 VanDerWaalsContact O-CB 3.23Å; P764-A768 WeakPolarHBondContact O-CB 3.47Å; P764-A768 PolarHBondContact O-N 2.96Å; S765-A768 CarbonylContact O-C 3.59Å; S765-A768 PolarHBondContact O-N 3.28Å; A768-R772 VanDerWaalsContact O-CB 3.26Å; A768-R772 WeakPolarHBondContact O-CB 3.28Å; A768-R772 VanDerWaalsContact O-CG 3.28Å; A768-R772 WeakPolarHBondContact O-CG 3.32Å; A768-R772 PolarHBondContact O-N 3.33Å; A768-R772 PolarHBondContact O-NE 3.43Å
769	E	76.3	Confident	70.6	Confident	97 Å²	97	100.5 Å²	100.5	45%	0.453	49%	0.491	S	S	.	.	H	α-helix	trans	-72	-52.5	170.9	-75	169.7	-179.3	0	0	110.7	S765 M766 F767 V771 R772 D773	S765-E769 WeakPolarHBondContact O-CB 3.25Å; S765-E769 WeakPolarHBondContact O-CG 3.47Å; S765-E769 PolarHBondContact O-N 3.36Å; M766-E769 PolarHBondContact O-N 3.36Å; F767-E769 VanDerWaalsContact C-N 3.32Å; F767-E769 PolarHBondContact O-N 2.86Å; E769-V771 VanDerWaalsContact C-N 3.25Å; E769-V771 PolarHBondContact O-N 2.85Å; E769-R772 CarbonylContact O-C 3.4Å; E769-R772 WeakPolarHBondContact O-CA 3.44Å; E769-R772 PolarHBondContact O-N 3.04Å; E769-D773 WeakPolarHBondContact O-CB 3.44Å; E769-D773 VanDerWaalsContact O-CG 3.25Å; E769-D773 PolarHBondContact O-N 2.8Å
770	M	72.6	Confident	70.2	Confident	72 Å²	72	99.9 Å²	99.9	36%	0.355	49%	0.489	S	S	.	.	H	α-helix	trans	-53.5	-41.6	174.3	-71.5	173.3	63.6	0	0	112.6	M766 F767 C774	M766-M770 WeakPolarHBondContact O-CB 3.16Å; M766-M770 VanDerWaalsContact O-CG 3.29Å; M766-M770 WeakPolarHBondContact O-CG 3.42Å; M766-M770 PolarHBondContact O-N 2.89Å; F767-M770 PolarHBondContact O-N 3.11Å; M770-C774 WeakPolarHBondContact O-CB 3.5Å; M770-C774 PolarHBondContact O-N 3.48Å; M770-C774 VanDerWaalsContact O-N 3.14Å; M770-C774 PolarHBondContact O-SG 3.37Å; M770-C774 VanDerWaalsContact O-SG 3.4Å
771	V	73.9	Confident	69.8	Low	68 Å²	68	103.1 Å²	103.1	41%	0.412	50%	0.495	S	S	.	.	H	α-helix	trans	-70.7	-39.8	175.8	171.5	0	0	0	0	111.8	F767 E769 V775	F767-V771 HydrophobicContact CD1-CG2 4.27Å; F767-V771 HydrophobicContact CE1-CG2 3.93Å; F767-V771 HydrophobicContact CE2-CG2 4.28Å; F767-V771 HydrophobicContact CZ-CG2 3.93Å; F767-V771 WeakPolarHBondContact O-CB 3.31Å; F767-V771 VanDerWaalsContact O-CG2 3.28Å; F767-V771 WeakPolarHBondContact O-CG2 3.39Å; F767-V771 PolarHBondContact O-N 3.36Å; E769-V771 VanDerWaalsContact C-N 3.25Å; E769-V771 PolarHBondContact O-N 2.85Å; V771-V775 HydrophobicContact CG1-CG2 4.47Å; V771-V775 WeakPolarHBondContact O-CB 3.3Å; V771-V775 WeakPolarHBondContact O-CG2 3.46Å; V771-V775 PolarHBondContact O-N 3.12Å
772	R	73.9	Confident	69.4	Low	137 Å²	137	98 Å²	98	52%	0.517	48%	0.483	S	S	.	.	H	α-helix	trans	-63.8	-44.1	174.3	-87.1	-175.7	-65.9	-124.5	1	112	A768 E769 V775 L776	A768-R772 VanDerWaalsContact O-CB 3.26Å; A768-R772 WeakPolarHBondContact O-CB 3.28Å; A768-R772 VanDerWaalsContact O-CG 3.28Å; A768-R772 WeakPolarHBondContact O-CG 3.32Å; A768-R772 PolarHBondContact O-N 3.33Å; A768-R772 PolarHBondContact O-NE 3.43Å; E769-R772 CarbonylContact O-C 3.4Å; E769-R772 WeakPolarHBondContact O-CA 3.44Å; E769-R772 PolarHBondContact O-N 3.04Å; R772-V775 CarbonylContact O-C 3.38Å; R772-V775 PolarHBondContact O-N 2.97Å; R772-V775 VanDerWaalsContact O-N 3.14Å; R772-L776 WeakPolarHBondContact O-CB 3.21Å; R772-L776 VanDerWaalsContact O-CG 3.25Å; R772-L776 WeakPolarHBondContact O-CG 3.38Å; R772-L776 PolarHBondContact O-N 3.45Å
773	D	70.8	Confident	69.1	Low	67 Å²	67	95.7 Å²	95.7	36%	0.358	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-47.1	-177.8	-66.5	-13.5	0	0	0	110	H38 E769 V775 L776 E777	H38-D773 IonicContact CE1-OD2 3.52Å; E769-D773 WeakPolarHBondContact O-CB 3.44Å; E769-D773 VanDerWaalsContact O-CG 3.25Å; E769-D773 PolarHBondContact O-N 2.8Å; D773-V775 VanDerWaalsContact C-N 3.32Å; D773-V775 PolarHBondContact O-N 2.99Å; D773-L776 PolarHBondContact O-N 2.96Å; D773-E777 WeakPolarHBondContact O-CB 3.41Å; D773-E777 WeakPolarHBondContact O-CG 3.24Å; D773-E777 PolarHBondContact O-N 3.19Å
774	C	67.4	Low	68.7	Low	47 Å²	47	92.6 Å²	92.6	32%	0.318	47%	0.468	S	S	.	.	H	α-helix	trans	-59.5	-38.2	171.4	-71.7	0	0	0	0	113.1	M770 M778	M770-C774 WeakPolarHBondContact O-CB 3.5Å; M770-C774 PolarHBondContact O-N 3.48Å; M770-C774 VanDerWaalsContact O-N 3.14Å; M770-C774 PolarHBondContact O-SG 3.37Å; M770-C774 VanDerWaalsContact O-SG 3.4Å; C774-M778 WeakPolarHBondContact O-CB 3.43Å; C774-M778 WeakPolarHBondContact O-CG 3.32Å; C774-M778 PolarHBondContact O-N 3.4Å
775	V	69.8	Low	68.3	Low	88 Å²	88	97.5 Å²	97.5	53%	0.533	48%	0.477	S	S	.	.	H	α-helix	trans	-74	-31	177.8	168.6	0	0	0	0	112.5	V771 R772 D773 M778 R779	V771-V775 HydrophobicContact CG1-CG2 4.47Å; V771-V775 WeakPolarHBondContact O-CB 3.3Å; V771-V775 WeakPolarHBondContact O-CG2 3.46Å; V771-V775 PolarHBondContact O-N 3.12Å; R772-V775 CarbonylContact O-C 3.38Å; R772-V775 PolarHBondContact O-N 2.97Å; R772-V775 VanDerWaalsContact O-N 3.14Å; D773-V775 VanDerWaalsContact C-N 3.32Å; D773-V775 PolarHBondContact O-N 2.99Å; V775-M778 CarbonylContact O-C 3.58Å; V775-M778 PolarHBondContact O-N 3.27Å; V775-R779 PolarHBondContact O-N 3.16Å
776	L	66.4	Low	68.2	Low	93 Å²	93	102.1 Å²	102.1	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-73.9	-43.4	175.2	-75.2	168.8	0	0	0	111.2	R772 D773 M778 R779	R772-L776 WeakPolarHBondContact O-CB 3.21Å; R772-L776 VanDerWaalsContact O-CG 3.25Å; R772-L776 WeakPolarHBondContact O-CG 3.38Å; R772-L776 PolarHBondContact O-N 3.45Å; D773-L776 PolarHBondContact O-N 2.96Å; L776-M778 VanDerWaalsContact C-N 3.27Å; L776-M778 PolarHBondContact O-N 2.87Å; L776-R779 WeakPolarHBondContact O-CB 3.16Å; L776-R779 PolarHBondContact O-N 2.77Å
777	E	61.6	Low	68.2	Low	104 Å²	104	101 Å²	101	49%	0.486	50%	0.496	S	S	.	.	H	α-helix	trans	-53.5	-46	167.2	-77.8	-167.8	144	0	0	110.5	D773 R779 F784	D773-E777 WeakPolarHBondContact O-CB 3.41Å; D773-E777 WeakPolarHBondContact O-CG 3.24Å; D773-E777 PolarHBondContact O-N 3.19Å; E777-R779 VanDerWaalsContact C-N 3.26Å; E777-R779 PolarHBondContact O-N 3.36Å; E777-F784 HydrophobicContact CB-CD2 3.83Å; E777-F784 HydrophobicContact CB-CE2 3.87Å; E777-F784 VanDerWaalsContact O-CB 3.29Å; E777-F784 WeakPolarHBondContact O-CB 3.38Å; E777-F784 WeakPolarHBondContact O-CD2 3.34Å; E777-F784 WeakPolarHBondContact O-CG 3.36Å
778	M	62.1	Low	68	Low	124 Å²	124	97.4 Å²	97.4	61%	0.611	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-11.1	176.8	-72.3	176.7	65.5	0	0	115	C774 V775 L776	C774-M778 WeakPolarHBondContact O-CB 3.43Å; C774-M778 WeakPolarHBondContact O-CG 3.32Å; C774-M778 PolarHBondContact O-N 3.4Å; V775-M778 CarbonylContact O-C 3.58Å; V775-M778 PolarHBondContact O-N 3.27Å; L776-M778 VanDerWaalsContact C-N 3.27Å; L776-M778 PolarHBondContact O-N 2.87Å
779	R	63.1	Low	67.9	Low	203 Å²	203	100.5 Å²	100.5	77%	0.766	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-37.7	-174.5	-158.1	177.3	81.4	171.1	4.8	112.3	V775 L776 E777 R781	V775-R779 PolarHBondContact O-N 3.16Å; L776-R779 WeakPolarHBondContact O-CB 3.16Å; L776-R779 PolarHBondContact O-N 2.77Å; E777-R779 VanDerWaalsContact C-N 3.26Å; E777-R779 PolarHBondContact O-N 3.36Å; R779-R781 PolarHBondContact O-N 3.34Å
780	D	62.1	Low	67.7	Low	92 Å²	92	97.9 Å²	97.9	49%	0.492	49%	0.491	S	S	.	.			trans	-91.1	88	170.7	-167.7	-22.7	0	0	0	110.7	G782 A783 F784	D780-G782 PolarHBondContact O-N 3.26Å; D780-G782 VanDerWaalsContact O-N 3.12Å; D780-G782 WeakPolarHBondContact OD1-CA 3.29Å; D780-G782 PolarHBondContact OD1-N 2.89Å; D780-A783 HydrophobicContact CB-CB 4.06Å; D780-A783 VanDerWaalsContact CG-CB 3.44Å; D780-A783 PolarHBondContact O-N 2.88Å; D780-A783 PolarHBondContact OD1-N 2.97Å; D780-A783 VanDerWaalsContact OD2-CB 3.29Å; D780-A783 WeakPolarHBondContact OD2-CB 3.28Å; D780-F784 WeakPolarHBondContact O-CB 3.43Å; D780-F784 PolarHBondContact O-N 3.22Å
781	R	60.7	Low	67.6	Low	219 Å²	219	101.2 Å²	101.2	83%	0.826	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-14	175.7	-70.5	-178.7	170	-174.1	-3.3	114.2	R779 R785	R779-R781 PolarHBondContact O-N 3.34Å; R781-R785 VanDerWaalsContact O-CB 3.3Å; R781-R785 WeakPolarHBondContact O-CB 3.2Å
782	G	66.5	Low	67.1	Low	38 Å²	38	103.7 Å²	103.7	39%	0.392	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-64.1	172.8	0	0	0	0	0	110.8	D780 F784 R785 Q786	D780-G782 PolarHBondContact O-N 3.26Å; D780-G782 VanDerWaalsContact O-N 3.12Å; D780-G782 WeakPolarHBondContact OD1-CA 3.29Å; D780-G782 PolarHBondContact OD1-N 2.89Å; G782-F784 PolarHBondContact O-N 2.96Å; G782-R785 WeakPolarHBondContact O-CB 3.25Å; G782-R785 PolarHBondContact O-N 2.95Å; G782-R785 VanDerWaalsContact O-N 3.15Å; G782-Q786 PolarHBondContact O-N 3.42Å
783	A	66.3	Low	66.9	Low	46 Å²	46	102 Å²	102	38%	0.38	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-40.7	-176.9	0	0	0	0	0	112.6	D780 R785 Q786 A787	D780-A783 HydrophobicContact CB-CB 4.06Å; D780-A783 VanDerWaalsContact CG-CB 3.44Å; D780-A783 PolarHBondContact O-N 2.88Å; D780-A783 PolarHBondContact OD1-N 2.97Å; D780-A783 VanDerWaalsContact OD2-CB 3.29Å; D780-A783 WeakPolarHBondContact OD2-CB 3.28Å; A783-R785 VanDerWaalsContact C-N 3.29Å; A783-R785 PolarHBondContact O-N 3.07Å; A783-Q786 PolarHBondContact O-N 3.32Å; A783-A787 VanDerWaalsContact O-CB 3.26Å; A783-A787 WeakPolarHBondContact O-CB 3.48Å; A783-A787 PolarHBondContact O-N 3.03Å
784	F	66.2	Low	66.5	Low	87 Å²	87	106.6 Å²	106.6	38%	0.382	54%	0.539	S	S	.	.	H	α-helix	trans	-62.9	-36.8	176.1	-174.7	-98.2	0	0	0	112.3	E777 D780 G782 S788	E777-F784 HydrophobicContact CB-CD2 3.83Å; E777-F784 HydrophobicContact CB-CE2 3.87Å; E777-F784 VanDerWaalsContact O-CB 3.29Å; E777-F784 WeakPolarHBondContact O-CB 3.38Å; E777-F784 WeakPolarHBondContact O-CD2 3.34Å; E777-F784 WeakPolarHBondContact O-CG 3.36Å; D780-F784 WeakPolarHBondContact O-CB 3.43Å; D780-F784 PolarHBondContact O-N 3.22Å; G782-F784 PolarHBondContact O-N 2.96Å; F784-S788 VanDerWaalsContact O-CB 3.22Å; F784-S788 WeakPolarHBondContact O-CB 3.44Å; F784-S788 PolarHBondContact O-N 3.24Å; F784-S788 PolarHBondContact O-OG 3.45Å
785	R	66.8	Low	65.9	Low	184 Å²	184	109.8 Å²	109.8	69%	0.694	56%	0.557	S	S	*	*	H	α-helix	trans	-71.5	-40.5	177.7	-166.1	178.2	-167.7	178.4	3.4	111.2	R781 G782 A783 L789	R781-R785 VanDerWaalsContact O-CB 3.3Å; R781-R785 WeakPolarHBondContact O-CB 3.2Å; G782-R785 WeakPolarHBondContact O-CB 3.25Å; G782-R785 PolarHBondContact O-N 2.95Å; G782-R785 VanDerWaalsContact O-N 3.15Å; A783-R785 VanDerWaalsContact C-N 3.29Å; A783-R785 PolarHBondContact O-N 3.07Å; R785-L789 HydrophobicContact CG-CD1 4.4Å; R785-L789 WeakPolarHBondContact O-CB 3.06Å; R785-L789 WeakPolarHBondContact O-CD1 3.17Å; R785-L789 VanDerWaalsContact O-CG 3.27Å; R785-L789 WeakPolarHBondContact O-CG 3.42Å; R785-L789 PolarHBondContact O-N 3.16Å
786	Q	69.1	Low	64.7	Low	144 Å²	144	117.3 Å²	117.3	67%	0.673	58%	0.582	S	S	*	*	H	α-helix	trans	-66.7	-44.7	173.2	-76.3	-177.6	-36.5	0	0	112.3	G782 A783 S788 L789 A790	G782-Q786 PolarHBondContact O-N 3.42Å; A783-Q786 PolarHBondContact O-N 3.32Å; Q786-S788 PolarHBondContact O-N 3.43Å; Q786-L789 PolarHBondContact O-N 3.01Å; Q786-A790 VanDerWaalsContact O-CB 3.31Å; Q786-A790 WeakPolarHBondContact O-CB 3.23Å; Q786-A790 PolarHBondContact O-N 3Å
787	A	71.1	Confident	64.6	Low	52 Å²	52	118.5 Å²	118.5	43%	0.43	59%	0.587	S	S	.	*	H	α-helix	trans	-66	-36.1	177.7	0	0	0	0	0	112.6	A783 K791	A783-A787 VanDerWaalsContact O-CB 3.26Å; A783-A787 WeakPolarHBondContact O-CB 3.48Å; A783-A787 PolarHBondContact O-N 3.03Å; A787-K791 PolarHBondContact O-N 2.92Å
788	S	68.2	Low	64.7	Low	46 Å²	46	119.3 Å²	119.3	32%	0.322	59%	0.592	S	S	.	*	H	α-helix	trans	-67.2	-40.9	172.5	-61.8	0	0	0	0	112	F784 Q786 L792	F784-S788 VanDerWaalsContact O-CB 3.22Å; F784-S788 WeakPolarHBondContact O-CB 3.44Å; F784-S788 PolarHBondContact O-N 3.24Å; F784-S788 PolarHBondContact O-OG 3.45Å; Q786-S788 PolarHBondContact O-N 3.43Å; S788-L792 WeakPolarHBondContact O-CB 3.26Å; S788-L792 WeakPolarHBondContact O-CD1 3.35Å; S788-L792 VanDerWaalsContact O-CG 3.3Å; S788-L792 WeakPolarHBondContact O-CG 3.38Å; S788-L792 PolarHBondContact O-N 3.1Å; S788-L792 VanDerWaalsContact O-N 3.12Å
789	L	71.3	Confident	64.9	Low	102 Å²	102	119 Å²	119	53%	0.534	59%	0.591	S	S	.	*	H	α-helix	trans	-66.7	-41.7	174.1	-77.2	165.7	0	0	0	112	R785 Q786 L792 T793	R785-L789 HydrophobicContact CG-CD1 4.4Å; R785-L789 WeakPolarHBondContact O-CB 3.06Å; R785-L789 WeakPolarHBondContact O-CD1 3.17Å; R785-L789 VanDerWaalsContact O-CG 3.27Å; R785-L789 WeakPolarHBondContact O-CG 3.42Å; R785-L789 PolarHBondContact O-N 3.16Å; Q786-L789 PolarHBondContact O-N 3.01Å; L789-L792 CarbonylContact O-C 3.58Å; L789-L792 WeakPolarHBondContact O-CB 3.29Å; L789-L792 PolarHBondContact O-N 3.32Å; L789-T793 PolarHBondContact O-N 2.9Å; L789-T793 PolarHBondContact O-OG1 2.84Å
790	A	72.3	Confident	65	Low	42 Å²	42	114.1 Å²	114.1	35%	0.347	58%	0.581	S	S	.	*	H	α-helix	trans	-61.4	-48.3	177.7	0	0	0	0	0	111.5	Q786 L792 T793 E794	Q786-A790 VanDerWaalsContact O-CB 3.31Å; Q786-A790 WeakPolarHBondContact O-CB 3.23Å; Q786-A790 PolarHBondContact O-N 3Å; A790-L792 VanDerWaalsContact C-N 3.29Å; A790-L792 PolarHBondContact O-N 3.18Å; A790-T793 WeakPolarHBondContact CA-OG1 3.45Å; A790-T793 CarbonylContact O-C 3.49Å; A790-T793 PolarHBondContact O-N 3.3Å; A790-T793 PolarHBondContact O-OG1 2.86Å; A790-E794 PolarHBondContact O-N 3.48Å
791	K	69.9	Low	65.2	Low	142 Å²	142	115.4 Å²	115.4	62%	0.617	59%	0.586	S	S	*	*	H	α-helix	trans	-58.6	-39.4	173	-78.9	179.4	174.4	171.1	0	112.3	A787 T793 E794 T795	A787-K791 PolarHBondContact O-N 2.92Å; K791-T793 VanDerWaalsContact C-N 3.26Å; K791-T793 PolarHBondContact O-N 3.25Å; K791-E794 PolarHBondContact O-N 2.87Å; K791-T795 WeakPolarHBondContact O-CG2 3.32Å; K791-T795 PolarHBondContact O-N 3.46Å; K791-T795 VanDerWaalsContact O-N 3.07Å; K791-T795 PolarHBondContact O-OG1 3.29Å; K791-T795 VanDerWaalsContact O-OG1 3.11Å
792	L	64	Low	65.5	Low	120 Å²	120	108.5 Å²	108.5	63%	0.628	57%	0.57	S	S	*	*	H	α-helix	trans	-68.5	-20.7	175.3	-75.8	167.1	0	0	0	113.9	S788 L789 A790	S788-L792 WeakPolarHBondContact O-CB 3.26Å; S788-L792 WeakPolarHBondContact O-CD1 3.35Å; S788-L792 VanDerWaalsContact O-CG 3.3Å; S788-L792 WeakPolarHBondContact O-CG 3.38Å; S788-L792 PolarHBondContact O-N 3.1Å; S788-L792 VanDerWaalsContact O-N 3.12Å; L789-L792 CarbonylContact O-C 3.58Å; L789-L792 WeakPolarHBondContact O-CB 3.29Å; L789-L792 PolarHBondContact O-N 3.32Å; A790-L792 VanDerWaalsContact C-N 3.29Å; A790-L792 PolarHBondContact O-N 3.18Å
793	T	68.4	Low	65.4	Low	103 Å²	103	113.6 Å²	113.6	63%	0.632	58%	0.583	S	S	*	*	H	α-helix	trans	-91.5	-27.5	172.1	48.3	0	0	0	0	113.9	L789 A790 K791	L789-T793 PolarHBondContact O-N 2.9Å; L789-T793 PolarHBondContact O-OG1 2.84Å; A790-T793 WeakPolarHBondContact CA-OG1 3.45Å; A790-T793 CarbonylContact O-C 3.49Å; A790-T793 PolarHBondContact O-N 3.3Å; A790-T793 PolarHBondContact O-OG1 2.86Å; K791-T793 VanDerWaalsContact C-N 3.26Å; K791-T793 PolarHBondContact O-N 3.25Å
794	E	63.7	Low	65.3	Low	163 Å²	163	118.8 Å²	118.8	76%	0.762	60%	0.599	S	S	*	*	H	α-helix	trans	-77.1	-26.3	173.8	-72.3	-177.2	136.6	0	0	112.8	A790 K791 K796	A790-E794 PolarHBondContact O-N 3.48Å; K791-E794 PolarHBondContact O-N 2.87Å; E794-K796 PolarHBondContact O-N 3.5Å
795	T	54.3	Low	65.3	Low	114 Å²	114	121.4 Å²	121.4	70%	0.699	62%	0.617	S	S	*	*			trans	-87.9	43.7	174.3	63.4	0	0	0	0	112.5	K791	K791-T795 WeakPolarHBondContact O-CG2 3.32Å; K791-T795 PolarHBondContact O-N 3.46Å; K791-T795 VanDerWaalsContact O-N 3.07Å; K791-T795 PolarHBondContact O-OG1 3.29Å; K791-T795 VanDerWaalsContact O-OG1 3.11Å
796	K	44.3	Very low	65.1	Low	245 Å²	245	115.7 Å²	115.7	100%	1.065	61%	0.61	S	S	*	*			trans	-143.1	0	-175.8	-145.6	-170.8	-176.5	-166.9	0	113.8	E794	E794-K796 PolarHBondContact O-N 3.5Å

Retrieved 796 of 796 residues in 973.5 ms (Link to these results)

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