A0A087X331_POEFO Loading...

ATP-dependent RNA helicase

RNA helicase.

AlphaFold DB , UniProt , Accession A0A087X331, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 707 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.8	Very low	29.6	Very low	233 Å²	233	136 Å²	136	100%	1.148	76%	0.762	S	S	*	*				0	147.2	0	-72.6	165.4	158.6	0	0	108.3
2	T	26.1	Very low	29	Very low	129 Å²	129	134.8 Å²	134.8	79%	0.791	75%	0.753	S	S	*	*			trans	29.9	106.8	151.5	52.6	0	0	0	0	118.6
3	S	29.8	Very low	28.7	Very low	113 Å²	113	136 Å²	136	79%	0.79	75%	0.754	S	S	*	*				93.2	155.3	96.6	-111.6	0	0	0	0	113
4	S	33.5	Very low	28.4	Very low	99 Å²	99	134.3 Å²	134.3	69%	0.692	75%	0.754	S	S	*	*			cis	-146.4	141.3	2	-111.9	0	0	0	0	109
5	A	34.2	Very low	28.1	Very low	80 Å²	80	131.8 Å²	131.8	66%	0.661	75%	0.749	S	S	*	*				74.4	142.8	92.5	0	0	0	0	0	114
6	E	37.3	Very low	28.1	Very low	155 Å²	155	132 Å²	132	72%	0.724	75%	0.754	S	S	*	*			cis	-149.3	-155	-6.2	-132.8	166.3	-84.8	0	0	107.4
7	Q	31.7	Very low	28.4	Very low	144 Å²	144	130.9 Å²	130.9	67%	0.673	75%	0.752	S	S	*	*			cis	-163.1	160.1	5.6	-127.8	156.8	38.4	0	0	106.5
8	Q	27.4	Very low	28.2	Very low	154 Å²	154	129.1 Å²	129.1	72%	0.72	75%	0.749	S	S	*	*			cis	-152.6	-159.9	-1.4	-148.9	165.6	59.2	0	0	111.4
9	L	26.4	Very low	28.1	Very low	146 Å²	146	128.2 Å²	128.2	76%	0.764	75%	0.751	S	S	*	*			trans	-84.2	176.2	-171.8	-82.2	83.1	0	0	0	116.1
10	C	24.8	Very low	28	Very low	96 Å²	96	126.8 Å²	126.8	65%	0.649	75%	0.748	S	S	*	*			cis	-170.8	154.4	-26.9	-104.9	0	0	0	0	114.2
11	L	26.1	Very low	27.8	Very low	147 Å²	147	125.3 Å²	125.3	77%	0.77	75%	0.745	S	S	*	*			trans	59.8	146.7	135	-67	168.3	0	0	0	126.4
12	N	22.9	Very low	27.7	Very low	122 Å²	122	119 Å²	119	65%	0.652	72%	0.724	S	S	*	*			trans	93.8	89.9	143.6	-70.6	-4.2	0	0	0	124.8
13	I	25.4	Very low	27.6	Very low	150 Å²	150	118 Å²	118	77%	0.769	72%	0.722	S	S	*	*				66.5	129.1	104.7	-67.4	170.6	0	0	0	122.7
14	C	24	Very low	27.2	Very low	112 Å²	112	120.5 Å²	120.5	76%	0.757	73%	0.725	S	S	*	*			trans	91.9	115.6	149.9	-93	0	0	0	0	125.7
15	S	23.7	Very low	26.9	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	73%	0.734	S	S	*	*				63.2	118.4	126.9	66.5	0	0	0	0	125.3
16	V	29.1	Very low	26.3	Very low	135 Å²	135	126.4 Å²	126.4	82%	0.818	74%	0.739	S	S	*	*			trans	18.1	143.3	136.7	-85.1	0	0	0	0	121.4
17	P	32.9	Very low	25.7	Very low	113 Å²	113	123.8 Å²	123.8	73%	0.734	74%	0.738	S	S	*	*				-157.6	170	64.4	44.4	-23.9	0	0	0	121.4
18	S	25.1	Very low	25.4	Very low	98 Å²	98	127.4 Å²	127.4	69%	0.685	75%	0.745	S	S	*	*			trans	45.7	148.7	142.3	63.8	0	0	0	0	125.7
19	S	26.3	Very low	25.3	Very low	112 Å²	112	126.6 Å²	126.6	78%	0.783	74%	0.739	S	S	*	*			trans	72.2	157.5	157.1	75.9	0	0	0	0	118.2
20	S	24.5	Very low	25.2	Very low	100 Å²	100	130 Å²	130	70%	0.699	74%	0.742	S	S	*	*			cis	-163.4	170.8	-29.5	54.3	0	0	0	0	111.2
21	S	24.8	Very low	25.4	Very low	97 Å²	97	129.5 Å²	129.5	68%	0.678	75%	0.745	S	S	*	*			trans	59.9	122.5	147.5	55.2	0	0	0	0	123.1
22	S	25	Very low	25.4	Very low	101 Å²	101	131.7 Å²	131.7	71%	0.706	75%	0.748	S	S	*	*			trans	67.7	104.2	132.6	64.1	0	0	0	0	124
23	S	23.7	Very low	25.8	Very low	107 Å²	107	134 Å²	134	75%	0.748	76%	0.755	S	S	*	*				94.1	157.3	111.3	80.5	0	0	0	0	123.2
24	L	23.3	Very low	25.9	Very low	166 Å²	166	135.6 Å²	135.6	87%	0.869	76%	0.756	S	S	*	*			trans	84.4	146.5	160.1	-68.9	166.8	0	0	0	121.4
25	H	25.8	Very low	25.9	Very low	190 Å²	190	137.1 Å²	137.1	88%	0.88	75%	0.75	S	S	*	*			trans	-75.3	152.8	-178.7	-73.2	-65.5	0	0	0	113.2
26	C	21.9	Very low	26	Very low	113 Å²	113	142 Å²	142	76%	0.764	75%	0.753	S	S	*	*				-165.1	125.5	109.7	-154.6	0	0	0	0	115.2
27	S	24.3	Very low	25.9	Very low	99 Å²	99	141.3 Å²	141.3	69%	0.692	75%	0.75	S	S	*	*			trans	11	160	142.3	-47.2	0	0	0	0	124.3
28	R	26.3	Very low	25.6	Very low	220 Å²	220	140.8 Å²	140.8	83%	0.83	75%	0.749	S	S	*	*			trans	98.7	150.8	154.2	-56.7	179.3	178	-169.4	1	116.8
29	K	24.8	Very low	25.5	Very low	138 Å²	138	146.3 Å²	146.3	60%	0.6	76%	0.761	S	S	*	*			cis	-169.3	157	-25.3	-106.7	-171.6	-175.7	-174.5	0	108.9
30	W	24.3	Very low	25.5	Very low	217 Å²	217	150.3 Å²	150.3	82%	0.822	76%	0.764	S	S	*	*			trans	58.7	129.9	162.4	-66.5	-58.4	0	0	0	117.7
31	A	28.4	Very low	25.4	Very low	86 Å²	86	155 Å²	155	71%	0.711	78%	0.775	S	S	*	*			cis	80.3	122.4	17.3	0	0	0	0	0	118
32	K	27.9	Very low	25.4	Very low	192 Å²	192	159.5 Å²	159.5	84%	0.835	78%	0.782	S	S	*	*			trans	-164.6	122.9	159.9	-100.2	148	-175.5	176.9	0	106.9
33	H	29.4	Very low	26.2	Very low	172 Å²	172	159.6 Å²	159.6	80%	0.796	78%	0.78	S	S	*	*				74.7	149.8	81	-80.5	-39	0	0	0	113.7
34	K	28	Very low	26.4	Very low	182 Å²	182	161.4 Å²	161.4	79%	0.791	78%	0.777	S	S	*	*			cis	-156.8	170.1	20	-116.1	152.7	-178.1	-178	0	106.7
35	K	25.6	Very low	26.5	Very low	145 Å²	145	160.9 Å²	160.9	63%	0.63	77%	0.768	S	S	*	*			cis	-165.3	172.4	-10.1	-137.5	-166	172.5	-167.2	0	105.1
36	W	25.8	Very low	26.5	Very low	198 Å²	198	161.1 Å²	161.1	75%	0.75	77%	0.766	S	S	*	*			cis	-132.4	-108.4	-1.8	-164.2	-12.9	0	0	0	111.5
37	T	26.7	Very low	26.7	Very low	121 Å²	121	165 Å²	165	74%	0.742	77%	0.77	S	S	*	*			cis	-152.6	141.4	-6.1	-45.3	0	0	0	0	108.7
38	S	26.5	Very low	26.8	Very low	102 Å²	102	163.8 Å²	163.8	71%	0.713	76%	0.762	S	S	*	*			trans	-164.1	168.1	-178.5	-39.9	0	0	0	0	113.3
39	K	22.4	Very low	26.7	Very low	215 Å²	215	162.4 Å²	162.4	94%	0.935	76%	0.762	S	S	*	*			trans	-144.6	163.6	156.5	-111.2	179.9	179.3	-178.9	0	111.6
40	K	26.4	Very low	26.8	Very low	195 Å²	195	162.5 Å²	162.5	85%	0.848	77%	0.768	S	S	*	*			trans	-129.4	164.4	-171.4	-59.3	175.7	174.8	179.6	0	111.1
41	Q	22.2	Very low	26.8	Very low	198 Å²	198	156.9 Å²	156.9	93%	0.925	76%	0.761	S	S	*	*				-166.4	-177.4	123.3	-107.2	161	-11.6	0	0	114.2
42	K	25	Very low	27.8	Very low	192 Å²	192	156.8 Å²	156.8	84%	0.835	75%	0.754	S	S	*	*			trans	-146.3	-178.1	-172.5	-120.1	-167.6	177.7	-170.2	0	107
43	P	42	Very low	27.7	Very low	103 Å²	103	155 Å²	155	67%	0.669	75%	0.748	S	S	*	*			cis	-146.5	-176.8	22.9	44.7	-23.8	0	0	0	118.1
44	E	27.1	Very low	27.6	Very low	145 Å²	145	154.8 Å²	154.8	68%	0.678	75%	0.748	S	S	*	*			trans	38.2	160.4	137.6	-69.1	-178.2	179.1	0	0	124.3
45	K	26.8	Very low	27.5	Very low	156 Å²	156	153.8 Å²	153.8	68%	0.678	75%	0.746	S	S	*	*			cis	-167.4	152.4	13.3	-130.2	161.8	-173.1	145.9	0	114
46	K	25.2	Very low	27.6	Very low	195 Å²	195	153.6 Å²	153.6	85%	0.848	75%	0.752	S	S	*	*			trans	63.1	157	157.9	-74.8	179.7	179.2	-172.2	0	117.9
47	K	25.7	Very low	27.6	Very low	194 Å²	194	150.4 Å²	150.4	84%	0.843	75%	0.749	S	S	*	*			cis	-125.9	-120.9	33.1	-151.6	-158.9	176.3	-174.8	0	117.4
48	S	25.7	Very low	27.7	Very low	74 Å²	74	151 Å²	151	52%	0.517	75%	0.748	S	S	.	*			trans	-172.1	158.4	-153	65.3	0	0	0	0	117.7
49	F	25.1	Very low	27.8	Very low	190 Å²	190	155.1 Å²	155.1	83%	0.833	76%	0.756	S	S	*	*			trans	77.3	160.7	157.7	-78.7	-144.5	0	0	0	118.7
50	I	27.7	Very low	28.1	Very low	140 Å²	140	153.2 Å²	153.2	72%	0.718	75%	0.751	S	S	*	*			cis	-159.4	172.4	-32	-110.4	-179.1	0	0	0	108.6
51	S	23.2	Very low	28.4	Very low	99 Å²	99	147.6 Å²	147.6	69%	0.692	74%	0.74	S	S	*	*			trans	-89.1	-166.7	179.7	58.9	0	0	0	0	114.4
52	P	49.6	Very low	29.3	Very low	85 Å²	85	143.4 Å²	143.4	55%	0.552	73%	0.73	S	S	*	*			cis	-131.5	-147.5	-13.6	21.9	7.2	0	0	0	112.5
53	E	26.2	Very low	29.5	Very low	154 Å²	154	141.1 Å²	141.1	72%	0.72	73%	0.727	S	S	*	*			trans	71.1	155.3	155.5	-70.9	139.9	-161.5	0	0	117.7
54	E	27.1	Very low	28.9	Very low	168 Å²	168	145.1 Å²	145.1	79%	0.785	74%	0.736	S	S	*	*			cis	-151.2	-160.2	-5.6	-133.4	159.5	-147.6	0	0	112.8
55	E	25.9	Very low	28.9	Very low	161 Å²	161	142.7 Å²	142.7	75%	0.752	74%	0.741	S	S	*	*			trans	-95	165.6	-161.4	-62	167.8	140	0	0	116.1
56	D	26.7	Very low	29.5	Very low	141 Å²	141	141 Å²	141	75%	0.754	75%	0.746	S	S	*	*			trans	57.7	168.8	149.3	-56.1	-16.7	0	0	0	120.2
57	D	27.3	Very low	30.3	Very low	130 Å²	130	137.2 Å²	137.2	70%	0.695	74%	0.741	S	S	*	*			cis	-148.9	178	-0.8	-141.3	-22.6	0	0	0	112.7
58	D	27.5	Very low	30.6	Very low	135 Å²	135	134 Å²	134	72%	0.722	74%	0.74	S	S	*	*			trans	31	134.3	151.9	-85.7	-31.8	0	0	0	123.4
59	E	28.9	Very low	30.6	Very low	188 Å²	188	138.7 Å²	138.7	88%	0.879	75%	0.754	S	S	*	*				-162.7	151.2	102.7	-124.1	-173.1	-159.2	0	0	115.9
60	E	28.6	Very low	30.7	Very low	175 Å²	175	135.6 Å²	135.6	82%	0.818	75%	0.745	S	S	*	*			trans	-54.1	174.9	171.1	-73.4	-156.7	134.3	0	0	117.9
61	A	32.8	Very low	30.7	Very low	77 Å²	77	135.6 Å²	135.6	64%	0.636	75%	0.752	S	S	*	*			cis	-155.9	-114.5	-27.6	0	0	0	0	0	113
62	P	41.8	Very low	31	Very low	109 Å²	109	139.1 Å²	139.1	71%	0.708	76%	0.762	S	S	*	*				-123.9	176.9	-119.1	36.3	-19	0	0	0	116.2
63	L	29.6	Very low	29.9	Very low	145 Å²	145	138.6 Å²	138.6	76%	0.759	77%	0.772	S	S	*	*				175.1	106.3	121.6	-92.2	165	0	0	0	115
64	Q	28.9	Very low	30.1	Very low	186 Å²	186	137.2 Å²	137.2	87%	0.869	78%	0.776	S	S	*	*			trans	47.8	152.3	134.9	-64.7	-179.4	-4.3	0	0	124.6
65	A	26.3	Very low	30.4	Very low	94 Å²	94	134.9 Å²	134.9	78%	0.777	78%	0.776	S	S	*	*			trans	-90.3	-162.4	-176.8	0	0	0	0	0	112.1
66	P	39	Very low	30.4	Very low	121 Å²	121	136.6 Å²	136.6	79%	0.786	78%	0.784	S	S	*	*			cis	-136	-178.9	28.6	39.8	-18	0	0	0	116.5
67	P	42.6	Very low	30.6	Very low	115 Å²	115	140.1 Å²	140.1	75%	0.747	79%	0.792	S	S	*	*			trans	-104.2	-176.3	-179	41.3	-35.7	0	0	0	113.9
68	P	31.9	Very low	30.5	Very low	126 Å²	126	143.7 Å²	143.7	82%	0.818	80%	0.802	S	S	*	*			trans	-133.5	145.1	145.2	38	-26.5	0	0	0	116
69	E	25.3	Very low	30.8	Very low	174 Å²	174	149.2 Å²	149.2	81%	0.813	81%	0.813	S	S	*	*			trans	-73.4	176.8	157.4	-75.5	-171.4	128.4	0	0	111
70	L	28.3	Very low	30.5	Very low	124 Å²	124	152.3 Å²	152.3	65%	0.649	82%	0.816	S	S	*	*			cis	-164.3	158.5	-9.3	-117.2	167.6	0	0	0	106.5
71	T	27.6	Very low	30.6	Very low	141 Å²	141	155.6 Å²	155.6	87%	0.865	82%	0.821	S	S	*	*			trans	-175.6	154.5	143.3	13.2	0	0	0	0	112.6
72	L	28.7	Very low	30.1	Very low	173 Å²	173	160.7 Å²	160.7	91%	0.906	83%	0.832	S	S	*	*			trans	-122.8	145.4	179.9	-76.5	166.7	0	0	0	111.8
73	G	26.7	Very low	29.4	Very low	73 Å²	73	163.5 Å²	163.5	75%	0.753	84%	0.835	S	S	*	*			trans	-158.6	122.9	175	0	0	0	0	0	112.4
74	P	31.4	Very low	29.1	Very low	125 Å²	125	165.9 Å²	165.9	81%	0.812	84%	0.842	S	S	*	*			trans	-106.8	-176.2	-175.5	44	-37.8	0	0	0	112.2
75	P	32.8	Very low	29.1	Very low	119 Å²	119	163.1 Å²	163.1	77%	0.773	84%	0.838	S	S	*	*				-130.2	148.9	-71.2	36.8	-21.9	0	0	0	112.8
76	Q	26	Very low	29.1	Very low	197 Å²	197	168.6 Å²	168.6	92%	0.921	84%	0.844	S	S	*	*			trans	-130.2	127.4	169.5	-71.1	-161.1	0.9	0	0	114	K78	Q76-K78 PolarHBondContact O-N 3.02Å
77	K	30.5	Very low	28.5	Very low	215 Å²	215	171.8 Å²	171.8	94%	0.935	85%	0.849	S	S	*	*			trans	-78.6	114.1	179.8	-68.8	174.2	178.5	170.6	0	111.7
78	K	25.9	Very low	27.8	Very low	205 Å²	205	170.3 Å²	170.3	89%	0.891	85%	0.854	S	S	*	*			trans	-133.7	120	154.9	-87.1	177.1	179.4	165.3	0	110.6	Q76	Q76-K78 PolarHBondContact O-N 3.02Å
79	R	33.3	Very low	27.5	Very low	252 Å²	252	168.3 Å²	168.3	95%	0.951	86%	0.856	S	S	*	*			trans	-80	118.9	178	-67.4	165.4	71.1	-176.3	4.8	109.9
80	R	23.2	Very low	27.7	Very low	252 Å²	252	165.4 Å²	165.4	95%	0.951	86%	0.856	S	S	*	*			trans	-147.6	156.4	156.1	-111.2	178.9	-179.2	-172	-1.2	110.6
81	R	29.6	Very low	28.1	Very low	245 Å²	245	163.1 Å²	163.1	93%	0.925	86%	0.862	S	S	*	*			trans	-75.3	147.7	178	-68.9	170.1	164.8	168.4	-8.4	110.5
82	Q	22.5	Very low	28.2	Very low	184 Å²	184	161.5 Å²	161.5	86%	0.86	86%	0.857	S	S	*	*			trans	-151.6	167.1	138.1	-129.8	160.9	-16	0	0	110.1
83	E	26.6	Very low	28.5	Very low	167 Å²	167	158.5 Å²	158.5	78%	0.78	84%	0.84	S	S	*	*			trans	-77.2	153.9	179.8	-61.3	110.6	130.8	0	0	113.1
84	E	23.7	Very low	28.9	Very low	195 Å²	195	164.7 Å²	164.7	91%	0.911	85%	0.846	S	S	*	*			trans	-123.5	132.8	152.5	-76.7	-163.1	125.5	0	0	109.6
85	V	28.6	Very low	29.3	Very low	129 Å²	129	161.9 Å²	161.9	78%	0.782	83%	0.827	S	S	*	*			trans	-107.2	129	166.1	173.4	0	0	0	0	107.3
86	K	26.1	Very low	30.2	Very low	208 Å²	208	157.7 Å²	157.7	90%	0.904	80%	0.801	S	S	*	*			trans	-148.8	135.9	157.3	-113.2	168.7	-175	173	0	110.1
87	E	27.2	Very low	32.6	Very low	189 Å²	189	151.8 Å²	151.8	88%	0.883	78%	0.781	S	S	*	*			trans	-94	169.1	-177.7	-62.8	-173.8	105.1	0	0	112.2
88	G	27	Very low	35.2	Very low	83 Å²	83	141.7 Å²	141.7	86%	0.856	74%	0.737	S	S	*	*			trans	98.7	134.5	157.6	0	0	0	0	0	116.1
89	G	27.1	Very low	38.1	Very low	84 Å²	84	134.3 Å²	134.3	87%	0.866	71%	0.705	S	S	*	*	S	Bend	trans	116.2	3.8	148.7	0	0	0	0	0	120.3
90	S	29.1	Very low	40.5	Very low	114 Å²	114	129.1 Å²	129.1	80%	0.797	69%	0.686	S	S	*	*			trans	-159.7	131.3	160.4	-164.3	0	0	0	0	114.5	S92	S90-S92 PolarHBondContact O-N 3.35Å
91	G	35.9	Very low	43.4	Very low	76 Å²	76	124.7 Å²	124.7	78%	0.784	68%	0.675	S	S	*	*			trans	-76.4	59.5	179.1	0	0	0	0	0	113.8	I93	G91-I93 PolarHBondContact O-N 3.46Å
92	S	30.9	Very low	46.2	Very low	107 Å²	107	114.8 Å²	114.8	75%	0.748	64%	0.641	S	S	*	*			trans	-60.6	119	179.6	-171.6	0	0	0	0	111.4	S90 K94	S90-S92 PolarHBondContact O-N 3.35Å; S92-K94 PolarHBondContact O-N 2.78Å
93	I	34.5	Very low	49.1	Very low	109 Å²	109	109.2 Å²	109.2	56%	0.559	62%	0.621	S	S	*	*			trans	-63.3	118.2	-173.2	-62.2	172.4	0	0	0	109.5	G91 T95	G91-I93 PolarHBondContact O-N 3.46Å; I93-T95 PolarHBondContact O-N 3.17Å
94	K	35	Very low	51.9	Low	204 Å²	204	109.7 Å²	109.7	89%	0.887	62%	0.623	S	S	*	*			trans	-66	77.8	168.5	-70.9	-179.4	179.7	174.2	0	110	S92 S96	S92-K94 PolarHBondContact O-N 2.78Å; K94-S96 PolarHBondContact O-N 3.08Å; K94-S96 VanDerWaalsContact O-N 3.16Å
95	T	40.2	Very low	54.9	Low	66 Å²	66	104.3 Å²	104.3	41%	0.405	60%	0.599	S	S	.	*			trans	-51.7	123.8	174.5	65.8	0	0	0	0	108.7	I93 R100	I93-T95 PolarHBondContact O-N 3.17Å; T95-R100 VanDerWaalsContact OG1-CZ 3.27Å; T95-R100 PolarHBondContact OG1-NE 3.27Å; T95-R100 PolarHBondContact OG1-NH2 2.62Å
96	S	52.3	Low	57.7	Low	31 Å²	31	100.7 Å²	100.7	22%	0.217	58%	0.579	C	S	.	*			trans	-64.2	147.1	-158.3	64.4	0	0	0	0	114.6	K94 L98 T561	K94-S96 PolarHBondContact O-N 3.08Å; K94-S96 VanDerWaalsContact O-N 3.16Å; S96-L98 PolarHBondContact O-N 3.4Å; S96-T561 PolarHBondContact OG-OG1 3.27Å
97	S	74.8	Confident	60.3	Low	73 Å²	73	99.7 Å²	99.7	51%	0.51	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.2	-2.7	172.8	-163.4	0	0	0	0	113.3	K370	S97-K370 WeakPolarHBondContact O-CD 3.44Å; S97-K370 WeakPolarHBondContact O-CE 3.46Å; S97-K370 PolarHBondContact O-NZ 2.68Å
98	L	84.9	Confident	62.7	Low	2 Å²	2	91.4 Å²	91.4	1%	0.01	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-42.7	178	-178.1	57.6	0	0	0	112.1	S96 N102 K370 V371 V374 A560 Q564	S96-L98 PolarHBondContact O-N 3.4Å; L98-N102 PolarHBondContact O-ND2 2.77Å; L98-K370 HydrophobicContact CD1-CB 4.1Å; L98-K370 WeakPolarHBondContact CD1-O 3.3Å; L98-V371 HydrophobicContact CD1-CB 4.42Å; L98-V371 HydrophobicContact CD1-CG2 3.97Å; L98-V371 HydrophobicContact CG-CG2 4.28Å; L98-V374 HydrophobicContact CD2-CG2 4.34Å; L98-A560 WeakPolarHBondContact CD2-O 3.15Å; L98-Q564 HydrophobicContact CD1-CG 4.17Å; L98-Q564 HydrophobicContact CD2-CB 3.87Å; L98-Q564 HydrophobicContact CD2-CG 4.31Å
99	F	87	Confident	64.7	Low	51 Å²	51	90.4 Å²	90.4	22%	0.224	52%	0.517	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-22	-176.8	-68.2	-77.9	0	0	0	114.6	V371 L528 R557 A560	F99-V371 HydrophobicContact CD1-CG2 4.29Å; F99-V371 HydrophobicContact CE1-CG1 4.07Å; F99-V371 HydrophobicContact CE1-CG2 3.96Å; F99-V371 HydrophobicContact CZ-CG1 4.07Å; F99-V371 HydrophobicContact CZ-CG2 4.44Å; F99-L528 HydrophobicContact CE1-CD1 4.38Å; F99-L528 HydrophobicContact CZ-CD1 4.16Å; F99-R557 HydrophobicContact CD1-CG 4.09Å; F99-R557 HydrophobicContact CD2-CB 3.88Å; F99-R557 HydrophobicContact CD2-CG 3.96Å; F99-R557 HydrophobicContact CE1-CG 4.08Å; F99-R557 HydrophobicContact CE2-CB 3.81Å; F99-R557 HydrophobicContact CE2-CG 3.95Å; F99-R557 WeakPolarHBondContact CE2-O 3.34Å; F99-R557 HydrophobicContact CG-CB 4.43Å; F99-R557 HydrophobicContact CG-CG 4.04Å; F99-R557 HydrophobicContact CZ-CB 4.3Å; F99-R557 HydrophobicContact CZ-CG 4.01Å; F99-A560 HydrophobicContact CE2-CB 3.94Å; F99-A560 HydrophobicContact CZ-CB 3.77Å
100	R	85.1	Confident	66.6	Low	143 Å²	143	95.9 Å²	95.9	54%	0.54	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	144.3	172.4	-65.7	-177.3	172.7	-148.4	0.8	110.9	T95 N102 K370	T95-R100 VanDerWaalsContact OG1-CZ 3.27Å; T95-R100 PolarHBondContact OG1-NE 3.27Å; T95-R100 PolarHBondContact OG1-NH2 2.62Å; R100-N102 VanDerWaalsContact C-N 3.26Å; R100-N102 PolarHBondContact O-N 3.03Å; R100-K370 PolarHBondContact O-NZ 3.33Å
101	H	84.1	Confident	68.3	Low	159 Å²	159	93.1 Å²	93.1	74%	0.736	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	38.3	176.1	-42.2	116.9	0	0	0	114.5	H612	H101-H612 PolarHBondContact O-CE1 2.81Å
102	N	86.8	Confident	69.4	Low	36 Å²	36	94.9 Å²	94.9	19%	0.193	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-82.2	149.8	162.8	-79.2	-34.9	0	0	0	109.2	L98 R100 P368 K370	L98-N102 PolarHBondContact O-ND2 2.77Å; R100-N102 VanDerWaalsContact C-N 3.26Å; R100-N102 PolarHBondContact O-N 3.03Å; N102-P368 HydrophobicContact CB-CB 3.78Å; N102-P368 HydrophobicContact CB-CG 4.01Å; N102-P368 VanDerWaalsContact CG-CB 3.49Å; N102-K370 WeakPolarHBondContact OD1-CE 3.31Å
103	P	84.9	Confident	71.3	Confident	68 Å²	68	91.6 Å²	91.6	44%	0.442	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-57.8	146.2	163.9	27.3	-35	0	0	0	109.8	P368 P503	P103-P368 HydrophobicContact CG-CB 4.44Å; P103-P503 HydrophobicContact CB-CB 4.32Å; P103-P503 HydrophobicContact CG-CB 4.25Å; P103-P503 HydrophobicContact CG-CG 4.08Å
104	E	85.4	Confident	72.7	Confident	177 Å²	177	90.8 Å²	90.8	83%	0.827	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-61.8	150.2	170.8	-63.5	-177.3	162.6	0	0	110	P106 P503	E104-P106 WeakPolarHBondContact O-CD 3.32Å; E104-P503 VanDerWaalsContact O-CB 3.31Å; E104-P503 WeakPolarHBondContact O-CB 3.38Å
105	I	85.4	Confident	74	Confident	81 Å²	81	83.3 Å²	83.3	42%	0.415	45%	0.451	S	S	.	.			trans	-89.3	113.5	177.8	-63.8	176.4	0	0	0	106.4	L366 P368 P503 L524	I105-L366 HydrophobicContact CG2-CB 3.69Å; I105-L366 HydrophobicContact CG2-CD1 3.66Å; I105-L366 HydrophobicContact CG2-CG 4.25Å; I105-P368 HydrophobicContact CG1-CG 4.48Å; I105-P503 HydrophobicContact CG1-CG 4.2Å; I105-L524 HydrophobicContact CD1-CD2 4.4Å
106	P	87.1	Confident	75.2	Confident	54 Å²	54	82.9 Å²	82.9	35%	0.351	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-66.6	152.1	177.9	29.3	-36.2	0	0	0	110.4	E104 I108 L366 A506	E104-P106 WeakPolarHBondContact O-CD 3.32Å; P106-I108 PolarHBondContact O-N 3.48Å; P106-L366 HydrophobicContact CG-CD1 4.04Å; P106-A506 HydrophobicContact CG-CB 3.87Å
107	E	82.2	Confident	75.9	Confident	187 Å²	187	86.8 Å²	86.8	87%	0.874	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-62.7	130.5	166.8	-62	-165.4	156.8	0	0	109.3	P109	E107-P109 WeakPolarHBondContact O-CD 3.46Å
108	I	77.5	Confident	75.4	Confident	15 Å²	15	84 Å²	84	8%	0.077	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-69.9	126.1	-179.1	-73.2	170.5	0	0	0	109.1	P106 R110 V364 L366 I509 E521	P106-I108 PolarHBondContact O-N 3.48Å; I108-R110 PolarHBondContact O-N 3.26Å; I108-V364 HydrophobicContact CD1-CG1 3.95Å; I108-L366 HydrophobicContact CD1-CD1 4.14Å; I108-L366 HydrophobicContact CD1-CG 4.09Å; I108-L366 HydrophobicContact CG1-CD1 3.71Å; I108-L366 HydrophobicContact CG1-CG 4.18Å; I108-I509 HydrophobicContact CB-CD1 4.3Å; I108-I509 HydrophobicContact CD1-CD1 4.02Å; I108-I509 HydrophobicContact CG1-CD1 3.82Å; I108-I509 HydrophobicContact CG2-CD1 3.63Å; I108-I509 HydrophobicContact CG2-CG2 4.1Å; I108-E521 HydrophobicContact CD1-CB 3.87Å; I108-E521 HydrophobicContact CD1-CG 3.71Å
109	P	67.4	Low	74.3	Confident	61 Å²	61	90.6 Å²	90.6	40%	0.396	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-56.4	129	168.5	-23	33.9	0	0	0	110	E107 P111	E107-P109 WeakPolarHBondContact O-CD 3.46Å; P109-P111 WeakPolarHBondContact O-CD 3.5Å
110	R	67.2	Low	73.3	Confident	200 Å²	200	89.2 Å²	89.2	76%	0.755	46%	0.463	S	S	*	.			trans	-110.6	69.2	177.3	-63.3	-179.1	-173.6	166.5	2.9	110.4	I108 A112 E521	I108-R110 PolarHBondContact O-N 3.26Å; R110-A112 PolarHBondContact O-N 2.72Å; R110-E521 IonicContact NH2-OE2 2.74Å; R110-E521 PolarHBondContact NH2-OE2 3.09Å; R110-E521 VanDerWaalsContact NH2-OE2 3.08Å
111	P	65.8	Low	72.7	Confident	55 Å²	55	86.5 Å²	86.5	36%	0.357	46%	0.455	S	S	.	.			trans	-60.8	130	173.1	27.5	-33.1	0	0	0	109.1	P109 V113 A513	P109-P111 WeakPolarHBondContact O-CD 3.5Å; P111-V113 HydrophobicContact CB-CG2 3.99Å; P111-V113 HydrophobicContact CG-CG2 4.27Å; P111-V113 PolarHBondContact O-N 3.25Å; P111-V113 VanDerWaalsContact O-N 3.12Å; P111-A513 HydrophobicContact CB-CB 4.09Å; P111-A513 HydrophobicContact CG-CB 3.27Å
112	A	59.4	Low	72.3	Confident	113 Å²	113	79.7 Å²	79.7	93%	0.934	42%	0.424	S	S	*	.			trans	-77.5	97.6	177.7	0	0	0	0	0	109.2	R110	R110-A112 PolarHBondContact O-N 2.72Å
113	V	69.4	Low	71.8	Confident	38 Å²	38	83.3 Å²	83.3	23%	0.23	45%	0.453	C	S	.	.			trans	-118.5	131	-177.6	-161.5	0	0	0	0	111.6	P111 Q115 A513 N516	P111-V113 HydrophobicContact CB-CG2 3.99Å; P111-V113 HydrophobicContact CG-CG2 4.27Å; P111-V113 PolarHBondContact O-N 3.25Å; P111-V113 VanDerWaalsContact O-N 3.12Å; V113-Q115 PolarHBondContact O-N 3.42Å; V113-A513 HydrophobicContact CG2-CB 3.95Å; V113-N516 HydrophobicContact CG1-CB 4.16Å; V113-N516 VanDerWaalsContact CG1-OD1 3.28Å; V113-N516 WeakPolarHBondContact CG1-OD1 3.38Å
114	A	64.6	Low	71.6	Confident	93 Å²	93	80.8 Å²	80.8	77%	0.769	44%	0.437	S	S	*	.			trans	-73.8	86.9	176	0	0	0	0	0	110.3	L116	A114-L116 PolarHBondContact O-N 2.9Å
115	Q	63.5	Low	71.7	Confident	46 Å²	46	73.6 Å²	73.6	22%	0.215	41%	0.407	C	S	.	.			trans	-61.9	122.8	179.8	-178.3	179	-46	0	0	111.3	V113 K117 V356 S518	V113-Q115 PolarHBondContact O-N 3.42Å; Q115-K117 PolarHBondContact O-N 3.42Å; Q115-V356 HydrophobicContact CG-CG2 3.99Å; Q115-S518 PolarHBondContact OE1-O 2.83Å
116	L	65.2	Low	71.7	Confident	57 Å²	57	69.7 Å²	69.7	30%	0.298	39%	0.387	S	S	.	.			trans	-73	105	-179.5	-175.2	68.3	0	0	0	110.8	A114 A355 V356	A114-L116 PolarHBondContact O-N 2.9Å; L116-A355 HydrophobicContact CD2-CB 3.82Å; L116-A355 HydrophobicContact CG-CB 4.18Å; L116-V356 PolarHBondContact O-N 2.89Å
117	K	65.3	Low	71.7	Confident	113 Å²	113	70.4 Å²	70.4	49%	0.491	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	124.3	179.9	-71.4	-170.5	168.3	-144	0	111.5	Q115 E358	Q115-K117 PolarHBondContact O-N 3.42Å; K117-E358 HydrophobicContact CB-CB 4.22Å; K117-E358 HydrophobicContact CB-CG 4.35Å; K117-E358 HydrophobicContact CD-CG 4.19Å; K117-E358 PolarHBondContact NZ-O 3.42Å
118	E	65.6	Low	72	Confident	14 Å²	14	65.8 Å²	65.8	7%	0.065	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.7	179.8	-79.5	-175.9	177.6	0	0	113.2	V120 Q170 V339 S340 A355 V356	E118-V120 PolarHBondContact O-N 2.82Å; E118-Q170 VanDerWaalsContact CB-NE2 3.32Å; E118-Q170 WeakPolarHBondContact OE2-CG 3.34Å; E118-Q170 PolarHBondContact OE2-NE2 3.08Å; E118-V339 HydrophobicContact CG-CG1 4.26Å; E118-S340 WeakPolarHBondContact CG-OG 3.48Å; E118-S340 PolarHBondContact OE1-OG 2.72Å; E118-A355 HydrophobicContact CG-CB 3.93Å; E118-A355 WeakPolarHBondContact OE1-CB 3.45Å; E118-V356 PolarHBondContact N-O 3.26Å
119	K	62.3	Low	72.4	Confident	141 Å²	141	66.3 Å²	66.3	61%	0.613	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-72.6	116.5	167.7	-81.2	173.2	-179.9	177.3	0	110.1	S150 E358	K119-S150 PolarHBondContact O-OG 2.94Å; K119-E358 WeakPolarHBondContact CE-OE1 3.32Å; K119-E358 WeakPolarHBondContact CG-OE2 3.45Å
120	V	65.8	Low	73.4	Confident	23 Å²	23	71.8 Å²	71.8	14%	0.139	40%	0.397	C	S	.	.			trans	-74.3	-36.3	-173	-178.4	0	0	0	0	112.6	E118 T149 S150	E118-V120 PolarHBondContact O-N 2.82Å; V120-T149 HydrophobicContact CG1-CG2 4.18Å; V120-T149 CarbonylContact O-C 3.35Å; V120-T149 WeakPolarHBondContact O-CA 3.39Å; V120-T149 WeakPolarHBondContact O-CB 3.33Å; V120-S150 PolarHBondContact O-N 3.5Å; V120-S150 VanDerWaalsContact O-N 3.08Å
121	F	71.9	Confident	74.7	Confident	85 Å²	85	62.9 Å²	62.9	37%	0.373	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	148	-172.7	-75.4	-64.9	0	0	0	114.1	R147 T149 I491	F121-R147 HydrophobicContact CD1-CB 4.4Å; F121-T149 HydrophobicContact CD1-CG2 4.09Å; F121-T149 HydrophobicContact CE1-CG2 4.06Å; F121-I491 HydrophobicContact CE1-CG2 4.33Å; F121-I491 HydrophobicContact CE2-CG2 4.16Å; F121-I491 WeakPolarHBondContact CE2-O 3.36Å; F121-I491 HydrophobicContact CZ-CG2 3.49Å; F121-I491 VanDerWaalsContact CZ-CG2 3.49Å
122	T	76.6	Confident	76.1	Confident	16 Å²	16	62.9 Å²	62.9	10%	0.098	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	175	175.3	72	0	0	0	0	111.1	A124 R147 L148 Q153	T122-A124 PolarHBondContact OG1-N 3.46Å; T122-R147 PolarHBondContact O-NE 3.29Å; T122-R147 PolarHBondContact O-NH2 2.83Å; T122-L148 PolarHBondContact N-O 3.33Å; T122-L148 PolarHBondContact OG1-O 2.9Å; T122-Q153 HydrophobicContact CG2-CB 4.17Å; T122-Q153 VanDerWaalsContact CG2-OE1 3.31Å
123	S	76.1	Confident	77.8	Confident	113 Å²	113	61.9 Å²	61.9	79%	0.79	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	-20.7	168.2	44.5	0	0	0	0	113.6
124	A	80.8	Confident	79	Confident	14 Å²	14	65.1 Å²	65.1	12%	0.116	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	155.1	-172.1	0	0	0	0	0	113.6	T122 R147 L148 Q153	T122-A124 PolarHBondContact OG1-N 3.46Å; A124-R147 WeakPolarHBondContact O-CA 3.07Å; A124-L148 HydrophobicContact CB-CD1 3.86Å; A124-L148 PolarHBondContact O-N 3.45Å; A124-Q153 HydrophobicContact CB-CG 4.49Å
125	S	86.8	Confident	80.5	Confident	26 Å²	26	60.7 Å²	60.7	18%	0.182	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	159.4	-179.3	-169.7	0	0	0	0	112.2	S127 D128 S146 L148	S125-S127 PolarHBondContact O-N 3.43Å; S125-D128 PolarHBondContact N-OD2 2.87Å; S125-D128 WeakPolarHBondContact O-CB 3.08Å; S125-D128 PolarHBondContact O-N 3.33Å; S125-D128 VanDerWaalsContact O-N 3.17Å; S125-S146 WeakPolarHBondContact CA-O 3.32Å; S125-S146 WeakPolarHBondContact CB-O 3.49Å; S125-S146 PolarHBondContact OG-O 2.82Å; S125-L148 WeakPolarHBondContact O-CD1 3.32Å
126	F	85.6	Confident	81.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-64.1	-20	171.9	-74.1	-92.1	0	0	0	113.2	D128 L129 L131 L139 V145 L148 I156 V181	F126-D128 VanDerWaalsContact C-N 3.27Å; F126-D128 PolarHBondContact O-N 3.45Å; F126-L129 HydrophobicContact CD1-CD1 4.48Å; F126-L129 PolarHBondContact O-N 3.17Å; F126-L131 HydrophobicContact CB-CD1 4.43Å; F126-L131 HydrophobicContact CD1-CD1 4.12Å; F126-L139 HydrophobicContact CB-CD1 4.14Å; F126-L139 HydrophobicContact CD1-CD1 3.58Å; F126-L139 HydrophobicContact CD1-CD2 4.43Å; F126-L139 HydrophobicContact CE1-CD1 4.12Å; F126-L139 HydrophobicContact CE1-CD2 4.22Å; F126-L139 HydrophobicContact CG-CD1 3.92Å; F126-L139 HydrophobicContact CZ-CD2 4.43Å; F126-V145 HydrophobicContact CE2-CG1 3.8Å; F126-V145 HydrophobicContact CZ-CG1 4.42Å; F126-L148 HydrophobicContact CD1-CD2 3.79Å; F126-L148 HydrophobicContact CD2-CD2 3.97Å; F126-L148 HydrophobicContact CD2-CG 4.21Å; F126-L148 HydrophobicContact CE1-CD2 3.57Å; F126-L148 HydrophobicContact CE2-CD2 3.71Å; F126-L148 HydrophobicContact CE2-CG 4.19Å; F126-L148 HydrophobicContact CG-CD2 4.01Å; F126-L148 HydrophobicContact CG-CG 4.47Å; F126-L148 HydrophobicContact CZ-CD2 3.53Å; F126-L148 HydrophobicContact CZ-CG 4.47Å; F126-I156 HydrophobicContact CD1-CD1 4.34Å; F126-I156 HydrophobicContact CE1-CD1 3.64Å; F126-I156 HydrophobicContact CZ-CD1 4.43Å; F126-V181 HydrophobicContact CD1-CG1 4.48Å; F126-V181 HydrophobicContact CE1-CG2 4.15Å
127	S	86.6	Confident	83.2	Confident	68 Å²	68	58.5 Å²	58.5	48%	0.476	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-61	-35.7	172.3	-54.3	0	0	0	0	112.5	S125 L129	S125-S127 PolarHBondContact O-N 3.43Å; S127-L129 PolarHBondContact O-N 3.23Å
128	D	87.9	Confident	84.6	Confident	91 Å²	91	53.7 Å²	53.7	49%	0.487	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-72	-18.4	-172.9	-42.7	-18.8	0	0	0	111.6	S125 F126 H130	S125-D128 PolarHBondContact N-OD2 2.87Å; S125-D128 WeakPolarHBondContact O-CB 3.08Å; S125-D128 PolarHBondContact O-N 3.33Å; S125-D128 VanDerWaalsContact O-N 3.17Å; F126-D128 VanDerWaalsContact C-N 3.27Å; F126-D128 PolarHBondContact O-N 3.45Å; D128-H130 VanDerWaalsContact C-N 3.3Å; D128-H130 PolarHBondContact O-N 2.93Å; D128-H130 PolarHBondContact O-ND1 3.29Å
129	L	87.1	Confident	85.9	Confident	26 Å²	26	53 Å²	53	14%	0.136	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-87	12.3	-173.1	-59.1	-172.8	0	0	0	114.5	F126 S127 L131 L148 I156 P157	F126-L129 HydrophobicContact CD1-CD1 4.48Å; F126-L129 PolarHBondContact O-N 3.17Å; S127-L129 PolarHBondContact O-N 3.23Å; L129-L131 HydrophobicContact CB-CD1 4.07Å; L129-L131 HydrophobicContact CB-CG 3.89Å; L129-L131 PolarHBondContact O-N 2.7Å; L129-L131 VanDerWaalsContact O-N 3.09Å; L129-L148 HydrophobicContact CD1-CD1 3.8Å; L129-L148 HydrophobicContact CD1-CD2 3.7Å; L129-L148 HydrophobicContact CD1-CG 4.37Å; L129-L148 HydrophobicContact CD2-CD1 4.14Å; L129-L148 HydrophobicContact CG-CD1 3.97Å; L129-I156 HydrophobicContact CD1-CB 3.96Å; L129-I156 HydrophobicContact CD1-CD1 4.12Å; L129-I156 HydrophobicContact CD1-CG2 3.72Å; L129-P157 HydrophobicContact CD2-CG 4.02Å
130	H	88.9	Confident	87.2	Confident	175 Å²	175	49 Å²	49	81%	0.81	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	32	176.9	-63.4	67.8	0	0	0	113.7	D128	D128-H130 VanDerWaalsContact C-N 3.3Å; D128-H130 PolarHBondContact O-N 2.93Å; D128-H130 PolarHBondContact O-ND1 3.29Å
131	L	93.6	Very high	88.4	Confident	13 Å²	13	56 Å²	56	7%	0.068	31%	0.306	C	S	.	.			trans	-77.3	157.2	179.7	-62.6	172.5	0	0	0	111.5	F126 L129 L135 V136 L139 L160 V181 Q185	F126-L131 HydrophobicContact CB-CD1 4.43Å; F126-L131 HydrophobicContact CD1-CD1 4.12Å; L129-L131 HydrophobicContact CB-CD1 4.07Å; L129-L131 HydrophobicContact CB-CG 3.89Å; L129-L131 PolarHBondContact O-N 2.7Å; L129-L131 VanDerWaalsContact O-N 3.09Å; L131-L135 HydrophobicContact CD2-CD2 4.5Å; L131-V136 HydrophobicContact CB-CG2 3.73Å; L131-L139 HydrophobicContact CD1-CD1 4.48Å; L131-L160 HydrophobicContact CD2-CD1 4.12Å; L131-V181 HydrophobicContact CD1-CG1 3.5Å; L131-V181 HydrophobicContact CD2-CG1 4.02Å; L131-V181 HydrophobicContact CG-CG1 4.43Å; L131-Q185 HydrophobicContact CD2-CB 4.03Å; L131-Q185 HydrophobicContact CD2-CG 3.84Å
132	H	95.6	Very high	89.2	Confident	55 Å²	55	54.3 Å²	54.3	26%	0.255	30%	0.303	S	S	.	.			trans	-57.1	132.4	177.9	-176.2	-87.3	0	0	0	111	H134 L135 V136 Q185 Q188 F226	H132-H134 VanDerWaalsContact C-N 3.28Å; H132-H134 AromaticContact CE1-CG 3.63Å; H132-H134 AromaticContact CE1-ND1 3.63Å; H132-H134 AromaticContact ND1-CG 3.95Å; H132-H134 PolarHBondContact ND1-N 2.85Å; H132-H134 PolarHBondContact O-N 3.08Å; H132-H134 VanDerWaalsContact O-N 3.08Å; H132-L135 HydrophobicContact CB-CB 4.44Å; H132-L135 WeakPolarHBondContact O-CA 3.25Å; H132-L135 VanDerWaalsContact O-CB 3.29Å; H132-L135 WeakPolarHBondContact O-CB 3.32Å; H132-L135 PolarHBondContact O-N 3.35Å; H132-V136 PolarHBondContact O-N 3.38Å; H132-Q185 VanDerWaalsContact CB-OE1 3.32Å; H132-Q188 PolarHBondContact CD2-OE1 2.88Å; H132-F226 HydrophobicContact CB-CZ 4.19Å; H132-F226 AromaticContact CE1-CE1 4Å; H132-F226 AromaticContact CG-CZ 4Å; H132-F226 AromaticContact ND1-CE1 3.65Å; H132-F226 AromaticContact ND1-CZ 3.6Å
133	P	94.9	Very high	89.7	Confident	92 Å²	92	55.2 Å²	55.2	60%	0.597	31%	0.307	S	S	*	.	H	α-helix	trans	-54.2	-37.6	-171.3	-30.9	36.2	0	0	0	114.9	L135 V136 A137	P133-L135 VanDerWaalsContact C-N 3.31Å; P133-L135 PolarHBondContact O-N 3.48Å; P133-V136 PolarHBondContact O-N 2.94Å; P133-A137 WeakPolarHBondContact O-CB 3.37Å; P133-A137 PolarHBondContact O-N 2.97Å
134	H	95.1	Very high	90.2	Very high	107 Å²	107	56.2 Å²	56.2	50%	0.495	30%	0.303	S	S	.	.	H	α-helix	trans	-67.7	-27.6	176.2	-60.4	169.7	0	0	0	113.8	H132 T138 P225	H132-H134 VanDerWaalsContact C-N 3.28Å; H132-H134 AromaticContact CE1-CG 3.63Å; H132-H134 AromaticContact CE1-ND1 3.63Å; H132-H134 AromaticContact ND1-CG 3.95Å; H132-H134 PolarHBondContact ND1-N 2.85Å; H132-H134 PolarHBondContact O-N 3.08Å; H132-H134 VanDerWaalsContact O-N 3.08Å; H134-T138 VanDerWaalsContact O-CB 3.31Å; H134-T138 WeakPolarHBondContact O-CB 3.43Å; H134-T138 PolarHBondContact O-N 3.38Å; H134-T138 PolarHBondContact O-OG1 2.99Å; H134-P225 HydrophobicContact CB-CB 3.59Å; H134-P225 HydrophobicContact CB-CG 3.95Å
135	L	94.5	Very high	90.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-71.9	-46.3	175.6	-176.9	54.7	0	0	0	110	L131 H132 P133 A137 T138 L139 V181 V184 Q185 L222 F226	L131-L135 HydrophobicContact CD2-CD2 4.5Å; H132-L135 HydrophobicContact CB-CB 4.44Å; H132-L135 WeakPolarHBondContact O-CA 3.25Å; H132-L135 VanDerWaalsContact O-CB 3.29Å; H132-L135 WeakPolarHBondContact O-CB 3.32Å; H132-L135 PolarHBondContact O-N 3.35Å; P133-L135 VanDerWaalsContact C-N 3.31Å; P133-L135 PolarHBondContact O-N 3.48Å; L135-A137 PolarHBondContact O-N 2.92Å; L135-T138 WeakPolarHBondContact O-CB 3.4Å; L135-T138 PolarHBondContact O-N 2.98Å; L135-T138 VanDerWaalsContact O-N 3.14Å; L135-L139 HydrophobicContact CG-CD1 4.26Å; L135-L139 WeakPolarHBondContact O-CD1 3.42Å; L135-L139 WeakPolarHBondContact O-CG 3.46Å; L135-L139 PolarHBondContact O-N 3.43Å; L135-V181 HydrophobicContact CD2-CG1 4.2Å; L135-V184 HydrophobicContact CD1-CG1 3.99Å; L135-V184 HydrophobicContact CD2-CG1 4.26Å; L135-Q185 HydrophobicContact CD2-CB 4.06Å; L135-L222 HydrophobicContact CD1-CD2 3.91Å; L135-F226 HydrophobicContact CB-CE2 4.05Å; L135-F226 HydrophobicContact CB-CZ 4.15Å; L135-F226 HydrophobicContact CD1-CE2 4.33Å
136	V	93.8	Very high	90.2	Very high	16 Å²	16	59.1 Å²	59.1	10%	0.097	32%	0.321	C	S	.	.	H	α-helix	trans	-60.2	-45	173.4	-176.6	0	0	0	0	111.1	L131 H132 P133 T138 L139 N140	L131-V136 HydrophobicContact CB-CG2 3.73Å; H132-V136 PolarHBondContact O-N 3.38Å; P133-V136 PolarHBondContact O-N 2.94Å; V136-T138 VanDerWaalsContact C-N 3.28Å; V136-T138 PolarHBondContact O-N 3.49Å; V136-L139 PolarHBondContact O-N 2.94Å; V136-N140 WeakPolarHBondContact O-CB 3.35Å; V136-N140 PolarHBondContact O-N 2.92Å; V136-N140 PolarHBondContact O-ND2 3.33Å
137	A	93.4	Very high	90.3	Very high	40 Å²	40	65.2 Å²	65.2	33%	0.331	34%	0.344	S	S	.	.	H	α-helix	trans	-61.6	-35	175.2	0	0	0	0	0	112.7	P133 L135 K141	P133-A137 WeakPolarHBondContact O-CB 3.37Å; P133-A137 PolarHBondContact O-N 2.97Å; L135-A137 PolarHBondContact O-N 2.92Å; A137-K141 VanDerWaalsContact O-CB 3.25Å; A137-K141 WeakPolarHBondContact O-CB 3.5Å; A137-K141 WeakPolarHBondContact O-CG 3.42Å; A137-K141 PolarHBondContact O-N 3.36Å
138	T	93.8	Very high	90.3	Very high	12 Å²	12	62 Å²	62	7%	0.074	32%	0.321	C	S	.	.	H	α-helix	trans	-71.7	-42.4	176.9	-62.1	0	0	0	0	111.8	H134 L135 V136 V142 L143 K221	H134-T138 VanDerWaalsContact O-CB 3.31Å; H134-T138 WeakPolarHBondContact O-CB 3.43Å; H134-T138 PolarHBondContact O-N 3.38Å; H134-T138 PolarHBondContact O-OG1 2.99Å; L135-T138 WeakPolarHBondContact O-CB 3.4Å; L135-T138 PolarHBondContact O-N 2.98Å; L135-T138 VanDerWaalsContact O-N 3.14Å; V136-T138 VanDerWaalsContact C-N 3.28Å; V136-T138 PolarHBondContact O-N 3.49Å; T138-V142 HydrophobicContact CG2-CB 4.13Å; T138-V142 HydrophobicContact CG2-CG2 4.26Å; T138-V142 WeakPolarHBondContact O-CA 3.17Å; T138-V142 VanDerWaalsContact O-CB 3.3Å; T138-V142 WeakPolarHBondContact O-CB 3.09Å; T138-V142 PolarHBondContact O-N 3.34Å; T138-L143 PolarHBondContact O-N 3.31Å; T138-K221 WeakPolarHBondContact CG2-O 3.39Å
139	L	92.7	Very high	90.3	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.299	C	S	.	.	I	π-helix	trans	-57.9	-50.4	173	-74.6	155.9	0	0	0	111	F126 L131 L135 V136 L143 N144 V145 L177 V181 L222	F126-L139 HydrophobicContact CB-CD1 4.14Å; F126-L139 HydrophobicContact CD1-CD1 3.58Å; F126-L139 HydrophobicContact CD1-CD2 4.43Å; F126-L139 HydrophobicContact CE1-CD1 4.12Å; F126-L139 HydrophobicContact CE1-CD2 4.22Å; F126-L139 HydrophobicContact CG-CD1 3.92Å; F126-L139 HydrophobicContact CZ-CD2 4.43Å; L131-L139 HydrophobicContact CD1-CD1 4.48Å; L135-L139 HydrophobicContact CG-CD1 4.26Å; L135-L139 WeakPolarHBondContact O-CD1 3.42Å; L135-L139 WeakPolarHBondContact O-CG 3.46Å; L135-L139 PolarHBondContact O-N 3.43Å; V136-L139 PolarHBondContact O-N 2.94Å; L139-L143 HydrophobicContact CD2-CD1 3.91Å; L139-L143 CarbonylContact O-C 3.55Å; L139-L143 PolarHBondContact O-N 3.3Å; L139-N144 PolarHBondContact O-N 3.37Å; L139-V145 CarbonylContact C-O 3.37Å; L139-V145 PolarHBondContact O-N 2.97Å; L139-L177 HydrophobicContact CD2-CD1 4.24Å; L139-L177 HydrophobicContact CD2-CD2 4.38Å; L139-V181 HydrophobicContact CD1-CG1 4.39Å; L139-V181 HydrophobicContact CD1-CG2 4.14Å; L139-V181 HydrophobicContact CD2-CG2 3.93Å; L139-L222 HydrophobicContact CD2-CD2 4Å; L139-L222 HydrophobicContact CG-CD2 4.27Å
140	N	90.8	Very high	90.2	Very high	56 Å²	56	57.7 Å²	57.7	30%	0.299	30%	0.3	S	S	.	.	I	π-helix	trans	-66.5	-44.9	-180	-74.1	-26.9	0	0	0	113.8	V136 V145 S146	V136-N140 WeakPolarHBondContact O-CB 3.35Å; V136-N140 PolarHBondContact O-N 2.92Å; V136-N140 PolarHBondContact O-ND2 3.33Å; N140-V145 PolarHBondContact OD1-O 3.36Å; N140-S146 VanDerWaalsContact OD1-CA 3.24Å; N140-S146 WeakPolarHBondContact OD1-CA 3.43Å; N140-S146 WeakPolarHBondContact OD1-CB 3.29Å
141	K	90.5	Very high	90.2	Very high	171 Å²	171	49.4 Å²	49.4	74%	0.743	26%	0.262	S	S	*	.	I	π-helix	trans	-102.7	-16	-168.2	-59.3	-178.2	178.2	-177.5	0	115.9	A137	A137-K141 VanDerWaalsContact O-CB 3.25Å; A137-K141 WeakPolarHBondContact O-CB 3.5Å; A137-K141 WeakPolarHBondContact O-CG 3.42Å; A137-K141 PolarHBondContact O-N 3.36Å
142	V	89.1	Confident	90.1	Very high	50 Å²	50	49 Å²	49	30%	0.303	26%	0.26	S	S	.	.	I	π-helix	trans	-120.5	-29.1	-174.6	-172.8	0	0	0	0	112.1	T138 K221 K224	T138-V142 HydrophobicContact CG2-CB 4.13Å; T138-V142 HydrophobicContact CG2-CG2 4.26Å; T138-V142 WeakPolarHBondContact O-CA 3.17Å; T138-V142 VanDerWaalsContact O-CB 3.3Å; T138-V142 WeakPolarHBondContact O-CB 3.09Å; T138-V142 PolarHBondContact O-N 3.34Å; V142-K221 HydrophobicContact CG1-CB 4.4Å; V142-K221 HydrophobicContact CG1-CG 4.45Å; V142-K224 HydrophobicContact CG1-CD 4.25Å
143	L	86.3	Confident	89.9	Confident	35 Å²	35	50.5 Å²	50.5	18%	0.183	27%	0.267	C	S	.	.	I	π-helix	trans	-102.5	-14.3	173.2	-68.7	164.8	0	0	0	112.8	T138 L139 V145 L177 K221 L222	T138-L143 PolarHBondContact O-N 3.31Å; L139-L143 HydrophobicContact CD2-CD1 3.91Å; L139-L143 CarbonylContact O-C 3.55Å; L139-L143 PolarHBondContact O-N 3.3Å; L143-V145 VanDerWaalsContact C-N 3.26Å; L143-V145 HydrophobicContact CB-CG2 4.25Å; L143-V145 WeakPolarHBondContact O-CG2 3.5Å; L143-V145 PolarHBondContact O-N 3.35Å; L143-L177 HydrophobicContact CD1-CD2 4.11Å; L143-K221 HydrophobicContact CD2-CB 4.03Å; L143-K221 HydrophobicContact CD2-CD 3.51Å; L143-K221 HydrophobicContact CD2-CG 4.43Å; L143-K221 HydrophobicContact CG-CB 4.39Å; L143-K221 HydrophobicContact CG-CD 4.47Å; L143-L222 HydrophobicContact CD1-CD2 3.45Å; L143-L222 VanDerWaalsContact CD1-CD2 3.45Å; L143-L222 HydrophobicContact CD1-CG 3.98Å
144	N	87.4	Confident	89.6	Confident	133 Å²	133	50.2 Å²	50.2	71%	0.711	26%	0.258	S	S	*	.			trans	57.3	34.7	-176.8	-56.5	-16.7	0	0	0	113.3	L139	L139-N144 PolarHBondContact O-N 3.37Å
145	V	85.4	Confident	89.6	Confident	36 Å²	36	45.1 Å²	45.1	22%	0.218	23%	0.234	C	C	.	.			trans	-116.8	108	178	-168	0	0	0	0	109.5	F126 L139 N140 L143 L177	F126-V145 HydrophobicContact CE2-CG1 3.8Å; F126-V145 HydrophobicContact CZ-CG1 4.42Å; L139-V145 CarbonylContact C-O 3.37Å; L139-V145 PolarHBondContact O-N 2.97Å; N140-V145 PolarHBondContact OD1-O 3.36Å; L143-V145 VanDerWaalsContact C-N 3.26Å; L143-V145 HydrophobicContact CB-CG2 4.25Å; L143-V145 WeakPolarHBondContact O-CG2 3.5Å; L143-V145 PolarHBondContact O-N 3.35Å; V145-L177 HydrophobicContact CG1-CD1 4.5Å; V145-L177 HydrophobicContact CG2-CD1 4.19Å
146	S	82	Confident	89.6	Confident	65 Å²	65	45.1 Å²	45.1	46%	0.455	23%	0.234	S	C	.	.			trans	-110	-18	-177.2	57.5	0	0	0	0	114.9	S125 N140	S125-S146 WeakPolarHBondContact CA-O 3.32Å; S125-S146 WeakPolarHBondContact CB-O 3.49Å; S125-S146 PolarHBondContact OG-O 2.82Å; N140-S146 VanDerWaalsContact OD1-CA 3.24Å; N140-S146 WeakPolarHBondContact OD1-CA 3.43Å; N140-S146 WeakPolarHBondContact OD1-CB 3.29Å
147	R	86.3	Confident	89.6	Confident	129 Å²	129	47.2 Å²	47.2	49%	0.487	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	142.1	179.2	-66.6	177	68.3	155	-2.2	110.4	F121 T122 A124	F121-R147 HydrophobicContact CD1-CB 4.4Å; T122-R147 PolarHBondContact O-NE 3.29Å; T122-R147 PolarHBondContact O-NH2 2.83Å; A124-R147 WeakPolarHBondContact O-CA 3.07Å
148	L	87.1	Confident	89.6	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	136.6	177.5	-70.9	161.6	0	0	0	110.7	T122 A124 S125 F126 L129 Q152 Q153 I156	T122-L148 PolarHBondContact N-O 3.33Å; T122-L148 PolarHBondContact OG1-O 2.9Å; A124-L148 HydrophobicContact CB-CD1 3.86Å; A124-L148 PolarHBondContact O-N 3.45Å; S125-L148 WeakPolarHBondContact O-CD1 3.32Å; F126-L148 HydrophobicContact CD1-CD2 3.79Å; F126-L148 HydrophobicContact CD2-CD2 3.97Å; F126-L148 HydrophobicContact CD2-CG 4.21Å; F126-L148 HydrophobicContact CE1-CD2 3.57Å; F126-L148 HydrophobicContact CE2-CD2 3.71Å; F126-L148 HydrophobicContact CE2-CG 4.19Å; F126-L148 HydrophobicContact CG-CD2 4.01Å; F126-L148 HydrophobicContact CG-CG 4.47Å; F126-L148 HydrophobicContact CZ-CD2 3.53Å; F126-L148 HydrophobicContact CZ-CG 4.47Å; L129-L148 HydrophobicContact CD1-CD1 3.8Å; L129-L148 HydrophobicContact CD1-CD2 3.7Å; L129-L148 HydrophobicContact CD1-CG 4.37Å; L129-L148 HydrophobicContact CD2-CD1 4.14Å; L129-L148 HydrophobicContact CG-CD1 3.97Å; L148-Q152 HydrophobicContact CB-CB 4.46Å; L148-Q152 HydrophobicContact CD2-CB 3.78Å; L148-Q153 HydrophobicContact CB-CB 4.31Å; L148-Q153 HydrophobicContact CD1-CG 4.5Å; L148-I156 HydrophobicContact CD2-CD1 4Å
149	T	87.2	Confident	89.6	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.025	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	158.8	162.9	68.9	0	0	0	0	110.8	V120 F121 I151 Q152 Q153 S173	V120-T149 HydrophobicContact CG1-CG2 4.18Å; V120-T149 CarbonylContact O-C 3.35Å; V120-T149 WeakPolarHBondContact O-CA 3.39Å; V120-T149 WeakPolarHBondContact O-CB 3.33Å; F121-T149 HydrophobicContact CD1-CG2 4.09Å; F121-T149 HydrophobicContact CE1-CG2 4.06Å; T149-I151 PolarHBondContact O-N 3.33Å; T149-I151 WeakPolarHBondContact OG1-CG2 3.31Å; T149-Q152 WeakPolarHBondContact O-CB 3.25Å; T149-Q152 PolarHBondContact O-N 2.96Å; T149-Q152 WeakPolarHBondContact OG1-CG 3.26Å; T149-Q152 PolarHBondContact OG1-N 3.32Å; T149-Q152 PolarHBondContact OG1-OE1 2.91Å; T149-Q153 PolarHBondContact O-N 3.35Å; T149-S173 VanDerWaalsContact CB-O 3.27Å; T149-S173 WeakPolarHBondContact CB-O 3.24Å; T149-S173 WeakPolarHBondContact CG2-O 3.43Å; T149-S173 PolarHBondContact OG1-O 3.36Å
150	S	85.6	Confident	89.7	Confident	22 Å²	22	47.8 Å²	47.8	15%	0.154	25%	0.247	C	C	.	.	H	α-helix	trans	-57.5	-35.6	-176	-51.7	0	0	0	0	112.7	K119 V120	K119-S150 PolarHBondContact O-OG 2.94Å; V120-S150 PolarHBondContact O-N 3.5Å; V120-S150 VanDerWaalsContact O-N 3.08Å
151	I	88.5	Confident	89.8	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-73.4	-37.8	173.6	-166.7	60.4	0	0	0	112.5	T149 Q153 Q154 T155 V167 S173 I337 V339	T149-I151 PolarHBondContact O-N 3.33Å; T149-I151 WeakPolarHBondContact OG1-CG2 3.31Å; I151-Q153 PolarHBondContact O-N 3.14Å; I151-Q154 PolarHBondContact O-N 3Å; I151-T155 VanDerWaalsContact O-CB 3.25Å; I151-T155 WeakPolarHBondContact O-CB 3.47Å; I151-T155 PolarHBondContact O-N 3.45Å; I151-T155 PolarHBondContact O-OG1 3.49Å; I151-V167 HydrophobicContact CD1-CG1 3.64Å; I151-V167 HydrophobicContact CG1-CG1 3.82Å; I151-S173 VanDerWaalsContact CG2-O 3.31Å; I151-S173 WeakPolarHBondContact CG2-O 3.41Å; I151-I337 HydrophobicContact CD1-CG2 3.7Å; I151-V339 HydrophobicContact CB-CG2 3.94Å; I151-V339 HydrophobicContact CD1-CG2 3.86Å; I151-V339 HydrophobicContact CG1-CG2 4.44Å
152	Q	91.9	Very high	89.9	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.019	24%	0.235	C	C	.	.	H	α-helix	trans	-65.2	-39.6	177.6	-71.3	163	1.2	0	0	112	L148 T149 Q154 T155 I156 G174 S178	L148-Q152 HydrophobicContact CB-CB 4.46Å; L148-Q152 HydrophobicContact CD2-CB 3.78Å; T149-Q152 WeakPolarHBondContact O-CB 3.25Å; T149-Q152 PolarHBondContact O-N 2.96Å; T149-Q152 WeakPolarHBondContact OG1-CG 3.26Å; T149-Q152 PolarHBondContact OG1-N 3.32Å; T149-Q152 PolarHBondContact OG1-OE1 2.91Å; Q152-Q154 VanDerWaalsContact C-N 3.28Å; Q152-Q154 PolarHBondContact O-N 3.49Å; Q152-T155 PolarHBondContact O-N 2.7Å; Q152-I156 HydrophobicContact CB-CD1 3.95Å; Q152-I156 HydrophobicContact CB-CG1 4.49Å; Q152-I156 HydrophobicContact CG-CD1 4.38Å; Q152-I156 WeakPolarHBondContact O-CB 3.35Å; Q152-I156 WeakPolarHBondContact O-CG1 3.46Å; Q152-I156 PolarHBondContact O-N 2.91Å; Q152-G174 PolarHBondContact NE2-O 3.21Å; Q152-G174 VanDerWaalsContact NE2-O 3.09Å; Q152-S178 VanDerWaalsContact CG-OG 3.23Å; Q152-S178 WeakPolarHBondContact CG-OG 3.22Å
153	Q	91	Very high	90	Very high	86 Å²	86	45.7 Å²	45.7	40%	0.402	24%	0.244	S	C	.	.	H	α-helix	trans	-60.9	-37.2	178.3	-167	-173.5	23.7	0	0	111.9	T122 A124 L148 T149 I151 P157	T122-Q153 HydrophobicContact CG2-CB 4.17Å; T122-Q153 VanDerWaalsContact CG2-OE1 3.31Å; A124-Q153 HydrophobicContact CB-CG 4.49Å; L148-Q153 HydrophobicContact CB-CB 4.31Å; L148-Q153 HydrophobicContact CD1-CG 4.5Å; T149-Q153 PolarHBondContact O-N 3.35Å; I151-Q153 PolarHBondContact O-N 3.14Å; Q153-P157 WeakPolarHBondContact O-CD 3.4Å; Q153-P157 WeakPolarHBondContact O-CG 3.36Å
154	Q	90.3	Very high	90.4	Very high	87 Å²	87	44.5 Å²	44.5	41%	0.407	24%	0.238	S	C	.	.	H	α-helix	trans	-81.3	-46.8	176.6	-61.9	179.6	12.4	0	0	112.1	I151 Q152 A158 I337 S338	I151-Q154 PolarHBondContact O-N 3Å; Q152-Q154 VanDerWaalsContact C-N 3.28Å; Q152-Q154 PolarHBondContact O-N 3.49Å; Q154-A158 VanDerWaalsContact O-CB 3.32Å; Q154-A158 WeakPolarHBondContact O-CB 3.35Å; Q154-I337 HydrophobicContact CB-CG2 3.76Å; Q154-I337 VanDerWaalsContact OE1-CG2 3.26Å; Q154-S338 PolarHBondContact OE1-O 3Å
155	T	93.6	Very high	90.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-75	-37	-170.9	-57.7	0	0	0	0	113.9	I151 Q152 A158 L159 V167 I337	I151-T155 VanDerWaalsContact O-CB 3.25Å; I151-T155 WeakPolarHBondContact O-CB 3.47Å; I151-T155 PolarHBondContact O-N 3.45Å; I151-T155 PolarHBondContact O-OG1 3.49Å; Q152-T155 PolarHBondContact O-N 2.7Å; T155-A158 PolarHBondContact O-N 3.21Å; T155-L159 HydrophobicContact CG2-CD1 3.63Å; T155-L159 HydrophobicContact CG2-CG 3.99Å; T155-L159 WeakPolarHBondContact O-CB 3.36Å; T155-L159 WeakPolarHBondContact O-CG 3.38Å; T155-L159 PolarHBondContact O-N 2.85Å; T155-V167 HydrophobicContact CG2-CG1 4.45Å; T155-V167 HydrophobicContact CG2-CG2 4.06Å; T155-I337 HydrophobicContact CG2-CD1 4.46Å
156	I	95.3	Very high	91.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.9	-49	-174.7	-61.4	172.7	0	0	0	111.8	F126 L129 L148 Q152 A158 L159 L160 V181 P182	F126-I156 HydrophobicContact CD1-CD1 4.34Å; F126-I156 HydrophobicContact CE1-CD1 3.64Å; F126-I156 HydrophobicContact CZ-CD1 4.43Å; L129-I156 HydrophobicContact CD1-CB 3.96Å; L129-I156 HydrophobicContact CD1-CD1 4.12Å; L129-I156 HydrophobicContact CD1-CG2 3.72Å; L148-I156 HydrophobicContact CD2-CD1 4Å; Q152-I156 HydrophobicContact CB-CD1 3.95Å; Q152-I156 HydrophobicContact CB-CG1 4.49Å; Q152-I156 HydrophobicContact CG-CD1 4.38Å; Q152-I156 WeakPolarHBondContact O-CB 3.35Å; Q152-I156 WeakPolarHBondContact O-CG1 3.46Å; Q152-I156 PolarHBondContact O-N 2.91Å; I156-A158 VanDerWaalsContact C-N 3.33Å; I156-A158 PolarHBondContact O-N 2.9Å; I156-L159 PolarHBondContact O-N 2.91Å; I156-L160 HydrophobicContact CG2-CD1 4.05Å; I156-L160 HydrophobicContact CG2-CG 4.32Å; I156-L160 VanDerWaalsContact O-CG 3.31Å; I156-L160 WeakPolarHBondContact O-CG 3.36Å; I156-L160 PolarHBondContact O-N 2.87Å; I156-V181 HydrophobicContact CD1-CB 4.23Å; I156-V181 HydrophobicContact CD1-CG1 4.32Å; I156-V181 HydrophobicContact CG2-CG1 4.39Å; I156-P182 HydrophobicContact CG2-CB 4.4Å; I156-P182 HydrophobicContact CG2-CG 4.4Å
157	P	93.4	Very high	91.7	Very high	59 Å²	59	34.5 Å²	34.5	38%	0.383	18%	0.181	S	C	.	.	H	α-helix	trans	-60.3	-41.7	174.5	-22.3	33.6	0	0	0	112.7	L129 Q153 L159 L160 S161	L129-P157 HydrophobicContact CD2-CG 4.02Å; Q153-P157 WeakPolarHBondContact O-CD 3.4Å; Q153-P157 WeakPolarHBondContact O-CG 3.36Å; P157-L159 PolarHBondContact O-N 3.16Å; P157-L160 PolarHBondContact O-N 2.88Å; P157-S161 PolarHBondContact O-N 2.76Å; P157-S161 VanDerWaalsContact O-N 3.08Å
158	A	92.9	Very high	91.8	Very high	15 Å²	15	31.1 Å²	31.1	12%	0.124	17%	0.169	C	C	.	.	H	α-helix	trans	-56.3	-48.9	176.5	0	0	0	0	0	111.8	Q154 T155 I156 S161 I335 I337	Q154-A158 VanDerWaalsContact O-CB 3.32Å; Q154-A158 WeakPolarHBondContact O-CB 3.35Å; T155-A158 PolarHBondContact O-N 3.21Å; I156-A158 VanDerWaalsContact C-N 3.33Å; I156-A158 PolarHBondContact O-N 2.9Å; A158-S161 WeakPolarHBondContact O-CB 3.49Å; A158-S161 PolarHBondContact O-N 3.46Å; A158-S161 PolarHBondContact O-OG 3.18Å; A158-I335 HydrophobicContact CB-CD1 3.64Å; A158-I337 HydrophobicContact CB-CD1 3.74Å
159	L	95.6	Very high	91.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-72.9	-30.4	178.4	-69.5	-177.7	0	0	0	113.5	T155 I156 P157 S161 G162 A165 P182 W278 Q311 V313	T155-L159 HydrophobicContact CG2-CD1 3.63Å; T155-L159 HydrophobicContact CG2-CG 3.99Å; T155-L159 WeakPolarHBondContact O-CB 3.36Å; T155-L159 WeakPolarHBondContact O-CG 3.38Å; T155-L159 PolarHBondContact O-N 2.85Å; I156-L159 PolarHBondContact O-N 2.91Å; P157-L159 PolarHBondContact O-N 3.16Å; L159-S161 PolarHBondContact O-N 2.92Å; L159-G162 PolarHBondContact O-N 2.81Å; L159-A165 HydrophobicContact CD2-CB 3.82Å; L159-P182 HydrophobicContact CB-CB 3.88Å; L159-P182 HydrophobicContact CB-CG 3.72Å; L159-P182 HydrophobicContact CD1-CG 3.89Å; L159-P182 HydrophobicContact CG-CG 4.47Å; L159-W278 HydrophobicContact CB-CH2 4.19Å; L159-W278 HydrophobicContact CD1-CZ3 4.41Å; L159-W278 HydrophobicContact CD2-CZ3 4.45Å; L159-Q311 PolarHBondContact O-NE2 2.86Å; L159-V313 HydrophobicContact CD1-CG1 4.17Å; L159-V313 HydrophobicContact CD1-CG2 4.09Å; L159-V313 HydrophobicContact CD2-CG1 4.29Å; L159-V313 HydrophobicContact CD2-CG2 3.53Å; L159-V313 HydrophobicContact CG-CG2 4.49Å
160	L	94.4	Very high	90.9	Very high	49 Å²	49	31.8 Å²	31.8	26%	0.257	17%	0.172	S	C	.	.	H	α-helix	trans	-63.9	-29.8	171.5	-72.6	174.3	0	0	0	112.2	L131 I156 P157 G162 P182 Q185 R186	L131-L160 HydrophobicContact CD2-CD1 4.12Å; I156-L160 HydrophobicContact CG2-CD1 4.05Å; I156-L160 HydrophobicContact CG2-CG 4.32Å; I156-L160 VanDerWaalsContact O-CG 3.31Å; I156-L160 WeakPolarHBondContact O-CG 3.36Å; I156-L160 PolarHBondContact O-N 2.87Å; P157-L160 PolarHBondContact O-N 2.88Å; L160-G162 PolarHBondContact O-N 2.87Å; L160-P182 HydrophobicContact CD2-CB 3.82Å; L160-P182 HydrophobicContact CG-CB 4Å; L160-Q185 HydrophobicContact CD2-CB 4.11Å; L160-Q185 HydrophobicContact CD2-CG 3.83Å; L160-R186 HydrophobicContact CD2-CG 4.46Å
161	S	92.7	Very high	90.2	Very high	73 Å²	73	31.1 Å²	31.1	51%	0.51	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-9.9	174.6	80.5	0	0	0	0	114.5	P157 A158 L159	P157-S161 PolarHBondContact O-N 2.76Å; P157-S161 VanDerWaalsContact O-N 3.08Å; A158-S161 WeakPolarHBondContact O-CB 3.49Å; A158-S161 PolarHBondContact O-N 3.46Å; A158-S161 PolarHBondContact O-OG 3.18Å; L159-S161 PolarHBondContact O-N 2.92Å
162	G	91.6	Very high	89.2	Confident	28 Å²	28	32 Å²	32	29%	0.289	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	0.5	176.4	0	0	0	0	0	115.8	L159 L160 Q311	L159-G162 PolarHBondContact O-N 2.81Å; L160-G162 PolarHBondContact O-N 2.87Å; G162-Q311 VanDerWaalsContact C-CD 3.5Å; G162-Q311 VanDerWaalsContact C-NE2 3.31Å
163	R	90.8	Very high	88.4	Confident	132 Å²	132	32 Å²	32	50%	0.498	18%	0.177	S	C	.	.			trans	-80.5	154	176.5	-67.3	-164.5	-74	166.5	-0.2	113	Q311 I335	R163-Q311 PolarHBondContact O-NE2 2.95Å; R163-I335 HydrophobicContact CB-CD1 3.85Å; R163-I335 HydrophobicContact CB-CG1 4.12Å
164	D	95.3	Very high	87.9	Confident	11 Å²	11	28.9 Å²	28.9	6%	0.059	17%	0.167	C	C	.	.			trans	-65.3	157.2	169	-77.9	12.9	0	0	0	110.7	Q311 N312 L331 H332 P334 I335	D164-Q311 WeakPolarHBondContact OD1-CA 3.31Å; D164-N312 VanDerWaalsContact CA-O 3.26Å; D164-N312 WeakPolarHBondContact CA-O 3.35Å; D164-N312 WeakPolarHBondContact CB-O 3.5Å; D164-N312 PolarHBondContact OD1-N 2.95Å; D164-N312 WeakPolarHBondContact OD2-CB 3.43Å; D164-N312 PolarHBondContact OD2-ND2 2.91Å; D164-L331 HydrophobicContact CB-CB 4.42Å; D164-L331 WeakPolarHBondContact OD2-CA 3.31Å; D164-H332 PolarHBondContact OD2-N 3.34Å; D164-P334 HydrophobicContact CB-CB 4.17Å; D164-P334 WeakPolarHBondContact O-CA 3.21Å; D164-I335 PolarHBondContact O-N 2.88Å
165	A	95.3	Very high	87.8	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	136.5	178.6	0	0	0	0	0	113.7	L159 V167 N312 V313 L314 I335 I337	L159-A165 HydrophobicContact CD2-CB 3.82Å; A165-V167 HydrophobicContact CB-CG2 3.88Å; A165-N312 PolarHBondContact N-O 3.4Å; A165-N312 VanDerWaalsContact N-O 3.16Å; A165-V313 HydrophobicContact CB-CG1 4.49Å; A165-V313 WeakPolarHBondContact O-CA 3.49Å; A165-L314 PolarHBondContact O-N 3.46Å; A165-I335 WeakPolarHBondContact CA-O 3.35Å; A165-I337 HydrophobicContact CB-CD1 4.29Å
166	A	94.8	Very high	87.7	Confident	21 Å²	21	26.5 Å²	26.5	17%	0.174	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	107.6	167.5	0	0	0	0	0	108.5	L331 P334 I335 I337	A166-L331 HydrophobicContact CB-CD1 3.89Å; A166-P334 HydrophobicContact CB-CB 4.48Å; A166-I335 PolarHBondContact N-O 2.9Å; A166-I337 PolarHBondContact O-N 3.29Å
167	V	92.1	Very high	87.7	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.012	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	100.9	-166.4	-170.9	0	0	0	0	110.4	I151 T155 A165 V313 L314 L315 S316	I151-V167 HydrophobicContact CD1-CG1 3.64Å; I151-V167 HydrophobicContact CG1-CG1 3.82Å; T155-V167 HydrophobicContact CG2-CG1 4.45Å; T155-V167 HydrophobicContact CG2-CG2 4.06Å; A165-V167 HydrophobicContact CB-CG2 3.88Å; V167-V313 HydrophobicContact CG2-CG1 4.15Å; V167-L314 PolarHBondContact N-O 2.97Å; V167-L315 HydrophobicContact CB-CB 4.48Å; V167-L315 HydrophobicContact CB-CD2 4.09Å; V167-L315 HydrophobicContact CB-CG 3.99Å; V167-L315 HydrophobicContact CG1-CD2 4.08Å; V167-L315 HydrophobicContact CG2-CD2 4.49Å; V167-L315 HydrophobicContact CG2-CG 4.37Å; V167-L315 WeakPolarHBondContact O-CA 3.23Å; V167-S316 PolarHBondContact O-N 2.77Å; V167-S316 VanDerWaalsContact O-N 3.08Å
168	R	88	Confident	87.7	Confident	58 Å²	58	24.6 Å²	24.6	22%	0.219	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	112.5	175.3	-169.5	-171.3	-173.1	-164.9	-3.7	110.2	L319 I337 S353	R168-L319 HydrophobicContact CG-CG 4.39Å; R168-I337 PolarHBondContact N-O 3.37Å; R168-S353 PolarHBondContact NH2-O 3.43Å
169	S	81.8	Confident	87.9	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.021	14%	0.139	C	C	.	.			trans	-155.9	151.5	166	66	0	0	0	0	113.6	S173 K175 S316 A317	S169-S173 PolarHBondContact OG-OG 3.09Å; S169-K175 WeakPolarHBondContact O-CE 3.32Å; S169-K175 PolarHBondContact O-NZ 3.48Å; S169-K175 WeakPolarHBondContact OG-CD 3.43Å; S169-K175 VanDerWaalsContact OG-CG 3.24Å; S169-K175 WeakPolarHBondContact OG-CG 3.39Å; S169-S316 PolarHBondContact N-O 3.1Å; S169-A317 WeakPolarHBondContact O-CA 3.27Å
170	Q	73.6	Confident	87.9	Confident	15 Å²	15	23.9 Å²	23.9	7%	0.07	14%	0.139	C	C	.	.			trans	-55.3	159.5	177.7	61.5	174.8	-35.3	0	0	113.6	E118 S173 P357	E118-Q170 VanDerWaalsContact CB-NE2 3.32Å; E118-Q170 WeakPolarHBondContact OE2-CG 3.34Å; E118-Q170 PolarHBondContact OE2-NE2 3.08Å; Q170-S173 WeakPolarHBondContact O-CB 3.14Å; Q170-S173 PolarHBondContact O-OG 2.96Å; Q170-P357 VanDerWaalsContact OE1-CG 3.31Å; Q170-P357 VanDerWaalsContact OE1-N 3.16Å
171	T	71.4	Confident	88	Confident	8 Å²	8	21.6 Å²	21.6	5%	0.049	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	131.5	178.4	60.3	0	0	0	0	111.1	H483 G486 R487	T171-H483 WeakPolarHBondContact CG2-ND1 3.24Å; T171-G486 PolarHBondContact OG1-O 3.2Å; T171-R487 PolarHBondContact OG1-NH2 3.31Å
172	G	68.4	Low	88.3	Confident	20 Å²	20	18.1 Å²	18.1	21%	0.206	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.7	-0.7	-175.6	0	0	0	0	0	114.9	G174	G172-G174 PolarHBondContact O-N 3.12Å
173	S	73.4	Confident	88.5	Confident	6 Å²	6	16.8 Å²	16.8	4%	0.042	9%	0.088	C	C	.	.	S	Bend	trans	-71.7	-4.9	177	65	0	0	0	0	115.3	T149 I151 S169 Q170	T149-S173 VanDerWaalsContact CB-O 3.27Å; T149-S173 WeakPolarHBondContact CB-O 3.24Å; T149-S173 WeakPolarHBondContact CG2-O 3.43Å; T149-S173 PolarHBondContact OG1-O 3.36Å; I151-S173 VanDerWaalsContact CG2-O 3.31Å; I151-S173 WeakPolarHBondContact CG2-O 3.41Å; S169-S173 PolarHBondContact OG-OG 3.09Å; Q170-S173 WeakPolarHBondContact O-CB 3.14Å; Q170-S173 PolarHBondContact O-OG 2.96Å
174	G	81.3	Confident	88.8	Confident	19 Å²	19	10.5 Å²	10.5	20%	0.196	7%	0.065	C	C	.	.			trans	88.6	20.3	-174.4	0	0	0	0	0	115.4	Q152 G172 T176 L177 S178	Q152-G174 PolarHBondContact NE2-O 3.21Å; Q152-G174 VanDerWaalsContact NE2-O 3.09Å; G172-G174 PolarHBondContact O-N 3.12Å; G174-T176 VanDerWaalsContact C-N 3.29Å; G174-T176 PolarHBondContact O-N 3.17Å; G174-T176 VanDerWaalsContact O-N 3.17Å; G174-L177 PolarHBondContact O-N 3.47Å; G174-S178 PolarHBondContact O-N 2.73Å; G174-S178 PolarHBondContact O-OG 3.41Å; G174-S178 VanDerWaalsContact O-OG 3.12Å
175	K	88.3	Confident	88.9	Confident	12 Å²	12	11.4 Å²	11.4	5%	0.052	7%	0.069	C	C	.	.	H	α-helix	trans	-39.6	-49.7	176	-79.4	-169.2	-76.4	-166.1	0	114.2	S169 L177 S178 Y179 E283 L315	S169-K175 WeakPolarHBondContact O-CE 3.32Å; S169-K175 PolarHBondContact O-NZ 3.48Å; S169-K175 WeakPolarHBondContact OG-CD 3.43Å; S169-K175 VanDerWaalsContact OG-CG 3.24Å; S169-K175 WeakPolarHBondContact OG-CG 3.39Å; K175-L177 PolarHBondContact O-N 3.39Å; K175-S178 WeakPolarHBondContact O-CA 3.45Å; K175-S178 WeakPolarHBondContact O-CB 3.33Å; K175-S178 PolarHBondContact O-N 3.06Å; K175-S178 PolarHBondContact O-OG 3.01Å; K175-Y179 WeakPolarHBondContact O-CD1 3.13Å; K175-E283 WeakPolarHBondContact CE-OE2 3.49Å; K175-E283 IonicContact NZ-OE2 2.93Å; K175-E283 PolarHBondContact NZ-OE2 3.49Å; K175-L315 HydrophobicContact CB-CD2 4.02Å; K175-L315 HydrophobicContact CD-CB 4.14Å; K175-L315 HydrophobicContact CD-CD2 4.31Å; K175-L315 HydrophobicContact CG-CD2 4.13Å
176	T	92.4	Very high	88.9	Confident	26 Å²	26	17.4 Å²	17.4	16%	0.16	9%	0.091	C	C	.	.	H	α-helix	trans	-56.2	-43	-175.5	-46.4	0	0	0	0	113.8	G174 S178 A180 T215 T218	G174-T176 VanDerWaalsContact C-N 3.29Å; G174-T176 PolarHBondContact O-N 3.17Å; G174-T176 VanDerWaalsContact O-N 3.17Å; T176-S178 VanDerWaalsContact C-N 3.3Å; T176-S178 PolarHBondContact O-N 3.46Å; T176-A180 WeakPolarHBondContact O-CB 3.09Å; T176-A180 PolarHBondContact O-N 2.82Å; T176-T215 HydrophobicContact CG2-CG2 4.23Å; T176-T218 HydrophobicContact CG2-CG2 4.09Å
177	L	94	Very high	89	Confident	19 Å²	19	16.6 Å²	16.6	10%	0.099	8%	0.084	C	C	.	.	H	α-helix	trans	-73.3	-24.7	176.7	-65.4	-179.5	0	0	0	112.6	L139 L143 V145 G174 K175 Y179 A180 V181 T218 L222	L139-L177 HydrophobicContact CD2-CD1 4.24Å; L139-L177 HydrophobicContact CD2-CD2 4.38Å; L143-L177 HydrophobicContact CD1-CD2 4.11Å; V145-L177 HydrophobicContact CG1-CD1 4.5Å; V145-L177 HydrophobicContact CG2-CD1 4.19Å; G174-L177 PolarHBondContact O-N 3.47Å; K175-L177 PolarHBondContact O-N 3.39Å; L177-Y179 VanDerWaalsContact C-N 3.29Å; L177-Y179 PolarHBondContact O-N 3.04Å; L177-A180 PolarHBondContact O-N 3.49Å; L177-V181 HydrophobicContact CB-CG2 4.26Å; L177-V181 HydrophobicContact CD2-CG2 4.43Å; L177-V181 WeakPolarHBondContact O-CB 3.27Å; L177-V181 WeakPolarHBondContact O-CG2 3.19Å; L177-V181 PolarHBondContact O-N 2.92Å; L177-T218 HydrophobicContact CD2-CG2 3.85Å; L177-L222 HydrophobicContact CD2-CD1 4.08Å; L177-L222 HydrophobicContact CD2-CD2 4.37Å
178	S	94.1	Very high	89.2	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.9	-34.9	-178	-48.1	0	0	0	0	112.2	Q152 G174 K175 T176 P182	Q152-S178 VanDerWaalsContact CG-OG 3.23Å; Q152-S178 WeakPolarHBondContact CG-OG 3.22Å; G174-S178 PolarHBondContact O-N 2.73Å; G174-S178 PolarHBondContact O-OG 3.41Å; G174-S178 VanDerWaalsContact O-OG 3.12Å; K175-S178 WeakPolarHBondContact O-CA 3.45Å; K175-S178 WeakPolarHBondContact O-CB 3.33Å; K175-S178 PolarHBondContact O-N 3.06Å; K175-S178 PolarHBondContact O-OG 3.01Å; T176-S178 VanDerWaalsContact C-N 3.3Å; T176-S178 PolarHBondContact O-N 3.46Å; S178-P182 WeakPolarHBondContact O-CD 3.32Å; S178-P182 VanDerWaalsContact O-CG 3.27Å; S178-P182 WeakPolarHBondContact O-CG 3.34Å
179	Y	95.8	Very high	89.5	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-97.1	-35.7	170.2	63	-99.5	0	0	0	113.5	K175 L177 V181 P182 L183 V204 T215 F219 V280 D282 L315	K175-Y179 WeakPolarHBondContact O-CD1 3.13Å; L177-Y179 VanDerWaalsContact C-N 3.29Å; L177-Y179 PolarHBondContact O-N 3.04Å; Y179-V181 PolarHBondContact O-N 3.5Å; Y179-P182 VanDerWaalsContact O-CD 3.32Å; Y179-P182 WeakPolarHBondContact O-CD 3.47Å; Y179-P182 WeakPolarHBondContact O-CG 3.33Å; Y179-L183 WeakPolarHBondContact O-CB 3.37Å; Y179-L183 PolarHBondContact O-N 3.15Å; Y179-L183 VanDerWaalsContact O-N 3.15Å; Y179-V204 HydrophobicContact CE2-CG1 3.86Å; Y179-V204 HydrophobicContact CE2-CG2 4.36Å; Y179-T215 HydrophobicContact CE2-CG2 4.44Å; Y179-T215 WeakPolarHBondContact OH-CG2 3.27Å; Y179-F219 HydrophobicContact CD2-CZ 4.31Å; Y179-F219 HydrophobicContact CE2-CE2 4.2Å; Y179-F219 HydrophobicContact CE2-CZ 4.09Å; Y179-V280 HydrophobicContact CD1-CG1 3.89Å; Y179-V280 HydrophobicContact CD2-CB 4.43Å; Y179-V280 HydrophobicContact CD2-CG1 3.86Å; Y179-V280 HydrophobicContact CD2-CG2 4.06Å; Y179-V280 HydrophobicContact CE1-CG1 4.01Å; Y179-V280 HydrophobicContact CE2-CG1 4.03Å; Y179-V280 HydrophobicContact CG-CG1 3.79Å; Y179-V280 HydrophobicContact CG-CG2 4.33Å; Y179-D282 HydrophobicContact CE1-CB 4.05Å; Y179-D282 VanDerWaalsContact CE1-OD2 3.27Å; Y179-D282 WeakPolarHBondContact CE1-OD2 3.45Å; Y179-D282 PolarHBondContact OH-OD2 3.05Å; Y179-L315 HydrophobicContact CD1-CD1 3.52Å; Y179-L315 HydrophobicContact CD1-CD2 3.76Å; Y179-L315 HydrophobicContact CD1-CG 4.32Å; Y179-L315 HydrophobicContact CE1-CD1 3.88Å; Y179-L315 HydrophobicContact CE1-CD2 4.26Å; Y179-L315 HydrophobicContact CG-CD1 4.34Å
180	A	97.1	Very high	90	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-67.8	-34.5	-173.9	0	0	0	0	0	113.2	T176 L177 V184 F219 L222	T176-A180 WeakPolarHBondContact O-CB 3.09Å; T176-A180 PolarHBondContact O-N 2.82Å; L177-A180 PolarHBondContact O-N 3.49Å; A180-V184 WeakPolarHBondContact O-CB 3.37Å; A180-V184 VanDerWaalsContact O-CG2 3.22Å; A180-V184 WeakPolarHBondContact O-CG2 3.3Å; A180-V184 PolarHBondContact O-N 2.54Å; A180-F219 HydrophobicContact CB-CD1 4.31Å; A180-F219 HydrophobicContact CB-CE1 3.58Å; A180-F219 HydrophobicContact CB-CE2 4.37Å; A180-F219 HydrophobicContact CB-CZ 3.61Å; A180-L222 HydrophobicContact CB-CD1 3.59Å
181	V	96.9	Very high	90.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.9	-54.8	177.6	173	0	0	0	0	112.7	F126 L131 L135 L139 I156 L177 Y179 L183 V184 Q185 L222	F126-V181 HydrophobicContact CD1-CG1 4.48Å; F126-V181 HydrophobicContact CE1-CG2 4.15Å; L131-V181 HydrophobicContact CD1-CG1 3.5Å; L131-V181 HydrophobicContact CD2-CG1 4.02Å; L131-V181 HydrophobicContact CG-CG1 4.43Å; L135-V181 HydrophobicContact CD2-CG1 4.2Å; L139-V181 HydrophobicContact CD1-CG1 4.39Å; L139-V181 HydrophobicContact CD1-CG2 4.14Å; L139-V181 HydrophobicContact CD2-CG2 3.93Å; I156-V181 HydrophobicContact CD1-CB 4.23Å; I156-V181 HydrophobicContact CD1-CG1 4.32Å; I156-V181 HydrophobicContact CG2-CG1 4.39Å; L177-V181 HydrophobicContact CB-CG2 4.26Å; L177-V181 HydrophobicContact CD2-CG2 4.43Å; L177-V181 WeakPolarHBondContact O-CB 3.27Å; L177-V181 WeakPolarHBondContact O-CG2 3.19Å; L177-V181 PolarHBondContact O-N 2.92Å; Y179-V181 PolarHBondContact O-N 3.5Å; V181-L183 VanDerWaalsContact C-N 3.34Å; V181-L183 PolarHBondContact O-N 3.25Å; V181-V184 PolarHBondContact O-N 3.23Å; V181-Q185 WeakPolarHBondContact O-CB 3.36Å; V181-Q185 PolarHBondContact O-N 3.39Å; V181-L222 HydrophobicContact CG2-CD2 4.44Å
182	P	97	Very high	91.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.7	-35.9	178.5	22.8	-32.1	0	0	0	112.7	I156 L159 L160 S178 Y179 Q185 R186 W278	I156-P182 HydrophobicContact CG2-CB 4.4Å; I156-P182 HydrophobicContact CG2-CG 4.4Å; L159-P182 HydrophobicContact CB-CB 3.88Å; L159-P182 HydrophobicContact CB-CG 3.72Å; L159-P182 HydrophobicContact CD1-CG 3.89Å; L159-P182 HydrophobicContact CG-CG 4.47Å; L160-P182 HydrophobicContact CD2-CB 3.82Å; L160-P182 HydrophobicContact CG-CB 4Å; S178-P182 WeakPolarHBondContact O-CD 3.32Å; S178-P182 VanDerWaalsContact O-CG 3.27Å; S178-P182 WeakPolarHBondContact O-CG 3.34Å; Y179-P182 VanDerWaalsContact O-CD 3.32Å; Y179-P182 WeakPolarHBondContact O-CD 3.47Å; Y179-P182 WeakPolarHBondContact O-CG 3.33Å; P182-Q185 PolarHBondContact O-N 3.01Å; P182-R186 WeakPolarHBondContact O-CB 3.43Å; P182-R186 WeakPolarHBondContact O-CG 3.21Å; P182-R186 PolarHBondContact O-N 3.18Å; P182-W278 HydrophobicContact CB-CH2 4.42Å
183	L	97.3	Very high	93.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.4	-49	174.8	-173.8	169.9	0	0	0	111.2	Y179 V181 R186 L187 A202 V204 F219 V253 W278 V280	Y179-L183 WeakPolarHBondContact O-CB 3.37Å; Y179-L183 PolarHBondContact O-N 3.15Å; Y179-L183 VanDerWaalsContact O-N 3.15Å; V181-L183 VanDerWaalsContact C-N 3.34Å; V181-L183 PolarHBondContact O-N 3.25Å; L183-R186 PolarHBondContact O-N 2.92Å; L183-L187 HydrophobicContact CD2-CD1 3.66Å; L183-L187 HydrophobicContact CD2-CG 4.19Å; L183-L187 WeakPolarHBondContact O-CG 3.5Å; L183-L187 PolarHBondContact O-N 3.43Å; L183-A202 HydrophobicContact CD1-CB 3.97Å; L183-A202 HydrophobicContact CD2-CB 3.86Å; L183-A202 HydrophobicContact CG-CB 4.1Å; L183-V204 HydrophobicContact CD1-CG2 4.45Å; L183-F219 HydrophobicContact CD1-CE1 4.31Å; L183-F219 HydrophobicContact CD1-CZ 4.08Å; L183-F219 HydrophobicContact CD2-CE1 4.09Å; L183-V253 HydrophobicContact CD2-CG2 4.17Å; L183-W278 HydrophobicContact CB-CD2 4.27Å; L183-W278 HydrophobicContact CB-CE3 4.23Å; L183-W278 HydrophobicContact CB-CZ3 4.37Å; L183-W278 HydrophobicContact CD1-CB 4.44Å; L183-W278 HydrophobicContact CD1-CD2 4.41Å; L183-W278 HydrophobicContact CD1-CE3 4.31Å; L183-W278 HydrophobicContact CD1-CG 4.49Å; L183-W278 HydrophobicContact CG-CD2 4.02Å; L183-W278 HydrophobicContact CG-CE3 4.25Å; L183-W278 HydrophobicContact CG-CG 4.14Å; L183-V280 HydrophobicContact CD1-CG2 4.33Å
184	V	97.4	Very high	94.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-42.7	176.5	168.9	0	0	0	0	111.5	L135 A180 V181 R186 L187 Q188 F219 L222 L223 F226	L135-V184 HydrophobicContact CD1-CG1 3.99Å; L135-V184 HydrophobicContact CD2-CG1 4.26Å; A180-V184 WeakPolarHBondContact O-CB 3.37Å; A180-V184 VanDerWaalsContact O-CG2 3.22Å; A180-V184 WeakPolarHBondContact O-CG2 3.3Å; A180-V184 PolarHBondContact O-N 2.54Å; V181-V184 PolarHBondContact O-N 3.23Å; V184-R186 VanDerWaalsContact C-N 3.28Å; V184-R186 PolarHBondContact O-N 3.44Å; V184-L187 PolarHBondContact O-N 2.92Å; V184-Q188 WeakPolarHBondContact O-CG 3.48Å; V184-Q188 PolarHBondContact O-N 3.4Å; V184-F219 HydrophobicContact CG2-CD1 4.06Å; V184-F219 HydrophobicContact CG2-CE1 4.14Å; V184-L222 HydrophobicContact CG2-CB 4.27Å; V184-L223 HydrophobicContact CB-CD2 4.37Å; V184-L223 HydrophobicContact CG1-CD2 3.79Å; V184-L223 HydrophobicContact CG2-CD2 3.75Å; V184-L223 HydrophobicContact CG2-CG 4.23Å; V184-F226 HydrophobicContact CG1-CD2 3.66Å; V184-F226 HydrophobicContact CG1-CE2 3.71Å
185	Q	96.8	Very high	94.8	Very high	31 Å²	31	38.3 Å²	38.3	15%	0.145	20%	0.201	C	C	.	.	H	α-helix	trans	-58.2	-39.7	176.2	179.3	64.4	13.4	0	0	112.2	L131 H132 L135 L160 V181 P182 Q188 A189	L131-Q185 HydrophobicContact CD2-CB 4.03Å; L131-Q185 HydrophobicContact CD2-CG 3.84Å; H132-Q185 VanDerWaalsContact CB-OE1 3.32Å; L135-Q185 HydrophobicContact CD2-CB 4.06Å; L160-Q185 HydrophobicContact CD2-CB 4.11Å; L160-Q185 HydrophobicContact CD2-CG 3.83Å; V181-Q185 WeakPolarHBondContact O-CB 3.36Å; V181-Q185 PolarHBondContact O-N 3.39Å; P182-Q185 PolarHBondContact O-N 3.01Å; Q185-Q188 WeakPolarHBondContact O-CG 3.3Å; Q185-Q188 PolarHBondContact O-NE2 3.06Å; Q185-A189 WeakPolarHBondContact O-CB 3.44Å; Q185-A189 PolarHBondContact O-N 3.5Å
186	R	95.7	Very high	95.1	Very high	126 Å²	126	44 Å²	44	48%	0.475	22%	0.222	S	C	.	.	H	α-helix	trans	-77.5	-33.8	-179.8	-69.2	-87.7	-79.8	172.3	-4.2	113	L160 P182 L183 V184 W278	L160-R186 HydrophobicContact CD2-CG 4.46Å; P182-R186 WeakPolarHBondContact O-CB 3.43Å; P182-R186 WeakPolarHBondContact O-CG 3.21Å; P182-R186 PolarHBondContact O-N 3.18Å; L183-R186 PolarHBondContact O-N 2.92Å; V184-R186 VanDerWaalsContact C-N 3.28Å; V184-R186 PolarHBondContact O-N 3.44Å; R186-W278 HydrophobicContact CB-CZ2 4.24Å; R186-W278 HydrophobicContact CG-CZ2 4.09Å
187	L	95.8	Very high	95.1	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-74.4	-37.3	174.3	-68.8	-175	0	0	0	112.9	L183 V184 A189 S190 V194 L201 A202 I229 V253	L183-L187 HydrophobicContact CD2-CD1 3.66Å; L183-L187 HydrophobicContact CD2-CG 4.19Å; L183-L187 WeakPolarHBondContact O-CG 3.5Å; L183-L187 PolarHBondContact O-N 3.43Å; V184-L187 PolarHBondContact O-N 2.92Å; L187-A189 VanDerWaalsContact C-N 3.32Å; L187-S190 WeakPolarHBondContact O-CB 3.47Å; L187-S190 PolarHBondContact O-N 2.93Å; L187-V194 WeakPolarHBondContact O-CG2 3.44Å; L187-L201 HydrophobicContact CD2-CB 3.81Å; L187-L201 HydrophobicContact CD2-CD1 3.91Å; L187-A202 HydrophobicContact CD1-CB 4.38Å; L187-I229 HydrophobicContact CB-CD1 3.8Å; L187-I229 HydrophobicContact CD1-CG2 4.15Å; L187-V253 HydrophobicContact CD1-CG2 3.69Å
188	Q	95.8	Very high	95	Very high	27 Å²	27	50 Å²	50	13%	0.126	26%	0.262	C	S	.	.	H	α-helix	trans	-71.7	-28	178.2	74.5	80.7	46.9	0	0	112.8	H132 V184 Q185 S190 F226 W228 I229	H132-Q188 PolarHBondContact CD2-OE1 2.88Å; V184-Q188 WeakPolarHBondContact O-CG 3.48Å; V184-Q188 PolarHBondContact O-N 3.4Å; Q185-Q188 WeakPolarHBondContact O-CG 3.3Å; Q185-Q188 PolarHBondContact O-NE2 3.06Å; Q188-S190 VanDerWaalsContact C-N 3.3Å; Q188-F226 HydrophobicContact CB-CD1 3.6Å; Q188-F226 HydrophobicContact CB-CD2 4.2Å; Q188-F226 HydrophobicContact CB-CE1 3.69Å; Q188-F226 HydrophobicContact CB-CE2 4.29Å; Q188-F226 HydrophobicContact CB-CG 3.86Å; Q188-F226 HydrophobicContact CB-CZ 4.04Å; Q188-F226 HydrophobicContact CG-CD1 4.13Å; Q188-F226 HydrophobicContact CG-CD2 4.49Å; Q188-F226 HydrophobicContact CG-CE1 3.68Å; Q188-F226 HydrophobicContact CG-CE2 4.08Å; Q188-F226 HydrophobicContact CG-CZ 3.65Å; Q188-W228 HydrophobicContact CB-CZ2 4.4Å; Q188-I229 HydrophobicContact CB-CD1 4.07Å
189	A	94.9	Very high	95	Very high	64 Å²	64	50.7 Å²	50.7	53%	0.529	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	9.1	174.4	0	0	0	0	0	114.1	Q185 L187	Q185-A189 WeakPolarHBondContact O-CB 3.44Å; Q185-A189 PolarHBondContact O-N 3.5Å; L187-A189 VanDerWaalsContact C-N 3.32Å
190	S	92.7	Very high	94.9	Very high	15 Å²	15	51.2 Å²	51.2	11%	0.105	27%	0.273	C	S	.	.			trans	-74.8	129	176.7	-175.8	0	0	0	0	110.5	L187 Q188 P192 K193 R277	L187-S190 WeakPolarHBondContact O-CB 3.47Å; L187-S190 PolarHBondContact O-N 2.93Å; Q188-S190 VanDerWaalsContact C-N 3.3Å; S190-P192 CarbonylContact C-O 3.48Å; S190-P192 CarbonylContact O-C 3.57Å; S190-P192 VanDerWaalsContact O-C 3.31Å; S190-P192 VanDerWaalsContact O-O 3.06Å; S190-P192 PolarHBondContact OG-O 3.35Å; S190-K193 WeakPolarHBondContact O-CA 3.44Å; S190-K193 PolarHBondContact O-N 2.96Å; S190-R277 PolarHBondContact OG-NH1 3.05Å
191	E	91.1	Very high	94.9	Very high	176 Å²	176	51.3 Å²	51.3	82%	0.822	27%	0.273	S	S	*	.	S	Bend	trans	-115.9	129.6	167.7	-61.2	-162.7	154.6	0	0	109.5
192	P	92.3	Very high	94.9	Very high	118 Å²	118	51.3 Å²	51.3	77%	0.766	27%	0.273	S	S	*	.	S	Bend	cis	-60.1	159.3	-9.3	29.5	-36.7	0	0	0	112.5	S190 V194	S190-P192 CarbonylContact C-O 3.48Å; S190-P192 CarbonylContact O-C 3.57Å; S190-P192 VanDerWaalsContact O-C 3.31Å; S190-P192 VanDerWaalsContact O-O 3.06Å; S190-P192 PolarHBondContact OG-O 3.35Å; P192-V194 PolarHBondContact O-N 3.02Å
193	K	94.3	Very high	95	Very high	147 Å²	147	51.4 Å²	51.4	64%	0.639	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-60.7	135.7	-177.5	-71.2	-174.8	178.7	178.8	0	111.2	S190 S195	S190-K193 WeakPolarHBondContact O-CA 3.44Å; S190-K193 PolarHBondContact O-N 2.96Å; K193-S195 PolarHBondContact O-N 2.91Å
194	V	96.2	Very high	95	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.024	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-51	130.6	179.4	173.3	0	0	0	0	111.6	L187 P192 D198 L201 I229 N252	L187-V194 WeakPolarHBondContact O-CG2 3.44Å; P192-V194 PolarHBondContact O-N 3.02Å; V194-D198 VanDerWaalsContact CA-OD2 3.3Å; V194-D198 WeakPolarHBondContact CA-OD2 3.47Å; V194-L201 HydrophobicContact CB-CD1 4.18Å; V194-L201 HydrophobicContact CG1-CD1 3.62Å; V194-L201 HydrophobicContact CG2-CD1 3.55Å; V194-I229 HydrophobicContact CB-CG1 4.3Å; V194-I229 HydrophobicContact CG1-CG1 4.38Å; V194-N252 HydrophobicContact CG1-CB 4.01Å; V194-N252 VanDerWaalsContact CG1-CG 3.5Å; V194-N252 WeakPolarHBondContact CG1-ND2 3.28Å
195	S	95.3	Very high	95	Very high	36 Å²	36	51.4 Å²	51.4	25%	0.252	27%	0.273	S	S	.	.			trans	-117.5	163.1	-179.8	92.5	0	0	0	0	112	K193 S197 D198 N252	K193-S195 PolarHBondContact O-N 2.91Å; S195-S197 PolarHBondContact O-N 3.06Å; S195-S197 WeakPolarHBondContact OG-CB 3.31Å; S195-S197 PolarHBondContact OG-N 2.91Å; S195-S197 VanDerWaalsContact OG-N 3.15Å; S195-S197 PolarHBondContact OG-OG 3.15Å; S195-D198 WeakPolarHBondContact CB-OD1 3.45Å; S195-D198 PolarHBondContact N-OD1 2.73Å; S195-D198 PolarHBondContact N-OD2 2.83Å; S195-D198 WeakPolarHBondContact O-CB 3.36Å; S195-D198 PolarHBondContact O-N 2.97Å; S195-D198 PolarHBondContact OG-N 3.12Å; S195-D198 PolarHBondContact OG-OD1 3.46Å; S195-N252 PolarHBondContact O-ND2 2.82Å
196	R	93.4	Very high	95	Very high	132 Å²	132	49.9 Å²	49.9	50%	0.498	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-62.7	-30.2	171.7	-80.2	175	173.6	-78.1	-6.2	112.7	D198 G199 V230 K249 G250	R196-D198 VanDerWaalsContact C-N 3.3Å; R196-D198 PolarHBondContact O-N 3.27Å; R196-G199 PolarHBondContact O-N 3.42Å; R196-V230 HydrophobicContact CG-CG2 3.85Å; R196-V230 VanDerWaalsContact CZ-CG2 3.47Å; R196-K249 WeakPolarHBondContact CD-O 3.29Å; R196-K249 PolarHBondContact NH1-O 2.87Å; R196-G250 PolarHBondContact NH1-O 3.29Å; R196-G250 WeakPolarHBondContact O-CA 3.42Å
197	S	92.8	Very high	94.7	Very high	113 Å²	113	44.2 Å²	44.2	79%	0.79	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-68.3	-26.5	-179.9	4.4	0	0	0	0	113.2	S195 G199	S195-S197 PolarHBondContact O-N 3.06Å; S195-S197 WeakPolarHBondContact OG-CB 3.31Å; S195-S197 PolarHBondContact OG-N 2.91Å; S195-S197 VanDerWaalsContact OG-N 3.15Å; S195-S197 PolarHBondContact OG-OG 3.15Å; S197-G199 PolarHBondContact O-N 2.82Å; S197-G199 VanDerWaalsContact O-N 3.16Å
198	D	92.8	Very high	94.2	Very high	57 Å²	57	45 Å²	45	31%	0.305	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-62.5	-23.1	178.8	-49.5	-3	0	0	0	112.2	V194 S195 R196 L201 A275	V194-D198 VanDerWaalsContact CA-OD2 3.3Å; V194-D198 WeakPolarHBondContact CA-OD2 3.47Å; S195-D198 WeakPolarHBondContact CB-OD1 3.45Å; S195-D198 PolarHBondContact N-OD1 2.73Å; S195-D198 PolarHBondContact N-OD2 2.83Å; S195-D198 WeakPolarHBondContact O-CB 3.36Å; S195-D198 PolarHBondContact O-N 2.97Å; S195-D198 PolarHBondContact OG-N 3.12Å; S195-D198 PolarHBondContact OG-OD1 3.46Å; R196-D198 VanDerWaalsContact C-N 3.3Å; R196-D198 PolarHBondContact O-N 3.27Å; D198-L201 HydrophobicContact CB-CD1 4.37Å; D198-L201 HydrophobicContact CB-CD2 4.09Å; D198-L201 HydrophobicContact CB-CG 4.28Å; D198-A275 WeakPolarHBondContact O-CB 3.48Å
199	G	93.1	Very high	93.8	Very high	15 Å²	15	48 Å²	48	16%	0.155	26%	0.261	C	S	.	.			trans	66.5	-154.5	-173	0	0	0	0	0	112.5	R196 S197 L201 M251 N252	R196-G199 PolarHBondContact O-N 3.42Å; S197-G199 PolarHBondContact O-N 2.82Å; S197-G199 VanDerWaalsContact O-N 3.16Å; G199-L201 PolarHBondContact O-N 3.25Å; G199-M251 CarbonylContact C-O 3.53Å; G199-M251 VanDerWaalsContact C-O 3.24Å; G199-N252 WeakPolarHBondContact O-CA 3.37Å; G199-N252 PolarHBondContact O-ND2 3.37Å
200	P	95.4	Very high	93.2	Very high	11 Å²	11	45.5 Å²	45.5	7%	0.071	24%	0.238	C	C	.	.			trans	-62	115.7	178.9	-23.3	34.8	0	0	0	112.5	M251 V254 L271 A272 A275 V276	P200-M251 VanDerWaalsContact CA-O 3.29Å; P200-M251 WeakPolarHBondContact CA-O 3.47Å; P200-M251 VanDerWaalsContact N-O 3.16Å; P200-V254 HydrophobicContact CB-CG2 3.89Å; P200-V254 HydrophobicContact CG-CG2 3.91Å; P200-L271 HydrophobicContact CG-CD1 3.78Å; P200-A272 WeakPolarHBondContact CD-O 3.37Å; P200-A275 CarbonylContact O-C 3.54Å; P200-V276 HydrophobicContact CB-CG2 3.88Å; P200-V276 VanDerWaalsContact O-CG2 3.25Å; P200-V276 WeakPolarHBondContact O-CG2 3.44Å; P200-V276 PolarHBondContact O-N 3.02Å
201	L	96.5	Very high	92.9	Very high	2 Å²	2	45 Å²	45	1%	0.01	23%	0.234	C	C	.	.	S	Bend	trans	-100.2	-24.3	170	-62.7	-177.3	0	0	0	111.9	L187 V194 D198 G199 N252 A275 R277 W278	L187-L201 HydrophobicContact CD2-CB 3.81Å; L187-L201 HydrophobicContact CD2-CD1 3.91Å; V194-L201 HydrophobicContact CB-CD1 4.18Å; V194-L201 HydrophobicContact CG1-CD1 3.62Å; V194-L201 HydrophobicContact CG2-CD1 3.55Å; D198-L201 HydrophobicContact CB-CD1 4.37Å; D198-L201 HydrophobicContact CB-CD2 4.09Å; D198-L201 HydrophobicContact CB-CG 4.28Å; G199-L201 PolarHBondContact O-N 3.25Å; L201-N252 PolarHBondContact N-O 3.29Å; L201-A275 HydrophobicContact CD2-CB 3.86Å; L201-A275 VanDerWaalsContact CD2-O 3.29Å; L201-A275 WeakPolarHBondContact CD2-O 3.33Å; L201-R277 PolarHBondContact O-N 2.78Å; L201-W278 PolarHBondContact O-N 2.91Å; L201-W278 VanDerWaalsContact O-N 3.15Å
202	A	97.3	Very high	93	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	139.8	177.6	0	0	0	0	0	111.8	L183 L187 N252 V253 V254 W278	L183-A202 HydrophobicContact CD1-CB 3.97Å; L183-A202 HydrophobicContact CD2-CB 3.86Å; L183-A202 HydrophobicContact CG-CB 4.1Å; L187-A202 HydrophobicContact CD1-CB 4.38Å; A202-N252 PolarHBondContact N-O 3.25Å; A202-V253 HydrophobicContact CB-CG1 4.44Å; A202-V253 HydrophobicContact CB-CG2 4.36Å; A202-V254 PolarHBondContact O-N 3.14Å; A202-W278 WeakPolarHBondContact CA-O 3.46Å; A202-W278 HydrophobicContact CB-CB 3.78Å; A202-W278 HydrophobicContact CB-CG 4.48Å
203	L	97.4	Very high	92.9	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	123.6	-177.9	-177.3	63.7	0	0	0	110.2	V205 V254 L261 V276 W278 L279 V280 I299 L303	L203-V205 HydrophobicContact CD2-CG2 4.46Å; L203-V205 HydrophobicContact CG-CG2 4.21Å; L203-V254 WeakPolarHBondContact CA-O 3.32Å; L203-V254 HydrophobicContact CD1-CB 3.93Å; L203-V254 HydrophobicContact CD1-CG1 3.99Å; L203-L261 HydrophobicContact CD1-CD1 4Å; L203-L261 HydrophobicContact CD1-CD2 3.7Å; L203-L261 HydrophobicContact CD2-CD2 3.82Å; L203-L261 HydrophobicContact CG-CD2 4.11Å; L203-V276 HydrophobicContact CB-CG1 4.15Å; L203-W278 PolarHBondContact N-O 3.34Å; L203-L279 HydrophobicContact CB-CD1 4.34Å; L203-L279 HydrophobicContact CD2-CD1 3.98Å; L203-L279 HydrophobicContact CG-CD1 4.19Å; L203-L279 CarbonylContact O-C 3.58Å; L203-L279 WeakPolarHBondContact O-CA 3.29Å; L203-V280 PolarHBondContact O-N 3.25Å; L203-I299 HydrophobicContact CD2-CG2 4.15Å; L203-L303 HydrophobicContact CD2-CD1 3.87Å; L203-L303 HydrophobicContact CD2-CD2 3.98Å; L203-L303 HydrophobicContact CD2-CG 4.33Å
204	V	98.4	Very high	92.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	105.7	-178.4	-175.5	0	0	0	0	109	Y179 L183 V206 T215 F219 V254 V255 S256 V280	Y179-V204 HydrophobicContact CE2-CG1 3.86Å; Y179-V204 HydrophobicContact CE2-CG2 4.36Å; L183-V204 HydrophobicContact CD1-CG2 4.45Å; V204-V206 HydrophobicContact CG1-CG1 4.4Å; V204-T215 HydrophobicContact CG1-CG2 4.01Å; V204-F219 HydrophobicContact CG2-CE2 3.96Å; V204-F219 HydrophobicContact CG2-CZ 4.12Å; V204-V254 PolarHBondContact N-O 3.01Å; V204-V255 HydrophobicContact CB-CG1 4.5Å; V204-V255 HydrophobicContact CB-CG2 4.38Å; V204-V255 CarbonylContact O-C 3.38Å; V204-V255 WeakPolarHBondContact O-CA 3.36Å; V204-S256 PolarHBondContact O-N 3.05Å; V204-V280 HydrophobicContact CB-CB 4.39Å; V204-V280 HydrophobicContact CG1-CB 4.16Å; V204-V280 HydrophobicContact CG1-CG1 4.3Å; V204-V280 HydrophobicContact CG2-CB 4.13Å; V204-V280 HydrophobicContact CG2-CG2 4.23Å
205	V	97.8	Very high	92.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	130.3	-178.3	-169.3	0	0	0	0	109.5	L203 S256 P258 L261 L279 V280 L281 D282 I287 L296	L203-V205 HydrophobicContact CD2-CG2 4.46Å; L203-V205 HydrophobicContact CG-CG2 4.21Å; V205-S256 WeakPolarHBondContact CA-O 3.48Å; V205-P258 HydrophobicContact CG1-CB 4.39Å; V205-P258 HydrophobicContact CG1-CG 3.69Å; V205-L261 HydrophobicContact CG2-CD2 3.97Å; V205-L279 HydrophobicContact CG2-CD1 4.07Å; V205-V280 PolarHBondContact N-O 3.37Å; V205-L281 HydrophobicContact CB-CD2 3.75Å; V205-L281 HydrophobicContact CG1-CD2 4.47Å; V205-L281 HydrophobicContact CG2-CD2 3.89Å; V205-D282 PolarHBondContact O-N 2.94Å; V205-I287 HydrophobicContact CG1-CD1 4.22Å; V205-L296 HydrophobicContact CG1-CD2 4.47Å
206	V	95.3	Very high	92.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.141	C	C	.	.			trans	-138.2	145.6	-175.5	-74.4	0	0	0	0	111.5	V204 T208 L211 A212 V255 S256 T257 P258 D282	V204-V206 HydrophobicContact CG1-CG1 4.4Å; V206-T208 PolarHBondContact O-N 2.81Å; V206-L211 HydrophobicContact CB-CB 4.46Å; V206-L211 HydrophobicContact CB-CD2 3.83Å; V206-L211 HydrophobicContact CB-CG 3.93Å; V206-L211 HydrophobicContact CG1-CD2 3.78Å; V206-L211 HydrophobicContact CG1-CG 3.83Å; V206-A212 HydrophobicContact CG2-CB 3.61Å; V206-V255 HydrophobicContact CG2-CG1 4.18Å; V206-S256 PolarHBondContact N-O 3.08Å; V206-T257 WeakPolarHBondContact O-CA 3.46Å; V206-P258 WeakPolarHBondContact O-CD 3.42Å; V206-D282 HydrophobicContact CG1-CB 4.03Å
207	P	89.9	Confident	92.6	Very high	6 Å²	6	23.9 Å²	23.9	4%	0.039	13%	0.13	C	C	.	.	S	Bend	trans	-65.7	-32.5	-173.7	25	-38.5	0	0	0	115.1	L211 D282 E283 R286 I287 L290	P207-L211 HydrophobicContact CG-CD2 4.22Å; P207-D282 WeakPolarHBondContact CD-O 3.07Å; P207-E283 HydrophobicContact CG-CB 3.91Å; P207-R286 HydrophobicContact CB-CB 3.94Å; P207-R286 HydrophobicContact CB-CG 3.69Å; P207-R286 HydrophobicContact CG-CB 3.93Å; P207-R286 HydrophobicContact CG-CG 3.95Å; P207-I287 HydrophobicContact CB-CG1 3.98Å; P207-I287 HydrophobicContact CG-CG1 4.41Å; P207-L290 HydrophobicContact CB-CD1 3.89Å
208	T	86.5	Confident	92.7	Very high	20 Å²	20	19.7 Å²	19.7	12%	0.123	10%	0.1	C	C	.	.	S	Bend	trans	-123.7	151.5	-170.9	68.3	0	0	0	0	112.8	V206 E210 L211 A212	V206-T208 PolarHBondContact O-N 2.81Å; T208-E210 VanDerWaalsContact C-N 3.26Å; T208-E210 PolarHBondContact O-N 2.85Å; T208-L211 PolarHBondContact O-N 2.99Å; T208-L211 VanDerWaalsContact OG1-CB 3.31Å; T208-L211 WeakPolarHBondContact OG1-CB 3.46Å; T208-L211 PolarHBondContact OG1-N 2.82Å; T208-A212 PolarHBondContact O-N 3.12Å
209	R	86.1	Confident	92.9	Very high	91 Å²	91	17 Å²	17	34%	0.343	9%	0.085	S	C	.	.	H	α-helix	trans	-63.7	-34.9	179.9	-59.5	170	-174.7	-179.3	-0.1	111.6	A212 L213 M235 G236 T257	R209-A212 WeakPolarHBondContact O-CB 3.34Å; R209-A212 PolarHBondContact O-N 2.93Å; R209-L213 PolarHBondContact O-N 3.31Å; R209-M235 HydrophobicContact CB-CE 3.98Å; R209-M235 HydrophobicContact CB-SD 3.94Å; R209-M235 HydrophobicContact CG-CB 4.38Å; R209-G236 WeakPolarHBondContact CD-O 3.16Å; R209-G236 VanDerWaalsContact CZ-O 3.31Å; R209-G236 PolarHBondContact NE-O 2.8Å; R209-G236 VanDerWaalsContact NE-O 3.09Å; R209-T257 HydrophobicContact CG-CG2 4.08Å
210	E	83.6	Confident	93	Very high	12 Å²	12	20.4 Å²	20.4	6%	0.056	10%	0.097	C	C	.	.	H	α-helix	trans	-72.5	-41.9	-178.8	-66.2	61.5	-124.3	0	0	110.9	T208 A212 L213 Q214 Q433 R436 L461	T208-E210 VanDerWaalsContact C-N 3.26Å; T208-E210 PolarHBondContact O-N 2.85Å; E210-A212 VanDerWaalsContact C-N 3.3Å; E210-A212 PolarHBondContact O-N 3.32Å; E210-L213 PolarHBondContact O-N 2.85Å; E210-Q214 WeakPolarHBondContact O-CB 3.47Å; E210-Q214 PolarHBondContact O-N 2.83Å; E210-Q433 PolarHBondContact OE1-NE2 3.08Å; E210-R436 VanDerWaalsContact CD-NH1 3.3Å; E210-R436 IonicContact OE1-CZ 3.29Å; E210-R436 VanDerWaalsContact OE1-CZ 3.32Å; E210-R436 IonicContact OE1-NH1 3.55Å; E210-R436 PolarHBondContact OE1-NH1 2.92Å; E210-R436 IonicContact OE1-NH2 3.06Å; E210-R436 PolarHBondContact OE1-NH2 2.88Å; E210-R436 IonicContact OE2-CZ 3.32Å; E210-R436 IonicContact OE2-NH1 2.66Å; E210-R436 PolarHBondContact OE2-NH1 3.27Å; E210-R436 IonicContact OE2-NH2 3.32Å; E210-R436 PolarHBondContact OE2-NH2 3.01Å; E210-L461 HydrophobicContact CB-CD2 3.28Å; E210-L461 HydrophobicContact CG-CD2 4.01Å
211	L	86.4	Confident	93	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.016	11%	0.114	C	C	.	.	H	α-helix	trans	-63.7	-37	170.4	179.1	57.9	0	0	0	111.1	V206 P207 T208 L213 Q214 T215 E283	V206-L211 HydrophobicContact CB-CB 4.46Å; V206-L211 HydrophobicContact CB-CD2 3.83Å; V206-L211 HydrophobicContact CB-CG 3.93Å; V206-L211 HydrophobicContact CG1-CD2 3.78Å; V206-L211 HydrophobicContact CG1-CG 3.83Å; P207-L211 HydrophobicContact CG-CD2 4.22Å; T208-L211 PolarHBondContact O-N 2.99Å; T208-L211 VanDerWaalsContact OG1-CB 3.31Å; T208-L211 WeakPolarHBondContact OG1-CB 3.46Å; T208-L211 PolarHBondContact OG1-N 2.82Å; L211-L213 PolarHBondContact O-N 2.9Å; L211-Q214 PolarHBondContact O-N 3.15Å; L211-T215 WeakPolarHBondContact O-CB 3.24Å; L211-T215 PolarHBondContact O-N 2.8Å; L211-T215 PolarHBondContact O-OG1 3.05Å; L211-E283 HydrophobicContact CD2-CG 3.98Å
212	A	91.9	Very high	93	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.3	-43.9	174.2	0	0	0	0	0	112.1	V206 T208 R209 E210 Y216 V233 V255 T257	V206-A212 HydrophobicContact CG2-CB 3.61Å; T208-A212 PolarHBondContact O-N 3.12Å; R209-A212 WeakPolarHBondContact O-CB 3.34Å; R209-A212 PolarHBondContact O-N 2.93Å; E210-A212 VanDerWaalsContact C-N 3.3Å; E210-A212 PolarHBondContact O-N 3.32Å; A212-Y216 WeakPolarHBondContact O-CB 3.4Å; A212-Y216 PolarHBondContact O-N 3.16Å; A212-V233 HydrophobicContact CB-CG2 3.83Å; A212-V255 HydrophobicContact CB-CG1 4.17Å; A212-V255 WeakPolarHBondContact O-CG1 3.43Å; A212-T257 HydrophobicContact CB-CG2 4.4Å
213	L	90.1	Very high	93	Very high	41 Å²	41	24.7 Å²	24.7	22%	0.215	12%	0.115	C	C	.	.	H	α-helix	trans	-66.2	-42.3	175	-176	60.9	0	0	0	112.3	R209 E210 L211 Y216 N217	R209-L213 PolarHBondContact O-N 3.31Å; E210-L213 PolarHBondContact O-N 2.85Å; L211-L213 PolarHBondContact O-N 2.9Å; L213-Y216 HydrophobicContact CD1-CD1 4.31Å; L213-Y216 PolarHBondContact O-N 3.44Å; L213-N217 VanDerWaalsContact O-CB 3.3Å; L213-N217 WeakPolarHBondContact O-CB 3.41Å; L213-N217 PolarHBondContact O-N 3.38Å; L213-N217 PolarHBondContact O-ND2 3.28Å; L213-N217 PolarHBondContact O-OD1 3.28Å
214	Q	88.8	Confident	92.9	Very high	32 Å²	32	30.8 Å²	30.8	15%	0.15	14%	0.142	C	C	.	.	H	α-helix	trans	-63.5	-46.7	178.2	178.3	-175.4	-54.4	0	0	112.7	E210 L211 N217 T218 G460 D462	E210-Q214 WeakPolarHBondContact O-CB 3.47Å; E210-Q214 PolarHBondContact O-N 2.83Å; L211-Q214 PolarHBondContact O-N 3.15Å; Q214-N217 PolarHBondContact O-N 3.19Å; Q214-T218 PolarHBondContact O-N 2.88Å; Q214-T218 PolarHBondContact O-OG1 2.97Å; Q214-G460 PolarHBondContact NE2-O 3.23Å; Q214-G460 PolarHBondContact OE1-O 2.89Å; Q214-D462 HydrophobicContact CG-CB 4.46Å
215	T	94.4	Very high	92.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-68.2	-40.8	176.4	-68	0	0	0	0	110.8	T176 Y179 V204 L211 T218 F219 V255	T176-T215 HydrophobicContact CG2-CG2 4.23Å; Y179-T215 HydrophobicContact CE2-CG2 4.44Å; Y179-T215 WeakPolarHBondContact OH-CG2 3.27Å; V204-T215 HydrophobicContact CG1-CG2 4.01Å; L211-T215 WeakPolarHBondContact O-CB 3.24Å; L211-T215 PolarHBondContact O-N 2.8Å; L211-T215 PolarHBondContact O-OG1 3.05Å; T215-T218 WeakPolarHBondContact O-CB 3.49Å; T215-T218 PolarHBondContact O-N 3.36Å; T215-T218 VanDerWaalsContact O-N 3.15Å; T215-F219 HydrophobicContact CG2-CD2 3.94Å; T215-F219 HydrophobicContact CG2-CE2 3.68Å; T215-F219 VanDerWaalsContact O-CD2 3.28Å; T215-F219 WeakPolarHBondContact O-CD2 3.29Å; T215-F219 PolarHBondContact O-N 3Å; T215-V255 HydrophobicContact CG2-CG1 3.94Å; T215-V255 HydrophobicContact CG2-CG2 4.14Å
216	Y	95.9	Very high	92.6	Very high	46 Å²	46	32.3 Å²	32.3	18%	0.18	15%	0.152	C	C	.	.	H	α-helix	trans	-59.3	-47.5	171.5	169.1	-104.7	0	0	0	112.5	A212 L213 T218 F219 Q220 P231 G232 V233	A212-Y216 WeakPolarHBondContact O-CB 3.4Å; A212-Y216 PolarHBondContact O-N 3.16Å; L213-Y216 HydrophobicContact CD1-CD1 4.31Å; L213-Y216 PolarHBondContact O-N 3.44Å; Y216-T218 PolarHBondContact O-N 2.7Å; Y216-F219 PolarHBondContact O-N 3.17Å; Y216-F219 VanDerWaalsContact O-N 3.13Å; Y216-Q220 HydrophobicContact CD1-CG 4.35Å; Y216-Q220 HydrophobicContact CD2-CG 4.38Å; Y216-Q220 HydrophobicContact CE1-CG 3.89Å; Y216-Q220 VanDerWaalsContact CE1-OE1 3.32Å; Y216-Q220 HydrophobicContact CE2-CG 3.89Å; Y216-Q220 WeakPolarHBondContact O-CG 3.17Å; Y216-Q220 PolarHBondContact O-N 3.49Å; Y216-Q220 PolarHBondContact OH-NE2 3.47Å; Y216-P231 HydrophobicContact CD2-CB 4.16Å; Y216-P231 HydrophobicContact CE2-CB 3.99Å; Y216-P231 HydrophobicContact CE2-CG 4.2Å; Y216-G232 VanDerWaalsContact CE2-CA 3.48Å; Y216-V233 HydrophobicContact CD1-CB 4.46Å; Y216-V233 HydrophobicContact CD1-CG1 4.3Å; Y216-V233 HydrophobicContact CD2-CB 4.21Å; Y216-V233 HydrophobicContact CG-CB 3.98Å; Y216-V233 HydrophobicContact CG-CG1 4.29Å
217	N	93.8	Very high	92.6	Very high	52 Å²	52	38 Å²	38	28%	0.278	19%	0.186	S	C	.	.	H	α-helix	trans	-60.8	-31.3	175.6	-70.2	-11.3	0	0	0	111.9	L213 Q214 Q220 K221	L213-N217 VanDerWaalsContact O-CB 3.3Å; L213-N217 WeakPolarHBondContact O-CB 3.41Å; L213-N217 PolarHBondContact O-N 3.38Å; L213-N217 PolarHBondContact O-ND2 3.28Å; L213-N217 PolarHBondContact O-OD1 3.28Å; Q214-N217 PolarHBondContact O-N 3.19Å; N217-Q220 PolarHBondContact OD1-OE1 2.95Å; N217-K221 WeakPolarHBondContact O-CG 3.1Å; N217-K221 PolarHBondContact O-N 2.81Å
218	T	94.8	Very high	92.9	Very high	25 Å²	25	41.5 Å²	41.5	15%	0.153	20%	0.199	C	C	.	.	H	α-helix	trans	-68.1	-47.3	173.5	-56.4	0	0	0	0	111.4	T176 L177 Q214 T215 Y216 Q220 K221 L222	T176-T218 HydrophobicContact CG2-CG2 4.09Å; L177-T218 HydrophobicContact CD2-CG2 3.85Å; Q214-T218 PolarHBondContact O-N 2.88Å; Q214-T218 PolarHBondContact O-OG1 2.97Å; T215-T218 WeakPolarHBondContact O-CB 3.49Å; T215-T218 PolarHBondContact O-N 3.36Å; T215-T218 VanDerWaalsContact O-N 3.15Å; Y216-T218 PolarHBondContact O-N 2.7Å; T218-Q220 PolarHBondContact O-N 2.87Å; T218-K221 PolarHBondContact O-N 3.22Å; T218-L222 HydrophobicContact CG2-CD1 4.14Å; T218-L222 WeakPolarHBondContact O-CG 3.36Å; T218-L222 PolarHBondContact O-N 3.13Å
219	F	97.3	Very high	93.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.6	-40.3	173	-78.7	-69.2	0	0	0	112.7	Y179 A180 L183 V184 V204 T215 Y216 K221 L222 L223 P231 V253 V255	Y179-F219 HydrophobicContact CD2-CZ 4.31Å; Y179-F219 HydrophobicContact CE2-CE2 4.2Å; Y179-F219 HydrophobicContact CE2-CZ 4.09Å; A180-F219 HydrophobicContact CB-CD1 4.31Å; A180-F219 HydrophobicContact CB-CE1 3.58Å; A180-F219 HydrophobicContact CB-CE2 4.37Å; A180-F219 HydrophobicContact CB-CZ 3.61Å; L183-F219 HydrophobicContact CD1-CE1 4.31Å; L183-F219 HydrophobicContact CD1-CZ 4.08Å; L183-F219 HydrophobicContact CD2-CE1 4.09Å; V184-F219 HydrophobicContact CG2-CD1 4.06Å; V184-F219 HydrophobicContact CG2-CE1 4.14Å; V204-F219 HydrophobicContact CG2-CE2 3.96Å; V204-F219 HydrophobicContact CG2-CZ 4.12Å; T215-F219 HydrophobicContact CG2-CD2 3.94Å; T215-F219 HydrophobicContact CG2-CE2 3.68Å; T215-F219 VanDerWaalsContact O-CD2 3.28Å; T215-F219 WeakPolarHBondContact O-CD2 3.29Å; T215-F219 PolarHBondContact O-N 3Å; Y216-F219 PolarHBondContact O-N 3.17Å; Y216-F219 VanDerWaalsContact O-N 3.13Å; F219-K221 VanDerWaalsContact C-N 3.25Å; F219-K221 PolarHBondContact O-N 2.77Å; F219-L222 PolarHBondContact O-N 2.73Å; F219-L223 HydrophobicContact CB-CD1 4.46Å; F219-L223 VanDerWaalsContact O-CB 3.28Å; F219-L223 WeakPolarHBondContact O-CB 3.5Å; F219-L223 WeakPolarHBondContact O-CG 3.17Å; F219-L223 PolarHBondContact O-N 3.26Å; F219-P231 HydrophobicContact CB-CB 4.11Å; F219-V253 HydrophobicContact CD1-CG1 4.04Å; F219-V253 HydrophobicContact CD2-CG1 4.1Å; F219-V253 HydrophobicContact CE1-CG1 4.06Å; F219-V253 HydrophobicContact CE2-CG1 4.12Å; F219-V253 HydrophobicContact CG-CG1 4.07Å; F219-V253 HydrophobicContact CZ-CG1 4.1Å; F219-V255 HydrophobicContact CD2-CG2 3.9Å; F219-V255 HydrophobicContact CE2-CG2 4.23Å
220	Q	96	Very high	93.9	Very high	87 Å²	87	37.3 Å²	37.3	41%	0.407	18%	0.183	S	C	.	.	H	α-helix	trans	-59.3	-34.5	174.3	-73.4	-166.3	-62.5	0	0	112.9	Y216 N217 T218 K224 P231	Y216-Q220 HydrophobicContact CD1-CG 4.35Å; Y216-Q220 HydrophobicContact CD2-CG 4.38Å; Y216-Q220 HydrophobicContact CE1-CG 3.89Å; Y216-Q220 VanDerWaalsContact CE1-OE1 3.32Å; Y216-Q220 HydrophobicContact CE2-CG 3.89Å; Y216-Q220 WeakPolarHBondContact O-CG 3.17Å; Y216-Q220 PolarHBondContact O-N 3.49Å; Y216-Q220 PolarHBondContact OH-NE2 3.47Å; N217-Q220 PolarHBondContact OD1-OE1 2.95Å; T218-Q220 PolarHBondContact O-N 2.87Å; Q220-K224 WeakPolarHBondContact O-CG 3.25Å; Q220-P231 HydrophobicContact CG-CG 4.11Å
221	K	95.5	Very high	94.6	Very high	94 Å²	94	37.9 Å²	37.9	41%	0.409	19%	0.188	S	C	.	.	H	α-helix	trans	-72.4	-47.9	174.3	-70.5	174.1	-174.3	-179.5	0	111.4	T138 V142 L143 N217 T218 F219 L223 K224	T138-K221 WeakPolarHBondContact CG2-O 3.39Å; V142-K221 HydrophobicContact CG1-CB 4.4Å; V142-K221 HydrophobicContact CG1-CG 4.45Å; L143-K221 HydrophobicContact CD2-CB 4.03Å; L143-K221 HydrophobicContact CD2-CD 3.51Å; L143-K221 HydrophobicContact CD2-CG 4.43Å; L143-K221 HydrophobicContact CG-CB 4.39Å; L143-K221 HydrophobicContact CG-CD 4.47Å; N217-K221 WeakPolarHBondContact O-CG 3.1Å; N217-K221 PolarHBondContact O-N 2.81Å; T218-K221 PolarHBondContact O-N 3.22Å; F219-K221 VanDerWaalsContact C-N 3.25Å; F219-K221 PolarHBondContact O-N 2.77Å; K221-L223 VanDerWaalsContact C-N 3.33Å; K221-L223 PolarHBondContact O-N 3.15Å; K221-K224 WeakPolarHBondContact O-CG 3.44Å; K221-K224 PolarHBondContact O-N 3.35Å
222	L	96.4	Very high	95.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.4	-32.7	-179.1	-70.9	170.5	0	0	0	113.7	L135 L139 L143 L177 A180 V181 V184 T218 F219 P225	L135-L222 HydrophobicContact CD1-CD2 3.91Å; L139-L222 HydrophobicContact CD2-CD2 4Å; L139-L222 HydrophobicContact CG-CD2 4.27Å; L143-L222 HydrophobicContact CD1-CD2 3.45Å; L143-L222 VanDerWaalsContact CD1-CD2 3.45Å; L143-L222 HydrophobicContact CD1-CG 3.98Å; L177-L222 HydrophobicContact CD2-CD1 4.08Å; L177-L222 HydrophobicContact CD2-CD2 4.37Å; A180-L222 HydrophobicContact CB-CD1 3.59Å; V181-L222 HydrophobicContact CG2-CD2 4.44Å; V184-L222 HydrophobicContact CG2-CB 4.27Å; T218-L222 HydrophobicContact CG2-CD1 4.14Å; T218-L222 WeakPolarHBondContact O-CG 3.36Å; T218-L222 PolarHBondContact O-N 3.13Å; F219-L222 PolarHBondContact O-N 2.73Å; L222-P225 WeakPolarHBondContact O-CD 3.33Å
223	L	96.6	Very high	95.3	Very high	9 Å²	9	38.3 Å²	38.3	5%	0.047	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	1.7	-176.8	-67.7	175.3	0	0	0	114.4	V184 F219 K221 P225 F226 I229 P231 V253	V184-L223 HydrophobicContact CB-CD2 4.37Å; V184-L223 HydrophobicContact CG1-CD2 3.79Å; V184-L223 HydrophobicContact CG2-CD2 3.75Å; V184-L223 HydrophobicContact CG2-CG 4.23Å; F219-L223 HydrophobicContact CB-CD1 4.46Å; F219-L223 VanDerWaalsContact O-CB 3.28Å; F219-L223 WeakPolarHBondContact O-CB 3.5Å; F219-L223 WeakPolarHBondContact O-CG 3.17Å; F219-L223 PolarHBondContact O-N 3.26Å; K221-L223 VanDerWaalsContact C-N 3.33Å; K221-L223 PolarHBondContact O-N 3.15Å; L223-P225 VanDerWaalsContact C-CD 3.5Å; L223-F226 HydrophobicContact CD2-CB 4.23Å; L223-F226 HydrophobicContact CD2-CD2 4.36Å; L223-F226 CarbonylContact O-C 3.31Å; L223-F226 PolarHBondContact O-N 3.17Å; L223-I229 HydrophobicContact CD1-CB 4.35Å; L223-I229 HydrophobicContact CD1-CG2 3.89Å; L223-I229 HydrophobicContact CD2-CB 3.92Å; L223-I229 HydrophobicContact CD2-CD1 3.96Å; L223-I229 HydrophobicContact CD2-CG2 3.92Å; L223-P231 HydrophobicContact CD1-CB 4Å; L223-P231 HydrophobicContact CD1-CG 3.92Å; L223-V253 HydrophobicContact CD1-CG2 4.38Å
224	K	94.8	Very high	95.6	Very high	128 Å²	128	36.3 Å²	36.3	56%	0.557	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.4	-44.4	174.5	-77	-173.1	177.6	-174.2	0	114.8	V142 Q220 K221 F226 T227	V142-K224 HydrophobicContact CG1-CD 4.25Å; Q220-K224 WeakPolarHBondContact O-CG 3.25Å; K221-K224 WeakPolarHBondContact O-CG 3.44Å; K221-K224 PolarHBondContact O-N 3.35Å; K224-F226 VanDerWaalsContact C-N 3.32Å; K224-T227 WeakPolarHBondContact O-CG2 3.28Å
225	P	95.5	Very high	95.8	Very high	32 Å²	32	35.4 Å²	35.4	21%	0.208	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-4.9	176.9	32.6	-36.3	0	0	0	114.6	H134 L222 L223	H134-P225 HydrophobicContact CB-CB 3.59Å; H134-P225 HydrophobicContact CB-CG 3.95Å; L222-P225 WeakPolarHBondContact O-CD 3.33Å; L223-P225 VanDerWaalsContact C-CD 3.5Å
226	F	96.1	Very high	95.3	Very high	1 Å²	1	36 Å²	36	0%	0.004	18%	0.183	C	C	.	.			trans	-122.6	53.4	-172.9	-53	-58.4	0	0	0	110.7	H132 L135 V184 Q188 L223 K224 W228 I229	H132-F226 HydrophobicContact CB-CZ 4.19Å; H132-F226 AromaticContact CE1-CE1 4Å; H132-F226 AromaticContact CG-CZ 4Å; H132-F226 AromaticContact ND1-CE1 3.65Å; H132-F226 AromaticContact ND1-CZ 3.6Å; L135-F226 HydrophobicContact CB-CE2 4.05Å; L135-F226 HydrophobicContact CB-CZ 4.15Å; L135-F226 HydrophobicContact CD1-CE2 4.33Å; V184-F226 HydrophobicContact CG1-CD2 3.66Å; V184-F226 HydrophobicContact CG1-CE2 3.71Å; Q188-F226 HydrophobicContact CB-CD1 3.6Å; Q188-F226 HydrophobicContact CB-CD2 4.2Å; Q188-F226 HydrophobicContact CB-CE1 3.69Å; Q188-F226 HydrophobicContact CB-CE2 4.29Å; Q188-F226 HydrophobicContact CB-CG 3.86Å; Q188-F226 HydrophobicContact CB-CZ 4.04Å; Q188-F226 HydrophobicContact CG-CD1 4.13Å; Q188-F226 HydrophobicContact CG-CD2 4.49Å; Q188-F226 HydrophobicContact CG-CE1 3.68Å; Q188-F226 HydrophobicContact CG-CE2 4.08Å; Q188-F226 HydrophobicContact CG-CZ 3.65Å; L223-F226 HydrophobicContact CD2-CB 4.23Å; L223-F226 HydrophobicContact CD2-CD2 4.36Å; L223-F226 CarbonylContact O-C 3.31Å; L223-F226 PolarHBondContact O-N 3.17Å; K224-F226 VanDerWaalsContact C-N 3.32Å; F226-W228 HydrophobicContact CB-CH2 4.37Å; F226-W228 HydrophobicContact CB-CZ2 4.28Å; F226-W228 AromaticContact CD1-CH2 3.71Å; F226-W228 HydrophobicContact CD1-CH2 3.71Å; F226-W228 AromaticContact CD1-CZ2 3.88Å; F226-W228 HydrophobicContact CD1-CZ2 3.88Å; F226-W228 HydrophobicContact CD1-CZ3 4.5Å; F226-W228 PolarHBondContact O-N 3.31Å; F226-I229 HydrophobicContact CB-CD1 3.94Å; F226-I229 HydrophobicContact CB-CG1 4.39Å; F226-I229 PolarHBondContact O-N 3.06Å
227	T	94.6	Very high	94.7	Very high	118 Å²	118	36.7 Å²	36.7	72%	0.724	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-13.4	-166.2	54.6	0	0	0	0	116	K224	K224-T227 WeakPolarHBondContact O-CG2 3.28Å
228	W	95.9	Very high	94.2	Very high	80 Å²	80	37.2 Å²	37.2	30%	0.303	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-25.2	173.1	58.2	96.6	0	0	0	113.2	Q188 F226	Q188-W228 HydrophobicContact CB-CZ2 4.4Å; F226-W228 HydrophobicContact CB-CH2 4.37Å; F226-W228 HydrophobicContact CB-CZ2 4.28Å; F226-W228 AromaticContact CD1-CH2 3.71Å; F226-W228 HydrophobicContact CD1-CH2 3.71Å; F226-W228 AromaticContact CD1-CZ2 3.88Å; F226-W228 HydrophobicContact CD1-CZ2 3.88Å; F226-W228 HydrophobicContact CD1-CZ3 4.5Å; F226-W228 PolarHBondContact O-N 3.31Å
229	I	97.3	Very high	93.9	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	23%	0.233	C	C	.	.	S	Bend	trans	-85.9	118	177.4	-51.4	173.2	0	0	0	109.1	L187 Q188 V194 L223 F226 P231 N252 V253	L187-I229 HydrophobicContact CB-CD1 3.8Å; L187-I229 HydrophobicContact CD1-CG2 4.15Å; Q188-I229 HydrophobicContact CB-CD1 4.07Å; V194-I229 HydrophobicContact CB-CG1 4.3Å; V194-I229 HydrophobicContact CG1-CG1 4.38Å; L223-I229 HydrophobicContact CD1-CB 4.35Å; L223-I229 HydrophobicContact CD1-CG2 3.89Å; L223-I229 HydrophobicContact CD2-CB 3.92Å; L223-I229 HydrophobicContact CD2-CD1 3.96Å; L223-I229 HydrophobicContact CD2-CG2 3.92Å; F226-I229 HydrophobicContact CB-CD1 3.94Å; F226-I229 HydrophobicContact CB-CG1 4.39Å; F226-I229 PolarHBondContact O-N 3.06Å; I229-P231 WeakPolarHBondContact O-CD 3.35Å; I229-N252 HydrophobicContact CG2-CB 4.12Å; I229-V253 HydrophobicContact CG2-CG2 4.07Å
230	V	96.9	Very high	93.5	Very high	19 Å²	19	47.4 Å²	47.4	12%	0.115	25%	0.247	C	C	.	.			trans	-102.5	110.9	-172.6	-174.6	0	0	0	0	111.3	R196 M251 N252 V253	R196-V230 HydrophobicContact CG-CG2 3.85Å; R196-V230 VanDerWaalsContact CZ-CG2 3.47Å; V230-M251 CarbonylContact O-C 3.56Å; V230-N252 PolarHBondContact N-OD1 3.1Å; V230-N252 PolarHBondContact O-N 2.95Å; V230-V253 PolarHBondContact O-N 2.91Å
231	P	97.6	Very high	93.3	Very high	24 Å²	24	52.2 Å²	52.2	16%	0.156	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	155.9	169.1	33.5	-33.6	0	0	0	111.2	Y216 F219 Q220 L223 I229 V253	Y216-P231 HydrophobicContact CD2-CB 4.16Å; Y216-P231 HydrophobicContact CE2-CB 3.99Å; Y216-P231 HydrophobicContact CE2-CG 4.2Å; F219-P231 HydrophobicContact CB-CB 4.11Å; Q220-P231 HydrophobicContact CG-CG 4.11Å; L223-P231 HydrophobicContact CD1-CB 4Å; L223-P231 HydrophobicContact CD1-CG 3.92Å; I229-P231 WeakPolarHBondContact O-CD 3.35Å; P231-V253 CarbonylContact C-O 3.55Å; P231-V253 WeakPolarHBondContact CA-O 3.4Å; P231-V253 HydrophobicContact CB-CB 4.47Å
232	G	96.4	Very high	93.1	Very high	3 Å²	3	50 Å²	50	3%	0.031	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	151.7	169.8	0	0	0	0	0	112.7	Y216 V253 V254 V255	Y216-G232 VanDerWaalsContact CE2-CA 3.48Å; G232-V253 PolarHBondContact N-O 2.97Å; G232-V254 WeakPolarHBondContact O-CA 3.26Å; G232-V255 PolarHBondContact O-N 3.01Å
233	V	96.4	Very high	93	Very high	9 Å²	9	50 Å²	50	6%	0.055	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	141.9	178.9	64.7	0	0	0	0	111.7	A212 Y216 M235 R246 V255	A212-V233 HydrophobicContact CB-CG2 3.83Å; Y216-V233 HydrophobicContact CD1-CB 4.46Å; Y216-V233 HydrophobicContact CD1-CG1 4.3Å; Y216-V233 HydrophobicContact CD2-CB 4.21Å; Y216-V233 HydrophobicContact CG-CB 3.98Å; Y216-V233 HydrophobicContact CG-CG1 4.29Å; V233-M235 HydrophobicContact CG2-CB 4.5Å; V233-M235 HydrophobicContact CG2-CG 4.25Å; V233-M235 HydrophobicContact CG2-SD 4.22Å; V233-R246 VanDerWaalsContact O-CZ 3.23Å; V233-R246 PolarHBondContact O-NH1 3.42Å; V233-R246 PolarHBondContact O-NH2 3.03Å; V233-V255 CarbonylContact C-O 3.44Å; V233-V255 VanDerWaalsContact CA-O 3.26Å; V233-V255 WeakPolarHBondContact CA-O 3.32Å
234	L	95.9	Very high	92.8	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	117.3	172.3	-62.4	177.3	0	0	0	109.1	E243 I247 M251 V254 V255 S256 T257 R260	L234-E243 WeakPolarHBondContact CA-OE1 3.19Å; L234-E243 HydrophobicContact CD2-CB 3.81Å; L234-E243 HydrophobicContact CD2-CG 3.73Å; L234-I247 HydrophobicContact CD1-CD1 4.07Å; L234-I247 HydrophobicContact CD1-CG1 4.42Å; L234-I247 HydrophobicContact CD2-CD1 3.98Å; L234-I247 HydrophobicContact CD2-CG1 4.12Å; L234-M251 HydrophobicContact CD2-CE 4.31Å; L234-M251 HydrophobicContact CG-CE 4.19Å; L234-V254 HydrophobicContact CD1-CG1 3.77Å; L234-V254 HydrophobicContact CG-CG1 4.13Å; L234-V255 PolarHBondContact N-O 2.98Å; L234-S256 WeakPolarHBondContact CB-OG 3.49Å; L234-S256 VanDerWaalsContact O-CA 3.24Å; L234-S256 WeakPolarHBondContact O-CA 3.39Å; L234-S256 WeakPolarHBondContact O-CB 3.33Å; L234-S256 PolarHBondContact O-OG 3.39Å; L234-T257 PolarHBondContact O-N 3.17Å; L234-R260 HydrophobicContact CB-CG 4.47Å
235	M	92.9	Very high	92.7	Very high	12 Å²	12	48.4 Å²	48.4	6%	0.059	27%	0.267	C	S	.	.			trans	-152.6	152.7	-171.4	61.6	174.4	-122.2	0	0	115.4	R209 V233 E238 E243 T257 Q433	R209-M235 HydrophobicContact CB-CE 3.98Å; R209-M235 HydrophobicContact CB-SD 3.94Å; R209-M235 HydrophobicContact CG-CB 4.38Å; V233-M235 HydrophobicContact CG2-CB 4.5Å; V233-M235 HydrophobicContact CG2-CG 4.25Å; V233-M235 HydrophobicContact CG2-SD 4.22Å; M235-E238 HydrophobicContact CG-CG 4.41Å; M235-E238 PolarHBondContact O-N 2.81Å; M235-E243 PolarHBondContact N-OE1 2.95Å; M235-T257 HydrophobicContact CB-CG2 4.32Å; M235-Q433 HydrophobicContact CE-CG 4.12Å
236	G	85.4	Confident	92.6	Very high	14 Å²	14	50.3 Å²	50.3	14%	0.144	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	139.8	175.9	0	0	0	0	0	112.2	R209	R209-G236 WeakPolarHBondContact CD-O 3.16Å; R209-G236 VanDerWaalsContact CZ-O 3.31Å; R209-G236 PolarHBondContact NE-O 2.8Å; R209-G236 VanDerWaalsContact NE-O 3.09Å
237	G	82.4	Confident	92.6	Very high	60 Å²	60	50.9 Å²	50.9	62%	0.619	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.4	-22	-176.7	0	0	0	0	0	114.7
238	E	84.6	Confident	92.5	Very high	62 Å²	62	53.3 Å²	53.3	29%	0.29	27%	0.269	S	S	.	.	S	Bend	trans	-73.3	159.5	173.3	-85.2	-161.3	-124.7	0	0	113.1	M235 K240 E243 R246 R260	M235-E238 HydrophobicContact CG-CG 4.41Å; M235-E238 PolarHBondContact O-N 2.81Å; E238-K240 PolarHBondContact O-N 2.84Å; E238-E243 HydrophobicContact CB-CG 4.4Å; E238-R246 IonicContact OE1-NH2 2.76Å; E238-R246 PolarHBondContact OE1-NH2 2.95Å; E238-R246 VanDerWaalsContact OE1-NH2 3.08Å; E238-R246 IonicContact OE2-CZ 3.34Å; E238-R246 IonicContact OE2-NE 2.69Å; E238-R246 IonicContact OE2-NH2 3.43Å; E238-R246 PolarHBondContact OE2-NH2 2.71Å; E238-R260 PolarHBondContact O-NH2 2.87Å
239	K	87.9	Confident	92.4	Very high	172 Å²	172	56.8 Å²	56.8	75%	0.748	29%	0.286	S	S	*	.			trans	-77.4	105.2	176	-68	176.1	-178.2	171.5	0	109.8	K241 A242 E243	K239-K241 PolarHBondContact O-N 3.37Å; K239-A242 HydrophobicContact CB-CB 4.49Å; K239-A242 WeakPolarHBondContact O-CA 3.39Å; K239-A242 WeakPolarHBondContact O-CB 3.45Å; K239-A242 PolarHBondContact O-N 3.07Å; K239-E243 PolarHBondContact O-N 3.48Å
240	K	88.8	Confident	92.2	Very high	68 Å²	68	57 Å²	57	30%	0.296	29%	0.289	S	S	.	.	H	α-helix	trans	-49.9	-28.7	-177.2	-166.8	171.2	-177.6	171.6	0	115.2	E238 K244 D263	E238-K240 PolarHBondContact O-N 2.84Å; K240-K244 WeakPolarHBondContact O-CB 3.36Å; K240-K244 WeakPolarHBondContact O-CG 3.4Å; K240-K244 PolarHBondContact O-N 3.19Å; K240-D263 VanDerWaalsContact CE-OD2 3.22Å; K240-D263 WeakPolarHBondContact CE-OD2 3.11Å; K240-D263 IonicContact NZ-OD1 3.31Å; K240-D263 PolarHBondContact NZ-OD1 2.71Å; K240-D263 IonicContact NZ-OD2 3.75Å; K240-D263 PolarHBondContact NZ-OD2 2.92Å
241	K	91.1	Very high	92.1	Very high	187 Å²	187	56.5 Å²	56.5	81%	0.813	29%	0.286	S	S	*	.	H	α-helix	trans	-64.5	-37.8	172.8	-173.9	175.8	179.2	179	0	112.5	K239 A245	K239-K241 PolarHBondContact O-N 3.37Å; K241-A245 PolarHBondContact O-N 3.21Å; K241-A245 VanDerWaalsContact O-N 3.16Å
242	A	91.6	Very high	92.1	Very high	48 Å²	48	55.3 Å²	55.3	40%	0.397	28%	0.278	S	S	.	.	H	α-helix	trans	-71.7	-45.6	177.2	0	0	0	0	0	111.4	K239 K244 A245 R246	K239-A242 HydrophobicContact CB-CB 4.49Å; K239-A242 WeakPolarHBondContact O-CA 3.39Å; K239-A242 WeakPolarHBondContact O-CB 3.45Å; K239-A242 PolarHBondContact O-N 3.07Å; A242-K244 PolarHBondContact O-N 2.89Å; A242-A245 CarbonylContact O-C 3.55Å; A242-A245 WeakPolarHBondContact O-CA 3.39Å; A242-A245 WeakPolarHBondContact O-CB 3.28Å; A242-A245 PolarHBondContact O-N 3.44Å; A242-R246 WeakPolarHBondContact O-CG 3.5Å; A242-R246 PolarHBondContact O-N 3Å
243	E	93.7	Very high	92.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.3	-46	173.2	-74.8	169.3	135.4	0	0	112.1	L234 M235 E238 K239 A245 R246 I247 R260 H264	L234-E243 WeakPolarHBondContact CA-OE1 3.19Å; L234-E243 HydrophobicContact CD2-CB 3.81Å; L234-E243 HydrophobicContact CD2-CG 3.73Å; M235-E243 PolarHBondContact N-OE1 2.95Å; E238-E243 HydrophobicContact CB-CG 4.4Å; K239-E243 PolarHBondContact O-N 3.48Å; E243-A245 PolarHBondContact O-N 3.2Å; E243-A245 VanDerWaalsContact O-N 3.16Å; E243-R246 PolarHBondContact O-N 3.34Å; E243-I247 WeakPolarHBondContact O-CG1 3.47Å; E243-I247 PolarHBondContact O-N 3.36Å; E243-R260 IonicContact OE1-NE 3.28Å; E243-R260 IonicContact OE2-CZ 2.61Å; E243-R260 IonicContact OE2-NE 2.96Å; E243-R260 PolarHBondContact OE2-NE 3.41Å; E243-R260 IonicContact OE2-NH2 3.3Å; E243-R260 PolarHBondContact OE2-NH2 2.95Å; E243-H264 IonicContact OE2-NE2 3.81Å; E243-H264 PolarHBondContact OE2-NE2 2.88Å
244	K	93	Very high	92.3	Very high	58 Å²	58	54.9 Å²	54.9	25%	0.252	28%	0.275	S	S	.	.	H	α-helix	trans	-59.3	-25.7	172.7	-75.2	-168.4	171	-168.9	0	112.8	K240 A242 R248 N267 T268	K240-K244 WeakPolarHBondContact O-CB 3.36Å; K240-K244 WeakPolarHBondContact O-CG 3.4Å; K240-K244 PolarHBondContact O-N 3.19Å; A242-K244 PolarHBondContact O-N 2.89Å; K244-R248 VanDerWaalsContact C-NH1 3.35Å; K244-R248 VanDerWaalsContact O-CG 3.31Å; K244-R248 WeakPolarHBondContact O-CG 2.97Å; K244-R248 PolarHBondContact O-N 3.12Å; K244-R248 PolarHBondContact O-NH1 3Å; K244-N267 WeakPolarHBondContact CE-O 3.35Å; K244-N267 PolarHBondContact NZ-O 2.82Å; K244-T268 HydrophobicContact CD-CG2 4.22Å; K244-T268 WeakPolarHBondContact CE-OG1 3.45Å; K244-T268 HydrophobicContact CG-CG2 3.88Å
245	A	93.3	Very high	92.4	Very high	46 Å²	46	54.9 Å²	54.9	38%	0.38	28%	0.275	S	S	.	.	H	α-helix	trans	-80.8	-33.5	172	0	0	0	0	0	112.6	K241 A242 E243 K249	K241-A245 PolarHBondContact O-N 3.21Å; K241-A245 VanDerWaalsContact O-N 3.16Å; A242-A245 CarbonylContact O-C 3.55Å; A242-A245 WeakPolarHBondContact O-CA 3.39Å; A242-A245 WeakPolarHBondContact O-CB 3.28Å; A242-A245 PolarHBondContact O-N 3.44Å; E243-A245 PolarHBondContact O-N 3.2Å; E243-A245 VanDerWaalsContact O-N 3.16Å; A245-K249 WeakPolarHBondContact O-CG 3.42Å; A245-K249 PolarHBondContact O-N 3.08Å
246	R	93.5	Very high	92.6	Very high	71 Å²	71	54.3 Å²	54.3	27%	0.268	27%	0.272	S	S	.	.	H	α-helix	trans	-67.7	-46	173.6	-66.3	-165.8	-77.8	105	-18.8	111.6	V233 E238 A242 E243 R248 K249 M251	V233-R246 VanDerWaalsContact O-CZ 3.23Å; V233-R246 PolarHBondContact O-NH1 3.42Å; V233-R246 PolarHBondContact O-NH2 3.03Å; E238-R246 IonicContact OE1-NH2 2.76Å; E238-R246 PolarHBondContact OE1-NH2 2.95Å; E238-R246 VanDerWaalsContact OE1-NH2 3.08Å; E238-R246 IonicContact OE2-CZ 3.34Å; E238-R246 IonicContact OE2-NE 2.69Å; E238-R246 IonicContact OE2-NH2 3.43Å; E238-R246 PolarHBondContact OE2-NH2 2.71Å; A242-R246 WeakPolarHBondContact O-CG 3.5Å; A242-R246 PolarHBondContact O-N 3Å; E243-R246 PolarHBondContact O-N 3.34Å; R246-R248 PolarHBondContact O-N 3.04Å; R246-K249 PolarHBondContact O-N 3.32Å; R246-K249 VanDerWaalsContact O-N 3.08Å; R246-M251 HydrophobicContact CB-SD 3.86Å
247	I	94.7	Very high	93.1	Very high	13 Å²	13	54.1 Å²	54.1	7%	0.067	27%	0.268	C	S	.	.	H	α-helix	trans	-56.7	-49.6	176.4	-66.7	166.4	0	0	0	110.8	L234 E243 K249 G250 T268 S270 L271	L234-I247 HydrophobicContact CD1-CD1 4.07Å; L234-I247 HydrophobicContact CD1-CG1 4.42Å; L234-I247 HydrophobicContact CD2-CD1 3.98Å; L234-I247 HydrophobicContact CD2-CG1 4.12Å; E243-I247 WeakPolarHBondContact O-CG1 3.47Å; E243-I247 PolarHBondContact O-N 3.36Å; I247-K249 PolarHBondContact O-N 3.45Å; I247-K249 VanDerWaalsContact O-N 3.13Å; I247-G250 PolarHBondContact O-N 3.27Å; I247-T268 HydrophobicContact CD1-CG2 4.29Å; I247-S270 WeakPolarHBondContact CG2-O 3.46Å; I247-L271 HydrophobicContact CG2-CB 4.16Å; I247-L271 HydrophobicContact CG2-CD1 4.16Å
248	R	93.3	Very high	93.8	Very high	169 Å²	169	51.2 Å²	51.2	64%	0.638	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-17	177.9	-73.3	-174.3	-160.5	104	-19.6	114.9	K244 R246 G250	K244-R248 VanDerWaalsContact C-NH1 3.35Å; K244-R248 VanDerWaalsContact O-CG 3.31Å; K244-R248 WeakPolarHBondContact O-CG 2.97Å; K244-R248 PolarHBondContact O-N 3.12Å; K244-R248 PolarHBondContact O-NH1 3Å; R246-R248 PolarHBondContact O-N 3.04Å; R248-G250 VanDerWaalsContact C-N 3.33Å
249	K	93.4	Very high	94.3	Very high	154 Å²	154	49.8 Å²	49.8	67%	0.67	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	1	175.1	-75.4	-175.5	174.9	-167.2	0	113.2	R196 A245 R246 I247	R196-K249 WeakPolarHBondContact CD-O 3.29Å; R196-K249 PolarHBondContact NH1-O 2.87Å; A245-K249 WeakPolarHBondContact O-CG 3.42Å; A245-K249 PolarHBondContact O-N 3.08Å; R246-K249 PolarHBondContact O-N 3.32Å; R246-K249 VanDerWaalsContact O-N 3.08Å; I247-K249 PolarHBondContact O-N 3.45Å; I247-K249 VanDerWaalsContact O-N 3.13Å
250	G	92.9	Very high	94.6	Very high	7 Å²	7	43.3 Å²	43.3	7%	0.072	21%	0.211	C	C	.	.			trans	80.9	128.5	-172.7	0	0	0	0	0	112.5	R196 I247 R248	R196-G250 PolarHBondContact NH1-O 3.29Å; R196-G250 WeakPolarHBondContact O-CA 3.42Å; I247-G250 PolarHBondContact O-N 3.27Å; R248-G250 VanDerWaalsContact C-N 3.33Å
251	M	95.6	Very high	95	Very high	9 Å²	9	40.1 Å²	40.1	4%	0.044	20%	0.197	C	C	.	.			trans	-141.7	115.8	173.4	-78.8	171.2	33	0	0	107.2	G199 P200 V230 L234 R246 V254	G199-M251 CarbonylContact C-O 3.53Å; G199-M251 VanDerWaalsContact C-O 3.24Å; P200-M251 VanDerWaalsContact CA-O 3.29Å; P200-M251 WeakPolarHBondContact CA-O 3.47Å; P200-M251 VanDerWaalsContact N-O 3.16Å; V230-M251 CarbonylContact O-C 3.56Å; L234-M251 HydrophobicContact CD2-CE 4.31Å; L234-M251 HydrophobicContact CG-CE 4.19Å; R246-M251 HydrophobicContact CB-SD 3.86Å; M251-V254 HydrophobicContact CB-CG2 4.23Å; M251-V254 HydrophobicContact CE-CB 4.44Å; M251-V254 HydrophobicContact CE-CG1 4.12Å; M251-V254 HydrophobicContact CE-CG2 3.93Å
252	N	97.3	Very high	95.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	-89.9	-32.8	-175	-51.4	108.5	0	0	0	113.1	V194 S195 G199 L201 A202 I229 V230	V194-N252 HydrophobicContact CG1-CB 4.01Å; V194-N252 VanDerWaalsContact CG1-CG 3.5Å; V194-N252 WeakPolarHBondContact CG1-ND2 3.28Å; S195-N252 PolarHBondContact O-ND2 2.82Å; G199-N252 WeakPolarHBondContact O-CA 3.37Å; G199-N252 PolarHBondContact O-ND2 3.37Å; L201-N252 PolarHBondContact N-O 3.29Å; A202-N252 PolarHBondContact N-O 3.25Å; I229-N252 HydrophobicContact CG2-CB 4.12Å; V230-N252 PolarHBondContact N-OD1 3.1Å; V230-N252 PolarHBondContact O-N 2.95Å
253	V	98.1	Very high	95.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	111.4	173	-174.8	0	0	0	0	108.4	L183 L187 A202 F219 L223 I229 V230 P231 G232	L183-V253 HydrophobicContact CD2-CG2 4.17Å; L187-V253 HydrophobicContact CD1-CG2 3.69Å; A202-V253 HydrophobicContact CB-CG1 4.44Å; A202-V253 HydrophobicContact CB-CG2 4.36Å; F219-V253 HydrophobicContact CD1-CG1 4.04Å; F219-V253 HydrophobicContact CD2-CG1 4.1Å; F219-V253 HydrophobicContact CE1-CG1 4.06Å; F219-V253 HydrophobicContact CE2-CG1 4.12Å; F219-V253 HydrophobicContact CG-CG1 4.07Å; F219-V253 HydrophobicContact CZ-CG1 4.1Å; L223-V253 HydrophobicContact CD1-CG2 4.38Å; I229-V253 HydrophobicContact CG2-CG2 4.07Å; V230-V253 PolarHBondContact O-N 2.91Å; P231-V253 CarbonylContact C-O 3.55Å; P231-V253 WeakPolarHBondContact CA-O 3.4Å; P231-V253 HydrophobicContact CB-CB 4.47Å; G232-V253 PolarHBondContact N-O 2.97Å
254	V	98	Very high	95.5	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.012	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	113.7	-177.2	-176.5	0	0	0	0	109.5	P200 A202 L203 V204 G232 L234 M251	P200-V254 HydrophobicContact CB-CG2 3.89Å; P200-V254 HydrophobicContact CG-CG2 3.91Å; A202-V254 PolarHBondContact O-N 3.14Å; L203-V254 WeakPolarHBondContact CA-O 3.32Å; L203-V254 HydrophobicContact CD1-CB 3.93Å; L203-V254 HydrophobicContact CD1-CG1 3.99Å; V204-V254 PolarHBondContact N-O 3.01Å; G232-V254 WeakPolarHBondContact O-CA 3.26Å; L234-V254 HydrophobicContact CD1-CG1 3.77Å; L234-V254 HydrophobicContact CG-CG1 4.13Å; M251-V254 HydrophobicContact CB-CG2 4.23Å; M251-V254 HydrophobicContact CE-CB 4.44Å; M251-V254 HydrophobicContact CE-CG1 4.12Å; M251-V254 HydrophobicContact CE-CG2 3.93Å
255	V	98.3	Very high	95.5	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	129.8	171.9	-170.7	0	0	0	0	108.6	V204 V206 A212 T215 F219 G232 V233 L234	V204-V255 HydrophobicContact CB-CG1 4.5Å; V204-V255 HydrophobicContact CB-CG2 4.38Å; V204-V255 CarbonylContact O-C 3.38Å; V204-V255 WeakPolarHBondContact O-CA 3.36Å; V206-V255 HydrophobicContact CG2-CG1 4.18Å; A212-V255 HydrophobicContact CB-CG1 4.17Å; A212-V255 WeakPolarHBondContact O-CG1 3.43Å; T215-V255 HydrophobicContact CG2-CG1 3.94Å; T215-V255 HydrophobicContact CG2-CG2 4.14Å; F219-V255 HydrophobicContact CD2-CG2 3.9Å; F219-V255 HydrophobicContact CE2-CG2 4.23Å; G232-V255 PolarHBondContact O-N 3.01Å; V233-V255 CarbonylContact C-O 3.44Å; V233-V255 VanDerWaalsContact CA-O 3.26Å; V233-V255 WeakPolarHBondContact CA-O 3.32Å; L234-V255 PolarHBondContact N-O 2.98Å
256	S	97.4	Very high	95.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	151.5	-174.6	-163.8	0	0	0	0	116.4	V204 V205 V206 L234	V204-S256 PolarHBondContact O-N 3.05Å; V205-S256 WeakPolarHBondContact CA-O 3.48Å; V206-S256 PolarHBondContact N-O 3.08Å; L234-S256 WeakPolarHBondContact CB-OG 3.49Å; L234-S256 VanDerWaalsContact O-CA 3.24Å; L234-S256 WeakPolarHBondContact O-CA 3.39Å; L234-S256 WeakPolarHBondContact O-CB 3.33Å; L234-S256 PolarHBondContact O-OG 3.39Å
257	T	95.9	Very high	95.4	Very high	10 Å²	10	34.3 Å²	34.3	6%	0.061	17%	0.166	C	C	.	.			trans	-82.1	135.5	165.2	57.2	0	0	0	0	111.2	V206 R209 A212 L234 M235 G259 R260 L261	V206-T257 WeakPolarHBondContact O-CA 3.46Å; R209-T257 HydrophobicContact CG-CG2 4.08Å; A212-T257 HydrophobicContact CB-CG2 4.4Å; L234-T257 PolarHBondContact O-N 3.17Å; M235-T257 HydrophobicContact CB-CG2 4.32Å; T257-G259 PolarHBondContact O-N 2.8Å; T257-R260 PolarHBondContact O-N 2.86Å; T257-L261 PolarHBondContact O-N 3.36Å; T257-L261 VanDerWaalsContact O-N 3.16Å
258	P	96.6	Very high	95.3	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-44.9	-55.7	-171.7	-28.2	26.6	0	0	0	115.5	V205 V206 R260 L261 A262 I287 F292 E295 I299	V205-P258 HydrophobicContact CG1-CB 4.39Å; V205-P258 HydrophobicContact CG1-CG 3.69Å; V206-P258 WeakPolarHBondContact O-CD 3.42Å; P258-R260 VanDerWaalsContact C-N 3.31Å; P258-R260 PolarHBondContact O-N 2.74Å; P258-L261 WeakPolarHBondContact O-CB 3.36Å; P258-L261 PolarHBondContact O-N 2.66Å; P258-L261 VanDerWaalsContact O-N 3.1Å; P258-A262 PolarHBondContact O-N 3.03Å; P258-I287 HydrophobicContact CG-CG2 3.78Å; P258-F292 HydrophobicContact CB-CB 3.93Å; P258-F292 HydrophobicContact CB-CD1 4.2Å; P258-F292 HydrophobicContact CB-CD2 4.27Å; P258-F292 HydrophobicContact CB-CG 3.91Å; P258-F292 HydrophobicContact CG-CB 4.09Å; P258-F292 HydrophobicContact CG-CD2 3.84Å; P258-F292 HydrophobicContact CG-CE2 4.38Å; P258-F292 HydrophobicContact CG-CG 3.97Å; P258-E295 HydrophobicContact CB-CB 3.75Å; P258-I299 HydrophobicContact CB-CD1 4.1Å
259	G	95.2	Very high	94.9	Very high	32 Å²	32	35 Å²	35	33%	0.33	18%	0.182	S	C	.	.	H	α-helix	trans	-62.5	-31.4	-176.3	0	0	0	0	0	114.8	T257 D263	T257-G259 PolarHBondContact O-N 2.8Å; G259-D263 WeakPolarHBondContact O-CB 3.42Å; G259-D263 PolarHBondContact O-N 3.09Å
260	R	95.3	Very high	94.5	Very high	36 Å²	36	30 Å²	30	14%	0.136	17%	0.166	C	C	.	.	H	α-helix	trans	-78.2	-32.6	175.4	-173.3	50.6	147.7	-116.2	-9.5	111.9	L234 E238 E243 T257 P258 H264	L234-R260 HydrophobicContact CB-CG 4.47Å; E238-R260 PolarHBondContact O-NH2 2.87Å; E243-R260 IonicContact OE1-NE 3.28Å; E243-R260 IonicContact OE2-CZ 2.61Å; E243-R260 IonicContact OE2-NE 2.96Å; E243-R260 PolarHBondContact OE2-NE 3.41Å; E243-R260 IonicContact OE2-NH2 3.3Å; E243-R260 PolarHBondContact OE2-NH2 2.95Å; T257-R260 PolarHBondContact O-N 2.86Å; P258-R260 VanDerWaalsContact C-N 3.31Å; P258-R260 PolarHBondContact O-N 2.74Å; R260-H264 PolarHBondContact O-CD2 2.82Å; R260-H264 VanDerWaalsContact O-CD2 3.26Å; R260-H264 PolarHBondContact O-N 2.95Å
261	L	96.6	Very high	94.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.8	-48.9	173.5	-173.5	58.5	0	0	0	111.4	L203 V205 T257 P258 D263 H264 I265 L271 I299	L203-L261 HydrophobicContact CD1-CD1 4Å; L203-L261 HydrophobicContact CD1-CD2 3.7Å; L203-L261 HydrophobicContact CD2-CD2 3.82Å; L203-L261 HydrophobicContact CG-CD2 4.11Å; V205-L261 HydrophobicContact CG2-CD2 3.97Å; T257-L261 PolarHBondContact O-N 3.36Å; T257-L261 VanDerWaalsContact O-N 3.16Å; P258-L261 WeakPolarHBondContact O-CB 3.36Å; P258-L261 PolarHBondContact O-N 2.66Å; P258-L261 VanDerWaalsContact O-N 3.1Å; L261-D263 VanDerWaalsContact C-N 3.33Å; L261-D263 PolarHBondContact O-N 2.94Å; L261-H264 PolarHBondContact O-N 3.27Å; L261-I265 HydrophobicContact CD1-CD1 4.36Å; L261-I265 HydrophobicContact CD1-CG1 4.48Å; L261-I265 HydrophobicContact CG-CD1 3.96Å; L261-I265 HydrophobicContact CG-CG1 4.48Å; L261-I265 WeakPolarHBondContact O-CG1 3.48Å; L261-I265 PolarHBondContact O-N 2.89Å; L261-L271 HydrophobicContact CD1-CD2 4.31Å; L261-I299 HydrophobicContact CB-CD1 4.21Å; L261-I299 HydrophobicContact CB-CG1 4.33Å; L261-I299 HydrophobicContact CD2-CD1 3.85Å; L261-I299 HydrophobicContact CD2-CG1 3.8Å; L261-I299 HydrophobicContact CD2-CG2 3.88Å; L261-I299 HydrophobicContact CG-CD1 4.29Å; L261-I299 HydrophobicContact CG-CG1 4Å
262	A	96.1	Very high	94	Very high	5 Å²	5	33.4 Å²	33.4	4%	0.041	19%	0.193	C	C	.	.	H	α-helix	trans	-57.3	-44.4	176.8	0	0	0	0	0	111.9	P258 H264 I265 Q266 E295 V298	P258-A262 PolarHBondContact O-N 3.03Å; A262-H264 VanDerWaalsContact C-N 3.34Å; A262-H264 PolarHBondContact O-N 3.01Å; A262-I265 PolarHBondContact O-N 3.17Å; A262-Q266 WeakPolarHBondContact O-CB 3.33Å; A262-Q266 WeakPolarHBondContact O-CG 3.31Å; A262-Q266 PolarHBondContact O-N 2.82Å; A262-E295 HydrophobicContact CB-CB 4.2Å; A262-E295 HydrophobicContact CB-CG 4.26Å; A262-V298 HydrophobicContact CB-CB 4.15Å; A262-V298 HydrophobicContact CB-CG1 3.9Å
263	D	95.2	Very high	93.7	Very high	34 Å²	34	33.9 Å²	33.9	18%	0.182	20%	0.196	C	C	.	.	H	α-helix	trans	-59.2	-41.2	172.7	175.8	29.9	0	0	0	112.5	K240 G259 L261 N267	K240-D263 VanDerWaalsContact CE-OD2 3.22Å; K240-D263 WeakPolarHBondContact CE-OD2 3.11Å; K240-D263 IonicContact NZ-OD1 3.31Å; K240-D263 PolarHBondContact NZ-OD1 2.71Å; K240-D263 IonicContact NZ-OD2 3.75Å; K240-D263 PolarHBondContact NZ-OD2 2.92Å; G259-D263 WeakPolarHBondContact O-CB 3.42Å; G259-D263 PolarHBondContact O-N 3.09Å; L261-D263 VanDerWaalsContact C-N 3.33Å; L261-D263 PolarHBondContact O-N 2.94Å; D263-N267 VanDerWaalsContact O-CB 3.25Å; D263-N267 WeakPolarHBondContact O-CB 3.49Å; D263-N267 PolarHBondContact O-N 3.4Å; D263-N267 PolarHBondContact O-ND2 2.98Å; D263-N267 PolarHBondContact OD1-ND2 3.42Å
264	H	95.5	Very high	93.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-68.7	-41.5	175.5	-84.9	-67.6	0	0	0	113	E243 R260 L261 A262 Q266 N267 T268 L271	E243-H264 IonicContact OE2-NE2 3.81Å; E243-H264 PolarHBondContact OE2-NE2 2.88Å; R260-H264 PolarHBondContact O-CD2 2.82Å; R260-H264 VanDerWaalsContact O-CD2 3.26Å; R260-H264 PolarHBondContact O-N 2.95Å; L261-H264 PolarHBondContact O-N 3.27Å; A262-H264 VanDerWaalsContact C-N 3.34Å; A262-H264 PolarHBondContact O-N 3.01Å; H264-Q266 VanDerWaalsContact C-N 3.31Å; H264-Q266 PolarHBondContact O-N 2.87Å; H264-N267 PolarHBondContact O-N 2.59Å; H264-T268 PolarHBondContact ND1-OG1 2.83Å; H264-T268 WeakPolarHBondContact O-CA 3.36Å; H264-T268 WeakPolarHBondContact O-CB 3.4Å; H264-T268 PolarHBondContact O-N 2.92Å; H264-T268 PolarHBondContact O-OG1 3.15Å; H264-L271 HydrophobicContact CB-CD2 3.76Å
265	I	94.1	Very high	92.9	Very high	42 Å²	42	36.9 Å²	36.9	22%	0.215	22%	0.223	C	C	.	.	H	α-helix	trans	-58.6	-42.7	176	-69.4	171.3	0	0	0	111	L261 A262 L271 L273 V298 I299	L261-I265 HydrophobicContact CD1-CD1 4.36Å; L261-I265 HydrophobicContact CD1-CG1 4.48Å; L261-I265 HydrophobicContact CG-CD1 3.96Å; L261-I265 HydrophobicContact CG-CG1 4.48Å; L261-I265 WeakPolarHBondContact O-CG1 3.48Å; L261-I265 PolarHBondContact O-N 2.89Å; A262-I265 PolarHBondContact O-N 3.17Å; I265-L271 HydrophobicContact CG1-CD2 4.19Å; I265-L273 HydrophobicContact CD1-CD1 3.72Å; I265-L273 HydrophobicContact CG1-CD1 3.84Å; I265-V298 HydrophobicContact CG2-CG1 4.39Å; I265-I299 HydrophobicContact CD1-CB 4.31Å; I265-I299 HydrophobicContact CD1-CG1 3.99Å; I265-I299 HydrophobicContact CD1-CG2 4.49Å
266	Q	92.3	Very high	92.7	Very high	122 Å²	122	37 Å²	37	57%	0.57	22%	0.224	S	C	*	.	H	α-helix	trans	-76.6	-40.5	179.9	-69	173.1	-14.9	0	0	113	A262 H264 V298	A262-Q266 WeakPolarHBondContact O-CB 3.33Å; A262-Q266 WeakPolarHBondContact O-CG 3.31Å; A262-Q266 PolarHBondContact O-N 2.82Å; H264-Q266 VanDerWaalsContact C-N 3.31Å; H264-Q266 PolarHBondContact O-N 2.87Å; Q266-V298 HydrophobicContact CG-CG1 4.09Å
267	N	92.6	Very high	92.5	Very high	85 Å²	85	42.5 Å²	42.5	46%	0.455	25%	0.245	S	C	.	.	H	α-helix	trans	-116.6	15.2	-164.8	-58	-64.9	0	0	0	114.4	K244 D263 H264	K244-N267 WeakPolarHBondContact CE-O 3.35Å; K244-N267 PolarHBondContact NZ-O 2.82Å; D263-N267 VanDerWaalsContact O-CB 3.25Å; D263-N267 WeakPolarHBondContact O-CB 3.49Å; D263-N267 PolarHBondContact O-N 3.4Å; D263-N267 PolarHBondContact O-ND2 2.98Å; D263-N267 PolarHBondContact OD1-ND2 3.42Å; H264-N267 PolarHBondContact O-N 2.59Å
268	T	91.6	Very high	92.6	Very high	8 Å²	8	42.4 Å²	42.4	5%	0.049	24%	0.244	C	C	.	.			trans	-139.1	88.3	-177.5	-47	0	0	0	0	112.7	K244 I247 H264 S270 L271	K244-T268 HydrophobicContact CD-CG2 4.22Å; K244-T268 WeakPolarHBondContact CE-OG1 3.45Å; K244-T268 HydrophobicContact CG-CG2 3.88Å; I247-T268 HydrophobicContact CD1-CG2 4.29Å; H264-T268 PolarHBondContact ND1-OG1 2.83Å; H264-T268 WeakPolarHBondContact O-CA 3.36Å; H264-T268 WeakPolarHBondContact O-CB 3.4Å; H264-T268 PolarHBondContact O-N 2.92Å; H264-T268 PolarHBondContact O-OG1 3.15Å; T268-S270 WeakPolarHBondContact CG2-OG 3.22Å; T268-S270 PolarHBondContact O-N 3.27Å; T268-L271 HydrophobicContact CG2-CB 4.47Å; T268-L271 PolarHBondContact O-N 2.84Å
269	L	85	Confident	92.6	Very high	188 Å²	188	42.4 Å²	42.4	98%	0.984	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-26	177.1	-59.2	175.5	0	0	0	115	L271	L269-L271 VanDerWaalsContact C-N 3.3Å; L269-L271 PolarHBondContact O-N 3.46Å
270	S	84.6	Confident	92.7	Very high	49 Å²	49	40.9 Å²	40.9	34%	0.343	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	3.5	177.7	68.5	0	0	0	0	114.7	I247 T268	I247-S270 WeakPolarHBondContact CG2-O 3.46Å; T268-S270 WeakPolarHBondContact CG2-OG 3.22Å; T268-S270 PolarHBondContact O-N 3.27Å
271	L	89.6	Confident	92.8	Very high	18 Å²	18	39.2 Å²	39.2	9%	0.094	22%	0.222	C	C	.	.			trans	-100.2	81.4	172.2	-176.1	66.6	0	0	0	109.4	P200 I247 L261 H264 I265 T268 L269 L273	P200-L271 HydrophobicContact CG-CD1 3.78Å; I247-L271 HydrophobicContact CG2-CB 4.16Å; I247-L271 HydrophobicContact CG2-CD1 4.16Å; L261-L271 HydrophobicContact CD1-CD2 4.31Å; H264-L271 HydrophobicContact CB-CD2 3.76Å; I265-L271 HydrophobicContact CG1-CD2 4.19Å; T268-L271 HydrophobicContact CG2-CB 4.47Å; T268-L271 PolarHBondContact O-N 2.84Å; L269-L271 VanDerWaalsContact C-N 3.3Å; L269-L271 PolarHBondContact O-N 3.46Å; L271-L273 HydrophobicContact CD1-CD2 4.36Å; L271-L273 HydrophobicContact CD2-CD2 4.5Å; L271-L273 HydrophobicContact CG-CD2 4.15Å
272	A	88.3	Confident	92.7	Very high	70 Å²	70	39.4 Å²	39.4	58%	0.579	22%	0.222	S	C	*	.			trans	-72.2	136.6	168.7	0	0	0	0	0	110	P200	P200-A272 WeakPolarHBondContact CD-O 3.37Å
273	L	91.3	Very high	92.4	Very high	11 Å²	11	39.5 Å²	39.5	6%	0.058	22%	0.222	C	C	.	.			trans	-111.1	-4.7	174.9	-63.8	-174.8	0	0	0	113.7	I265 L271 A275 V276 L303	I265-L273 HydrophobicContact CD1-CD1 3.72Å; I265-L273 HydrophobicContact CG1-CD1 3.84Å; L271-L273 HydrophobicContact CD1-CD2 4.36Å; L271-L273 HydrophobicContact CD2-CD2 4.5Å; L271-L273 HydrophobicContact CG-CD2 4.15Å; L273-A275 PolarHBondContact O-N 2.93Å; L273-V276 HydrophobicContact CB-CG2 4.28Å; L273-V276 HydrophobicContact CD2-CG2 4.08Å; L273-V276 WeakPolarHBondContact O-CB 3.47Å; L273-V276 VanDerWaalsContact O-CG2 3.31Å; L273-V276 WeakPolarHBondContact O-CG2 3.37Å; L273-V276 PolarHBondContact O-N 3.26Å; L273-L303 HydrophobicContact CB-CD2 4.26Å; L273-L303 HydrophobicContact CD1-CD2 4.01Å; L273-L303 HydrophobicContact CD1-CG 4.25Å
274	G	88.6	Confident	92.2	Very high	31 Å²	31	37.9 Å²	37.9	32%	0.32	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-6.7	-176	0	0	0	0	0	116.3	T306 G307 P308	G274-T306 WeakPolarHBondContact CA-OG1 3.47Å; G274-T306 PolarHBondContact N-OG1 3.1Å; G274-G307 WeakPolarHBondContact O-CA 3.18Å; G274-P308 VanDerWaalsContact O-CD 3.31Å; G274-P308 WeakPolarHBondContact O-CD 3.35Å
275	A	91.3	Very high	91.9	Very high	33 Å²	33	38 Å²	38	27%	0.273	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	0	175.4	0	0	0	0	0	113.5	D198 P200 L201 L273 R277	D198-A275 WeakPolarHBondContact O-CB 3.48Å; P200-A275 CarbonylContact O-C 3.54Å; L201-A275 HydrophobicContact CD2-CB 3.86Å; L201-A275 VanDerWaalsContact CD2-O 3.29Å; L201-A275 WeakPolarHBondContact CD2-O 3.33Å; L273-A275 PolarHBondContact O-N 2.93Å; A275-R277 PolarHBondContact O-N 3.46Å; A275-R277 VanDerWaalsContact O-N 3.12Å
276	V	94.4	Very high	91.4	Very high	4 Å²	4	38 Å²	38	2%	0.024	21%	0.211	C	C	.	.			trans	-71.1	108.6	-174.8	177.8	0	0	0	0	111	P200 L203 L273 W278 L303 R310	P200-V276 HydrophobicContact CB-CG2 3.88Å; P200-V276 VanDerWaalsContact O-CG2 3.25Å; P200-V276 WeakPolarHBondContact O-CG2 3.44Å; P200-V276 PolarHBondContact O-N 3.02Å; L203-V276 HydrophobicContact CB-CG1 4.15Å; L273-V276 HydrophobicContact CB-CG2 4.28Å; L273-V276 HydrophobicContact CD2-CG2 4.08Å; L273-V276 WeakPolarHBondContact O-CB 3.47Å; L273-V276 VanDerWaalsContact O-CG2 3.31Å; L273-V276 WeakPolarHBondContact O-CG2 3.37Å; L273-V276 PolarHBondContact O-N 3.26Å; V276-W278 WeakPolarHBondContact CG1-O 3.34Å; V276-L303 HydrophobicContact CB-CD2 3.94Å; V276-L303 HydrophobicContact CG1-CD2 3.86Å; V276-L303 HydrophobicContact CG2-CD2 4.1Å; V276-R310 WeakPolarHBondContact O-CG 3.4Å
277	R	93.5	Very high	91.3	Very high	114 Å²	114	32.1 Å²	32.1	43%	0.43	18%	0.184	S	C	.	.			trans	-93.2	-13.9	177.4	-56.5	-179.1	-168.7	168	3.2	113.4	S190 L201 A275 R310 Q311	S190-R277 PolarHBondContact OG-NH1 3.05Å; L201-R277 PolarHBondContact O-N 2.78Å; A275-R277 PolarHBondContact O-N 3.46Å; A275-R277 VanDerWaalsContact O-N 3.12Å; R277-R310 WeakPolarHBondContact O-CA 3.23Å; R277-Q311 PolarHBondContact O-N 2.85Å
278	W	96.6	Very high	91.2	Very high	9 Å²	9	29.4 Å²	29.4	3%	0.034	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130.4	178	-74.4	76	0	0	0	112.7	L159 P182 L183 R186 L201 A202 L203 V276 Q311 V313	L159-W278 HydrophobicContact CB-CH2 4.19Å; L159-W278 HydrophobicContact CD1-CZ3 4.41Å; L159-W278 HydrophobicContact CD2-CZ3 4.45Å; P182-W278 HydrophobicContact CB-CH2 4.42Å; L183-W278 HydrophobicContact CB-CD2 4.27Å; L183-W278 HydrophobicContact CB-CE3 4.23Å; L183-W278 HydrophobicContact CB-CZ3 4.37Å; L183-W278 HydrophobicContact CD1-CB 4.44Å; L183-W278 HydrophobicContact CD1-CD2 4.41Å; L183-W278 HydrophobicContact CD1-CE3 4.31Å; L183-W278 HydrophobicContact CD1-CG 4.49Å; L183-W278 HydrophobicContact CG-CD2 4.02Å; L183-W278 HydrophobicContact CG-CE3 4.25Å; L183-W278 HydrophobicContact CG-CG 4.14Å; R186-W278 HydrophobicContact CB-CZ2 4.24Å; R186-W278 HydrophobicContact CG-CZ2 4.09Å; L201-W278 PolarHBondContact O-N 2.91Å; L201-W278 VanDerWaalsContact O-N 3.15Å; A202-W278 WeakPolarHBondContact CA-O 3.46Å; A202-W278 HydrophobicContact CB-CB 3.78Å; A202-W278 HydrophobicContact CB-CG 4.48Å; L203-W278 PolarHBondContact N-O 3.34Å; V276-W278 WeakPolarHBondContact CG1-O 3.34Å; W278-Q311 WeakPolarHBondContact CA-O 3.36Å; W278-Q311 HydrophobicContact CD2-CB 4.5Å; W278-Q311 HydrophobicContact CH2-CG 4.47Å; W278-Q311 HydrophobicContact CZ3-CG 4.43Å; W278-V313 HydrophobicContact CE3-CG2 4.24Å; W278-V313 HydrophobicContact CZ3-CG2 3.97Å
279	L	97.1	Very high	90.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.9	161.9	176.1	63.4	0	0	0	109.7	L203 V205 L281 L300 L303 Q311 N312 V313	L203-L279 HydrophobicContact CB-CD1 4.34Å; L203-L279 HydrophobicContact CD2-CD1 3.98Å; L203-L279 HydrophobicContact CG-CD1 4.19Å; L203-L279 CarbonylContact O-C 3.58Å; L203-L279 WeakPolarHBondContact O-CA 3.29Å; V205-L279 HydrophobicContact CG2-CD1 4.07Å; L279-L281 HydrophobicContact CD1-CD2 3.96Å; L279-L281 HydrophobicContact CD2-CD2 4.37Å; L279-L281 HydrophobicContact CG-CD2 4.21Å; L279-L281 HydrophobicContact CG-CG 4.46Å; L279-L300 HydrophobicContact CD2-CD2 3.67Å; L279-L303 HydrophobicContact CD1-CD1 3.93Å; L279-L303 HydrophobicContact CD2-CD1 3.89Å; L279-L303 HydrophobicContact CG-CD1 4.37Å; L279-Q311 PolarHBondContact N-O 2.83Å; L279-N312 CarbonylContact O-C 3.49Å; L279-N312 WeakPolarHBondContact O-CA 3.48Å; L279-V313 PolarHBondContact O-N 2.9Å
280	V	97.8	Very high	90.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.9	171.8	-175.3	0	0	0	0	109.1	Y179 L183 L203 V204 V205 D282 V313 L315	Y179-V280 HydrophobicContact CD1-CG1 3.89Å; Y179-V280 HydrophobicContact CD2-CB 4.43Å; Y179-V280 HydrophobicContact CD2-CG1 3.86Å; Y179-V280 HydrophobicContact CD2-CG2 4.06Å; Y179-V280 HydrophobicContact CE1-CG1 4.01Å; Y179-V280 HydrophobicContact CE2-CG1 4.03Å; Y179-V280 HydrophobicContact CG-CG1 3.79Å; Y179-V280 HydrophobicContact CG-CG2 4.33Å; L183-V280 HydrophobicContact CD1-CG2 4.33Å; L203-V280 PolarHBondContact O-N 3.25Å; V204-V280 HydrophobicContact CB-CB 4.39Å; V204-V280 HydrophobicContact CG1-CB 4.16Å; V204-V280 HydrophobicContact CG1-CG1 4.3Å; V204-V280 HydrophobicContact CG2-CB 4.13Å; V204-V280 HydrophobicContact CG2-CG2 4.23Å; V205-V280 PolarHBondContact N-O 3.37Å; V280-D282 HydrophobicContact CG1-CB 4.42Å; V280-V313 CarbonylContact C-O 3.46Å; V280-V313 WeakPolarHBondContact CA-O 3.44Å; V280-V313 HydrophobicContact CG1-CB 4.43Å; V280-V313 HydrophobicContact CG2-CB 4.3Å; V280-V313 HydrophobicContact CG2-CG2 4.46Å; V280-L315 HydrophobicContact CG1-CD1 3.47Å; V280-L315 VanDerWaalsContact CG1-CD1 3.47Å
281	L	96.9	Very high	90.9	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	104.8	170.9	-54.5	-176	0	0	0	108.1	V205 L279 A284 L296 V313 L315 L326 C330	V205-L281 HydrophobicContact CB-CD2 3.75Å; V205-L281 HydrophobicContact CG1-CD2 4.47Å; V205-L281 HydrophobicContact CG2-CD2 3.89Å; L279-L281 HydrophobicContact CD1-CD2 3.96Å; L279-L281 HydrophobicContact CD2-CD2 4.37Å; L279-L281 HydrophobicContact CG-CD2 4.21Å; L279-L281 HydrophobicContact CG-CG 4.46Å; L281-A284 HydrophobicContact CB-CB 4.35Å; L281-L296 HydrophobicContact CD2-CD2 4.18Å; L281-V313 PolarHBondContact N-O 3.41Å; L281-L315 PolarHBondContact O-N 3.46Å; L281-L326 HydrophobicContact CD1-CD1 4.2Å; L281-L326 HydrophobicContact CD1-CD2 4.11Å; L281-L326 HydrophobicContact CD1-CG 4.19Å; L281-C330 HydrophobicContact CD1-CB 4.49Å
282	D	94.3	Very high	91	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.016	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	137	-173.5	-173.3	19.5	0	0	0	111.6	Y179 V205 V206 P207 V280 A284 L315	Y179-D282 HydrophobicContact CE1-CB 4.05Å; Y179-D282 VanDerWaalsContact CE1-OD2 3.27Å; Y179-D282 WeakPolarHBondContact CE1-OD2 3.45Å; Y179-D282 PolarHBondContact OH-OD2 3.05Å; V205-D282 PolarHBondContact O-N 2.94Å; V206-D282 HydrophobicContact CG1-CB 4.03Å; P207-D282 WeakPolarHBondContact CD-O 3.07Å; V280-D282 HydrophobicContact CG1-CB 4.42Å; D282-A284 VanDerWaalsContact C-N 3.34Å; D282-L315 HydrophobicContact CB-CD1 4.3Å
283	E	90.1	Very high	91.1	Very high	8 Å²	8	29.3 Å²	29.3	4%	0.037	16%	0.164	C	C	.	.	S	Bend	trans	50	51.1	-160.8	-54.2	-93.6	-105.5	0	0	111.2	K175 P207 L211 D285 R286 I287 L315 G460	K175-E283 WeakPolarHBondContact CE-OE2 3.49Å; K175-E283 IonicContact NZ-OE2 2.93Å; K175-E283 PolarHBondContact NZ-OE2 3.49Å; P207-E283 HydrophobicContact CG-CB 3.91Å; L211-E283 HydrophobicContact CD2-CG 3.98Å; E283-D285 VanDerWaalsContact C-N 3.31Å; E283-D285 PolarHBondContact O-N 3.38Å; E283-R286 HydrophobicContact CB-CB 4.37Å; E283-R286 WeakPolarHBondContact O-CB 3.35Å; E283-R286 PolarHBondContact O-N 2.78Å; E283-I287 PolarHBondContact O-N 3.01Å; E283-L315 PolarHBondContact N-O 3.21Å; E283-L315 VanDerWaalsContact N-O 3.14Å; E283-G460 PolarHBondContact OE1-N 2.97Å
284	A	91.4	Very high	91.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.6	-34.8	-173	0	0	0	0	0	113.9	L281 D282 R286 I287 L288 L314 L315 L326	L281-A284 HydrophobicContact CB-CB 4.35Å; D282-A284 VanDerWaalsContact C-N 3.34Å; A284-R286 VanDerWaalsContact C-N 3.26Å; A284-R286 PolarHBondContact O-N 3.3Å; A284-I287 WeakPolarHBondContact O-CB 3.13Å; A284-I287 PolarHBondContact O-N 3.48Å; A284-I287 VanDerWaalsContact O-N 3.1Å; A284-L288 PolarHBondContact O-N 3.38Å; A284-L314 HydrophobicContact CB-CD1 4.31Å; A284-L314 HydrophobicContact CB-CD2 3.94Å; A284-L314 HydrophobicContact CB-CG 3.86Å; A284-L315 PolarHBondContact N-O 3.44Å; A284-L326 HydrophobicContact CB-CD2 4.35Å
285	D	87.8	Confident	91.6	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-49.9	-46.1	168.4	49.7	34.2	0	0	0	112.1	E283 I287 L288 D289 S316 A317 T318 V323 R459 H483	E283-D285 VanDerWaalsContact C-N 3.31Å; E283-D285 PolarHBondContact O-N 3.38Å; D285-I287 VanDerWaalsContact C-N 3.34Å; D285-I287 PolarHBondContact O-N 3.37Å; D285-L288 PolarHBondContact O-N 3.04Å; D285-D289 VanDerWaalsContact O-CG 3.32Å; D285-D289 PolarHBondContact O-N 3.48Å; D285-S316 WeakPolarHBondContact CB-OG 3.49Å; D285-S316 PolarHBondContact OD2-OG 2.99Å; D285-A317 PolarHBondContact OD2-N 3.02Å; D285-T318 VanDerWaalsContact CB-OG1 3.26Å; D285-T318 WeakPolarHBondContact CB-OG1 3.42Å; D285-T318 PolarHBondContact OD2-N 3.1Å; D285-T318 VanDerWaalsContact OD2-N 3.12Å; D285-T318 PolarHBondContact OD2-OG1 2.97Å; D285-V323 HydrophobicContact CB-CG2 3.87Å; D285-R459 IonicContact OD1-NH1 2.71Å; D285-R459 PolarHBondContact OD1-NH1 3.36Å; D285-H483 IonicContact OD1-CE1 3.76Å; D285-H483 IonicContact OD2-CE1 2.78Å; D285-H483 IonicContact OD2-NE2 3.22Å
286	R	84.5	Confident	91.8	Very high	42 Å²	42	37.2 Å²	37.2	16%	0.158	18%	0.179	C	C	.	.	H	α-helix	trans	-73.7	-23.6	180	-170	48.5	162.6	173.4	-6.4	113.7	P207 E283 A284 L288 L290 R459	P207-R286 HydrophobicContact CB-CB 3.94Å; P207-R286 HydrophobicContact CB-CG 3.69Å; P207-R286 HydrophobicContact CG-CB 3.93Å; P207-R286 HydrophobicContact CG-CG 3.95Å; E283-R286 HydrophobicContact CB-CB 4.37Å; E283-R286 WeakPolarHBondContact O-CB 3.35Å; E283-R286 PolarHBondContact O-N 2.78Å; A284-R286 VanDerWaalsContact C-N 3.26Å; A284-R286 PolarHBondContact O-N 3.3Å; R286-L288 VanDerWaalsContact C-N 3.31Å; R286-L290 HydrophobicContact CG-CD1 4.02Å; R286-L290 HydrophobicContact CG-CG 4.36Å; R286-L290 WeakPolarHBondContact O-CB 3.42Å; R286-L290 WeakPolarHBondContact O-CD1 3.49Å; R286-L290 VanDerWaalsContact O-CG 3.24Å; R286-L290 WeakPolarHBondContact O-CG 3.45Å; R286-L290 PolarHBondContact O-N 2.96Å; R286-R459 HydrophobicContact CG-CB 4.24Å
287	I	90.4	Very high	91.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66	-41.6	174.1	-59	177.6	0	0	0	109.3	V205 P207 P258 E283 A284 D285 F292 L296	V205-I287 HydrophobicContact CG1-CD1 4.22Å; P207-I287 HydrophobicContact CB-CG1 3.98Å; P207-I287 HydrophobicContact CG-CG1 4.41Å; P258-I287 HydrophobicContact CG-CG2 3.78Å; E283-I287 PolarHBondContact O-N 3.01Å; A284-I287 WeakPolarHBondContact O-CB 3.13Å; A284-I287 PolarHBondContact O-N 3.48Å; A284-I287 VanDerWaalsContact O-N 3.1Å; D285-I287 VanDerWaalsContact C-N 3.34Å; D285-I287 PolarHBondContact O-N 3.37Å; I287-F292 HydrophobicContact CG2-CB 3.78Å; I287-F292 HydrophobicContact CG2-CD2 4.17Å; I287-F292 HydrophobicContact CG2-CG 4.47Å; I287-F292 WeakPolarHBondContact O-CB 3.33Å; I287-F292 PolarHBondContact O-N 3.25Å; I287-L296 HydrophobicContact CB-CD1 4.46Å; I287-L296 HydrophobicContact CG2-CD1 3.57Å; I287-L296 HydrophobicContact CG2-CD2 4.05Å; I287-L296 HydrophobicContact CG2-CG 3.77Å
288	L	89.9	Confident	91.9	Very high	28 Å²	28	37.2 Å²	37.2	15%	0.147	19%	0.191	C	C	.	.	H	α-helix	trans	-73.6	-41.9	176.6	-59.9	176.7	0	0	0	112.5	A284 D285 R286 L290 G291 L296 G322 V323 L326	A284-L288 PolarHBondContact O-N 3.38Å; D285-L288 PolarHBondContact O-N 3.04Å; R286-L288 VanDerWaalsContact C-N 3.31Å; L288-L290 PolarHBondContact O-N 3.48Å; L288-L290 VanDerWaalsContact O-N 3.08Å; L288-G291 PolarHBondContact O-N 3.45Å; L288-L296 HydrophobicContact CD2-CD1 3.99Å; L288-G322 WeakPolarHBondContact CD1-O 3.39Å; L288-V323 HydrophobicContact CD1-CG2 4.21Å; L288-L326 HydrophobicContact CD1-CB 4.3Å; L288-L326 HydrophobicContact CD1-CD2 4.12Å; L288-L326 HydrophobicContact CD2-CD2 4.26Å; L288-L326 HydrophobicContact CG-CD2 4.22Å
289	D	83.4	Confident	91.8	Very high	87 Å²	87	36.8 Å²	36.8	47%	0.465	19%	0.19	S	C	.	.	H	α-helix	trans	-61.6	-18.4	176	-69.8	-19.4	0	0	0	113.8	D285 R459	D285-D289 VanDerWaalsContact O-CG 3.32Å; D285-D289 PolarHBondContact O-N 3.48Å; D289-R459 IonicContact OD2-CZ 3.88Å; D289-R459 IonicContact OD2-NH1 2.89Å; D289-R459 PolarHBondContact OD2-NH1 3.32Å; D289-R459 IonicContact OD2-NH2 3.47Å; D289-R459 PolarHBondContact OD2-NH2 3.33Å
290	L	82.5	Confident	91.6	Very high	72 Å²	72	37.5 Å²	37.5	38%	0.377	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	1.6	174.7	-69	172.4	0	0	0	113.1	P207 R286 L288 F292	P207-L290 HydrophobicContact CB-CD1 3.89Å; R286-L290 HydrophobicContact CG-CD1 4.02Å; R286-L290 HydrophobicContact CG-CG 4.36Å; R286-L290 WeakPolarHBondContact O-CB 3.42Å; R286-L290 WeakPolarHBondContact O-CD1 3.49Å; R286-L290 VanDerWaalsContact O-CG 3.24Å; R286-L290 WeakPolarHBondContact O-CG 3.45Å; R286-L290 PolarHBondContact O-N 2.96Å; L288-L290 PolarHBondContact O-N 3.48Å; L288-L290 VanDerWaalsContact O-N 3.08Å; L290-F292 HydrophobicContact CB-CD2 3.7Å; L290-F292 HydrophobicContact CB-CE2 3.64Å; L290-F292 HydrophobicContact CB-CZ 4.41Å; L290-F292 HydrophobicContact CD1-CD2 4.42Å; L290-F292 HydrophobicContact CD1-CE2 3.81Å; L290-F292 HydrophobicContact CG-CE2 4.38Å
291	G	88.9	Confident	91.3	Very high	43 Å²	43	41.1 Å²	41.1	44%	0.443	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	21.8	176.7	0	0	0	0	0	115	L288 D293	L288-G291 PolarHBondContact O-N 3.45Å; G291-D293 PolarHBondContact O-N 2.85Å
292	F	92	Very high	90.9	Very high	49 Å²	49	41.7 Å²	41.7	22%	0.215	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	18.9	-178.5	-66.6	-53.6	0	0	0	114.3	P258 I287 L290 R294 E295 L296	P258-F292 HydrophobicContact CB-CB 3.93Å; P258-F292 HydrophobicContact CB-CD1 4.2Å; P258-F292 HydrophobicContact CB-CD2 4.27Å; P258-F292 HydrophobicContact CB-CG 3.91Å; P258-F292 HydrophobicContact CG-CB 4.09Å; P258-F292 HydrophobicContact CG-CD2 3.84Å; P258-F292 HydrophobicContact CG-CE2 4.38Å; P258-F292 HydrophobicContact CG-CG 3.97Å; I287-F292 HydrophobicContact CG2-CB 3.78Å; I287-F292 HydrophobicContact CG2-CD2 4.17Å; I287-F292 HydrophobicContact CG2-CG 4.47Å; I287-F292 WeakPolarHBondContact O-CB 3.33Å; I287-F292 PolarHBondContact O-N 3.25Å; L290-F292 HydrophobicContact CB-CD2 3.7Å; L290-F292 HydrophobicContact CB-CE2 3.64Å; L290-F292 HydrophobicContact CB-CZ 4.41Å; L290-F292 HydrophobicContact CD1-CD2 4.42Å; L290-F292 HydrophobicContact CD1-CE2 3.81Å; L290-F292 HydrophobicContact CG-CE2 4.38Å; F292-R294 PolarHBondContact O-N 2.96Å; F292-E295 WeakPolarHBondContact CA-OE2 3.43Å; F292-E295 HydrophobicContact CB-CB 4.32Å; F292-E295 HydrophobicContact CD1-CB 4.48Å; F292-E295 HydrophobicContact CD1-CG 4.14Å; F292-E295 PolarHBondContact O-N 3.45Å; F292-L296 WeakPolarHBondContact O-CB 3.41Å; F292-L296 PolarHBondContact O-N 3.37Å
293	D	91.3	Very high	90.7	Very high	80 Å²	80	41.7 Å²	41.7	43%	0.428	22%	0.219	S	C	.	.	H	α-helix	trans	-54.4	-38	179.9	-50.8	-111	0	0	0	112.2	G291 T297	G291-D293 PolarHBondContact O-N 2.85Å; D293-T297 WeakPolarHBondContact O-CB 3.05Å; D293-T297 PolarHBondContact O-N 2.93Å; D293-T297 PolarHBondContact O-OG1 3.11Å
294	R	94.1	Very high	90.5	Very high	181 Å²	181	46.1 Å²	46.1	68%	0.683	24%	0.243	S	C	*	.	H	α-helix	trans	-71.2	-44.7	179.8	-70	176.5	166.8	-171.3	-6.8	111.3	F292 T297 V298	F292-R294 PolarHBondContact O-N 2.96Å; R294-T297 WeakPolarHBondContact O-CB 3.47Å; R294-T297 PolarHBondContact O-N 3.11Å; R294-V298 WeakPolarHBondContact O-CG2 3.43Å; R294-V298 PolarHBondContact O-N 3.13Å
295	E	96.5	Very high	89.7	Confident	56 Å²	56	55.8 Å²	55.8	26%	0.262	28%	0.279	S	S	.	.	H	α-helix	trans	-64.5	-46	178.1	-69.2	61.5	-145.6	0	0	110.3	P258 A262 F292 T297 V298 I299	P258-E295 HydrophobicContact CB-CB 3.75Å; A262-E295 HydrophobicContact CB-CB 4.2Å; A262-E295 HydrophobicContact CB-CG 4.26Å; F292-E295 WeakPolarHBondContact CA-OE2 3.43Å; F292-E295 HydrophobicContact CB-CB 4.32Å; F292-E295 HydrophobicContact CD1-CB 4.48Å; F292-E295 HydrophobicContact CD1-CG 4.14Å; F292-E295 PolarHBondContact O-N 3.45Å; E295-T297 VanDerWaalsContact C-N 3.33Å; E295-T297 PolarHBondContact O-N 3.08Å; E295-V298 PolarHBondContact O-N 3.49Å; E295-V298 VanDerWaalsContact O-N 3.16Å; E295-I299 VanDerWaalsContact O-CD1 3.26Å; E295-I299 WeakPolarHBondContact O-CD1 3.5Å; E295-I299 WeakPolarHBondContact O-CG1 3.37Å; E295-I299 PolarHBondContact O-N 3.34Å
296	L	94.9	Very high	88.6	Confident	4 Å²	4	59 Å²	59	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-57	-44.9	171.1	-77.3	-179.3	0	0	0	111.7	V205 L281 I287 L288 F292 V298 I299 L300 L326	V205-L296 HydrophobicContact CG1-CD2 4.47Å; L281-L296 HydrophobicContact CD2-CD2 4.18Å; I287-L296 HydrophobicContact CB-CD1 4.46Å; I287-L296 HydrophobicContact CG2-CD1 3.57Å; I287-L296 HydrophobicContact CG2-CD2 4.05Å; I287-L296 HydrophobicContact CG2-CG 3.77Å; L288-L296 HydrophobicContact CD2-CD1 3.99Å; F292-L296 WeakPolarHBondContact O-CB 3.41Å; F292-L296 PolarHBondContact O-N 3.37Å; L296-V298 VanDerWaalsContact C-N 3.3Å; L296-V298 PolarHBondContact O-N 3.08Å; L296-I299 PolarHBondContact O-N 3.48Å; L296-I299 VanDerWaalsContact O-N 3.13Å; L296-L300 WeakPolarHBondContact O-CB 3.27Å; L296-L300 WeakPolarHBondContact O-CG 3.13Å; L296-L300 PolarHBondContact O-N 2.92Å; L296-L326 HydrophobicContact CD1-CD1 3.99Å; L296-L326 HydrophobicContact CD1-CD2 3.85Å
297	T	93.8	Very high	87.5	Confident	77 Å²	77	59.7 Å²	59.7	47%	0.472	32%	0.319	S	S	.	.	H	α-helix	trans	-59.6	-40	176.2	-59.7	0	0	0	0	111.7	D293 R294 E295 N301	D293-T297 WeakPolarHBondContact O-CB 3.05Å; D293-T297 PolarHBondContact O-N 2.93Å; D293-T297 PolarHBondContact O-OG1 3.11Å; R294-T297 WeakPolarHBondContact O-CB 3.47Å; R294-T297 PolarHBondContact O-N 3.11Å; E295-T297 VanDerWaalsContact C-N 3.33Å; E295-T297 PolarHBondContact O-N 3.08Å; T297-N301 WeakPolarHBondContact CG2-ND2 3.39Å; T297-N301 VanDerWaalsContact O-CB 3.27Å; T297-N301 WeakPolarHBondContact O-CB 3.5Å; T297-N301 PolarHBondContact O-N 3.22Å; T297-N301 VanDerWaalsContact O-N 3.08Å; T297-N301 PolarHBondContact O-ND2 3.05Å
298	V	95.1	Very high	86.4	Confident	40 Å²	40	63.3 Å²	63.3	24%	0.242	34%	0.343	C	S	.	.	H	α-helix	trans	-66.3	-40.7	174.4	170.5	0	0	0	0	111.6	A262 I265 Q266 R294 E295 L296 G302	A262-V298 HydrophobicContact CB-CB 4.15Å; A262-V298 HydrophobicContact CB-CG1 3.9Å; I265-V298 HydrophobicContact CG2-CG1 4.39Å; Q266-V298 HydrophobicContact CG-CG1 4.09Å; R294-V298 WeakPolarHBondContact O-CG2 3.43Å; R294-V298 PolarHBondContact O-N 3.13Å; E295-V298 PolarHBondContact O-N 3.49Å; E295-V298 VanDerWaalsContact O-N 3.16Å; L296-V298 VanDerWaalsContact C-N 3.3Å; L296-V298 PolarHBondContact O-N 3.08Å; V298-G302 PolarHBondContact O-N 3.12Å
299	I	94.6	Very high	86	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-66	-51.4	-180	-65.7	155.1	0	0	0	110.9	L203 P258 L261 I265 E295 L296 N301 G302 L303	L203-I299 HydrophobicContact CD2-CG2 4.15Å; P258-I299 HydrophobicContact CB-CD1 4.1Å; L261-I299 HydrophobicContact CB-CD1 4.21Å; L261-I299 HydrophobicContact CB-CG1 4.33Å; L261-I299 HydrophobicContact CD2-CD1 3.85Å; L261-I299 HydrophobicContact CD2-CG1 3.8Å; L261-I299 HydrophobicContact CD2-CG2 3.88Å; L261-I299 HydrophobicContact CG-CD1 4.29Å; L261-I299 HydrophobicContact CG-CG1 4Å; I265-I299 HydrophobicContact CD1-CB 4.31Å; I265-I299 HydrophobicContact CD1-CG1 3.99Å; I265-I299 HydrophobicContact CD1-CG2 4.49Å; E295-I299 VanDerWaalsContact O-CD1 3.26Å; E295-I299 WeakPolarHBondContact O-CD1 3.5Å; E295-I299 WeakPolarHBondContact O-CG1 3.37Å; E295-I299 PolarHBondContact O-N 3.34Å; L296-I299 PolarHBondContact O-N 3.48Å; L296-I299 VanDerWaalsContact O-N 3.13Å; I299-N301 PolarHBondContact O-N 2.94Å; I299-G302 WeakPolarHBondContact O-CA 3.34Å; I299-G302 PolarHBondContact O-N 3.28Å; I299-G302 VanDerWaalsContact O-N 3.11Å; I299-L303 HydrophobicContact CG2-CD1 3.85Å; I299-L303 WeakPolarHBondContact O-CG 3.44Å; I299-L303 PolarHBondContact O-N 3Å
300	L	92.8	Very high	86.4	Confident	14 Å²	14	65.3 Å²	65.3	7%	0.073	36%	0.36	C	S	.	.	H	α-helix	trans	-62.6	-42.3	179.4	-67.1	173.8	0	0	0	111.6	L279 L296 G302 L303 N304 L326 V329 C330	L279-L300 HydrophobicContact CD2-CD2 3.67Å; L296-L300 WeakPolarHBondContact O-CB 3.27Å; L296-L300 WeakPolarHBondContact O-CG 3.13Å; L296-L300 PolarHBondContact O-N 2.92Å; L300-G302 VanDerWaalsContact C-N 3.33Å; L300-G302 PolarHBondContact O-N 3.08Å; L300-L303 PolarHBondContact O-N 3.4Å; L300-N304 WeakPolarHBondContact O-CB 3.23Å; L300-N304 VanDerWaalsContact O-CG 3.26Å; L300-N304 PolarHBondContact O-N 3.39Å; L300-L326 HydrophobicContact CD1-CD1 4.34Å; L300-V329 HydrophobicContact CD1-CG1 4.36Å; L300-C330 HydrophobicContact CD2-CB 4.49Å
301	N	91.4	Very high	87	Confident	77 Å²	77	62.5 Å²	62.5	41%	0.412	35%	0.345	S	S	.	.	H	α-helix	trans	-64.8	-35.3	173	-79.6	-61	0	0	0	112.7	T297 I299 R305	T297-N301 WeakPolarHBondContact CG2-ND2 3.39Å; T297-N301 VanDerWaalsContact O-CB 3.27Å; T297-N301 WeakPolarHBondContact O-CB 3.5Å; T297-N301 PolarHBondContact O-N 3.22Å; T297-N301 VanDerWaalsContact O-N 3.08Å; T297-N301 PolarHBondContact O-ND2 3.05Å; I299-N301 PolarHBondContact O-N 2.94Å; N301-R305 WeakPolarHBondContact O-CB 3.41Å; N301-R305 VanDerWaalsContact O-CD 3.23Å; N301-R305 WeakPolarHBondContact O-CD 3.26Å; N301-R305 WeakPolarHBondContact O-CG 3.48Å; N301-R305 PolarHBondContact O-N 3.34Å
302	G	90.4	Very high	87.3	Confident	13 Å²	13	61 Å²	61	13%	0.134	33%	0.327	C	S	.	.	H	α-helix	trans	-64.2	-38.9	173.6	0	0	0	0	0	112.8	V298 I299 L300	V298-G302 PolarHBondContact O-N 3.12Å; I299-G302 WeakPolarHBondContact O-CA 3.34Å; I299-G302 PolarHBondContact O-N 3.28Å; I299-G302 VanDerWaalsContact O-N 3.11Å; L300-G302 VanDerWaalsContact C-N 3.33Å; L300-G302 PolarHBondContact O-N 3.08Å
303	L	89.8	Confident	87.6	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-77.2	-33.8	179	-68.7	164.8	0	0	0	113.5	L203 L273 V276 L279 I299 L300 R310	L203-L303 HydrophobicContact CD2-CD1 3.87Å; L203-L303 HydrophobicContact CD2-CD2 3.98Å; L203-L303 HydrophobicContact CD2-CG 4.33Å; L273-L303 HydrophobicContact CB-CD2 4.26Å; L273-L303 HydrophobicContact CD1-CD2 4.01Å; L273-L303 HydrophobicContact CD1-CG 4.25Å; V276-L303 HydrophobicContact CB-CD2 3.94Å; V276-L303 HydrophobicContact CG1-CD2 3.86Å; V276-L303 HydrophobicContact CG2-CD2 4.1Å; L279-L303 HydrophobicContact CD1-CD1 3.93Å; L279-L303 HydrophobicContact CD2-CD1 3.89Å; L279-L303 HydrophobicContact CG-CD1 4.37Å; I299-L303 HydrophobicContact CG2-CD1 3.85Å; I299-L303 WeakPolarHBondContact O-CG 3.44Å; I299-L303 PolarHBondContact O-N 3Å; L300-L303 PolarHBondContact O-N 3.4Å; L303-R310 PolarHBondContact O-NH1 3.34Å
304	N	84.9	Confident	87.8	Confident	102 Å²	102	55.1 Å²	55.1	55%	0.545	30%	0.298	S	S	.	.	H	α-helix	trans	-85.3	-12.5	-176.8	-68.5	-5.9	0	0	0	113.4	L300 R310	L300-N304 WeakPolarHBondContact O-CB 3.23Å; L300-N304 VanDerWaalsContact O-CG 3.26Å; L300-N304 PolarHBondContact O-N 3.39Å; N304-R310 PolarHBondContact OD1-NH1 2.98Å; N304-R310 PolarHBondContact OD1-NH2 3.33Å
305	R	75.3	Confident	87.8	Confident	203 Å²	203	46.5 Å²	46.5	77%	0.766	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-19.4	173	-77.8	167.6	-174.6	-170.4	-0.4	114	N301	N301-R305 WeakPolarHBondContact O-CB 3.41Å; N301-R305 VanDerWaalsContact O-CD 3.23Å; N301-R305 WeakPolarHBondContact O-CD 3.26Å; N301-R305 WeakPolarHBondContact O-CG 3.48Å; N301-R305 PolarHBondContact O-N 3.34Å
306	T	63.3	Low	87.5	Confident	68 Å²	68	43.9 Å²	43.9	42%	0.417	25%	0.254	S	S	.	.	S	Bend	trans	-148.8	124.8	-171.2	58.9	0	0	0	0	111.9	G274	G274-T306 WeakPolarHBondContact CA-OG1 3.47Å; G274-T306 PolarHBondContact N-OG1 3.1Å
307	G	62.4	Low	86.8	Confident	56 Å²	56	44.3 Å²	44.3	58%	0.577	26%	0.257	S	S	*	.			trans	130.6	179.5	160.2	0	0	0	0	0	115.6	G274	G274-G307 WeakPolarHBondContact O-CA 3.18Å
308	P	67.3	Low	86.1	Confident	77 Å²	77	41 Å²	41	50%	0.5	24%	0.237	S	C	.	.	S	Bend	trans	-75.1	179.4	173.7	35	-37	0	0	0	111.5	G274	G274-P308 VanDerWaalsContact O-CD 3.31Å; G274-P308 WeakPolarHBondContact O-CD 3.35Å
309	S	82.3	Confident	85.4	Confident	122 Å²	122	43.3 Å²	43.3	85%	0.853	25%	0.247	S	C	*	.			trans	-55	141.9	167.3	-172	0	0	0	0	111.3
310	R	91.2	Very high	84.8	Confident	34 Å²	34	44.5 Å²	44.5	13%	0.128	26%	0.256	C	S	.	.			trans	-135.7	130.1	-167.2	176.6	-174	67.1	-111.6	-1.5	109.2	V276 R277 L303 N304 N312	V276-R310 WeakPolarHBondContact O-CG 3.4Å; R277-R310 WeakPolarHBondContact O-CA 3.23Å; L303-R310 PolarHBondContact O-NH1 3.34Å; N304-R310 PolarHBondContact OD1-NH1 2.98Å; N304-R310 PolarHBondContact OD1-NH2 3.33Å; R310-N312 PolarHBondContact NE-OD1 2.8Å; R310-N312 PolarHBondContact NH2-OD1 3.19Å; R310-N312 PolarHBondContact O-ND2 3.31Å
311	Q	95.2	Very high	84.4	Confident	13 Å²	13	48.1 Å²	48.1	6%	0.061	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	126.5	176.3	-166.7	174.4	-2.9	0	0	109.8	L159 G162 R163 D164 R277 W278 L279	L159-Q311 PolarHBondContact O-NE2 2.86Å; G162-Q311 VanDerWaalsContact C-CD 3.5Å; G162-Q311 VanDerWaalsContact C-NE2 3.31Å; R163-Q311 PolarHBondContact O-NE2 2.95Å; D164-Q311 WeakPolarHBondContact OD1-CA 3.31Å; R277-Q311 PolarHBondContact O-N 2.85Å; W278-Q311 WeakPolarHBondContact CA-O 3.36Å; W278-Q311 HydrophobicContact CD2-CB 4.5Å; W278-Q311 HydrophobicContact CH2-CG 4.47Å; W278-Q311 HydrophobicContact CZ3-CG 4.43Å; L279-Q311 PolarHBondContact N-O 2.83Å
312	N	96	Very high	84.2	Confident	11 Å²	11	45.2 Å²	45.2	6%	0.059	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.4	-175.4	-43.4	-78.7	0	0	0	110.4	D164 A165 L279 R310 C330 L331	D164-N312 VanDerWaalsContact CA-O 3.26Å; D164-N312 WeakPolarHBondContact CA-O 3.35Å; D164-N312 WeakPolarHBondContact CB-O 3.5Å; D164-N312 PolarHBondContact OD1-N 2.95Å; D164-N312 WeakPolarHBondContact OD2-CB 3.43Å; D164-N312 PolarHBondContact OD2-ND2 2.91Å; A165-N312 PolarHBondContact N-O 3.4Å; A165-N312 VanDerWaalsContact N-O 3.16Å; L279-N312 CarbonylContact O-C 3.49Å; L279-N312 WeakPolarHBondContact O-CA 3.48Å; R310-N312 PolarHBondContact NE-OD1 2.8Å; R310-N312 PolarHBondContact NH2-OD1 3.19Å; R310-N312 PolarHBondContact O-ND2 3.31Å; N312-C330 WeakPolarHBondContact CB-O 3.26Å; N312-C330 VanDerWaalsContact CG-O 3.3Å; N312-C330 PolarHBondContact ND2-O 2.87Å; N312-L331 HydrophobicContact CB-CD2 3.56Å
313	V	97.2	Very high	84.2	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	119	-178.5	-167.8	0	0	0	0	109.4	L159 A165 V167 W278 L279 V280 L281 L315	L159-V313 HydrophobicContact CD1-CG1 4.17Å; L159-V313 HydrophobicContact CD1-CG2 4.09Å; L159-V313 HydrophobicContact CD2-CG1 4.29Å; L159-V313 HydrophobicContact CD2-CG2 3.53Å; L159-V313 HydrophobicContact CG-CG2 4.49Å; A165-V313 HydrophobicContact CB-CG1 4.49Å; A165-V313 WeakPolarHBondContact O-CA 3.49Å; V167-V313 HydrophobicContact CG2-CG1 4.15Å; W278-V313 HydrophobicContact CE3-CG2 4.24Å; W278-V313 HydrophobicContact CZ3-CG2 3.97Å; L279-V313 PolarHBondContact O-N 2.9Å; V280-V313 CarbonylContact C-O 3.46Å; V280-V313 WeakPolarHBondContact CA-O 3.44Å; V280-V313 HydrophobicContact CG1-CB 4.43Å; V280-V313 HydrophobicContact CG2-CB 4.3Å; V280-V313 HydrophobicContact CG2-CG2 4.46Å; L281-V313 PolarHBondContact N-O 3.41Å; V313-L315 HydrophobicContact CB-CD1 4.48Å; V313-L315 HydrophobicContact CG1-CD1 3.76Å; V313-L315 HydrophobicContact CG1-CG 4.19Å
314	L	96.2	Very high	84.2	Confident	5 Å²	5	47.6 Å²	47.6	3%	0.026	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.5	173.4	-172	153.8	0	0	0	108.7	A165 V167 A284 V323 L326 A327 L331	A165-L314 PolarHBondContact O-N 3.46Å; V167-L314 PolarHBondContact N-O 2.97Å; A284-L314 HydrophobicContact CB-CD1 4.31Å; A284-L314 HydrophobicContact CB-CD2 3.94Å; A284-L314 HydrophobicContact CB-CG 3.86Å; L314-V323 HydrophobicContact CD2-CG1 3.82Å; L314-L326 HydrophobicContact CD1-CB 4.4Å; L314-L326 HydrophobicContact CD1-CD2 4.24Å; L314-L326 HydrophobicContact CD1-CG 3.99Å; L314-A327 HydrophobicContact CD1-CB 4.12Å; L314-L331 HydrophobicContact CB-CD1 4.09Å; L314-L331 HydrophobicContact CB-CD2 4.28Å
315	L	93.7	Very high	84.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.8	174.8	-53.5	99.1	0	0	0	110.9	V167 K175 Y179 V280 L281 D282 E283 A284 V313	V167-L315 HydrophobicContact CB-CB 4.48Å; V167-L315 HydrophobicContact CB-CD2 4.09Å; V167-L315 HydrophobicContact CB-CG 3.99Å; V167-L315 HydrophobicContact CG1-CD2 4.08Å; V167-L315 HydrophobicContact CG2-CD2 4.49Å; V167-L315 HydrophobicContact CG2-CG 4.37Å; V167-L315 WeakPolarHBondContact O-CA 3.23Å; K175-L315 HydrophobicContact CB-CD2 4.02Å; K175-L315 HydrophobicContact CD-CB 4.14Å; K175-L315 HydrophobicContact CD-CD2 4.31Å; K175-L315 HydrophobicContact CG-CD2 4.13Å; Y179-L315 HydrophobicContact CD1-CD1 3.52Å; Y179-L315 HydrophobicContact CD1-CD2 3.76Å; Y179-L315 HydrophobicContact CD1-CG 4.32Å; Y179-L315 HydrophobicContact CE1-CD1 3.88Å; Y179-L315 HydrophobicContact CE1-CD2 4.26Å; Y179-L315 HydrophobicContact CG-CD1 4.34Å; V280-L315 HydrophobicContact CG1-CD1 3.47Å; V280-L315 VanDerWaalsContact CG1-CD1 3.47Å; L281-L315 PolarHBondContact O-N 3.46Å; D282-L315 HydrophobicContact CB-CD1 4.3Å; E283-L315 PolarHBondContact N-O 3.21Å; E283-L315 VanDerWaalsContact N-O 3.14Å; A284-L315 PolarHBondContact N-O 3.44Å; V313-L315 HydrophobicContact CB-CD1 4.48Å; V313-L315 HydrophobicContact CG1-CD1 3.76Å; V313-L315 HydrophobicContact CG1-CG 4.19Å
316	S	88.9	Confident	85.3	Confident	2 Å²	2	41 Å²	41	1%	0.014	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	159.5	-176.7	-163.6	0	0	0	0	110.7	V167 S169 D285 T318	V167-S316 PolarHBondContact O-N 2.77Å; V167-S316 VanDerWaalsContact O-N 3.08Å; S169-S316 PolarHBondContact N-O 3.1Å; D285-S316 WeakPolarHBondContact CB-OG 3.49Å; D285-S316 PolarHBondContact OD2-OG 2.99Å; S316-T318 WeakPolarHBondContact CB-O 3.2Å; S316-T318 PolarHBondContact OG-N 2.85Å; S316-T318 PolarHBondContact OG-O 3.38Å
317	A	81.3	Confident	86.6	Confident	12 Å²	12	38.5 Å²	38.5	10%	0.099	24%	0.235	C	C	.	.	S	Bend	trans	-91.1	-36.1	163.3	0	0	0	0	0	110.6	S169 D285	S169-A317 WeakPolarHBondContact O-CA 3.27Å; D285-A317 PolarHBondContact OD2-N 3.02Å
318	T	78.2	Confident	87.9	Confident	7 Å²	7	41.3 Å²	41.3	4%	0.043	24%	0.237	C	C	.	.			trans	-108.2	160.8	-176.3	72	0	0	0	0	112.5	D285 S316 F354 A479	D285-T318 VanDerWaalsContact CB-OG1 3.26Å; D285-T318 WeakPolarHBondContact CB-OG1 3.42Å; D285-T318 PolarHBondContact OD2-N 3.1Å; D285-T318 VanDerWaalsContact OD2-N 3.12Å; D285-T318 PolarHBondContact OD2-OG1 2.97Å; S316-T318 WeakPolarHBondContact CB-O 3.2Å; S316-T318 PolarHBondContact OG-N 2.85Å; S316-T318 PolarHBondContact OG-O 3.38Å; T318-F354 HydrophobicContact CG2-CD1 4.45Å; T318-F354 HydrophobicContact CG2-CE1 3.73Å; T318-A479 HydrophobicContact CG2-CB 3.79Å
319	L	80.1	Confident	89	Confident	89 Å²	89	42.6 Å²	42.6	47%	0.466	24%	0.244	S	C	.	.			trans	-115.8	50.7	174.9	-77.5	177.6	0	0	0	110.1	R168	R168-L319 HydrophobicContact CG-CG 4.39Å
320	S	82.9	Confident	89.4	Confident	27 Å²	27	37.3 Å²	37.3	19%	0.189	21%	0.206	C	C	.	.			trans	-62.1	153.2	177.5	83.7	0	0	0	0	110.6	G322 V323 T324 E352	S320-G322 PolarHBondContact O-N 3.34Å; S320-G322 PolarHBondContact OG-N 2.89Å; S320-V323 WeakPolarHBondContact O-CA 3.47Å; S320-V323 WeakPolarHBondContact O-CB 3.37Å; S320-V323 PolarHBondContact O-N 2.68Å; S320-V323 PolarHBondContact OG-N 2.95Å; S320-T324 PolarHBondContact O-N 3.47Å; S320-T324 PolarHBondContact O-OG1 2.9Å; S320-E352 WeakPolarHBondContact CA-OE1 3.43Å
321	P	85.3	Confident	89.4	Confident	90 Å²	90	36.6 Å²	36.6	58%	0.584	21%	0.205	S	C	*	.	H	α-helix	trans	-57.2	-20	177.9	-27.4	35.4	0	0	0	114.3	R325	P321-R325 WeakPolarHBondContact O-CG 3.38Å; P321-R325 VanDerWaalsContact O-CZ 3.31Å; P321-R325 PolarHBondContact O-N 3.43Å; P321-R325 PolarHBondContact O-NH1 3.33Å
322	G	86.8	Confident	89.1	Confident	16 Å²	16	43.5 Å²	43.5	17%	0.165	24%	0.237	C	C	.	.	H	α-helix	trans	-72.1	-44.2	170.2	0	0	0	0	0	112.7	L288 S320 R325 L326	L288-G322 WeakPolarHBondContact CD1-O 3.39Å; S320-G322 PolarHBondContact O-N 3.34Å; S320-G322 PolarHBondContact OG-N 2.89Å; G322-R325 PolarHBondContact O-N 3.46Å; G322-L326 WeakPolarHBondContact O-CB 3.45Å; G322-L326 PolarHBondContact O-N 3.41Å
323	V	89.5	Confident	88.8	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.012	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-40.8	177.1	176	0	0	0	0	111.1	D285 L288 L314 S320 L326 A327	D285-V323 HydrophobicContact CB-CG2 3.87Å; L288-V323 HydrophobicContact CD1-CG2 4.21Å; L314-V323 HydrophobicContact CD2-CG1 3.82Å; S320-V323 WeakPolarHBondContact O-CA 3.47Å; S320-V323 WeakPolarHBondContact O-CB 3.37Å; S320-V323 PolarHBondContact O-N 2.68Å; S320-V323 PolarHBondContact OG-N 2.95Å; V323-L326 PolarHBondContact O-N 2.92Å; V323-A327 PolarHBondContact O-N 3.09Å
324	T	90.4	Very high	88.6	Confident	62 Å²	62	50.9 Å²	50.9	38%	0.38	28%	0.279	S	S	.	.	H	α-helix	trans	-59.2	-53.5	176	-46.4	0	0	0	0	111.1	S320 L326 A327 D328	S320-T324 PolarHBondContact O-N 3.47Å; S320-T324 PolarHBondContact O-OG1 2.9Å; T324-L326 PolarHBondContact O-N 2.93Å; T324-A327 WeakPolarHBondContact O-CA 3.45Å; T324-A327 VanDerWaalsContact O-CB 3.31Å; T324-A327 WeakPolarHBondContact O-CB 3.31Å; T324-A327 PolarHBondContact O-N 2.82Å; T324-D328 PolarHBondContact O-N 3.46Å
325	R	90.8	Very high	88.5	Confident	150 Å²	150	52.2 Å²	52.2	57%	0.566	29%	0.286	S	S	*	.	H	α-helix	trans	-59.5	-31.9	176.1	-68.1	-172.1	-49.3	-89.7	1	113.5	P321 G322 D328 V329	P321-R325 WeakPolarHBondContact O-CG 3.38Å; P321-R325 VanDerWaalsContact O-CZ 3.31Å; P321-R325 PolarHBondContact O-N 3.43Å; P321-R325 PolarHBondContact O-NH1 3.33Å; G322-R325 PolarHBondContact O-N 3.46Å; R325-D328 WeakPolarHBondContact CA-OD2 3.24Å; R325-V329 WeakPolarHBondContact O-CB 3.2Å; R325-V329 VanDerWaalsContact O-CG2 3.29Å; R325-V329 WeakPolarHBondContact O-CG2 3.31Å; R325-V329 PolarHBondContact O-N 2.85Å
326	L	91.3	Very high	88.4	Confident	16 Å²	16	56.9 Å²	56.9	8%	0.084	32%	0.319	C	S	.	.	H	α-helix	trans	-70.8	-35.8	174.8	-179.8	60.6	0	0	0	111.5	L281 A284 L288 L296 L300 L314 G322 V323 T324 C330	L281-L326 HydrophobicContact CD1-CD1 4.2Å; L281-L326 HydrophobicContact CD1-CD2 4.11Å; L281-L326 HydrophobicContact CD1-CG 4.19Å; A284-L326 HydrophobicContact CB-CD2 4.35Å; L288-L326 HydrophobicContact CD1-CB 4.3Å; L288-L326 HydrophobicContact CD1-CD2 4.12Å; L288-L326 HydrophobicContact CD2-CD2 4.26Å; L288-L326 HydrophobicContact CG-CD2 4.22Å; L296-L326 HydrophobicContact CD1-CD1 3.99Å; L296-L326 HydrophobicContact CD1-CD2 3.85Å; L300-L326 HydrophobicContact CD1-CD1 4.34Å; L314-L326 HydrophobicContact CD1-CB 4.4Å; L314-L326 HydrophobicContact CD1-CD2 4.24Å; L314-L326 HydrophobicContact CD1-CG 3.99Å; G322-L326 WeakPolarHBondContact O-CB 3.45Å; G322-L326 PolarHBondContact O-N 3.41Å; V323-L326 PolarHBondContact O-N 2.92Å; T324-L326 PolarHBondContact O-N 2.93Å; L326-C330 WeakPolarHBondContact O-CB 3.35Å; L326-C330 PolarHBondContact O-N 2.98Å; L326-C330 VanDerWaalsContact O-N 3.08Å
327	A	91.8	Very high	88.4	Confident	16 Å²	16	57.2 Å²	57.2	13%	0.132	32%	0.32	C	S	.	.	H	α-helix	trans	-64.4	-49.4	171.1	0	0	0	0	0	111	L314 V323 T324 V329 C330 L331	L314-A327 HydrophobicContact CD1-CB 4.12Å; V323-A327 PolarHBondContact O-N 3.09Å; T324-A327 WeakPolarHBondContact O-CA 3.45Å; T324-A327 VanDerWaalsContact O-CB 3.31Å; T324-A327 WeakPolarHBondContact O-CB 3.31Å; T324-A327 PolarHBondContact O-N 2.82Å; A327-V329 PolarHBondContact O-N 3.32Å; A327-V329 VanDerWaalsContact O-N 3.15Å; A327-C330 PolarHBondContact O-N 3.48Å; A327-L331 HydrophobicContact CB-CD1 3.97Å; A327-L331 HydrophobicContact CB-CG 4.46Å; A327-L331 WeakPolarHBondContact O-CB 3.4Å; A327-L331 PolarHBondContact O-N 3.3Å
328	D	90.6	Very high	88.5	Confident	115 Å²	115	59.1 Å²	59.1	62%	0.615	33%	0.333	S	S	*	.	H	α-helix	trans	-56.7	-30.9	179.9	-54.1	-32.8	0	0	0	113.2	T324 R325	T324-D328 PolarHBondContact O-N 3.46Å; R325-D328 WeakPolarHBondContact CA-OD2 3.24Å
329	V	89.9	Confident	87.9	Confident	105 Å²	105	60.7 Å²	60.7	64%	0.636	34%	0.342	S	S	*	.	H	α-helix	trans	-93.5	-19.3	-179.8	172.5	0	0	0	0	113	L300 R325 A327	L300-V329 HydrophobicContact CD1-CG1 4.36Å; R325-V329 WeakPolarHBondContact O-CB 3.2Å; R325-V329 VanDerWaalsContact O-CG2 3.29Å; R325-V329 WeakPolarHBondContact O-CG2 3.31Å; R325-V329 PolarHBondContact O-N 2.85Å; A327-V329 PolarHBondContact O-N 3.32Å; A327-V329 VanDerWaalsContact O-N 3.15Å
330	C	89.6	Confident	86.7	Confident	10 Å²	10	57.7 Å²	57.7	7%	0.068	33%	0.329	C	S	.	.	H	α-helix	trans	-109.4	-22.4	-171.3	-171	0	0	0	0	114.4	L281 L300 N312 L326 A327	L281-C330 HydrophobicContact CD1-CB 4.49Å; L300-C330 HydrophobicContact CD2-CB 4.49Å; N312-C330 WeakPolarHBondContact CB-O 3.26Å; N312-C330 VanDerWaalsContact CG-O 3.3Å; N312-C330 PolarHBondContact ND2-O 2.87Å; L326-C330 WeakPolarHBondContact O-CB 3.35Å; L326-C330 PolarHBondContact O-N 2.98Å; L326-C330 VanDerWaalsContact O-N 3.08Å; A327-C330 PolarHBondContact O-N 3.48Å
331	L	91.9	Very high	84.7	Confident	20 Å²	20	59 Å²	59	11%	0.105	35%	0.346	C	S	.	.			trans	-117.7	149.5	-170.7	-50.5	-178.3	0	0	0	111.7	D164 A166 N312 L314 A327 P334	D164-L331 HydrophobicContact CB-CB 4.42Å; D164-L331 WeakPolarHBondContact OD2-CA 3.31Å; A166-L331 HydrophobicContact CB-CD1 3.89Å; N312-L331 HydrophobicContact CB-CD2 3.56Å; L314-L331 HydrophobicContact CB-CD1 4.09Å; L314-L331 HydrophobicContact CB-CD2 4.28Å; A327-L331 HydrophobicContact CB-CD1 3.97Å; A327-L331 HydrophobicContact CB-CG 4.46Å; A327-L331 WeakPolarHBondContact O-CB 3.4Å; A327-L331 PolarHBondContact O-N 3.3Å; L331-P334 HydrophobicContact CB-CB 3.88Å; L331-P334 HydrophobicContact CB-CG 3.85Å; L331-P334 HydrophobicContact CD1-CB 3.66Å; L331-P334 HydrophobicContact CD1-CG 3.96Å; L331-P334 HydrophobicContact CG-CB 4.38Å
332	H	89.6	Confident	82.3	Confident	157 Å²	157	58.9 Å²	58.9	73%	0.727	35%	0.346	S	S	*	.	S	Bend	trans	-121.8	118.9	174.1	-179	-65.3	0	0	0	110.9	D164	D164-H332 PolarHBondContact OD2-N 3.34Å
333	D	89.4	Confident	79.9	Confident	120 Å²	120	61.1 Å²	61.1	64%	0.642	36%	0.363	S	S	*	.	S	Bend	trans	45.3	54.7	-174.1	-170	39.4	0	0	0	113.7
334	P	93	Very high	77.6	Confident	48 Å²	48	67.7 Å²	67.7	31%	0.312	41%	0.405	S	S	.	.			trans	-73	139.7	-172.5	29.1	-34.5	0	0	0	113.1	D164 A166 L331 S336	D164-P334 HydrophobicContact CB-CB 4.17Å; D164-P334 WeakPolarHBondContact O-CA 3.21Å; A166-P334 HydrophobicContact CB-CB 4.48Å; L331-P334 HydrophobicContact CB-CB 3.88Å; L331-P334 HydrophobicContact CB-CG 3.85Å; L331-P334 HydrophobicContact CD1-CB 3.66Å; L331-P334 HydrophobicContact CD1-CG 3.96Å; L331-P334 HydrophobicContact CG-CB 4.38Å; P334-S336 PolarHBondContact O-N 3.35Å
335	I	93.2	Very high	74.9	Confident	33 Å²	33	69.4 Å²	69.4	17%	0.169	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	115.7	163.7	-50.9	166.1	0	0	0	108.2	A158 R163 D164 A165 A166 I337	A158-I335 HydrophobicContact CB-CD1 3.64Å; R163-I335 HydrophobicContact CB-CD1 3.85Å; R163-I335 HydrophobicContact CB-CG1 4.12Å; D164-I335 PolarHBondContact O-N 2.88Å; A165-I335 WeakPolarHBondContact CA-O 3.35Å; A166-I335 PolarHBondContact N-O 2.9Å; I335-I337 HydrophobicContact CB-CG1 4.3Å; I335-I337 HydrophobicContact CG2-CD1 4.17Å; I335-I337 HydrophobicContact CG2-CG1 3.68Å; I335-I337 PolarHBondContact O-N 3.33Å
336	S	91.3	Very high	72.3	Confident	98 Å²	98	67 Å²	67	69%	0.685	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	116.7	167.5	-70.1	0	0	0	0	110	P334	P334-S336 PolarHBondContact O-N 3.35Å
337	I	89.5	Confident	69.6	Low	9 Å²	9	71.4 Å²	71.4	5%	0.046	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.2	-177.9	-53.7	-176.7	0	0	0	109.1	I151 Q154 T155 A158 A165 A166 R168 I335	I151-I337 HydrophobicContact CD1-CG2 3.7Å; Q154-I337 HydrophobicContact CB-CG2 3.76Å; Q154-I337 VanDerWaalsContact OE1-CG2 3.26Å; T155-I337 HydrophobicContact CG2-CD1 4.46Å; A158-I337 HydrophobicContact CB-CD1 3.74Å; A165-I337 HydrophobicContact CB-CD1 4.29Å; A166-I337 PolarHBondContact O-N 3.29Å; R168-I337 PolarHBondContact N-O 3.37Å; I335-I337 HydrophobicContact CB-CG1 4.3Å; I335-I337 HydrophobicContact CG2-CD1 4.17Å; I335-I337 HydrophobicContact CG2-CG1 3.68Å; I335-I337 PolarHBondContact O-N 3.33Å
338	S	82.4	Confident	67.1	Low	52 Å²	52	76.5 Å²	76.5	36%	0.364	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	144.3	176.8	63.5	0	0	0	0	110.8	Q154	Q154-S338 PolarHBondContact OE1-O 3Å
339	V	66.9	Low	64.7	Low	40 Å²	40	75.6 Å²	75.6	24%	0.242	48%	0.482	C	S	.	.	S	Bend	trans	-85.7	-13	-176.7	-171.9	0	0	0	0	112.1	E118 I151	E118-V339 HydrophobicContact CG-CG1 4.26Å; I151-V339 HydrophobicContact CB-CG2 3.94Å; I151-V339 HydrophobicContact CD1-CG2 3.86Å; I151-V339 HydrophobicContact CG1-CG2 4.44Å
340	S	54.8	Low	62.3	Low	26 Å²	26	80.2 Å²	80.2	18%	0.182	50%	0.497	C	S	.	.	S	Bend	trans	-137.6	131	-176.3	-61.9	0	0	0	0	110.2	E118	E118-S340 WeakPolarHBondContact CG-OG 3.48Å; E118-S340 PolarHBondContact OE1-OG 2.72Å
341	G	40.1	Very low	60.5	Low	54 Å²	54	82.8 Å²	82.8	56%	0.557	52%	0.515	S	S	*	.			trans	-83.2	-163.2	-171.4	0	0	0	0	0	116
342	P	35	Very low	58.9	Low	88 Å²	88	84.6 Å²	84.6	57%	0.571	52%	0.523	S	S	*	.			cis	-77.7	-175.1	10.3	33.2	-38.1	0	0	0	114.5	D346	P342-D346 HydrophobicContact CB-CB 4.39Å; P342-D346 WeakPolarHBondContact CB-OD2 3.35Å; P342-D346 HydrophobicContact CG-CB 3.93Å; P342-D346 VanDerWaalsContact CG-OD2 3.32Å; P342-D346 WeakPolarHBondContact CG-OD2 3.49Å
343	A	36.5	Very low	57.6	Low	63 Å²	63	78.8 Å²	78.8	52%	0.521	50%	0.5	S	S	.	.			trans	-69.6	166.7	168.3	0	0	0	0	0	111.3	S345	A343-S345 PolarHBondContact O-N 2.83Å
344	P	41.8	Very low	56.8	Low	140 Å²	140	73.5 Å²	73.5	91%	0.909	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	9.4	-179.2	-22.3	34.7	0	0	0	116.6
345	S	34.3	Very low	55.6	Low	98 Å²	98	72 Å²	72	69%	0.685	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-21.6	-177	51.7	0	0	0	0	114.3	A343	A343-S345 PolarHBondContact O-N 2.83Å
346	D	34.9	Very low	54.7	Low	99 Å²	99	70.5 Å²	70.5	53%	0.529	46%	0.455	S	S	.	.	S	Bend	trans	-85.3	137.6	-179.9	-69.8	-25.3	0	0	0	110.9	P342	P342-D346 HydrophobicContact CB-CB 4.39Å; P342-D346 WeakPolarHBondContact CB-OD2 3.35Å; P342-D346 HydrophobicContact CG-CB 3.93Å; P342-D346 VanDerWaalsContact CG-OD2 3.32Å; P342-D346 WeakPolarHBondContact CG-OD2 3.49Å
347	P	34.9	Very low	53.9	Low	109 Å²	109	66.2 Å²	66.2	71%	0.708	43%	0.425	S	S	*	.			trans	-64.9	146.3	177.6	28	-34.7	0	0	0	110.6	S349	P347-S349 PolarHBondContact O-N 2.84Å
348	P	39.1	Very low	53.2	Low	123 Å²	123	69.2 Å²	69.2	80%	0.799	44%	0.439	S	S	*	.			trans	-67.9	98.9	-173.2	26.9	-34.9	0	0	0	111.8	Q350	P348-Q350 PolarHBondContact O-N 3.08Å
349	S	39.9	Very low	53.2	Low	96 Å²	96	70.5 Å²	70.5	67%	0.671	44%	0.439	S	S	*	.			trans	-57.2	125.9	160.3	47.7	0	0	0	0	108.6	P347 S351	P347-S349 PolarHBondContact O-N 2.84Å; S349-S351 PolarHBondContact O-N 3.45Å
350	Q	41.2	Very low	54.2	Low	202 Å²	202	68.8 Å²	68.8	94%	0.944	43%	0.429	S	S	*	.	S	Bend	trans	-73	-0.9	-163.7	-63.5	179.4	-2.9	0	0	114.5	P348	P348-Q350 PolarHBondContact O-N 3.08Å
351	S	49.8	Very low	55.9	Low	64 Å²	64	73 Å²	73	45%	0.448	45%	0.445	S	S	.	.	S	Bend	trans	-90.4	115.9	176.4	35.9	0	0	0	0	111.3	S349 S353	S349-S351 PolarHBondContact O-N 3.45Å; S351-S353 PolarHBondContact O-N 2.87Å
352	E	59.3	Low	58.5	Low	57 Å²	57	70.8 Å²	70.8	27%	0.266	42%	0.42	S	S	.	.			trans	-60.8	104.3	167.5	-74.8	-168.4	-161.5	0	0	109.7	S320 F354 H515	S320-E352 WeakPolarHBondContact CA-OE1 3.43Å; E352-F354 HydrophobicContact CB-CE1 4.14Å; E352-F354 HydrophobicContact CB-CE2 4.36Å; E352-F354 HydrophobicContact CB-CZ 3.78Å; E352-F354 WeakPolarHBondContact OE2-CE1 3.33Å; E352-F354 WeakPolarHBondContact OE2-CZ 3.3Å; E352-H515 PolarHBondContact O-ND1 2.99Å
353	S	63	Low	61.3	Low	35 Å²	35	68.3 Å²	68.3	25%	0.245	40%	0.401	C	S	.	.			trans	-74.3	130.5	171.4	56	0	0	0	0	110.2	R168 S351	R168-S353 PolarHBondContact NH2-O 3.43Å; S351-S353 PolarHBondContact O-N 2.87Å
354	F	71.6	Confident	64.2	Low	10 Å²	10	65.3 Å²	65.3	4%	0.044	38%	0.376	C	S	.	.			trans	-108	138.7	174.4	-57.8	-64.4	0	0	0	112.2	T318 E352 A478 A479 V482 H515 I517	T318-F354 HydrophobicContact CG2-CD1 4.45Å; T318-F354 HydrophobicContact CG2-CE1 3.73Å; E352-F354 HydrophobicContact CB-CE1 4.14Å; E352-F354 HydrophobicContact CB-CE2 4.36Å; E352-F354 HydrophobicContact CB-CZ 3.78Å; E352-F354 WeakPolarHBondContact OE2-CE1 3.33Å; E352-F354 WeakPolarHBondContact OE2-CZ 3.3Å; F354-A478 HydrophobicContact CD2-CB 4.15Å; F354-A478 HydrophobicContact CE2-CB 3.63Å; F354-A479 HydrophobicContact CE1-CB 4.22Å; F354-A479 HydrophobicContact CZ-CB 3.98Å; F354-V482 HydrophobicContact CB-CG1 4.48Å; F354-V482 HydrophobicContact CB-CG2 3.65Å; F354-V482 HydrophobicContact CD2-CG2 4.13Å; F354-V482 HydrophobicContact CG-CG2 3.88Å; F354-H515 HydrophobicContact CD2-CB 3.83Å; F354-H515 HydrophobicContact CE2-CB 3.94Å; F354-H515 AromaticContact CE2-CG 3.79Å; F354-H515 AromaticContact CE2-ND1 3.49Å; F354-H515 WeakPolarHBondContact CE2-ND1 3.48Å; F354-H515 PolarHBondContact N-O 3.33Å; F354-I517 HydrophobicContact CD2-CD1 4.11Å
355	A	68.4	Low	66.8	Low	15 Å²	15	58.6 Å²	58.6	12%	0.124	33%	0.332	C	S	.	.			trans	-87.2	147.4	166.9	0	0	0	0	0	110.4	L116 E118	L116-A355 HydrophobicContact CD2-CB 3.82Å; L116-A355 HydrophobicContact CG-CB 4.18Å; E118-A355 HydrophobicContact CG-CB 3.93Å; E118-A355 WeakPolarHBondContact OE1-CB 3.45Å
356	V	74.3	Confident	69.8	Low	2 Å²	2	54.3 Å²	54.3	1%	0.012	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	160.2	170	-64.5	0	0	0	0	110.6	Q115 L116 E118 L360 V482	Q115-V356 HydrophobicContact CG-CG2 3.99Å; L116-V356 PolarHBondContact O-N 2.89Å; E118-V356 PolarHBondContact N-O 3.26Å; V356-L360 HydrophobicContact CB-CD2 4.13Å; V356-V482 HydrophobicContact CG1-CG1 4.35Å; V356-V482 HydrophobicContact CG1-CG2 4.23Å
357	P	73.5	Confident	72.7	Confident	8 Å²	8	49.6 Å²	49.6	5%	0.052	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	141.8	-176.9	-22.7	33.6	0	0	0	112.8	Q170 E359 L360 A489	Q170-P357 VanDerWaalsContact OE1-CG 3.31Å; Q170-P357 VanDerWaalsContact OE1-N 3.16Å; P357-E359 VanDerWaalsContact C-N 3.28Å; P357-E359 PolarHBondContact O-N 3.13Å; P357-L360 HydrophobicContact CB-CB 4.14Å; P357-L360 HydrophobicContact CG-CB 4.42Å; P357-L360 WeakPolarHBondContact O-CB 3.45Å; P357-L360 PolarHBondContact O-N 3.48Å; P357-L360 VanDerWaalsContact O-N 3.08Å; P357-A489 HydrophobicContact CB-CB 3.77Å; P357-A489 WeakPolarHBondContact CB-O 3.33Å; P357-A489 HydrophobicContact CG-CB 4.02Å
358	E	74.7	Confident	75.5	Confident	72 Å²	72	44.6 Å²	44.6	34%	0.336	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-38.3	-178.2	-178.2	169.3	-149	0	0	113.4	K117 K119	K117-E358 HydrophobicContact CB-CB 4.22Å; K117-E358 HydrophobicContact CB-CG 4.35Å; K117-E358 HydrophobicContact CD-CG 4.19Å; K117-E358 PolarHBondContact NZ-O 3.42Å; K119-E358 WeakPolarHBondContact CE-OE1 3.32Å; K119-E358 WeakPolarHBondContact CG-OE2 3.45Å
359	E	83.3	Confident	78.1	Confident	79 Å²	79	39.5 Å²	39.5	37%	0.369	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	11.9	179.6	-65.5	-75.7	120.8	0	0	113.8	P357 R494 G495	P357-E359 VanDerWaalsContact C-N 3.28Å; P357-E359 PolarHBondContact O-N 3.13Å; E359-R494 HydrophobicContact CB-CG 4.19Å; E359-R494 WeakPolarHBondContact OE2-CG 3.46Å; E359-R494 IonicContact OE2-CZ 3.43Å; E359-R494 IonicContact OE2-NE 2.7Å; E359-R494 PolarHBondContact OE2-NE 3.41Å; E359-R494 IonicContact OE2-NH2 3.25Å; E359-R494 PolarHBondContact OE2-NH2 2.97Å; E359-G495 PolarHBondContact O-N 2.7Å
360	L	87.6	Confident	80.7	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.026	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.5	172.3	179.7	70	0	0	0	110.7	V356 P357 Q362 V485 T488 A489 G495	V356-L360 HydrophobicContact CB-CD2 4.13Å; P357-L360 HydrophobicContact CB-CB 4.14Å; P357-L360 HydrophobicContact CG-CB 4.42Å; P357-L360 WeakPolarHBondContact O-CB 3.45Å; P357-L360 PolarHBondContact O-N 3.48Å; P357-L360 VanDerWaalsContact O-N 3.08Å; L360-Q362 HydrophobicContact CD2-CG 3.74Å; L360-Q362 VanDerWaalsContact CD2-OE1 3.28Å; L360-Q362 HydrophobicContact CG-CG 3.81Å; L360-V485 HydrophobicContact CD1-CB 4.44Å; L360-V485 HydrophobicContact CD2-CB 3.83Å; L360-V485 HydrophobicContact CD2-CG2 3.57Å; L360-T488 HydrophobicContact CD1-CG2 3.55Å; L360-A489 HydrophobicContact CB-CB 3.79Å; L360-A489 HydrophobicContact CD1-CB 4.04Å; L360-G495 WeakPolarHBondContact CA-O 3.25Å
361	Q	91.1	Very high	83.2	Confident	113 Å²	113	25.5 Å²	25.5	53%	0.528	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	135.1	165.3	-57.6	-167.4	1.8	0	0	110.2	F363 G495 N496 S497	Q361-F363 HydrophobicContact CB-CD2 4.47Å; Q361-F363 HydrophobicContact CB-CE2 3.65Å; Q361-F363 HydrophobicContact CB-CZ 4.02Å; Q361-G495 PolarHBondContact N-O 3.34Å; Q361-N496 CarbonylContact O-C 3.55Å; Q361-N496 WeakPolarHBondContact O-CA 3.31Å; Q361-S497 PolarHBondContact O-N 2.8Å; Q361-S497 PolarHBondContact O-OG 3Å
362	Q	93.2	Very high	85.4	Confident	8 Å²	8	23 Å²	23	4%	0.037	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	117.9	-174.1	-54.2	-171.3	125.8	0	0	109.5	L360 S518 V519 S520	L360-Q362 HydrophobicContact CD2-CG 3.74Å; L360-Q362 VanDerWaalsContact CD2-OE1 3.28Å; L360-Q362 HydrophobicContact CG-CG 3.81Å; Q362-S518 PolarHBondContact NE2-O 3.01Å; Q362-V519 HydrophobicContact CB-CG1 4.1Å; Q362-S520 PolarHBondContact O-N 2.79Å
363	F	95.6	Very high	87.1	Confident	36 Å²	36	20.2 Å²	20.2	16%	0.158	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	152.7	-177.2	-59.2	-80.7	0	0	0	111.5	Q361 W468 N496 S497 L498 L499 S520 M522	Q361-F363 HydrophobicContact CB-CD2 4.47Å; Q361-F363 HydrophobicContact CB-CE2 3.65Å; Q361-F363 HydrophobicContact CB-CZ 4.02Å; F363-W468 AromaticContact CD2-CH2 3.94Å; F363-W468 HydrophobicContact CD2-CH2 3.94Å; F363-W468 AromaticContact CD2-CZ3 3.92Å; F363-W468 HydrophobicContact CD2-CZ3 3.92Å; F363-W468 HydrophobicContact CE2-CH2 4Å; F363-W468 HydrophobicContact CE2-CZ3 4.36Å; F363-N496 HydrophobicContact CE2-CB 4.44Å; F363-S497 WeakPolarHBondContact CA-O 3.21Å; F363-S497 WeakPolarHBondContact CB-O 3.43Å; F363-S497 WeakPolarHBondContact CD2-O 3.49Å; F363-S497 PolarHBondContact N-O 2.92Å; F363-L498 HydrophobicContact CB-CD1 3.73Å; F363-L498 CarbonylContact O-C 3.35Å; F363-L498 WeakPolarHBondContact O-CA 3.24Å; F363-L499 PolarHBondContact O-N 3.18Å; F363-S520 CarbonylContact C-O 3.36Å; F363-S520 VanDerWaalsContact CA-O 3.23Å; F363-S520 WeakPolarHBondContact CA-O 3.47Å; F363-M522 HydrophobicContact CB-CB 4.41Å; F363-M522 HydrophobicContact CB-CE 4.18Å; F363-M522 HydrophobicContact CD1-CE 4.05Å; F363-M522 HydrophobicContact CD2-CE 4.23Å; F363-M522 HydrophobicContact CG-CE 3.9Å
364	V	96.6	Very high	88.7	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	138.5	172.4	62.3	0	0	0	0	109.9	I108 L499 L501 I509 V519 S520 M522	I108-V364 HydrophobicContact CD1-CG1 3.95Å; V364-L499 WeakPolarHBondContact CA-O 3.12Å; V364-L499 HydrophobicContact CB-CB 4.41Å; V364-L499 HydrophobicContact CG2-CB 4.26Å; V364-L499 HydrophobicContact CG2-CD2 4.25Å; V364-L499 HydrophobicContact CG2-CG 4.37Å; V364-L501 HydrophobicContact CG2-CD1 3.7Å; V364-L501 HydrophobicContact CG2-CG 4.15Å; V364-I509 HydrophobicContact CG1-CD1 4Å; V364-I509 HydrophobicContact CG2-CD1 3.99Å; V364-I509 HydrophobicContact CG2-CG1 4.28Å; V364-V519 HydrophobicContact CB-CB 4.37Å; V364-V519 HydrophobicContact CB-CG2 4.1Å; V364-V519 HydrophobicContact CG1-CB 4.17Å; V364-V519 HydrophobicContact CG1-CG2 3.67Å; V364-S520 PolarHBondContact N-O 3.21Å; V364-M522 PolarHBondContact O-N 3.07Å
365	V	96.4	Very high	89.9	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	126.9	176.1	61.1	0	0	0	0	109.9	V367 L498 L499 F500 L501 M522 L524	V365-V367 HydrophobicContact CB-CG2 4.31Å; V365-V367 HydrophobicContact CG1-CG2 3.89Å; V365-V367 HydrophobicContact CG2-CG2 3.68Å; V365-L498 HydrophobicContact CB-CD1 4.04Å; V365-L498 HydrophobicContact CG1-CD1 3.77Å; V365-L498 HydrophobicContact CG1-CD2 4.29Å; V365-L498 HydrophobicContact CG1-CG 4.09Å; V365-L499 PolarHBondContact N-O 2.61Å; V365-F500 HydrophobicContact CG1-CD1 4.33Å; V365-F500 HydrophobicContact CG1-CD2 3.93Å; V365-F500 HydrophobicContact CG1-CE1 4.47Å; V365-F500 HydrophobicContact CG1-CE2 4.05Å; V365-F500 HydrophobicContact CG1-CG 4.06Å; V365-F500 HydrophobicContact CG1-CZ 4.32Å; V365-L501 PolarHBondContact O-N 3.29Å; V365-L501 VanDerWaalsContact O-N 3.1Å; V365-M522 WeakPolarHBondContact CG2-O 3.4Å; V365-L524 HydrophobicContact CG2-CB 4.46Å
366	L	96.4	Very high	91.3	Very high	7 Å²	7	17.4 Å²	17.4	4%	0.037	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	112.3	174.3	-61.4	-171	0	0	0	109.8	I105 P106 I108 L501 A506	I105-L366 HydrophobicContact CG2-CB 3.69Å; I105-L366 HydrophobicContact CG2-CD1 3.66Å; I105-L366 HydrophobicContact CG2-CG 4.25Å; P106-L366 HydrophobicContact CG-CD1 4.04Å; I108-L366 HydrophobicContact CD1-CD1 4.14Å; I108-L366 HydrophobicContact CD1-CG 4.09Å; I108-L366 HydrophobicContact CG1-CD1 3.71Å; I108-L366 HydrophobicContact CG1-CG 4.18Å; L366-L501 CarbonylContact C-O 3.5Å; L366-L501 WeakPolarHBondContact CA-O 3.39Å; L366-L501 HydrophobicContact CD2-CB 3.74Å; L366-L501 HydrophobicContact CD2-CD1 4.32Å; L366-A506 HydrophobicContact CD1-CB 4.21Å; L366-A506 HydrophobicContact CD2-CB 4.14Å
367	V	95.7	Very high	92.3	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.083	C	C	.	.			trans	-124.6	113.3	-173.8	-163.2	0	0	0	0	111.4	V365 S369 V371 R372 C375 F500 L501 T502 L524	V365-V367 HydrophobicContact CB-CG2 4.31Å; V365-V367 HydrophobicContact CG1-CG2 3.89Å; V365-V367 HydrophobicContact CG2-CG2 3.68Å; V367-S369 PolarHBondContact O-N 3.2Å; V367-V371 HydrophobicContact CG1-CB 4.06Å; V367-R372 HydrophobicContact CG1-CB 4.26Å; V367-C375 HydrophobicContact CG1-CB 3.82Å; V367-C375 HydrophobicContact CG2-CB 4.23Å; V367-F500 HydrophobicContact CG2-CD1 4.05Å; V367-F500 HydrophobicContact CG2-CE1 4.32Å; V367-L501 PolarHBondContact N-O 3.23Å; V367-T502 WeakPolarHBondContact O-CA 3.08Å; V367-L524 HydrophobicContact CG1-CD1 3.88Å; V367-L524 HydrophobicContact CG1-CD2 4.31Å; V367-L524 HydrophobicContact CG2-CD1 4.24Å
368	P	95.4	Very high	93.3	Very high	5 Å²	5	16.9 Å²	16.9	3%	0.032	8%	0.08	C	C	.	.			trans	-54.9	136.3	169.9	-26	35.6	0	0	0	111.5	N102 P103 I105 K370 V371 R372 P503	N102-P368 HydrophobicContact CB-CB 3.78Å; N102-P368 HydrophobicContact CB-CG 4.01Å; N102-P368 VanDerWaalsContact CG-CB 3.49Å; P103-P368 HydrophobicContact CG-CB 4.44Å; I105-P368 HydrophobicContact CG1-CG 4.48Å; P368-K370 PolarHBondContact O-N 2.82Å; P368-V371 PolarHBondContact O-N 2.81Å; P368-R372 PolarHBondContact O-N 2.75Å; P368-P503 HydrophobicContact CG-CG 4.26Å
369	S	93.6	Very high	94.3	Very high	15 Å²	15	13.5 Å²	13.5	11%	0.105	6%	0.064	C	C	.	.	H	α-helix	trans	-52.5	-37.9	-165.3	-37.7	0	0	0	0	114.1	V367 V371 R372 H612 S616	V367-S369 PolarHBondContact O-N 3.2Å; S369-V371 PolarHBondContact O-N 2.79Å; S369-R372 VanDerWaalsContact O-CB 3.29Å; S369-R372 WeakPolarHBondContact O-CB 3.47Å; S369-R372 PolarHBondContact O-N 3.15Å; S369-R372 VanDerWaalsContact O-N 3.15Å; S369-H612 CarbonylContact C-O 3.57Å; S369-S616 WeakPolarHBondContact O-CB 3.14Å
370	K	93.7	Very high	94.8	Very high	5 Å²	5	9.7 Å²	9.7	2%	0.022	5%	0.047	C	C	.	.	H	α-helix	trans	-58	-32.3	177.3	-71.5	-169.5	-74.8	-159.4	0	114.1	S97 L98 R100 N102 P368 H612 K615	S97-K370 WeakPolarHBondContact O-CD 3.44Å; S97-K370 WeakPolarHBondContact O-CE 3.46Å; S97-K370 PolarHBondContact O-NZ 2.68Å; L98-K370 HydrophobicContact CD1-CB 4.1Å; L98-K370 WeakPolarHBondContact CD1-O 3.3Å; R100-K370 PolarHBondContact O-NZ 3.33Å; N102-K370 WeakPolarHBondContact OD1-CE 3.31Å; P368-K370 PolarHBondContact O-N 2.82Å; K370-H612 WeakPolarHBondContact CD-CD2 3.29Å; K370-H612 WeakPolarHBondContact CE-NE2 3.32Å; K370-H612 HydrophobicContact CG-CB 3.77Å; K370-H612 PolarHBondContact NZ-NE2 3.4Å; K370-H612 VanDerWaalsContact NZ-NE2 3.1Å; K370-K615 HydrophobicContact CB-CD 4.2Å; K370-K615 HydrophobicContact CD-CD 3.98Å; K370-K615 HydrophobicContact CG-CB 4.17Å; K370-K615 HydrophobicContact CG-CD 3.99Å
371	V	94.3	Very high	95	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-96	-8.9	-176.6	-160.8	0	0	0	0	111.5	L98 F99 V367 P368 S369 L373 V374 C375 L524 L528	L98-V371 HydrophobicContact CD1-CB 4.42Å; L98-V371 HydrophobicContact CD1-CG2 3.97Å; L98-V371 HydrophobicContact CG-CG2 4.28Å; F99-V371 HydrophobicContact CD1-CG2 4.29Å; F99-V371 HydrophobicContact CE1-CG1 4.07Å; F99-V371 HydrophobicContact CE1-CG2 3.96Å; F99-V371 HydrophobicContact CZ-CG1 4.07Å; F99-V371 HydrophobicContact CZ-CG2 4.44Å; V367-V371 HydrophobicContact CG1-CB 4.06Å; P368-V371 PolarHBondContact O-N 2.81Å; S369-V371 PolarHBondContact O-N 2.79Å; V371-L373 VanDerWaalsContact C-N 3.31Å; V371-L373 PolarHBondContact O-N 2.89Å; V371-V374 HydrophobicContact CG1-CB 4.38Å; V371-V374 PolarHBondContact O-N 2.99Å; V371-C375 WeakPolarHBondContact O-CB 2.95Å; V371-C375 PolarHBondContact O-N 3.25Å; V371-L524 HydrophobicContact CG1-CD1 4.36Å; V371-L528 HydrophobicContact CG1-CD1 4.05Å
372	R	95.2	Very high	95	Very high	10 Å²	10	5.6 Å²	5.6	4%	0.038	3%	0.028	C	C	.	.	H	α-helix	trans	-56.8	-41.4	-172.4	-156.1	-174	177.6	107.2	-3.5	112.9	V367 P368 S369 C375 L376 Y472 F500 T502 E505	V367-R372 HydrophobicContact CG1-CB 4.26Å; P368-R372 PolarHBondContact O-N 2.75Å; S369-R372 VanDerWaalsContact O-CB 3.29Å; S369-R372 WeakPolarHBondContact O-CB 3.47Å; S369-R372 PolarHBondContact O-N 3.15Å; S369-R372 VanDerWaalsContact O-N 3.15Å; R372-C375 PolarHBondContact O-N 3.23Å; R372-L376 PolarHBondContact O-N 3.43Å; R372-Y472 HydrophobicContact CG-CE2 3.71Å; R372-Y472 PolarHBondContact NE-O 3.17Å; R372-Y472 PolarHBondContact NH2-O 3.09Å; R372-Y472 WeakPolarHBondContact O-CE2 3.48Å; R372-F500 HydrophobicContact CG-CD1 4.16Å; R372-F500 PolarHBondContact NH2-O 3.41Å; R372-T502 VanDerWaalsContact NH1-CG2 3.31Å; R372-E505 IonicContact NH1-OE2 2.74Å; R372-E505 PolarHBondContact NH1-OE2 3Å
373	L	95.9	Very high	94.8	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-67.1	-47.1	178.3	-172	67	0	0	0	112.2	V371 C375 L376 A377 L405 L408 F409 L567	V371-L373 VanDerWaalsContact C-N 3.31Å; V371-L373 PolarHBondContact O-N 2.89Å; L373-C375 VanDerWaalsContact C-N 3.33Å; L373-C375 PolarHBondContact O-N 3.3Å; L373-L376 PolarHBondContact O-N 2.69Å; L373-A377 PolarHBondContact O-N 2.98Å; L373-L405 HydrophobicContact CD1-CD2 3.64Å; L373-L408 HydrophobicContact CD1-CD2 4.21Å; L373-L408 HydrophobicContact CD2-CD2 4.17Å; L373-F409 HydrophobicContact CD1-CE1 4.02Å; L373-F409 HydrophobicContact CD1-CZ 3.88Å; L373-L567 HydrophobicContact CD2-CB 4.35Å; L373-L567 HydrophobicContact CD2-CD1 4.2Å; L373-L567 HydrophobicContact CG-CD1 4.17Å
374	V	95.9	Very high	94.3	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-60.2	-43.6	175.4	-164.9	0	0	0	0	111.1	L98 V371 L376 A377 A378 L528 L531 A560 L563 Q564	L98-V374 HydrophobicContact CD2-CG2 4.34Å; V371-V374 HydrophobicContact CG1-CB 4.38Å; V371-V374 PolarHBondContact O-N 2.99Å; V374-L376 VanDerWaalsContact C-N 3.31Å; V374-L376 PolarHBondContact O-N 3.39Å; V374-A377 PolarHBondContact O-N 3.49Å; V374-A378 VanDerWaalsContact O-CB 3.24Å; V374-A378 WeakPolarHBondContact O-CB 3.29Å; V374-A378 PolarHBondContact O-N 3.5Å; V374-L528 HydrophobicContact CB-CD2 4.48Å; V374-L528 HydrophobicContact CG1-CD2 3.96Å; V374-L531 HydrophobicContact CG1-CD1 4.33Å; V374-A560 HydrophobicContact CG1-CB 3.98Å; V374-A560 WeakPolarHBondContact CG1-O 3.38Å; V374-L563 HydrophobicContact CG1-CB 4.26Å; V374-L563 HydrophobicContact CG1-CD2 3.97Å; V374-L563 HydrophobicContact CG1-CG 4.18Å; V374-Q564 HydrophobicContact CG2-CB 3.66Å; V374-Q564 HydrophobicContact CG2-CG 4.23Å
375	C	97.1	Very high	93.5	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-63.4	-36.7	-178.7	-172.1	0	0	0	0	112	V367 V371 R372 L373 F379 F500 L524	V367-C375 HydrophobicContact CG1-CB 3.82Å; V367-C375 HydrophobicContact CG2-CB 4.23Å; V371-C375 WeakPolarHBondContact O-CB 2.95Å; V371-C375 PolarHBondContact O-N 3.25Å; R372-C375 PolarHBondContact O-N 3.23Å; L373-C375 VanDerWaalsContact C-N 3.33Å; L373-C375 PolarHBondContact O-N 3.3Å; C375-F379 VanDerWaalsContact O-CB 3.25Å; C375-F379 WeakPolarHBondContact O-CB 3.43Å; C375-F379 PolarHBondContact O-N 3.35Å; C375-F500 HydrophobicContact CB-CE1 3.95Å; C375-L524 HydrophobicContact CB-CD1 3.93Å; C375-L524 VanDerWaalsContact SG-CD1 3.56Å
376	L	97.3	Very high	92.7	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-68.7	-44.7	172.9	179.1	62.6	0	0	0	111.6	R372 L373 V374 F379 I380 V394 F409 V470 Y472 F500	R372-L376 PolarHBondContact O-N 3.43Å; L373-L376 PolarHBondContact O-N 2.69Å; V374-L376 VanDerWaalsContact C-N 3.31Å; V374-L376 PolarHBondContact O-N 3.39Å; L376-F379 PolarHBondContact O-N 3.15Å; L376-I380 HydrophobicContact CD1-CD1 3.88Å; L376-I380 HydrophobicContact CD1-CG1 4.27Å; L376-I380 HydrophobicContact CG-CD1 3.86Å; L376-I380 WeakPolarHBondContact O-CB 3.26Å; L376-I380 VanDerWaalsContact O-CG1 3.31Å; L376-I380 WeakPolarHBondContact O-CG1 3.21Å; L376-I380 PolarHBondContact O-N 2.88Å; L376-V394 HydrophobicContact CD1-CG1 4.09Å; L376-V394 HydrophobicContact CD2-CG1 4.28Å; L376-F409 HydrophobicContact CB-CZ 4.45Å; L376-F409 HydrophobicContact CD2-CE2 3.57Å; L376-F409 HydrophobicContact CD2-CZ 3.86Å; L376-F409 HydrophobicContact CG-CE2 3.97Å; L376-F409 HydrophobicContact CG-CZ 4.1Å; L376-V470 HydrophobicContact CD1-CG1 3.88Å; L376-Y472 HydrophobicContact CB-CD2 3.91Å; L376-Y472 HydrophobicContact CB-CE2 3.66Å; L376-Y472 HydrophobicContact CD1-CD2 4.14Å; L376-Y472 HydrophobicContact CD2-CD1 3.99Å; L376-Y472 HydrophobicContact CD2-CD2 3.6Å; L376-Y472 HydrophobicContact CD2-CE1 4.13Å; L376-Y472 HydrophobicContact CD2-CE2 3.73Å; L376-Y472 HydrophobicContact CD2-CG 3.72Å; L376-Y472 HydrophobicContact CG-CD2 4.09Å; L376-Y472 HydrophobicContact CG-CE2 4.22Å; L376-F500 HydrophobicContact CB-CE1 4.16Å; L376-F500 HydrophobicContact CB-CZ 4.24Å; L376-F500 HydrophobicContact CD1-CZ 4.31Å
377	A	95.8	Very high	91.7	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-62.6	-45.6	178.1	0	0	0	0	0	112.2	L373 V374 I380 L381 F409 L413 L563 L567	L373-A377 PolarHBondContact O-N 2.98Å; V374-A377 PolarHBondContact O-N 3.49Å; A377-I380 PolarHBondContact O-N 3.08Å; A377-L381 WeakPolarHBondContact O-CB 3.44Å; A377-L381 VanDerWaalsContact O-CG 3.28Å; A377-L381 WeakPolarHBondContact O-CG 3.42Å; A377-L381 PolarHBondContact O-N 2.86Å; A377-F409 HydrophobicContact CB-CE1 3.97Å; A377-F409 HydrophobicContact CB-CZ 4.41Å; A377-L413 HydrophobicContact CB-CD1 3.99Å; A377-L413 HydrophobicContact CB-CD2 4.09Å; A377-L563 HydrophobicContact CB-CD2 3.97Å; A377-L567 HydrophobicContact CB-CD1 4.46Å
378	A	94.9	Very high	90.3	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.4	-44.8	174.9	0	0	0	0	0	111.6	V374 I380 L381 E382 L528 C530 L531	V374-A378 VanDerWaalsContact O-CB 3.24Å; V374-A378 WeakPolarHBondContact O-CB 3.29Å; V374-A378 PolarHBondContact O-N 3.5Å; A378-I380 PolarHBondContact O-N 3.19Å; A378-L381 PolarHBondContact O-N 3.04Å; A378-E382 WeakPolarHBondContact O-CB 3.34Å; A378-E382 PolarHBondContact O-N 3.04Å; A378-L528 HydrophobicContact CB-CD2 3.99Å; A378-C530 PolarHBondContact O-SG 3Å; A378-L531 HydrophobicContact CB-CD1 4.29Å; A378-L531 HydrophobicContact CB-CD2 3.98Å; A378-L531 HydrophobicContact CB-CG 4.09Å
379	F	95.6	Very high	89.4	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.4	-43.1	176.1	-174.7	-96.9	0	0	0	112.7	C375 L376 E382 Q383 W468 V470 L498 M522 V527	C375-F379 VanDerWaalsContact O-CB 3.25Å; C375-F379 WeakPolarHBondContact O-CB 3.43Å; C375-F379 PolarHBondContact O-N 3.35Å; L376-F379 PolarHBondContact O-N 3.15Å; F379-E382 PolarHBondContact O-N 2.69Å; F379-Q383 HydrophobicContact CD1-CG 4.31Å; F379-Q383 HydrophobicContact CD2-CG 4.37Å; F379-Q383 HydrophobicContact CE1-CG 3.79Å; F379-Q383 HydrophobicContact CE2-CG 3.86Å; F379-Q383 HydrophobicContact CZ-CG 3.54Å; F379-Q383 WeakPolarHBondContact O-CG 3.38Å; F379-Q383 PolarHBondContact O-N 2.71Å; F379-W468 HydrophobicContact CE1-CD2 4.27Å; F379-W468 HydrophobicContact CE1-CE3 4.26Å; F379-W468 HydrophobicContact CE1-CG 4.5Å; F379-W468 HydrophobicContact CE2-CH2 4.23Å; F379-W468 HydrophobicContact CE2-CZ2 4.43Å; F379-W468 HydrophobicContact CE2-CZ3 4.26Å; F379-W468 AromaticContact CZ-CD2 3.64Å; F379-W468 HydrophobicContact CZ-CD2 3.64Å; F379-W468 AromaticContact CZ-CE2 3.91Å; F379-W468 AromaticContact CZ-CE3 3.54Å; F379-W468 HydrophobicContact CZ-CE3 3.54Å; F379-W468 HydrophobicContact CZ-CG 4.28Å; F379-W468 AromaticContact CZ-CH2 3.98Å; F379-W468 HydrophobicContact CZ-CH2 3.98Å; F379-W468 HydrophobicContact CZ-CZ2 4.08Å; F379-W468 AromaticContact CZ-CZ3 3.71Å; F379-W468 HydrophobicContact CZ-CZ3 3.71Å; F379-V470 HydrophobicContact CD1-CG2 3.77Å; F379-V470 HydrophobicContact CE1-CG2 3.45Å; F379-V470 VanDerWaalsContact CE1-CG2 3.45Å; F379-V470 HydrophobicContact CZ-CG2 4.46Å; F379-L498 HydrophobicContact CD1-CD2 4.23Å; F379-L498 HydrophobicContact CD2-CD2 3.52Å; F379-L498 HydrophobicContact CE1-CD2 4.18Å; F379-L498 HydrophobicContact CE2-CD2 3.45Å; F379-L498 VanDerWaalsContact CE2-CD2 3.45Å; F379-L498 HydrophobicContact CG-CD2 3.92Å; F379-L498 HydrophobicContact CZ-CD2 3.8Å; F379-M522 HydrophobicContact CE2-SD 4.41Å; F379-V527 HydrophobicContact CB-CG1 3.87Å; F379-V527 HydrophobicContact CD2-CG1 4.22Å
380	I	94.1	Very high	89.1	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.4	-43.9	176.1	-71.8	166.5	0	0	0	111.1	L376 A377 A378 E382 Q383 C384 F409 L413 F424 V450	L376-I380 HydrophobicContact CD1-CD1 3.88Å; L376-I380 HydrophobicContact CD1-CG1 4.27Å; L376-I380 HydrophobicContact CG-CD1 3.86Å; L376-I380 WeakPolarHBondContact O-CB 3.26Å; L376-I380 VanDerWaalsContact O-CG1 3.31Å; L376-I380 WeakPolarHBondContact O-CG1 3.21Å; L376-I380 PolarHBondContact O-N 2.88Å; A377-I380 PolarHBondContact O-N 3.08Å; A378-I380 PolarHBondContact O-N 3.19Å; I380-E382 VanDerWaalsContact C-N 3.35Å; I380-Q383 PolarHBondContact O-N 3.16Å; I380-C384 WeakPolarHBondContact O-CB 3.39Å; I380-C384 PolarHBondContact O-N 3.04Å; I380-F409 HydrophobicContact CD1-CD2 4.22Å; I380-F409 HydrophobicContact CD1-CE2 4.12Å; I380-L413 HydrophobicContact CG2-CD1 4.49Å; I380-F424 HydrophobicContact CD1-CE1 4.41Å; I380-F424 HydrophobicContact CG2-CE1 4.11Å; I380-F424 HydrophobicContact CG2-CZ 3.96Å; I380-V450 HydrophobicContact CD1-CG1 4.27Å; I380-V450 HydrophobicContact CG2-CG2 3.85Å
381	L	91.1	Very high	89	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.6	-42.8	174.5	-72.2	166.6	0	0	0	111.2	A377 A378 K385 F386 L413 L422 L531 F537 L563	A377-L381 WeakPolarHBondContact O-CB 3.44Å; A377-L381 VanDerWaalsContact O-CG 3.28Å; A377-L381 WeakPolarHBondContact O-CG 3.42Å; A377-L381 PolarHBondContact O-N 2.86Å; A378-L381 PolarHBondContact O-N 3.04Å; L381-K385 HydrophobicContact CD2-CD 4.11Å; L381-K385 WeakPolarHBondContact O-CA 3.37Å; L381-K385 VanDerWaalsContact O-CB 3.25Å; L381-K385 WeakPolarHBondContact O-CB 3.46Å; L381-K385 PolarHBondContact O-N 3.18Å; L381-F386 HydrophobicContact CB-CD2 4.28Å; L381-F386 HydrophobicContact CB-CE2 3.85Å; L381-F386 WeakPolarHBondContact O-CD2 3.28Å; L381-F386 PolarHBondContact O-N 3.22Å; L381-L413 HydrophobicContact CD1-CD2 4.41Å; L381-L422 HydrophobicContact CD2-CD1 4.12Å; L381-L531 HydrophobicContact CD1-CD2 4.1Å; L381-F537 HydrophobicContact CD1-CE2 3.84Å; L381-F537 HydrophobicContact CD1-CZ 3.64Å; L381-L563 HydrophobicContact CD1-CD2 4.26Å
382	E	90.7	Very high	89	Confident	32 Å²	32	22.2 Å²	22.2	15%	0.15	12%	0.115	C	C	.	.	H	α-helix	trans	-59.8	-51.2	176.8	-175.9	155.7	-113.9	0	0	112.5	A378 F379 I380 F386 S387 C530 K533	A378-E382 WeakPolarHBondContact O-CB 3.34Å; A378-E382 PolarHBondContact O-N 3.04Å; F379-E382 PolarHBondContact O-N 2.69Å; I380-E382 VanDerWaalsContact C-N 3.35Å; E382-F386 CarbonylContact O-C 3.51Å; E382-F386 PolarHBondContact O-N 3.27Å; E382-S387 WeakPolarHBondContact O-CB 3.22Å; E382-S387 PolarHBondContact O-N 2.94Å; E382-S387 PolarHBondContact O-OG 3.26Å; E382-C530 HydrophobicContact CB-CB 3.68Å; E382-C530 HydrophobicContact CG-CB 4.03Å; E382-C530 WeakPolarHBondContact OE1-CB 3.43Å; E382-K533 IonicContact OE1-NZ 3.13Å; E382-K533 PolarHBondContact OE1-NZ 2.83Å
383	Q	90	Very high	89	Confident	25 Å²	25	21.8 Å²	21.8	12%	0.117	11%	0.113	C	C	.	.	H	α-helix	trans	-79.5	-33.6	-171.9	-61.8	-53.8	-41.5	0	0	112.6	F379 I380 H388 N390 I392 W468	F379-Q383 HydrophobicContact CD1-CG 4.31Å; F379-Q383 HydrophobicContact CD2-CG 4.37Å; F379-Q383 HydrophobicContact CE1-CG 3.79Å; F379-Q383 HydrophobicContact CE2-CG 3.86Å; F379-Q383 HydrophobicContact CZ-CG 3.54Å; F379-Q383 WeakPolarHBondContact O-CG 3.38Å; F379-Q383 PolarHBondContact O-N 2.71Å; I380-Q383 PolarHBondContact O-N 3.16Å; Q383-H388 VanDerWaalsContact O-O 3.12Å; Q383-N390 HydrophobicContact CB-CB 4.19Å; Q383-N390 VanDerWaalsContact O-CB 3.3Å; Q383-N390 WeakPolarHBondContact O-CB 3.27Å; Q383-N390 PolarHBondContact O-N 2.94Å; Q383-N390 PolarHBondContact O-ND2 3.42Å; Q383-N390 PolarHBondContact OE1-ND2 2.88Å; Q383-I392 HydrophobicContact CB-CD1 3.68Å; Q383-W468 VanDerWaalsContact CD-NE1 3.33Å
384	C	84.8	Confident	89	Confident	8 Å²	8	21.8 Å²	21.8	5%	0.054	11%	0.113	C	C	.	.	H	α-helix	trans	-99.5	-23.6	-177.9	-69.1	0	0	0	0	115.5	I380 N390 I392 L422	I380-C384 WeakPolarHBondContact O-CB 3.39Å; I380-C384 PolarHBondContact O-N 3.04Å; C384-N390 PolarHBondContact SG-O 3.29Å; C384-N390 VanDerWaalsContact SG-O 3.38Å; C384-I392 WeakPolarHBondContact SG-CD1 3.45Å; C384-L422 HydrophobicContact CB-CD2 3.38Å
385	K	79.9	Confident	89.1	Confident	46 Å²	46	21.8 Å²	21.8	20%	0.2	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-44.1	-179.5	-176.9	-163.5	174.1	170.5	0	113.1	L381 H416 T417 D534	L381-K385 HydrophobicContact CD2-CD 4.11Å; L381-K385 WeakPolarHBondContact O-CA 3.37Å; L381-K385 VanDerWaalsContact O-CB 3.25Å; L381-K385 WeakPolarHBondContact O-CB 3.46Å; L381-K385 PolarHBondContact O-N 3.18Å; K385-H416 PolarHBondContact NZ-O 3.45Å; K385-T417 HydrophobicContact CD-CG2 3.81Å; K385-T417 HydrophobicContact CG-CG2 4.11Å; K385-D534 IonicContact NZ-OD2 2.78Å; K385-D534 PolarHBondContact NZ-OD2 3.25Å
386	F	78.9	Confident	89	Confident	46 Å²	46	21.9 Å²	21.9	20%	0.202	11%	0.114	C	C	.	.	S	Bend	trans	-96.9	1.2	-174.2	-52.9	-51.6	0	0	0	114.6	L381 E382 C530 K533 D534	L381-F386 HydrophobicContact CB-CD2 4.28Å; L381-F386 HydrophobicContact CB-CE2 3.85Å; L381-F386 WeakPolarHBondContact O-CD2 3.28Å; L381-F386 PolarHBondContact O-N 3.22Å; E382-F386 CarbonylContact O-C 3.51Å; E382-F386 PolarHBondContact O-N 3.27Å; F386-C530 HydrophobicContact CD2-CB 4.07Å; F386-C530 HydrophobicContact CE2-CB 4.43Å; F386-C530 WeakPolarHBondContact CE2-O 3.38Å; F386-K533 HydrophobicContact CB-CD 3.71Å; F386-K533 HydrophobicContact CD1-CB 3.96Å; F386-K533 HydrophobicContact CD1-CD 4.4Å; F386-K533 HydrophobicContact CD2-CB 4.35Å; F386-K533 HydrophobicContact CD2-CD 4.03Å; F386-K533 HydrophobicContact CE1-CB 4.01Å; F386-K533 HydrophobicContact CE2-CB 4.42Å; F386-K533 HydrophobicContact CG-CB 4.15Å; F386-K533 HydrophobicContact CG-CD 3.82Å; F386-K533 HydrophobicContact CZ-CB 4.27Å; F386-D534 HydrophobicContact CE1-CB 3.91Å; F386-D534 HydrophobicContact CZ-CB 3.59Å
387	S	75.3	Confident	88.7	Confident	43 Å²	43	23.4 Å²	23.4	30%	0.301	12%	0.124	S	C	.	.	S	Bend	trans	-132.1	175.3	177.6	-52.5	0	0	0	0	109.5	E382 S389	E382-S387 WeakPolarHBondContact O-CB 3.22Å; E382-S387 PolarHBondContact O-N 2.94Å; E382-S387 PolarHBondContact O-OG 3.26Å; S387-S389 PolarHBondContact O-N 2.88Å
388	H	66.8	Low	88.7	Confident	175 Å²	175	24 Å²	24	81%	0.81	13%	0.128	S	C	*	.	S	Bend	trans	-48.5	133.4	170.1	-54	-70.1	0	0	0	110.5	Q383 N390	Q383-H388 VanDerWaalsContact O-O 3.12Å; H388-N390 PolarHBondContact O-N 3.1Å; H388-N390 PolarHBondContact O-ND2 2.93Å
389	S	77.4	Confident	88.7	Confident	60 Å²	60	24.8 Å²	24.8	42%	0.42	13%	0.133	S	C	.	.			trans	-56	95.3	-169.6	-54.2	0	0	0	0	112.8	S387 Q420 A448	S387-S389 PolarHBondContact O-N 2.88Å; S389-Q420 PolarHBondContact OG-NE2 3.43Å; S389-Q420 VanDerWaalsContact OG-NE2 3.1Å; S389-A448 VanDerWaalsContact O-CB 3.29Å; S389-A448 WeakPolarHBondContact O-CB 3.47Å
390	N	85.9	Confident	88.7	Confident	21 Å²	21	28.3 Å²	28.3	11%	0.112	15%	0.15	C	C	.	.			trans	-81.3	158.7	-171.6	-84.6	-71.4	0	0	0	113.3	Q383 C384 H388 I392 A448 G449 T467	Q383-N390 HydrophobicContact CB-CB 4.19Å; Q383-N390 VanDerWaalsContact O-CB 3.3Å; Q383-N390 WeakPolarHBondContact O-CB 3.27Å; Q383-N390 PolarHBondContact O-N 2.94Å; Q383-N390 PolarHBondContact O-ND2 3.42Å; Q383-N390 PolarHBondContact OE1-ND2 2.88Å; C384-N390 PolarHBondContact SG-O 3.29Å; C384-N390 VanDerWaalsContact SG-O 3.38Å; H388-N390 PolarHBondContact O-N 3.1Å; H388-N390 PolarHBondContact O-ND2 2.93Å; N390-I392 HydrophobicContact CB-CG1 4.16Å; N390-A448 WeakPolarHBondContact O-CA 3.37Å; N390-G449 PolarHBondContact O-N 2.97Å; N390-T467 WeakPolarHBondContact CB-OG1 3.15Å; N390-T467 VanDerWaalsContact OD1-CB 3.24Å; N390-T467 WeakPolarHBondContact OD1-CB 3.43Å; N390-T467 PolarHBondContact OD1-OG1 3.45Å
391	K	91.5	Very high	88.8	Confident	1 Å²	1	28.3 Å²	28.3	0%	0.004	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	106	175.4	-172	172.7	-175.7	170	0	109.1	F443 S444 S446 G449 P464 V466 T467 W468	K391-F443 HydrophobicContact CD-CZ 4.36Å; K391-F443 WeakPolarHBondContact CE-O 3.36Å; K391-F443 HydrophobicContact CG-CE1 4.3Å; K391-F443 HydrophobicContact CG-CE2 3.76Å; K391-F443 HydrophobicContact CG-CZ 3.54Å; K391-F443 PolarHBondContact NZ-O 2.97Å; K391-S444 PolarHBondContact NZ-O 2.72Å; K391-S444 VanDerWaalsContact NZ-O 3.15Å; K391-S446 WeakPolarHBondContact CD-O 3.34Å; K391-S446 VanDerWaalsContact CE-O 3.26Å; K391-S446 WeakPolarHBondContact CE-O 3.14Å; K391-S446 PolarHBondContact NZ-O 3.06Å; K391-G449 WeakPolarHBondContact CA-O 3.44Å; K391-P464 WeakPolarHBondContact CE-O 3.4Å; K391-P464 PolarHBondContact NZ-O 2.69Å; K391-V466 HydrophobicContact CD-CG2 4.29Å; K391-V466 HydrophobicContact CG-CG2 4.25Å; K391-V466 WeakPolarHBondContact O-CG1 3.26Å; K391-T467 PolarHBondContact N-OG1 3.02Å; K391-T467 PolarHBondContact O-N 2.73Å; K391-T467 PolarHBondContact O-OG1 3.16Å; K391-W468 PolarHBondContact O-N 2.85Å
392	I	93.9	Very high	89.1	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.7	-167.4	-47.1	-172.6	0	0	0	110.2	Q383 C384 N390 V394 F443 G449 V450 L451 W468 V470	Q383-I392 HydrophobicContact CB-CD1 3.68Å; C384-I392 WeakPolarHBondContact SG-CD1 3.45Å; N390-I392 HydrophobicContact CB-CG1 4.16Å; I392-V394 HydrophobicContact CG2-CG2 4.08Å; I392-F443 WeakPolarHBondContact O-CZ 3.3Å; I392-G449 PolarHBondContact N-O 2.86Å; I392-V450 HydrophobicContact CB-CG2 4.43Å; I392-V450 WeakPolarHBondContact O-CA 3.48Å; I392-L451 PolarHBondContact O-N 3.36Å; I392-W468 WeakPolarHBondContact CA-O 3.18Å; I392-W468 HydrophobicContact CB-CB 4.42Å; I392-W468 HydrophobicContact CG1-CB 4.14Å; I392-W468 HydrophobicContact CG2-CB 4.04Å; I392-V470 HydrophobicContact CG2-CG2 3.87Å
393	I	95.4	Very high	89.4	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.7	163.1	-60.5	177.5	0	0	0	108.5	F395 F443 L451 C453 L463 V466 W468 I469 V470 R487	I393-F395 HydrophobicContact CG2-CD2 4.13Å; I393-F395 HydrophobicContact CG2-CE1 4.48Å; I393-F395 HydrophobicContact CG2-CE2 3.7Å; I393-F395 HydrophobicContact CG2-CZ 3.89Å; I393-F443 HydrophobicContact CD1-CE1 4.15Å; I393-F443 HydrophobicContact CG1-CE1 3.76Å; I393-F443 HydrophobicContact CG1-CZ 4Å; I393-L451 CarbonylContact C-O 3.55Å; I393-L451 WeakPolarHBondContact CA-O 3.24Å; I393-L451 HydrophobicContact CG1-CB 4.36Å; I393-L451 HydrophobicContact CG1-CD2 4.45Å; I393-C453 WeakPolarHBondContact CG2-SG 3.46Å; I393-L463 HydrophobicContact CD1-CB 4.48Å; I393-L463 HydrophobicContact CD1-CD1 3.58Å; I393-V466 HydrophobicContact CD1-CB 4.47Å; I393-V466 HydrophobicContact CD1-CG1 3.93Å; I393-V466 HydrophobicContact CD1-CG2 3.82Å; I393-V466 HydrophobicContact CG1-CG1 3.83Å; I393-V466 HydrophobicContact CG1-CG2 4.16Å; I393-W468 PolarHBondContact N-O 3.44Å; I393-I469 HydrophobicContact CB-CD1 3.84Å; I393-I469 HydrophobicContact CD1-CD1 4.05Å; I393-I469 HydrophobicContact CG1-CD1 4.23Å; I393-V470 PolarHBondContact O-N 2.88Å; I393-R487 HydrophobicContact CD1-CB 4.1Å; I393-R487 HydrophobicContact CD1-CG 4.42Å
394	V	96.9	Very high	89.7	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	114.6	175.4	-170.3	0	0	0	0	109.3	L376 I392 V396 V450 L451 L452 C453 V470	L376-V394 HydrophobicContact CD1-CG1 4.09Å; L376-V394 HydrophobicContact CD2-CG1 4.28Å; I392-V394 HydrophobicContact CG2-CG2 4.08Å; V394-V396 HydrophobicContact CG1-CG2 4.1Å; V394-V450 HydrophobicContact CG2-CG1 3.84Å; V394-L451 PolarHBondContact N-O 3.07Å; V394-L452 HydrophobicContact CB-CD2 3.63Å; V394-L452 HydrophobicContact CG1-CD2 4.26Å; V394-L452 HydrophobicContact CG2-CD2 3.69Å; V394-C453 PolarHBondContact O-N 3.24Å; V394-C453 PolarHBondContact O-SG 3.06Å; V394-V470 CarbonylContact C-O 3.54Å; V394-V470 WeakPolarHBondContact CA-O 3.47Å; V394-V470 HydrophobicContact CB-CB 4.44Å; V394-V470 HydrophobicContact CG1-CB 4.21Å; V394-V470 HydrophobicContact CG1-CG1 4.19Å; V394-V470 HydrophobicContact CG2-CB 4.19Å
395	F	96.7	Very high	90.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	125.9	175.1	-73.6	-75.9	0	0	0	111.3	I393 C453 A457 A458 I469 V470 Y472 T473 R484 R487	I393-F395 HydrophobicContact CG2-CD2 4.13Å; I393-F395 HydrophobicContact CG2-CE1 4.48Å; I393-F395 HydrophobicContact CG2-CE2 3.7Å; I393-F395 HydrophobicContact CG2-CZ 3.89Å; F395-C453 WeakPolarHBondContact CA-O 3.44Å; F395-C453 VanDerWaalsContact CD1-SG 3.59Å; F395-C453 VanDerWaalsContact CE1-SG 3.55Å; F395-A457 HydrophobicContact CE1-CB 4.09Å; F395-A457 HydrophobicContact CZ-CB 4.5Å; F395-A458 HydrophobicContact CD1-CB 4.46Å; F395-A458 HydrophobicContact CE1-CB 3.69Å; F395-A458 HydrophobicContact CZ-CB 4.05Å; F395-I469 HydrophobicContact CD2-CG2 3.81Å; F395-I469 HydrophobicContact CE2-CG2 3.76Å; F395-V470 PolarHBondContact N-O 3.34Å; F395-Y472 PolarHBondContact O-N 3.32Å; F395-T473 PolarHBondContact O-N 3.37Å; F395-T473 VanDerWaalsContact O-N 3.12Å; F395-R484 HydrophobicContact CD1-CG 4.13Å; F395-R484 HydrophobicContact CD2-CB 3.97Å; F395-R484 HydrophobicContact CD2-CG 3.85Å; F395-R484 HydrophobicContact CE1-CG 4.16Å; F395-R484 HydrophobicContact CE2-CB 3.8Å; F395-R484 HydrophobicContact CE2-CG 3.86Å; F395-R484 HydrophobicContact CG-CG 3.99Å; F395-R484 HydrophobicContact CZ-CB 4.32Å; F395-R484 HydrophobicContact CZ-CG 4.03Å; F395-R487 HydrophobicContact CE2-CG 4.37Å; F395-R487 HydrophobicContact CZ-CG 4.06Å
396	V	95.9	Very high	91.1	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.018	15%	0.148	C	C	.	.			trans	-134.2	142.4	-176.4	-169	0	0	0	0	108.7	V394 S398 A401 V402 L405 C453 T454 Y472	V394-V396 HydrophobicContact CG1-CG2 4.1Å; V396-S398 VanDerWaalsContact C-N 3.32Å; V396-S398 PolarHBondContact O-N 3.16Å; V396-A401 HydrophobicContact CG1-CB 3.62Å; V396-V402 HydrophobicContact CB-CG2 3.91Å; V396-V402 HydrophobicContact CG2-CG2 4.38Å; V396-L405 HydrophobicContact CG1-CD1 4.19Å; V396-L405 HydrophobicContact CG2-CD1 4.07Å; V396-C453 PolarHBondContact N-O 3.21Å; V396-T454 WeakPolarHBondContact O-CA 3.45Å; V396-Y472 HydrophobicContact CG2-CD1 4.38Å
397	S	92	Very high	91.8	Very high	31 Å²	31	28.8 Å²	28.8	22%	0.217	16%	0.155	C	C	.	.	S	Bend	trans	-70.6	-10.4	-167.5	58.6	0	0	0	0	117.7	T473	S397-T473 PolarHBondContact N-OG1 2.73Å
398	S	94.3	Very high	92.8	Very high	12 Å²	12	26.8 Å²	26.8	8%	0.084	14%	0.141	C	C	.	.			trans	-152.7	151.6	-172.2	56.2	0	0	0	0	113.9	V396 E400 A401 V402 S587	V396-S398 VanDerWaalsContact C-N 3.32Å; V396-S398 PolarHBondContact O-N 3.16Å; S398-E400 VanDerWaalsContact C-N 3.32Å; S398-E400 PolarHBondContact O-N 3.04Å; S398-A401 PolarHBondContact O-N 3.07Å; S398-A401 VanDerWaalsContact OG-CB 3.25Å; S398-A401 WeakPolarHBondContact OG-CB 3.36Å; S398-V402 WeakPolarHBondContact O-CG2 3.15Å; S398-V402 PolarHBondContact O-N 2.87Å; S398-S587 WeakPolarHBondContact CB-OG 3.47Å; S398-S587 WeakPolarHBondContact OG-CB 3.35Å; S398-S587 PolarHBondContact OG-OG 2.98Å
399	C	95.3	Very high	94.1	Very high	17 Å²	17	18.5 Å²	18.5	12%	0.115	10%	0.102	C	C	.	.	H	α-helix	trans	-57.1	-44.5	178	-67.3	0	0	0	0	111.9	A401 V402 E403 H428 N430	C399-A401 VanDerWaalsContact C-N 3.32Å; C399-A401 PolarHBondContact O-N 3.26Å; C399-V402 PolarHBondContact O-N 3.44Å; C399-E403 WeakPolarHBondContact O-CG 3.5Å; C399-E403 PolarHBondContact O-N 3.4Å; C399-H428 WeakPolarHBondContact CB-ND1 3.47Å; C399-H428 PolarHBondContact SG-ND1 3.45Å; C399-H428 VanDerWaalsContact SG-ND1 3.35Å; C399-N430 WeakPolarHBondContact CB-ND2 3.42Å; C399-N430 VanDerWaalsContact SG-CG 3.54Å; C399-N430 PolarHBondContact SG-OD1 3.18Å
400	E	96.4	Very high	94.8	Very high	74 Å²	74	17 Å²	17	35%	0.346	10%	0.096	S	C	.	.	H	α-helix	trans	-70.2	-30.1	-176	-58.5	65.5	-143.1	0	0	111.8	S398 F404 S587	S398-E400 VanDerWaalsContact C-N 3.32Å; S398-E400 PolarHBondContact O-N 3.04Å; E400-F404 VanDerWaalsContact O-CB 3.25Å; E400-F404 WeakPolarHBondContact O-CB 3.34Å; E400-F404 PolarHBondContact O-N 2.85Å; E400-S587 VanDerWaalsContact OE2-CB 3.3Å; E400-S587 WeakPolarHBondContact OE2-CB 3.45Å
401	A	96.4	Very high	95	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.008	10%	0.104	C	C	.	.	H	α-helix	trans	-76.2	-34.2	173.1	0	0	0	0	0	112.4	V396 S398 C399 L405 A584 F617	V396-A401 HydrophobicContact CG1-CB 3.62Å; S398-A401 PolarHBondContact O-N 3.07Å; S398-A401 VanDerWaalsContact OG-CB 3.25Å; S398-A401 WeakPolarHBondContact OG-CB 3.36Å; C399-A401 VanDerWaalsContact C-N 3.32Å; C399-A401 PolarHBondContact O-N 3.26Å; A401-L405 WeakPolarHBondContact O-CB 3.4Å; A401-L405 VanDerWaalsContact O-CG 3.27Å; A401-L405 WeakPolarHBondContact O-CG 3.25Å; A401-L405 PolarHBondContact O-N 3.27Å; A401-A584 HydrophobicContact CB-CB 4.36Å; A401-F617 HydrophobicContact CB-CE1 4.37Å
402	V	97.4	Very high	95	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.9	-48.9	171.2	168.8	0	0	0	0	111	V396 S398 C399 L405 H406 R426 L452 T454	V396-V402 HydrophobicContact CB-CG2 3.91Å; V396-V402 HydrophobicContact CG2-CG2 4.38Å; S398-V402 WeakPolarHBondContact O-CG2 3.15Å; S398-V402 PolarHBondContact O-N 2.87Å; C399-V402 PolarHBondContact O-N 3.44Å; V402-L405 PolarHBondContact O-N 2.89Å; V402-H406 VanDerWaalsContact O-CB 3.24Å; V402-H406 WeakPolarHBondContact O-CB 3.45Å; V402-H406 PolarHBondContact O-N 2.92Å; V402-R426 HydrophobicContact CG1-CB 3.68Å; V402-L452 HydrophobicContact CG1-CB 4.08Å; V402-L452 WeakPolarHBondContact CG1-O 3.48Å; V402-T454 HydrophobicContact CG2-CG2 3.94Å
403	E	96.6	Very high	94.7	Very high	54 Å²	54	18 Å²	18	25%	0.252	11%	0.105	S	C	.	.	H	α-helix	trans	-59.7	-47	176.1	-70.2	-72	-179.9	0	0	111.8	C399 H406 L407 R426 H428	C399-E403 WeakPolarHBondContact O-CG 3.5Å; C399-E403 PolarHBondContact O-N 3.4Å; E403-H406 PolarHBondContact O-N 2.83Å; E403-L407 WeakPolarHBondContact O-CG 3.08Å; E403-L407 PolarHBondContact O-N 2.96Å; E403-L407 VanDerWaalsContact O-N 3.07Å; E403-R426 VanDerWaalsContact CD-CD 3.48Å; E403-R426 IonicContact OE1-CZ 2.64Å; E403-R426 IonicContact OE1-NE 3.82Å; E403-R426 PolarHBondContact OE1-NE 3.04Å; E403-R426 IonicContact OE1-NH1 3.14Å; E403-R426 PolarHBondContact OE1-NH1 3.4Å; E403-R426 WeakPolarHBondContact OE2-CD 3.36Å; E403-R426 IonicContact OE2-CZ 3Å; E403-R426 IonicContact OE2-NE 2.59Å; E403-R426 PolarHBondContact OE2-NE 3.16Å; E403-R426 IonicContact OE2-NH1 2.83Å; E403-H428 IonicContact OE1-CE1 3.33Å; E403-H428 PolarHBondContact OE1-CE1 3.47Å; E403-H428 VanDerWaalsContact OE1-CE1 3.28Å; E403-H428 IonicContact OE1-NE2 3.4Å; E403-H428 PolarHBondContact OE1-NE2 3Å
404	F	97	Very high	94.1	Very high	6 Å²	6	20.3 Å²	20.3	3%	0.026	12%	0.119	C	C	.	.	H	α-helix	trans	-60.6	-47.9	178.4	170.4	-106.3	0	0	0	112.9	E400 L408 V571 A580 A581 A584 F617	E400-F404 VanDerWaalsContact O-CB 3.25Å; E400-F404 WeakPolarHBondContact O-CB 3.34Å; E400-F404 PolarHBondContact O-N 2.85Å; F404-L408 HydrophobicContact CE1-CD2 3.95Å; F404-L408 HydrophobicContact CE2-CD2 4.47Å; F404-L408 HydrophobicContact CZ-CD2 3.74Å; F404-L408 WeakPolarHBondContact O-CB 3.43Å; F404-L408 PolarHBondContact O-N 3.32Å; F404-V571 HydrophobicContact CE2-CG2 3.9Å; F404-V571 HydrophobicContact CZ-CG2 3.85Å; F404-A580 HydrophobicContact CD2-CB 4.27Å; F404-A581 HydrophobicContact CD2-CB 4.18Å; F404-A581 HydrophobicContact CE2-CB 3.55Å; F404-A581 HydrophobicContact CZ-CB 3.89Å; F404-A584 HydrophobicContact CB-CB 3.63Å; F404-A584 HydrophobicContact CD1-CB 3.97Å; F404-A584 HydrophobicContact CG-CB 3.83Å; F404-F617 AromaticContact CD1-CD1 3.9Å; F404-F617 HydrophobicContact CD1-CD1 3.9Å; F404-F617 HydrophobicContact CE1-CB 4.09Å; F404-F617 AromaticContact CE1-CD1 3.85Å; F404-F617 HydrophobicContact CE1-CD1 3.85Å; F404-F617 HydrophobicContact CE1-CG 4.42Å; F404-F617 HydrophobicContact CZ-CB 4.38Å; F404-F617 VanDerWaalsContact CZ-O 3.24Å; F404-F617 WeakPolarHBondContact CZ-O 3.45Å
405	L	97.1	Very high	93	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-69.5	-32.7	179.6	-68.6	172.6	0	0	0	112.1	L373 V396 A401 V402 F409 L452 Y472	L373-L405 HydrophobicContact CD1-CD2 3.64Å; V396-L405 HydrophobicContact CG1-CD1 4.19Å; V396-L405 HydrophobicContact CG2-CD1 4.07Å; A401-L405 WeakPolarHBondContact O-CB 3.4Å; A401-L405 VanDerWaalsContact O-CG 3.27Å; A401-L405 WeakPolarHBondContact O-CG 3.25Å; A401-L405 PolarHBondContact O-N 3.27Å; V402-L405 PolarHBondContact O-N 2.89Å; L405-F409 HydrophobicContact CB-CD2 4.37Å; L405-F409 HydrophobicContact CB-CE2 4.3Å; L405-F409 HydrophobicContact CD2-CE2 3.94Å; L405-F409 HydrophobicContact CD2-CZ 3.91Å; L405-F409 WeakPolarHBondContact O-CB 3.39Å; L405-F409 WeakPolarHBondContact O-CD2 3.36Å; L405-F409 WeakPolarHBondContact O-CG 3.34Å; L405-F409 PolarHBondContact O-N 2.83Å; L405-L452 VanDerWaalsContact C-CD1 3.5Å; L405-L452 HydrophobicContact CB-CD1 3.82Å; L405-Y472 HydrophobicContact CD1-CD1 4.15Å; L405-Y472 HydrophobicContact CD1-CE1 4.07Å
406	H	96.4	Very high	91.4	Very high	39 Å²	39	30.3 Å²	30.3	18%	0.181	16%	0.158	C	C	.	.	H	α-helix	trans	-61.6	-51.9	175.4	-179.3	-106.3	0	0	0	111	V402 E403 G410 F424 R426 L452	V402-H406 VanDerWaalsContact O-CB 3.24Å; V402-H406 WeakPolarHBondContact O-CB 3.45Å; V402-H406 PolarHBondContact O-N 2.92Å; E403-H406 PolarHBondContact O-N 2.83Å; H406-G410 PolarHBondContact O-N 3.33Å; H406-F424 PolarHBondContact NE2-O 2.97Å; H406-R426 HydrophobicContact CB-CB 4.31Å; H406-L452 VanDerWaalsContact CA-CD1 3.47Å; H406-L452 HydrophobicContact CB-CD1 3.98Å; H406-L452 VanDerWaalsContact N-CD1 3.28Å
407	L	94.1	Very high	89.6	Confident	65 Å²	65	30.8 Å²	30.8	34%	0.34	16%	0.161	S	C	.	.	H	α-helix	trans	-70.1	-39.4	-179	-62.9	170	0	0	0	111.8	E403 S411 W577	E403-L407 WeakPolarHBondContact O-CG 3.08Å; E403-L407 PolarHBondContact O-N 2.96Å; E403-L407 VanDerWaalsContact O-N 3.07Å; L407-S411 WeakPolarHBondContact O-CB 3.48Å; L407-S411 PolarHBondContact O-N 2.81Å; L407-S411 PolarHBondContact O-OG 2.81Å; L407-W577 HydrophobicContact CB-CH2 3.89Å; L407-W577 HydrophobicContact CB-CZ3 3.62Å; L407-W577 HydrophobicContact CD1-CH2 4.1Å; L407-W577 HydrophobicContact CD1-CZ3 3.73Å; L407-W577 HydrophobicContact CG-CH2 4.39Å; L407-W577 HydrophobicContact CG-CZ3 4.23Å
408	L	95.4	Very high	87.8	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-64.5	-54.7	177.2	176.9	62.3	0	0	0	112.1	L373 F404 S411 V412 L567 F570 V571	L373-L408 HydrophobicContact CD1-CD2 4.21Å; L373-L408 HydrophobicContact CD2-CD2 4.17Å; F404-L408 HydrophobicContact CE1-CD2 3.95Å; F404-L408 HydrophobicContact CE2-CD2 4.47Å; F404-L408 HydrophobicContact CZ-CD2 3.74Å; F404-L408 WeakPolarHBondContact O-CB 3.43Å; F404-L408 PolarHBondContact O-N 3.32Å; L408-S411 PolarHBondContact O-N 2.89Å; L408-V412 HydrophobicContact CD1-CG2 4.01Å; L408-V412 WeakPolarHBondContact O-CB 3.35Å; L408-V412 WeakPolarHBondContact O-CG2 3.31Å; L408-V412 PolarHBondContact O-N 2.78Å; L408-L567 HydrophobicContact CD1-CD2 3.83Å; L408-L567 HydrophobicContact CD2-CD2 4.05Å; L408-L567 HydrophobicContact CG-CD2 3.83Å; L408-F570 HydrophobicContact CD1-CB 4.36Å; L408-F570 HydrophobicContact CD1-CD1 3.56Å; L408-F570 HydrophobicContact CD1-CE1 4.34Å; L408-F570 HydrophobicContact CD1-CG 4.32Å; L408-V571 HydrophobicContact CD1-CG2 3.94Å; L408-V571 HydrophobicContact CD2-CG2 4.45Å
409	F	94.7	Very high	85.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-72.3	-38.6	-176.1	-65.5	-30.3	0	0	0	112.6	L373 L376 A377 I380 L405 S411 V412 L413 F424 L567	L373-F409 HydrophobicContact CD1-CE1 4.02Å; L373-F409 HydrophobicContact CD1-CZ 3.88Å; L376-F409 HydrophobicContact CB-CZ 4.45Å; L376-F409 HydrophobicContact CD2-CE2 3.57Å; L376-F409 HydrophobicContact CD2-CZ 3.86Å; L376-F409 HydrophobicContact CG-CE2 3.97Å; L376-F409 HydrophobicContact CG-CZ 4.1Å; A377-F409 HydrophobicContact CB-CE1 3.97Å; A377-F409 HydrophobicContact CB-CZ 4.41Å; I380-F409 HydrophobicContact CD1-CD2 4.22Å; I380-F409 HydrophobicContact CD1-CE2 4.12Å; L405-F409 HydrophobicContact CB-CD2 4.37Å; L405-F409 HydrophobicContact CB-CE2 4.3Å; L405-F409 HydrophobicContact CD2-CE2 3.94Å; L405-F409 HydrophobicContact CD2-CZ 3.91Å; L405-F409 WeakPolarHBondContact O-CB 3.39Å; L405-F409 WeakPolarHBondContact O-CD2 3.36Å; L405-F409 WeakPolarHBondContact O-CG 3.34Å; L405-F409 PolarHBondContact O-N 2.83Å; F409-S411 PolarHBondContact O-N 3.4Å; F409-V412 PolarHBondContact O-N 3.4Å; F409-L413 HydrophobicContact CB-CD1 3.95Å; F409-L413 HydrophobicContact CB-CG 4.16Å; F409-L413 HydrophobicContact CD1-CD1 3.8Å; F409-L413 HydrophobicContact CD1-CG 4.08Å; F409-L413 HydrophobicContact CE1-CD1 4.47Å; F409-L413 HydrophobicContact CG-CD1 3.92Å; F409-L413 HydrophobicContact CG-CG 4.4Å; F409-L413 WeakPolarHBondContact O-CB 3.43Å; F409-L413 PolarHBondContact O-N 2.97Å; F409-F424 HydrophobicContact CB-CD1 4.12Å; F409-F424 HydrophobicContact CB-CE1 3.68Å; F409-F424 HydrophobicContact CB-CE2 4.25Å; F409-F424 HydrophobicContact CB-CZ 3.76Å; F409-F424 HydrophobicContact CD2-CE1 4.31Å; F409-F424 HydrophobicContact CG-CE1 4.42Å; F409-L567 HydrophobicContact CD1-CD2 4.2Å; F409-L567 HydrophobicContact CE1-CD2 4.23Å
410	G	91.7	Very high	84	Confident	29 Å²	29	44.6 Å²	44.6	30%	0.299	24%	0.242	S	C	.	.	H	α-helix	trans	-61	-32.2	172.6	0	0	0	0	0	112.9	H406 T414	H406-G410 PolarHBondContact O-N 3.33Å; G410-T414 WeakPolarHBondContact O-CB 3.4Å; G410-T414 PolarHBondContact O-OG1 3.3Å
411	S	90.8	Very high	82.7	Confident	38 Å²	38	49.9 Å²	49.9	27%	0.266	27%	0.266	S	S	.	.	H	α-helix	trans	-84.7	-30.6	177.7	-59.3	0	0	0	0	114.5	L407 L408 F409 R415 F570	L407-S411 WeakPolarHBondContact O-CB 3.48Å; L407-S411 PolarHBondContact O-N 2.81Å; L407-S411 PolarHBondContact O-OG 2.81Å; L408-S411 PolarHBondContact O-N 2.89Å; F409-S411 PolarHBondContact O-N 3.4Å; S411-R415 WeakPolarHBondContact O-CG 3.43Å; S411-R415 PolarHBondContact O-NE 2.63Å; S411-R415 PolarHBondContact O-NH2 2.83Å; S411-F570 VanDerWaalsContact CB-CE2 3.46Å; S411-F570 WeakPolarHBondContact OG-CZ 3.48Å
412	V	90.7	Very high	82.1	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.024	27%	0.27	C	S	.	.	H	α-helix	trans	-99.6	-57.2	-175.2	178.9	0	0	0	0	111.7	L408 F409 T414 R415 H416 Q566 L567 F570	L408-V412 HydrophobicContact CD1-CG2 4.01Å; L408-V412 WeakPolarHBondContact O-CB 3.35Å; L408-V412 WeakPolarHBondContact O-CG2 3.31Å; L408-V412 PolarHBondContact O-N 2.78Å; F409-V412 PolarHBondContact O-N 3.4Å; V412-T414 VanDerWaalsContact C-N 3.33Å; V412-T414 PolarHBondContact O-N 3.43Å; V412-R415 WeakPolarHBondContact O-CB 3.38Å; V412-R415 PolarHBondContact O-N 2.99Å; V412-R415 VanDerWaalsContact O-N 3.12Å; V412-H416 PolarHBondContact O-CD2 2.85Å; V412-H416 VanDerWaalsContact O-CD2 3.3Å; V412-Q566 HydrophobicContact CG1-CB 4.37Å; V412-L567 HydrophobicContact CB-CD2 4.08Å; V412-L567 HydrophobicContact CG1-CD2 3.96Å; V412-L567 HydrophobicContact CG1-CG 4.47Å; V412-L567 HydrophobicContact CG2-CD2 4.25Å; V412-F570 HydrophobicContact CG2-CB 3.63Å; V412-F570 HydrophobicContact CG2-CD1 4.16Å; V412-F570 HydrophobicContact CG2-CD2 4.2Å; V412-F570 HydrophobicContact CG2-CG 3.71Å
413	L	88.3	Confident	81.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-67.8	-34.6	-168.9	-53.7	-172.4	0	0	0	112.2	A377 I380 L381 F409 R415 H416 L422 F424 L563	A377-L413 HydrophobicContact CB-CD1 3.99Å; A377-L413 HydrophobicContact CB-CD2 4.09Å; I380-L413 HydrophobicContact CG2-CD1 4.49Å; L381-L413 HydrophobicContact CD1-CD2 4.41Å; F409-L413 HydrophobicContact CB-CD1 3.95Å; F409-L413 HydrophobicContact CB-CG 4.16Å; F409-L413 HydrophobicContact CD1-CD1 3.8Å; F409-L413 HydrophobicContact CD1-CG 4.08Å; F409-L413 HydrophobicContact CE1-CD1 4.47Å; F409-L413 HydrophobicContact CG-CD1 3.92Å; F409-L413 HydrophobicContact CG-CG 4.4Å; F409-L413 WeakPolarHBondContact O-CB 3.43Å; F409-L413 PolarHBondContact O-N 2.97Å; L413-R415 PolarHBondContact O-N 2.64Å; L413-H416 PolarHBondContact O-N 3.15Å; L413-H416 VanDerWaalsContact O-N 3.11Å; L413-L422 HydrophobicContact CB-CD1 4.17Å; L413-F424 HydrophobicContact CB-CE2 4.42Å; L413-F424 HydrophobicContact CB-CZ 4.4Å; L413-F424 HydrophobicContact CD1-CZ 4.07Å; L413-L563 HydrophobicContact CD2-CD1 3.97Å
414	T	81.5	Confident	81.5	Confident	49 Å²	49	51 Å²	51	30%	0.301	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-63.7	-22	176.5	-32.1	0	0	0	0	113.4	G410 V412 H416 T417	G410-T414 WeakPolarHBondContact O-CB 3.4Å; G410-T414 PolarHBondContact O-OG1 3.3Å; V412-T414 VanDerWaalsContact C-N 3.33Å; V412-T414 PolarHBondContact O-N 3.43Å; T414-H416 PolarHBondContact O-N 2.94Å; T414-T417 PolarHBondContact O-N 2.76Å; T414-T417 PolarHBondContact O-OG1 2.75Å
415	R	73.9	Confident	81.4	Confident	172 Å²	172	51.4 Å²	51.4	65%	0.649	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-67.2	-26.4	174.8	-59.3	-178.9	-167.9	-176.8	2.6	112.5	S411 V412 L413 T417	S411-R415 WeakPolarHBondContact O-CG 3.43Å; S411-R415 PolarHBondContact O-NE 2.63Å; S411-R415 PolarHBondContact O-NH2 2.83Å; V412-R415 WeakPolarHBondContact O-CB 3.38Å; V412-R415 PolarHBondContact O-N 2.99Å; V412-R415 VanDerWaalsContact O-N 3.12Å; L413-R415 PolarHBondContact O-N 2.64Å; R415-T417 VanDerWaalsContact C-N 3.31Å
416	H	62.7	Low	81.3	Confident	38 Å²	38	53.6 Å²	53.6	18%	0.176	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-91.1	7.3	-176.3	-60.5	-82.3	0	0	0	112.3	K385 V412 L413 T414 A536 F537	K385-H416 PolarHBondContact NZ-O 3.45Å; V412-H416 PolarHBondContact O-CD2 2.85Å; V412-H416 VanDerWaalsContact O-CD2 3.3Å; L413-H416 PolarHBondContact O-N 3.15Å; L413-H416 VanDerWaalsContact O-N 3.11Å; T414-H416 PolarHBondContact O-N 2.94Å; H416-A536 VanDerWaalsContact ND1-CB 3.34Å; H416-A536 WeakPolarHBondContact ND1-CB 3.27Å; H416-F537 HydrophobicContact CB-CZ 4.22Å
417	T	58.5	Low	81.1	Confident	14 Å²	14	51.8 Å²	51.8	9%	0.086	28%	0.279	C	S	.	.			trans	-120.5	70.9	-173.7	56.3	0	0	0	0	113.3	K385 T414 R415 N419 Q420 L422	K385-T417 HydrophobicContact CD-CG2 3.81Å; K385-T417 HydrophobicContact CG-CG2 4.11Å; T414-T417 PolarHBondContact O-N 2.76Å; T414-T417 PolarHBondContact O-OG1 2.75Å; R415-T417 VanDerWaalsContact C-N 3.31Å; T417-N419 PolarHBondContact O-N 3.08Å; T417-N419 VanDerWaalsContact O-N 3.17Å; T417-Q420 WeakPolarHBondContact CB-O 3.46Å; T417-Q420 PolarHBondContact OG1-O 3.16Å; T417-L422 HydrophobicContact CG2-CD1 3.68Å; T417-L422 HydrophobicContact CG2-CG 3.94Å
418	A	54.4	Low	81	Confident	101 Å²	101	48.8 Å²	48.8	84%	0.835	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.2	178.5	0	0	0	0	0	114.8
419	N	50.9	Low	80.5	Confident	160 Å²	160	50.9 Å²	50.9	86%	0.856	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	-1.2	-171.4	-65.5	-0.5	0	0	0	115.1	T417	T417-N419 PolarHBondContact O-N 3.08Å; T417-N419 VanDerWaalsContact O-N 3.17Å
420	Q	59.8	Low	80.2	Confident	88 Å²	88	56.3 Å²	56.3	41%	0.411	31%	0.314	S	S	.	.	S	Bend	trans	-155.9	106.5	-177.7	-98.9	-176.7	-22.5	0	0	111.4	S389 T417 L422	S389-Q420 PolarHBondContact OG-NE2 3.43Å; S389-Q420 VanDerWaalsContact OG-NE2 3.1Å; T417-Q420 WeakPolarHBondContact CB-O 3.46Å; T417-Q420 PolarHBondContact OG1-O 3.16Å; Q420-L422 PolarHBondContact O-N 2.97Å
421	E	67.3	Low	80	Confident	185 Å²	185	55.6 Å²	55.6	86%	0.864	30%	0.303	S	S	*	.			trans	-67.9	116.5	-179.3	-64	-172.3	154.4	0	0	112.5	S423	E421-S423 PolarHBondContact O-N 3.16Å; E421-S423 VanDerWaalsContact O-N 3.11Å
422	L	84.1	Confident	79.9	Confident	15 Å²	15	61.2 Å²	61.2	8%	0.079	32%	0.323	C	S	.	.			trans	-74.1	98.2	172.7	-71.1	171.3	0	0	0	110.5	L381 C384 L413 T417 Q420 F424	L381-L422 HydrophobicContact CD2-CD1 4.12Å; C384-L422 HydrophobicContact CB-CD2 3.38Å; L413-L422 HydrophobicContact CB-CD1 4.17Å; T417-L422 HydrophobicContact CG2-CD1 3.68Å; T417-L422 HydrophobicContact CG2-CG 3.94Å; Q420-L422 PolarHBondContact O-N 2.97Å; L422-F424 HydrophobicContact CB-CD2 4.23Å; L422-F424 HydrophobicContact CB-CE2 3.62Å; L422-F424 HydrophobicContact CB-CZ 4.33Å; L422-F424 HydrophobicContact CD1-CE2 4.35Å; L422-F424 VanDerWaalsContact O-CD2 3.26Å; L422-F424 WeakPolarHBondContact O-CD2 3.48Å; L422-F424 PolarHBondContact O-N 3.48Å
423	S	89	Confident	79.4	Confident	46 Å²	46	62.5 Å²	62.5	32%	0.322	33%	0.328	S	S	.	.			trans	-73.1	110	176.2	-164.6	0	0	0	0	111.5	E421 G449 V450	E421-S423 PolarHBondContact O-N 3.16Å; E421-S423 VanDerWaalsContact O-N 3.11Å; S423-G449 WeakPolarHBondContact O-CA 3.48Å; S423-V450 PolarHBondContact O-N 2.56Å
424	F	93.6	Very high	79.2	Confident	17 Å²	17	69.6 Å²	69.6	8%	0.075	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127.5	172.1	-70.7	-84.3	0	0	0	111	I380 H406 F409 L413 L422 V450	I380-F424 HydrophobicContact CD1-CE1 4.41Å; I380-F424 HydrophobicContact CG2-CE1 4.11Å; I380-F424 HydrophobicContact CG2-CZ 3.96Å; H406-F424 PolarHBondContact NE2-O 2.97Å; F409-F424 HydrophobicContact CB-CD1 4.12Å; F409-F424 HydrophobicContact CB-CE1 3.68Å; F409-F424 HydrophobicContact CB-CE2 4.25Å; F409-F424 HydrophobicContact CB-CZ 3.76Å; F409-F424 HydrophobicContact CD2-CE1 4.31Å; F409-F424 HydrophobicContact CG-CE1 4.42Å; L413-F424 HydrophobicContact CB-CE2 4.42Å; L413-F424 HydrophobicContact CB-CZ 4.4Å; L413-F424 HydrophobicContact CD1-CZ 4.07Å; L422-F424 HydrophobicContact CB-CD2 4.23Å; L422-F424 HydrophobicContact CB-CE2 3.62Å; L422-F424 HydrophobicContact CB-CZ 4.33Å; L422-F424 HydrophobicContact CD1-CE2 4.35Å; L422-F424 VanDerWaalsContact O-CD2 3.26Å; L422-F424 WeakPolarHBondContact O-CD2 3.48Å; L422-F424 PolarHBondContact O-N 3.48Å; F424-V450 HydrophobicContact CD1-CB 3.81Å; F424-V450 HydrophobicContact CD1-CG1 4.09Å; F424-V450 HydrophobicContact CD1-CG2 4.34Å; F424-V450 HydrophobicContact CE1-CB 3.91Å; F424-V450 HydrophobicContact CE1-CG1 4.08Å; F424-V450 HydrophobicContact CE1-CG2 3.99Å
425	L	94.9	Very high	79.6	Confident	15 Å²	15	69.7 Å²	69.7	8%	0.079	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	157.9	178.3	-63.6	176.6	0	0	0	110.2	V439 Q442 F443 V450 L451 L452	L425-V439 HydrophobicContact CB-CG1 3.88Å; L425-V439 HydrophobicContact CD1-CG1 4.33Å; L425-V439 HydrophobicContact CD2-CG1 4.44Å; L425-V439 HydrophobicContact CG-CG1 4.44Å; L425-Q442 HydrophobicContact CD1-CG 4.14Å; L425-F443 HydrophobicContact CD1-CB 3.75Å; L425-F443 HydrophobicContact CD1-CD2 4.04Å; L425-F443 HydrophobicContact CD1-CG 4.34Å; L425-V450 PolarHBondContact N-O 2.79Å; L425-L451 HydrophobicContact CB-CD1 3.86Å; L425-L452 PolarHBondContact O-N 3.18Å
426	R	95.4	Very high	80.2	Confident	49 Å²	49	62.3 Å²	62.3	19%	0.185	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	141.2	178.3	54.7	176.2	174.4	79.4	22.9	112.5	V402 E403 H406 M431 E435 V439 L452	V402-R426 HydrophobicContact CG1-CB 3.68Å; E403-R426 VanDerWaalsContact CD-CD 3.48Å; E403-R426 IonicContact OE1-CZ 2.64Å; E403-R426 IonicContact OE1-NE 3.82Å; E403-R426 PolarHBondContact OE1-NE 3.04Å; E403-R426 IonicContact OE1-NH1 3.14Å; E403-R426 PolarHBondContact OE1-NH1 3.4Å; E403-R426 WeakPolarHBondContact OE2-CD 3.36Å; E403-R426 IonicContact OE2-CZ 3Å; E403-R426 IonicContact OE2-NE 2.59Å; E403-R426 PolarHBondContact OE2-NE 3.16Å; E403-R426 IonicContact OE2-NH1 2.83Å; H406-R426 HydrophobicContact CB-CB 4.31Å; R426-M431 HydrophobicContact CG-SD 4.49Å; R426-M431 VanDerWaalsContact O-CE 3.24Å; R426-M431 WeakPolarHBondContact O-CE 3.4Å; R426-M431 VanDerWaalsContact O-SD 3.36Å; R426-E435 IonicContact CZ-OE1 3.58Å; R426-E435 VanDerWaalsContact CZ-OE1 3.31Å; R426-E435 IonicContact NH1-OE1 2.63Å; R426-E435 PolarHBondContact NH1-OE1 2.85Å; R426-E435 IonicContact NH2-OE1 3.33Å; R426-E435 PolarHBondContact NH2-OE1 3.33Å; R426-V439 WeakPolarHBondContact O-CG1 3.41Å; R426-L452 CarbonylContact C-O 3.54Å; R426-L452 VanDerWaalsContact CA-O 3.24Å; R426-L452 WeakPolarHBondContact CA-O 3.34Å
427	L	92.1	Very high	81.1	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	109.6	175.3	-178.1	60.4	0	0	0	112.2	M431 R436 L451 L452 C453 T454 A457 L461	L427-M431 VanDerWaalsContact CA-SD 3.6Å; L427-R436 HydrophobicContact CD1-CB 3.93Å; L427-R436 HydrophobicContact CD1-CG 3.93Å; L427-L451 HydrophobicContact CB-CD1 3.87Å; L427-L451 HydrophobicContact CB-CD2 4.44Å; L427-L451 HydrophobicContact CB-CG 4.47Å; L427-L451 HydrophobicContact CD2-CD2 4.43Å; L427-L452 PolarHBondContact N-O 2.93Å; L427-C453 HydrophobicContact CB-CB 4.28Å; L427-C453 WeakPolarHBondContact O-CA 3.38Å; L427-C453 WeakPolarHBondContact O-CB 3.22Å; L427-T454 PolarHBondContact O-N 3.47Å; L427-A457 HydrophobicContact CD2-CB 4.22Å; L427-L461 HydrophobicContact CD2-CD1 3.85Å
428	H	91.4	Very high	82.6	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.009	36%	0.357	C	S	.	.			trans	-149	-175	179.1	59.3	102.6	0	0	0	111.7	C399 E403 M431 R436 T454	C399-H428 WeakPolarHBondContact CB-ND1 3.47Å; C399-H428 PolarHBondContact SG-ND1 3.45Å; C399-H428 VanDerWaalsContact SG-ND1 3.35Å; E403-H428 IonicContact OE1-CE1 3.33Å; E403-H428 PolarHBondContact OE1-CE1 3.47Å; E403-H428 VanDerWaalsContact OE1-CE1 3.28Å; E403-H428 IonicContact OE1-NE2 3.4Å; E403-H428 PolarHBondContact OE1-NE2 3Å; H428-M431 VanDerWaalsContact CD2-SD 3.54Å; H428-M431 PolarHBondContact N-SD 2.76Å; H428-M431 VanDerWaalsContact N-SD 3.43Å; H428-M431 WeakPolarHBondContact NE2-CG 3.5Å; H428-R436 WeakPolarHBondContact O-CD 3.49Å; H428-R436 PolarHBondContact O-NE 2.89Å; H428-R436 VanDerWaalsContact O-NE 3.14Å; H428-T454 HydrophobicContact CB-CG2 3.93Å
429	G	84.6	Confident	84.3	Confident	45 Å²	45	63.5 Å²	63.5	46%	0.464	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-26.9	-170.1	0	0	0	0	0	115.7	M431	G429-M431 VanDerWaalsContact C-N 3.33Å
430	N	88.2	Confident	86	Confident	115 Å²	115	57.1 Å²	57.1	62%	0.615	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-10.9	-173.8	-57.8	7.2	0	0	0	113.1	C399	C399-N430 WeakPolarHBondContact CB-ND2 3.42Å; C399-N430 VanDerWaalsContact SG-CG 3.54Å; C399-N430 PolarHBondContact SG-OD1 3.18Å
431	M	88.9	Confident	87.2	Confident	13 Å²	13	57.6 Å²	57.6	6%	0.064	29%	0.289	C	S	.	.	S	Bend	trans	-70.8	153.2	178.7	-67.1	170.9	72	0	0	112.2	R426 L427 H428 G429 E435 R436 V439	R426-M431 HydrophobicContact CG-SD 4.49Å; R426-M431 VanDerWaalsContact O-CE 3.24Å; R426-M431 WeakPolarHBondContact O-CE 3.4Å; R426-M431 VanDerWaalsContact O-SD 3.36Å; L427-M431 VanDerWaalsContact CA-SD 3.6Å; H428-M431 VanDerWaalsContact CD2-SD 3.54Å; H428-M431 PolarHBondContact N-SD 2.76Å; H428-M431 VanDerWaalsContact N-SD 3.43Å; H428-M431 WeakPolarHBondContact NE2-CG 3.5Å; G429-M431 VanDerWaalsContact C-N 3.33Å; M431-E435 HydrophobicContact CE-CB 4.49Å; M431-E435 HydrophobicContact CE-CG 3.66Å; M431-R436 HydrophobicContact CB-CG 3.41Å; M431-R436 VanDerWaalsContact CB-CG 3.41Å; M431-R436 HydrophobicContact CE-CG 4.33Å; M431-R436 HydrophobicContact CG-CG 4.42Å; M431-R436 WeakPolarHBondContact O-CD 3.43Å; M431-R436 HydrophobicContact SD-CG 4.24Å; M431-V439 HydrophobicContact CE-CG2 4.09Å
432	K	87.9	Confident	88.3	Confident	156 Å²	156	53.4 Å²	53.4	68%	0.678	27%	0.269	S	S	*	.			trans	-67.6	148.5	176	-67.6	177.7	-178	173.9	0	110.5	E434 E435 R436	K432-E434 VanDerWaalsContact C-N 3.27Å; K432-E434 PolarHBondContact O-N 3.38Å; K432-E435 HydrophobicContact CB-CB 4.11Å; K432-E435 PolarHBondContact N-OE2 3.36Å; K432-E435 WeakPolarHBondContact O-CB 3.42Å; K432-E435 PolarHBondContact O-N 2.98Å; K432-R436 WeakPolarHBondContact O-CG 3.37Å; K432-R436 PolarHBondContact O-N 2.85Å
433	Q	80.8	Confident	88.6	Confident	31 Å²	31	52.7 Å²	52.7	15%	0.145	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-38	-177	-171.7	59.4	43.8	0	0	112.6	E210 M235 R436 C437	E210-Q433 PolarHBondContact OE1-NE2 3.08Å; M235-Q433 HydrophobicContact CE-CG 4.12Å; Q433-R436 PolarHBondContact O-N 3.38Å; Q433-C437 WeakPolarHBondContact O-CB 3.24Å; Q433-C437 PolarHBondContact O-N 3.25Å; Q433-C437 PolarHBondContact O-SG 2.99Å
434	E	84.4	Confident	88.5	Confident	150 Å²	150	51.8 Å²	51.8	70%	0.701	26%	0.259	S	S	*	.	H	α-helix	trans	-63.2	-44.9	177.2	-65.6	162.8	174.6	0	0	111.3	K432 C437 Q438	K432-E434 VanDerWaalsContact C-N 3.27Å; K432-E434 PolarHBondContact O-N 3.38Å; E434-C437 PolarHBondContact O-N 3.04Å; E434-Q438 VanDerWaalsContact O-CG 3.29Å; E434-Q438 WeakPolarHBondContact O-CG 3.39Å; E434-Q438 PolarHBondContact O-N 3.45Å
435	E	88.9	Confident	88.2	Confident	50 Å²	50	55.1 Å²	55.1	23%	0.234	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-45.2	175.5	-173.7	-165.8	-177.8	0	0	111.7	R426 M431 K432 C437 Q438 V439	R426-E435 IonicContact CZ-OE1 3.58Å; R426-E435 VanDerWaalsContact CZ-OE1 3.31Å; R426-E435 IonicContact NH1-OE1 2.63Å; R426-E435 PolarHBondContact NH1-OE1 2.85Å; R426-E435 IonicContact NH2-OE1 3.33Å; R426-E435 PolarHBondContact NH2-OE1 3.33Å; M431-E435 HydrophobicContact CE-CB 4.49Å; M431-E435 HydrophobicContact CE-CG 3.66Å; K432-E435 HydrophobicContact CB-CB 4.11Å; K432-E435 PolarHBondContact N-OE2 3.36Å; K432-E435 WeakPolarHBondContact O-CB 3.42Å; K432-E435 PolarHBondContact O-N 2.98Å; E435-C437 VanDerWaalsContact C-N 3.34Å; E435-C437 PolarHBondContact O-N 3.4Å; E435-Q438 PolarHBondContact O-N 3.43Å; E435-V439 WeakPolarHBondContact O-CG2 3.45Å; E435-V439 PolarHBondContact O-N 2.75Å
436	R	86	Confident	87.9	Confident	17 Å²	17	56 Å²	56	6%	0.064	30%	0.297	C	S	.	.	H	α-helix	trans	-60.2	-43.1	175	-67.4	173.5	72.7	-109.2	-12.8	111.2	E210 L427 H428 M431 K432 Q433 F440	E210-R436 VanDerWaalsContact CD-NH1 3.3Å; E210-R436 IonicContact OE1-CZ 3.29Å; E210-R436 VanDerWaalsContact OE1-CZ 3.32Å; E210-R436 IonicContact OE1-NH1 3.55Å; E210-R436 PolarHBondContact OE1-NH1 2.92Å; E210-R436 IonicContact OE1-NH2 3.06Å; E210-R436 PolarHBondContact OE1-NH2 2.88Å; E210-R436 IonicContact OE2-CZ 3.32Å; E210-R436 IonicContact OE2-NH1 2.66Å; E210-R436 PolarHBondContact OE2-NH1 3.27Å; E210-R436 IonicContact OE2-NH2 3.32Å; E210-R436 PolarHBondContact OE2-NH2 3.01Å; L427-R436 HydrophobicContact CD1-CB 3.93Å; L427-R436 HydrophobicContact CD1-CG 3.93Å; H428-R436 WeakPolarHBondContact O-CD 3.49Å; H428-R436 PolarHBondContact O-NE 2.89Å; H428-R436 VanDerWaalsContact O-NE 3.14Å; M431-R436 HydrophobicContact CB-CG 3.41Å; M431-R436 VanDerWaalsContact CB-CG 3.41Å; M431-R436 HydrophobicContact CE-CG 4.33Å; M431-R436 HydrophobicContact CG-CG 4.42Å; M431-R436 WeakPolarHBondContact O-CD 3.43Å; M431-R436 HydrophobicContact SD-CG 4.24Å; K432-R436 WeakPolarHBondContact O-CG 3.37Å; K432-R436 PolarHBondContact O-N 2.85Å; Q433-R436 PolarHBondContact O-N 3.38Å; R436-F440 VanDerWaalsContact O-CB 3.24Å; R436-F440 WeakPolarHBondContact O-CB 3.48Å; R436-F440 PolarHBondContact O-N 3.1Å
437	C	82.8	Confident	87.5	Confident	28 Å²	28	59 Å²	59	19%	0.189	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-42.4	174.4	-72.2	0	0	0	0	112	Q433 E434 E435 F440 H441	Q433-C437 WeakPolarHBondContact O-CB 3.24Å; Q433-C437 PolarHBondContact O-N 3.25Å; Q433-C437 PolarHBondContact O-SG 2.99Å; E434-C437 PolarHBondContact O-N 3.04Å; E435-C437 VanDerWaalsContact C-N 3.34Å; E435-C437 PolarHBondContact O-N 3.4Å; C437-F440 PolarHBondContact O-N 3.14Å; C437-H441 PolarHBondContact O-N 3.36Å; C437-H441 PolarHBondContact O-ND1 3.4Å
438	Q	88.4	Confident	87.3	Confident	133 Å²	133	60.2 Å²	60.2	62%	0.621	33%	0.331	S	S	*	.	H	α-helix	trans	-61	-52.1	177.5	-75.8	166	-8.3	0	0	111.5	E434 E435 F440 H441 Q442	E434-Q438 VanDerWaalsContact O-CG 3.29Å; E434-Q438 WeakPolarHBondContact O-CG 3.39Å; E434-Q438 PolarHBondContact O-N 3.45Å; E435-Q438 PolarHBondContact O-N 3.43Å; Q438-F440 VanDerWaalsContact C-N 3.32Å; Q438-F440 PolarHBondContact O-N 2.9Å; Q438-H441 PolarHBondContact O-N 3.1Å; Q438-Q442 WeakPolarHBondContact O-CB 3.45Å; Q438-Q442 PolarHBondContact O-N 2.88Å
439	V	90.7	Very high	87.3	Confident	17 Å²	17	60.5 Å²	60.5	10%	0.103	34%	0.335	C	S	.	.	H	α-helix	trans	-63.2	-38.1	178.8	176.1	0	0	0	0	111.7	L425 R426 M431 E435 Q442 F443 L451	L425-V439 HydrophobicContact CB-CG1 3.88Å; L425-V439 HydrophobicContact CD1-CG1 4.33Å; L425-V439 HydrophobicContact CD2-CG1 4.44Å; L425-V439 HydrophobicContact CG-CG1 4.44Å; R426-V439 WeakPolarHBondContact O-CG1 3.41Å; M431-V439 HydrophobicContact CE-CG2 4.09Å; E435-V439 WeakPolarHBondContact O-CG2 3.45Å; E435-V439 PolarHBondContact O-N 2.75Å; V439-Q442 PolarHBondContact O-N 3.28Å; V439-F443 WeakPolarHBondContact O-CB 3.38Å; V439-F443 PolarHBondContact O-N 2.78Å; V439-L451 HydrophobicContact CG1-CD1 4.09Å
440	F	86.1	Confident	87.7	Confident	27 Å²	27	58.4 Å²	58.4	12%	0.118	31%	0.313	C	S	.	.	H	α-helix	trans	-60.7	-47	175	176.9	-93.7	0	0	0	112.2	R436 C437 Q438 S444 L461 L463	R436-F440 VanDerWaalsContact O-CB 3.24Å; R436-F440 WeakPolarHBondContact O-CB 3.48Å; R436-F440 PolarHBondContact O-N 3.1Å; C437-F440 PolarHBondContact O-N 3.14Å; Q438-F440 VanDerWaalsContact C-N 3.32Å; Q438-F440 PolarHBondContact O-N 2.9Å; F440-S444 WeakPolarHBondContact O-CB 3.48Å; F440-S444 PolarHBondContact O-N 3.22Å; F440-S444 PolarHBondContact O-OG 3.22Å; F440-L461 HydrophobicContact CD2-CD1 4.24Å; F440-L461 HydrophobicContact CD2-CD2 4.47Å; F440-L461 HydrophobicContact CE2-CB 4.29Å; F440-L461 HydrophobicContact CE2-CD1 4.26Å; F440-L461 HydrophobicContact CE2-CD2 4.15Å; F440-L461 HydrophobicContact CE2-CG 4.48Å; F440-L463 HydrophobicContact CD2-CD2 3.67Å; F440-L463 HydrophobicContact CE2-CD2 3.41Å; F440-L463 VanDerWaalsContact CE2-CD2 3.41Å; F440-L463 HydrophobicContact CE2-CG 4.1Å; F440-L463 HydrophobicContact CZ-CD2 4.2Å
441	H	86.3	Confident	88.1	Confident	97 Å²	97	53 Å²	53	45%	0.449	28%	0.284	S	S	.	.	H	α-helix	trans	-67.5	-41	177.8	-72.3	90.6	0	0	0	111.8	C437 Q438 S444 A445	C437-H441 PolarHBondContact O-N 3.36Å; C437-H441 PolarHBondContact O-ND1 3.4Å; Q438-H441 PolarHBondContact O-N 3.1Å; H441-S444 PolarHBondContact O-N 2.84Å; H441-A445 WeakPolarHBondContact O-CB 3.46Å; H441-A445 PolarHBondContact O-N 3.14Å
442	Q	90.4	Very high	88.5	Confident	97 Å²	97	52.4 Å²	52.4	45%	0.453	28%	0.281	S	S	.	.	H	α-helix	trans	-58.3	-57.2	175.9	-175.6	179.3	3.7	0	0	110.9	L425 Q438 V439 S444 A445 S446	L425-Q442 HydrophobicContact CD1-CG 4.14Å; Q438-Q442 WeakPolarHBondContact O-CB 3.45Å; Q438-Q442 PolarHBondContact O-N 2.88Å; V439-Q442 PolarHBondContact O-N 3.28Å; Q442-S444 VanDerWaalsContact C-N 3.28Å; Q442-S444 PolarHBondContact O-N 3.43Å; Q442-A445 PolarHBondContact O-N 3.49Å; Q442-S446 PolarHBondContact O-N 3.17Å; Q442-S446 PolarHBondContact O-OG 3.49Å
443	F	90.6	Very high	88.8	Confident	1 Å²	1	45 Å²	45	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-64.9	-31.5	179.5	-171	-114.3	0	0	0	112.6	K391 I392 I393 L425 V439 L451 L463 V466	K391-F443 HydrophobicContact CD-CZ 4.36Å; K391-F443 WeakPolarHBondContact CE-O 3.36Å; K391-F443 HydrophobicContact CG-CE1 4.3Å; K391-F443 HydrophobicContact CG-CE2 3.76Å; K391-F443 HydrophobicContact CG-CZ 3.54Å; K391-F443 PolarHBondContact NZ-O 2.97Å; I392-F443 WeakPolarHBondContact O-CZ 3.3Å; I393-F443 HydrophobicContact CD1-CE1 4.15Å; I393-F443 HydrophobicContact CG1-CE1 3.76Å; I393-F443 HydrophobicContact CG1-CZ 4Å; L425-F443 HydrophobicContact CD1-CB 3.75Å; L425-F443 HydrophobicContact CD1-CD2 4.04Å; L425-F443 HydrophobicContact CD1-CG 4.34Å; V439-F443 WeakPolarHBondContact O-CB 3.38Å; V439-F443 PolarHBondContact O-N 2.78Å; F443-L451 HydrophobicContact CD1-CB 3.96Å; F443-L451 HydrophobicContact CD1-CD2 3.64Å; F443-L451 HydrophobicContact CD1-CG 4.33Å; F443-L451 HydrophobicContact CD2-CB 4.04Å; F443-L451 HydrophobicContact CE1-CB 3.75Å; F443-L451 HydrophobicContact CE1-CD2 3.86Å; F443-L451 HydrophobicContact CE1-CG 4.44Å; F443-L451 HydrophobicContact CE2-CB 3.82Å; F443-L451 HydrophobicContact CG-CB 4.1Å; F443-L451 HydrophobicContact CG-CD2 4.26Å; F443-L451 HydrophobicContact CZ-CB 3.66Å; F443-L463 HydrophobicContact CD1-CD1 4.03Å; F443-L463 HydrophobicContact CD1-CD2 3.96Å; F443-L463 HydrophobicContact CD1-CG 4.41Å; F443-L463 HydrophobicContact CE1-CD1 4.1Å; F443-V466 HydrophobicContact CE1-CG2 4.01Å; F443-V466 HydrophobicContact CZ-CG2 4.39Å
444	S	86.1	Confident	89.4	Confident	26 Å²	26	44.2 Å²	44.2	18%	0.182	25%	0.246	C	C	.	.	H	α-helix	trans	-63.3	-43.3	173.9	-64.1	0	0	0	0	111.8	K391 F440 H441 Q442 L463	K391-S444 PolarHBondContact NZ-O 2.72Å; K391-S444 VanDerWaalsContact NZ-O 3.15Å; F440-S444 WeakPolarHBondContact O-CB 3.48Å; F440-S444 PolarHBondContact O-N 3.22Å; F440-S444 PolarHBondContact O-OG 3.22Å; H441-S444 PolarHBondContact O-N 2.84Å; Q442-S444 VanDerWaalsContact C-N 3.28Å; Q442-S444 PolarHBondContact O-N 3.43Å; S444-L463 WeakPolarHBondContact OG-CD2 3.4Å
445	A	87.6	Confident	89.4	Confident	87 Å²	87	38.5 Å²	38.5	72%	0.719	22%	0.221	S	C	*	.	H	α-helix	trans	-77.2	-28.7	179.4	0	0	0	0	0	113.9	H441 Q442	H441-A445 WeakPolarHBondContact O-CB 3.46Å; H441-A445 PolarHBondContact O-N 3.14Å; Q442-A445 PolarHBondContact O-N 3.49Å
446	S	88.3	Confident	88.9	Confident	33 Å²	33	37.9 Å²	37.9	23%	0.231	22%	0.22	C	C	.	.			trans	-61.8	134.2	175.9	-71.3	0	0	0	0	112.3	K391 Q442 A448	K391-S446 WeakPolarHBondContact CD-O 3.34Å; K391-S446 VanDerWaalsContact CE-O 3.26Å; K391-S446 WeakPolarHBondContact CE-O 3.14Å; K391-S446 PolarHBondContact NZ-O 3.06Å; Q442-S446 PolarHBondContact O-N 3.17Å; Q442-S446 PolarHBondContact O-OG 3.49Å; S446-A448 WeakPolarHBondContact CB-O 3.43Å
447	T	86.8	Confident	88.3	Confident	112 Å²	112	37.1 Å²	37.1	69%	0.687	22%	0.217	S	C	*	.	S	Bend	trans	-77.7	-27.8	171	49	0	0	0	0	112.7
448	A	88.5	Confident	87.4	Confident	27 Å²	27	35.9 Å²	35.9	22%	0.223	21%	0.209	C	C	.	.	S	Bend	trans	-141.8	162.1	-178.4	0	0	0	0	0	111.4	S389 N390 S446	S389-A448 VanDerWaalsContact O-CB 3.29Å; S389-A448 WeakPolarHBondContact O-CB 3.47Å; N390-A448 WeakPolarHBondContact O-CA 3.37Å; S446-A448 WeakPolarHBondContact CB-O 3.43Å
449	G	90.9	Very high	86.6	Confident	8 Å²	8	30 Å²	30	8%	0.082	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	133.4	175.6	177.5	0	0	0	0	0	113.2	N390 K391 I392 S423	N390-G449 PolarHBondContact O-N 2.97Å; K391-G449 WeakPolarHBondContact CA-O 3.44Å; I392-G449 PolarHBondContact N-O 2.86Å; S423-G449 WeakPolarHBondContact O-CA 3.48Å
450	V	94.3	Very high	85.2	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	116.5	-173.6	-173.9	0	0	0	0	110.6	I380 I392 V394 S423 F424 L425 L452	I380-V450 HydrophobicContact CD1-CG1 4.27Å; I380-V450 HydrophobicContact CG2-CG2 3.85Å; I392-V450 HydrophobicContact CB-CG2 4.43Å; I392-V450 WeakPolarHBondContact O-CA 3.48Å; V394-V450 HydrophobicContact CG2-CG1 3.84Å; S423-V450 PolarHBondContact O-N 2.56Å; F424-V450 HydrophobicContact CD1-CB 3.81Å; F424-V450 HydrophobicContact CD1-CG1 4.09Å; F424-V450 HydrophobicContact CD1-CG2 4.34Å; F424-V450 HydrophobicContact CE1-CB 3.91Å; F424-V450 HydrophobicContact CE1-CG1 4.08Å; F424-V450 HydrophobicContact CE1-CG2 3.99Å; L425-V450 PolarHBondContact N-O 2.79Å; V450-L452 HydrophobicContact CG1-CD2 3.76Å; V450-L452 HydrophobicContact CG1-CG 4.47Å
451	L	95.5	Very high	84.5	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	110.4	172	-178.3	65.4	0	0	0	110.7	I392 I393 V394 L425 L427 V439 F443 C453 L463	I392-L451 PolarHBondContact O-N 3.36Å; I393-L451 CarbonylContact C-O 3.55Å; I393-L451 WeakPolarHBondContact CA-O 3.24Å; I393-L451 HydrophobicContact CG1-CB 4.36Å; I393-L451 HydrophobicContact CG1-CD2 4.45Å; V394-L451 PolarHBondContact N-O 3.07Å; L425-L451 HydrophobicContact CB-CD1 3.86Å; L427-L451 HydrophobicContact CB-CD1 3.87Å; L427-L451 HydrophobicContact CB-CD2 4.44Å; L427-L451 HydrophobicContact CB-CG 4.47Å; L427-L451 HydrophobicContact CD2-CD2 4.43Å; V439-L451 HydrophobicContact CG1-CD1 4.09Å; F443-L451 HydrophobicContact CD1-CB 3.96Å; F443-L451 HydrophobicContact CD1-CD2 3.64Å; F443-L451 HydrophobicContact CD1-CG 4.33Å; F443-L451 HydrophobicContact CD2-CB 4.04Å; F443-L451 HydrophobicContact CE1-CB 3.75Å; F443-L451 HydrophobicContact CE1-CD2 3.86Å; F443-L451 HydrophobicContact CE1-CG 4.44Å; F443-L451 HydrophobicContact CE2-CB 3.82Å; F443-L451 HydrophobicContact CG-CB 4.1Å; F443-L451 HydrophobicContact CG-CD2 4.26Å; F443-L451 HydrophobicContact CZ-CB 3.66Å; L451-C453 HydrophobicContact CG-CB 4.48Å; L451-L463 HydrophobicContact CD2-CD1 3.93Å
452	L	96.9	Very high	83.7	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	127.5	171.7	-52.1	-177.7	0	0	0	109.4	V394 V402 L405 H406 L425 R426 L427 V450	V394-L452 HydrophobicContact CB-CD2 3.63Å; V394-L452 HydrophobicContact CG1-CD2 4.26Å; V394-L452 HydrophobicContact CG2-CD2 3.69Å; V402-L452 HydrophobicContact CG1-CB 4.08Å; V402-L452 WeakPolarHBondContact CG1-O 3.48Å; L405-L452 VanDerWaalsContact C-CD1 3.5Å; L405-L452 HydrophobicContact CB-CD1 3.82Å; H406-L452 VanDerWaalsContact CA-CD1 3.47Å; H406-L452 HydrophobicContact CB-CD1 3.98Å; H406-L452 VanDerWaalsContact N-CD1 3.28Å; L425-L452 PolarHBondContact O-N 3.18Å; R426-L452 CarbonylContact C-O 3.54Å; R426-L452 VanDerWaalsContact CA-O 3.24Å; R426-L452 WeakPolarHBondContact CA-O 3.34Å; L427-L452 PolarHBondContact N-O 2.93Å; V450-L452 HydrophobicContact CG1-CD2 3.76Å; V450-L452 HydrophobicContact CG1-CG 4.47Å
453	C	94.9	Very high	83	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	162.5	-171.4	64.2	0	0	0	0	114.6	I393 V394 F395 V396 L427 L451 A457	I393-C453 WeakPolarHBondContact CG2-SG 3.46Å; V394-C453 PolarHBondContact O-N 3.24Å; V394-C453 PolarHBondContact O-SG 3.06Å; F395-C453 WeakPolarHBondContact CA-O 3.44Å; F395-C453 VanDerWaalsContact CD1-SG 3.59Å; F395-C453 VanDerWaalsContact CE1-SG 3.55Å; V396-C453 PolarHBondContact N-O 3.21Å; L427-C453 HydrophobicContact CB-CB 4.28Å; L427-C453 WeakPolarHBondContact O-CA 3.38Å; L427-C453 WeakPolarHBondContact O-CB 3.22Å; L451-C453 HydrophobicContact CG-CB 4.48Å; C453-A457 HydrophobicContact CB-CB 3.81Å
454	T	92.6	Very high	82.1	Confident	15 Å²	15	24.7 Å²	24.7	9%	0.092	16%	0.164	C	C	.	.			trans	-98.6	178.1	164.6	67.1	0	0	0	0	110.1	V396 V402 L427 H428 V456 A457	V396-T454 WeakPolarHBondContact O-CA 3.45Å; V402-T454 HydrophobicContact CG2-CG2 3.94Å; L427-T454 PolarHBondContact O-N 3.47Å; H428-T454 HydrophobicContact CB-CG2 3.93Å; T454-V456 PolarHBondContact O-N 2.75Å; T454-V456 WeakPolarHBondContact OG1-CG2 3.39Å; T454-A457 PolarHBondContact O-N 3.04Å
455	D	85.3	Confident	81.6	Confident	31 Å²	31	30.7 Å²	30.7	17%	0.166	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	1.1	179.5	-62.6	-74.7	0	0	0	116.1	A457 A458 R484	D455-A457 PolarHBondContact O-N 2.83Å; D455-A458 HydrophobicContact CB-CB 4.07Å; D455-A458 PolarHBondContact O-N 3.29Å; D455-R484 VanDerWaalsContact CG-NH2 3.34Å; D455-R484 IonicContact OD1-CZ 2.69Å; D455-R484 VanDerWaalsContact OD1-CZ 3.29Å; D455-R484 IonicContact OD1-NE 3.08Å; D455-R484 PolarHBondContact OD1-NE 2.92Å; D455-R484 IonicContact OD1-NH2 2.6Å; D455-R484 PolarHBondContact OD1-NH2 3.1Å; D455-R484 IonicContact OD2-CZ 2.71Å; D455-R484 IonicContact OD2-NH2 2.72Å; D455-R484 PolarHBondContact OD2-NH2 2.9Å
456	V	78.3	Confident	81.7	Confident	37 Å²	37	26.8 Å²	26.8	22%	0.224	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-31.5	157.9	171.4	0	0	0	0	111.8	T454	T454-V456 PolarHBondContact O-N 2.75Å; T454-V456 WeakPolarHBondContact OG1-CG2 3.39Å
457	A	72.4	Confident	81.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	-94.8	-8	177.6	0	0	0	0	0	114.5	F395 L427 C453 T454 D455 L461 R487	F395-A457 HydrophobicContact CE1-CB 4.09Å; F395-A457 HydrophobicContact CZ-CB 4.5Å; L427-A457 HydrophobicContact CD2-CB 4.22Å; C453-A457 HydrophobicContact CB-CB 3.81Å; T454-A457 PolarHBondContact O-N 3.04Å; D455-A457 PolarHBondContact O-N 2.83Å; A457-L461 HydrophobicContact CB-CD1 3.85Å; A457-R487 WeakPolarHBondContact O-CD 3.33Å
458	A	64.1	Low	82.2	Confident	2 Å²	2	22.6 Å²	22.6	2%	0.017	13%	0.128	C	C	.	.	S	Bend	trans	-78.6	-19	-168.7	0	0	0	0	0	115	F395 D455 H483 R484 R487	F395-A458 HydrophobicContact CD1-CB 4.46Å; F395-A458 HydrophobicContact CE1-CB 3.69Å; F395-A458 HydrophobicContact CZ-CB 4.05Å; D455-A458 HydrophobicContact CB-CB 4.07Å; D455-A458 PolarHBondContact O-N 3.29Å; A458-H483 CarbonylContact O-C 3.55Å; A458-R484 HydrophobicContact CB-CG 3.77Å; A458-R487 PolarHBondContact O-NE 3.12Å; A458-R487 VanDerWaalsContact O-NE 3.1Å; A458-R487 PolarHBondContact O-NH2 3.45Å
459	R	72.1	Confident	82.5	Confident	11 Å²	11	21.3 Å²	21.3	4%	0.042	12%	0.118	C	C	.	.	S	Bend	trans	-133.4	154	-177.5	-64.5	-168	-155.5	178.1	10.7	112	D285 R286 D289 L461 H483	D285-R459 IonicContact OD1-NH1 2.71Å; D285-R459 PolarHBondContact OD1-NH1 3.36Å; R286-R459 HydrophobicContact CG-CB 4.24Å; D289-R459 IonicContact OD2-CZ 3.88Å; D289-R459 IonicContact OD2-NH1 2.89Å; D289-R459 PolarHBondContact OD2-NH1 3.32Å; D289-R459 IonicContact OD2-NH2 3.47Å; D289-R459 PolarHBondContact OD2-NH2 3.33Å; R459-L461 PolarHBondContact O-N 2.84Å; R459-H483 HydrophobicContact CG-CB 3.72Å; R459-H483 PolarHBondContact NE-CD2 3.16Å; R459-H483 PolarHBondContact NE-NE2 3.06Å; R459-H483 PolarHBondContact NH1-NE2 2.83Å
460	G	61	Low	82.8	Confident	7 Å²	7	21 Å²	21	7%	0.072	11%	0.114	C	C	.	.	S	Bend	trans	70	-49.9	-177.7	0	0	0	0	0	116.6	Q214 E283 D462	Q214-G460 PolarHBondContact NE2-O 3.23Å; Q214-G460 PolarHBondContact OE1-O 2.89Å; E283-G460 PolarHBondContact OE1-N 2.97Å; G460-D462 PolarHBondContact O-N 2.85Å
461	L	72.6	Confident	82.9	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.113	C	C	.	.			trans	-53.2	134.2	-171.8	-59	-161.2	0	0	0	113.3	E210 L427 F440 A457 R459 L463 R487 R490	E210-L461 HydrophobicContact CB-CD2 3.28Å; E210-L461 HydrophobicContact CG-CD2 4.01Å; L427-L461 HydrophobicContact CD2-CD1 3.85Å; F440-L461 HydrophobicContact CD2-CD1 4.24Å; F440-L461 HydrophobicContact CD2-CD2 4.47Å; F440-L461 HydrophobicContact CE2-CB 4.29Å; F440-L461 HydrophobicContact CE2-CD1 4.26Å; F440-L461 HydrophobicContact CE2-CD2 4.15Å; F440-L461 HydrophobicContact CE2-CG 4.48Å; A457-L461 HydrophobicContact CB-CD1 3.85Å; R459-L461 PolarHBondContact O-N 2.84Å; L461-L463 HydrophobicContact CB-CG 4.42Å; L461-L463 HydrophobicContact CD1-CD1 4.26Å; L461-R487 PolarHBondContact O-NH1 2.88Å; L461-R490 PolarHBondContact O-NH1 2.71Å; L461-R490 PolarHBondContact O-NH2 3.22Å; L461-R490 VanDerWaalsContact O-NH2 3.09Å
462	D	69.1	Low	83	Confident	61 Å²	61	21.3 Å²	21.3	33%	0.326	12%	0.115	S	C	.	.			trans	-105.4	103.1	166.1	-162.6	42.1	0	0	0	110.9	Q214 G460 R490	Q214-D462 HydrophobicContact CG-CB 4.46Å; G460-D462 PolarHBondContact O-N 2.85Å; D462-R490 VanDerWaalsContact CA-NH1 3.33Å; D462-R490 IonicContact OD1-CZ 3.61Å; D462-R490 IonicContact OD1-NH1 3.87Å; D462-R490 PolarHBondContact OD1-NH1 3.22Å
463	L	75.3	Confident	82.9	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.01	12%	0.116	C	C	.	.			trans	-112.6	96.8	177.2	-67.7	174.5	0	0	0	106.3	I393 F440 F443 S444 L451 L461 V466	I393-L463 HydrophobicContact CD1-CB 4.48Å; I393-L463 HydrophobicContact CD1-CD1 3.58Å; F440-L463 HydrophobicContact CD2-CD2 3.67Å; F440-L463 HydrophobicContact CE2-CD2 3.41Å; F440-L463 VanDerWaalsContact CE2-CD2 3.41Å; F440-L463 HydrophobicContact CE2-CG 4.1Å; F440-L463 HydrophobicContact CZ-CD2 4.2Å; F443-L463 HydrophobicContact CD1-CD1 4.03Å; F443-L463 HydrophobicContact CD1-CD2 3.96Å; F443-L463 HydrophobicContact CD1-CG 4.41Å; F443-L463 HydrophobicContact CE1-CD1 4.1Å; S444-L463 WeakPolarHBondContact OG-CD2 3.4Å; L451-L463 HydrophobicContact CD2-CD1 3.93Å; L461-L463 HydrophobicContact CB-CG 4.42Å; L461-L463 HydrophobicContact CD1-CD1 4.26Å; L463-V466 HydrophobicContact CB-CG2 3.79Å; L463-V466 WeakPolarHBondContact O-CG2 3.47Å
464	P	70.9	Confident	82.9	Confident	55 Å²	55	21.7 Å²	21.7	36%	0.357	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	148.8	-172.3	26.8	-34.9	0	0	0	111.3	K391 V466	K391-P464 WeakPolarHBondContact CE-O 3.4Å; K391-P464 PolarHBondContact NZ-O 2.69Å; P464-V466 PolarHBondContact O-N 2.6Å
465	Q	76.7	Confident	82.8	Confident	152 Å²	152	21 Å²	21	71%	0.71	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.4	22.9	171.9	-58.6	173.2	-21	0	0	115.5	T467	Q465-T467 PolarHBondContact O-N 3.21Å
466	V	89.1	Confident	83	Confident	5 Å²	5	21.7 Å²	21.7	3%	0.03	12%	0.12	C	C	.	.			trans	-65.2	123.5	168.4	176.3	0	0	0	0	108.8	K391 I393 F443 L463 P464 I469 T488	K391-V466 HydrophobicContact CD-CG2 4.29Å; K391-V466 HydrophobicContact CG-CG2 4.25Å; K391-V466 WeakPolarHBondContact O-CG1 3.26Å; I393-V466 HydrophobicContact CD1-CB 4.47Å; I393-V466 HydrophobicContact CD1-CG1 3.93Å; I393-V466 HydrophobicContact CD1-CG2 3.82Å; I393-V466 HydrophobicContact CG1-CG1 3.83Å; I393-V466 HydrophobicContact CG1-CG2 4.16Å; F443-V466 HydrophobicContact CE1-CG2 4.01Å; F443-V466 HydrophobicContact CZ-CG2 4.39Å; L463-V466 HydrophobicContact CB-CG2 3.79Å; L463-V466 WeakPolarHBondContact O-CG2 3.47Å; P464-V466 PolarHBondContact O-N 2.6Å; V466-I469 HydrophobicContact CG1-CD1 3.53Å; V466-T488 WeakPolarHBondContact O-CB 3.17Å; V466-T488 PolarHBondContact O-OG1 3.29Å
467	T	91.4	Very high	83.4	Confident	43 Å²	43	21.5 Å²	21.5	26%	0.264	12%	0.121	S	C	.	.			trans	-98.1	-25.3	-175	54.7	0	0	0	0	113.5	N390 K391 Q465 N496	N390-T467 WeakPolarHBondContact CB-OG1 3.15Å; N390-T467 VanDerWaalsContact OD1-CB 3.24Å; N390-T467 WeakPolarHBondContact OD1-CB 3.43Å; N390-T467 PolarHBondContact OD1-OG1 3.45Å; K391-T467 PolarHBondContact N-OG1 3.02Å; K391-T467 PolarHBondContact O-N 2.73Å; K391-T467 PolarHBondContact O-OG1 3.16Å; Q465-T467 PolarHBondContact O-N 3.21Å; T467-N496 PolarHBondContact O-N 2.75Å; T467-N496 PolarHBondContact O-ND2 3.09Å
468	W	94.4	Very high	84.1	Confident	15 Å²	15	21.9 Å²	21.9	6%	0.057	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	132.5	-178.9	-81.3	102.4	0	0	0	113.3	F363 F379 Q383 K391 I392 I393 N496 L498 M522	F363-W468 AromaticContact CD2-CH2 3.94Å; F363-W468 HydrophobicContact CD2-CH2 3.94Å; F363-W468 AromaticContact CD2-CZ3 3.92Å; F363-W468 HydrophobicContact CD2-CZ3 3.92Å; F363-W468 HydrophobicContact CE2-CH2 4Å; F363-W468 HydrophobicContact CE2-CZ3 4.36Å; F379-W468 HydrophobicContact CE1-CD2 4.27Å; F379-W468 HydrophobicContact CE1-CE3 4.26Å; F379-W468 HydrophobicContact CE1-CG 4.5Å; F379-W468 HydrophobicContact CE2-CH2 4.23Å; F379-W468 HydrophobicContact CE2-CZ2 4.43Å; F379-W468 HydrophobicContact CE2-CZ3 4.26Å; F379-W468 AromaticContact CZ-CD2 3.64Å; F379-W468 HydrophobicContact CZ-CD2 3.64Å; F379-W468 AromaticContact CZ-CE2 3.91Å; F379-W468 AromaticContact CZ-CE3 3.54Å; F379-W468 HydrophobicContact CZ-CE3 3.54Å; F379-W468 HydrophobicContact CZ-CG 4.28Å; F379-W468 AromaticContact CZ-CH2 3.98Å; F379-W468 HydrophobicContact CZ-CH2 3.98Å; F379-W468 HydrophobicContact CZ-CZ2 4.08Å; F379-W468 AromaticContact CZ-CZ3 3.71Å; F379-W468 HydrophobicContact CZ-CZ3 3.71Å; Q383-W468 VanDerWaalsContact CD-NE1 3.33Å; K391-W468 PolarHBondContact O-N 2.85Å; I392-W468 WeakPolarHBondContact CA-O 3.18Å; I392-W468 HydrophobicContact CB-CB 4.42Å; I392-W468 HydrophobicContact CG1-CB 4.14Å; I392-W468 HydrophobicContact CG2-CB 4.04Å; I393-W468 PolarHBondContact N-O 3.44Å; W468-N496 CarbonylContact C-O 3.24Å; W468-N496 VanDerWaalsContact CA-O 3.31Å; W468-N496 WeakPolarHBondContact CA-O 3.37Å; W468-N496 HydrophobicContact CD2-CB 3.53Å; W468-N496 HydrophobicContact CE3-CB 3.33Å; W468-N496 HydrophobicContact CG-CB 4.37Å; W468-N496 HydrophobicContact CH2-CB 3.58Å; W468-N496 HydrophobicContact CZ2-CB 3.76Å; W468-N496 HydrophobicContact CZ3-CB 3.37Å; W468-L498 HydrophobicContact CE3-CB 4.45Å; W468-L498 HydrophobicContact CZ3-CB 4.14Å; W468-M522 HydrophobicContact CH2-CE 4.16Å
469	I	95.2	Very high	84.9	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	106.8	169	-55.1	-56.8	0	0	0	110.1	I393 F395 V466 Q471 R487 T488 N496 S497 L498	I393-I469 HydrophobicContact CB-CD1 3.84Å; I393-I469 HydrophobicContact CD1-CD1 4.05Å; I393-I469 HydrophobicContact CG1-CD1 4.23Å; F395-I469 HydrophobicContact CD2-CG2 3.81Å; F395-I469 HydrophobicContact CE2-CG2 3.76Å; V466-I469 HydrophobicContact CG1-CD1 3.53Å; I469-Q471 HydrophobicContact CG2-CG 4.34Å; I469-R487 HydrophobicContact CD1-CB 3.57Å; I469-R487 HydrophobicContact CG1-CB 4.31Å; I469-T488 HydrophobicContact CG1-CG2 3.59Å; I469-N496 PolarHBondContact N-O 2.76Å; I469-S497 CarbonylContact O-C 3.51Å; I469-S497 WeakPolarHBondContact O-CA 3.46Å; I469-L498 PolarHBondContact O-N 3.34Å
470	V	97.4	Very high	85.6	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	119.1	175	-177.3	0	0	0	0	109.5	L376 F379 I392 I393 V394 F395 Y472 L498 F500	L376-V470 HydrophobicContact CD1-CG1 3.88Å; F379-V470 HydrophobicContact CD1-CG2 3.77Å; F379-V470 HydrophobicContact CE1-CG2 3.45Å; F379-V470 VanDerWaalsContact CE1-CG2 3.45Å; F379-V470 HydrophobicContact CZ-CG2 4.46Å; I392-V470 HydrophobicContact CG2-CG2 3.87Å; I393-V470 PolarHBondContact O-N 2.88Å; V394-V470 CarbonylContact C-O 3.54Å; V394-V470 WeakPolarHBondContact CA-O 3.47Å; V394-V470 HydrophobicContact CB-CB 4.44Å; V394-V470 HydrophobicContact CG1-CB 4.21Å; V394-V470 HydrophobicContact CG1-CG1 4.19Å; V394-V470 HydrophobicContact CG2-CB 4.19Å; F395-V470 PolarHBondContact N-O 3.34Å; V470-Y472 PolarHBondContact O-N 2.66Å; V470-L498 CarbonylContact C-O 3.57Å; V470-L498 WeakPolarHBondContact CA-O 3.29Å; V470-F500 HydrophobicContact CG1-CD2 3.78Å; V470-F500 HydrophobicContact CG1-CE2 3.49Å; V470-F500 VanDerWaalsContact CG1-CE2 3.49Å; V470-F500 HydrophobicContact CG1-CZ 4.41Å
471	Q	96.9	Very high	87	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	81	172.9	-59.9	-169.6	67.3	0	0	108.6	I469 T473 L498 L499 F500	I469-Q471 HydrophobicContact CG2-CG 4.34Å; Q471-T473 VanDerWaalsContact C-N 3.33Å; Q471-L498 PolarHBondContact N-O 2.85Å; Q471-L499 HydrophobicContact CB-CD1 3.74Å; Q471-F500 PolarHBondContact O-N 3.04Å
472	Y	97.1	Very high	87.5	Confident	10 Å²	10	23.1 Å²	23.1	4%	0.039	13%	0.131	C	C	.	.	S	Bend	trans	-74.1	-23.3	-175.4	-175.5	-110.8	0	0	0	113.1	R372 L376 F395 V396 L405 V470 F500	R372-Y472 HydrophobicContact CG-CE2 3.71Å; R372-Y472 PolarHBondContact NE-O 3.17Å; R372-Y472 PolarHBondContact NH2-O 3.09Å; R372-Y472 WeakPolarHBondContact O-CE2 3.48Å; L376-Y472 HydrophobicContact CB-CD2 3.91Å; L376-Y472 HydrophobicContact CB-CE2 3.66Å; L376-Y472 HydrophobicContact CD1-CD2 4.14Å; L376-Y472 HydrophobicContact CD2-CD1 3.99Å; L376-Y472 HydrophobicContact CD2-CD2 3.6Å; L376-Y472 HydrophobicContact CD2-CE1 4.13Å; L376-Y472 HydrophobicContact CD2-CE2 3.73Å; L376-Y472 HydrophobicContact CD2-CG 3.72Å; L376-Y472 HydrophobicContact CG-CD2 4.09Å; L376-Y472 HydrophobicContact CG-CE2 4.22Å; F395-Y472 PolarHBondContact O-N 3.32Å; V396-Y472 HydrophobicContact CG2-CD1 4.38Å; L405-Y472 HydrophobicContact CD1-CD1 4.15Å; L405-Y472 HydrophobicContact CD1-CE1 4.07Å; V470-Y472 PolarHBondContact O-N 2.66Å; Y472-F500 HydrophobicContact CD2-CB 4.44Å; Y472-F500 AromaticContact CD2-CD1 3.68Å; Y472-F500 HydrophobicContact CD2-CD1 3.68Å; Y472-F500 HydrophobicContact CD2-CD2 4.48Å; Y472-F500 AromaticContact CD2-CE1 3.97Å; Y472-F500 HydrophobicContact CD2-CE1 3.97Å; Y472-F500 AromaticContact CD2-CG 3.97Å; Y472-F500 HydrophobicContact CD2-CG 3.97Å; Y472-F500 AromaticContact CE2-CD1 3.89Å; Y472-F500 HydrophobicContact CE2-CD1 3.89Å; Y472-F500 HydrophobicContact CE2-CE1 4.08Å
473	T	94.6	Very high	88.2	Confident	5 Å²	5	20.2 Å²	20.2	3%	0.031	12%	0.116	C	C	.	.	S	Bend	trans	-114.2	135.3	154.4	-43.6	0	0	0	0	109	F395 S397 Q471 R484 F588	F395-T473 PolarHBondContact O-N 3.37Å; F395-T473 VanDerWaalsContact O-N 3.12Å; S397-T473 PolarHBondContact N-OG1 2.73Å; Q471-T473 VanDerWaalsContact C-N 3.33Å; T473-R484 PolarHBondContact O-NH1 2.95Å; T473-F588 HydrophobicContact CG2-CD2 4.46Å; T473-F588 HydrophobicContact CG2-CE2 3.91Å
474	P	94.1	Very high	88.8	Confident	4 Å²	4	20.2 Å²	20.2	3%	0.026	12%	0.116	C	C	.	.			trans	-56.9	155.1	176.6	-27.1	37.8	0	0	0	112.3	L499 L501 Y595 F603	P474-L499 HydrophobicContact CB-CD1 4.28Å; P474-L499 HydrophobicContact CG-CD1 4.47Å; P474-L501 HydrophobicContact CB-CD2 4.2Å; P474-L501 HydrophobicContact CG-CD2 3.61Å; P474-Y595 PolarHBondContact O-OH 3.44Å; P474-Y595 VanDerWaalsContact O-OH 3.07Å; P474-F603 HydrophobicContact CB-CE1 3.9Å; P474-F603 HydrophobicContact CB-CE2 4.48Å; P474-F603 HydrophobicContact CB-CZ 3.61Å; P474-F603 HydrophobicContact CG-CE1 3.81Å; P474-F603 HydrophobicContact CG-CZ 4.01Å
475	P	92	Very high	89.6	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.099	C	C	.	.			trans	-79.1	154.6	177	28.8	-28.7	0	0	0	111.6	S477 E480 Y481 F508	P475-S477 PolarHBondContact O-N 3.47Å; P475-E480 WeakPolarHBondContact CA-OE1 3.2Å; P475-E480 HydrophobicContact CB-CB 3.91Å; P475-E480 HydrophobicContact CB-CG 3.74Å; P475-E480 WeakPolarHBondContact CB-OE1 3.32Å; P475-Y481 HydrophobicContact CG-CD2 4.03Å; P475-Y481 HydrophobicContact CG-CG 4.32Å; P475-F508 HydrophobicContact CG-CE1 4.15Å; P475-F508 HydrophobicContact CG-CZ 4Å
476	S	88.5	Confident	89.9	Confident	45 Å²	45	10.5 Å²	10.5	32%	0.315	7%	0.066	S	C	.	.	S	Bend	trans	-79	-3.4	-179.6	76.3	0	0	0	0	114.7	E480 P596 L599	S476-E480 WeakPolarHBondContact CB-OE2 3.48Å; S476-E480 VanDerWaalsContact N-CD 3.27Å; S476-E480 PolarHBondContact N-OE1 3.09Å; S476-E480 PolarHBondContact N-OE2 3.38Å; S476-E480 PolarHBondContact OG-OE2 3.33Å; S476-P596 WeakPolarHBondContact O-CD 3.47Å; S476-P596 WeakPolarHBondContact O-CG 3.34Å; S476-L599 VanDerWaalsContact O-CD1 3.22Å; S476-L599 WeakPolarHBondContact O-CD1 3.49Å
477	S	86.9	Confident	89.7	Confident	34 Å²	34	10.4 Å²	10.4	24%	0.238	7%	0.065	C	C	.	.	S	Bend	trans	-159.5	160.7	175.8	58.7	0	0	0	0	111.7	P475 A479 E480 Y481	P475-S477 PolarHBondContact O-N 3.47Å; S477-A479 VanDerWaalsContact C-N 3.31Å; S477-A479 PolarHBondContact O-N 3.19Å; S477-E480 PolarHBondContact O-N 3.34Å; S477-E480 VanDerWaalsContact OG-CB 3.27Å; S477-E480 WeakPolarHBondContact OG-CB 3.24Å; S477-E480 PolarHBondContact OG-N 2.91Å; S477-E480 VanDerWaalsContact OG-N 3.15Å; S477-Y481 PolarHBondContact O-N 3.03Å; S477-Y481 VanDerWaalsContact O-N 3.08Å
478	A	86.2	Confident	89.5	Confident	7 Å²	7	8.5 Å²	8.5	6%	0.058	5%	0.053	C	C	.	.	H	α-helix	trans	-65.1	-32.3	172.2	0	0	0	0	0	112.7	F354 Y481 V482 L512 H515 I517	F354-A478 HydrophobicContact CD2-CB 4.15Å; F354-A478 HydrophobicContact CE2-CB 3.63Å; A478-Y481 WeakPolarHBondContact O-CB 3.31Å; A478-Y481 PolarHBondContact O-N 2.85Å; A478-V482 WeakPolarHBondContact O-CG2 3.44Å; A478-V482 PolarHBondContact O-N 3.28Å; A478-V482 VanDerWaalsContact O-N 3.11Å; A478-L512 HydrophobicContact CB-CD2 4.26Å; A478-H515 HydrophobicContact CB-CB 3.96Å; A478-H515 VanDerWaalsContact CB-CD2 3.43Å; A478-H515 WeakPolarHBondContact CB-CD2 3.4Å; A478-I517 HydrophobicContact CB-CD1 4.2Å
479	A	81.9	Confident	88.9	Confident	16 Å²	16	8 Å²	8	13%	0.132	5%	0.052	C	C	.	.	H	α-helix	trans	-57.8	-50.5	169.8	0	0	0	0	0	111.6	T318 F354 S477 Y481 V482 H483	T318-A479 HydrophobicContact CG2-CB 3.79Å; F354-A479 HydrophobicContact CE1-CB 4.22Å; F354-A479 HydrophobicContact CZ-CB 3.98Å; S477-A479 VanDerWaalsContact C-N 3.31Å; S477-A479 PolarHBondContact O-N 3.19Å; A479-Y481 VanDerWaalsContact C-N 3.32Å; A479-Y481 PolarHBondContact O-N 2.83Å; A479-V482 PolarHBondContact O-N 2.79Å; A479-V482 VanDerWaalsContact O-N 3.12Å; A479-H483 PolarHBondContact O-CD2 3.01Å; A479-H483 PolarHBondContact O-N 3.21Å
480	E	85.9	Confident	87.9	Confident	21 Å²	21	9.8 Å²	9.8	10%	0.098	6%	0.059	C	C	.	.	H	α-helix	trans	-61.4	-37.5	178.1	-176.3	-167.4	137.9	0	0	112.5	P475 S476 S477 V482 H483 R484	P475-E480 WeakPolarHBondContact CA-OE1 3.2Å; P475-E480 HydrophobicContact CB-CB 3.91Å; P475-E480 HydrophobicContact CB-CG 3.74Å; P475-E480 WeakPolarHBondContact CB-OE1 3.32Å; S476-E480 WeakPolarHBondContact CB-OE2 3.48Å; S476-E480 VanDerWaalsContact N-CD 3.27Å; S476-E480 PolarHBondContact N-OE1 3.09Å; S476-E480 PolarHBondContact N-OE2 3.38Å; S476-E480 PolarHBondContact OG-OE2 3.33Å; S477-E480 PolarHBondContact O-N 3.34Å; S477-E480 VanDerWaalsContact OG-CB 3.27Å; S477-E480 WeakPolarHBondContact OG-CB 3.24Å; S477-E480 PolarHBondContact OG-N 2.91Å; S477-E480 VanDerWaalsContact OG-N 3.15Å; E480-V482 PolarHBondContact O-N 2.96Å; E480-H483 PolarHBondContact O-N 3.33Å; E480-R484 WeakPolarHBondContact O-CB 3.25Å; E480-R484 VanDerWaalsContact O-CG 3.3Å; E480-R484 WeakPolarHBondContact O-CG 3.49Å; E480-R484 PolarHBondContact O-N 2.95Å; E480-R484 IonicContact OE1-CZ 2.92Å; E480-R484 IonicContact OE1-NE 3.79Å; E480-R484 PolarHBondContact OE1-NE 3.34Å; E480-R484 IonicContact OE1-NH1 3Å; E480-R484 IonicContact OE1-NH2 3.66Å; E480-R484 PolarHBondContact OE1-NH2 3.49Å
481	Y	90.1	Very high	86.6	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-53.3	-53.5	169.6	-179.7	-82.5	0	0	0	111.2	P475 S477 A478 A479 H483 R484 V485 L499 L512 I517 V519	P475-Y481 HydrophobicContact CG-CD2 4.03Å; P475-Y481 HydrophobicContact CG-CG 4.32Å; S477-Y481 PolarHBondContact O-N 3.03Å; S477-Y481 VanDerWaalsContact O-N 3.08Å; A478-Y481 WeakPolarHBondContact O-CB 3.31Å; A478-Y481 PolarHBondContact O-N 2.85Å; A479-Y481 VanDerWaalsContact C-N 3.32Å; A479-Y481 PolarHBondContact O-N 2.83Å; Y481-H483 PolarHBondContact O-N 2.9Å; Y481-R484 WeakPolarHBondContact O-CB 3.24Å; Y481-R484 PolarHBondContact O-N 3.43Å; Y481-V485 HydrophobicContact CD1-CG1 4.24Å; Y481-V485 HydrophobicContact CD1-CG2 4.29Å; Y481-V485 HydrophobicContact CE1-CG1 3.81Å; Y481-V485 HydrophobicContact CE1-CG2 4.09Å; Y481-V485 HydrophobicContact CE2-CG1 4.49Å; Y481-V485 PolarHBondContact O-N 2.85Å; Y481-L499 HydrophobicContact CE2-CB 4.5Å; Y481-L499 HydrophobicContact CE2-CD2 4.17Å; Y481-L512 HydrophobicContact CD1-CD2 4.26Å; Y481-L512 HydrophobicContact CD2-CD1 3.89Å; Y481-L512 HydrophobicContact CD2-CD2 3.86Å; Y481-L512 HydrophobicContact CE2-CD1 3.73Å; Y481-L512 HydrophobicContact CE2-CD2 4.42Å; Y481-L512 HydrophobicContact CG-CD2 3.78Å; Y481-I517 HydrophobicContact CD1-CD1 4.01Å; Y481-I517 HydrophobicContact CD1-CG2 4.07Å; Y481-I517 HydrophobicContact CE1-CG2 3.54Å; Y481-V519 WeakPolarHBondContact OH-CG1 3.48Å
482	V	84.8	Confident	85.2	Confident	10 Å²	10	16.1 Å²	16.1	6%	0.061	10%	0.102	C	C	.	.	H	α-helix	trans	-62.1	-43	-176.6	171.9	0	0	0	0	111.4	F354 V356 A478 A479 E480 R484 V485 G486 I517	F354-V482 HydrophobicContact CB-CG1 4.48Å; F354-V482 HydrophobicContact CB-CG2 3.65Å; F354-V482 HydrophobicContact CD2-CG2 4.13Å; F354-V482 HydrophobicContact CG-CG2 3.88Å; V356-V482 HydrophobicContact CG1-CG1 4.35Å; V356-V482 HydrophobicContact CG1-CG2 4.23Å; A478-V482 WeakPolarHBondContact O-CG2 3.44Å; A478-V482 PolarHBondContact O-N 3.28Å; A478-V482 VanDerWaalsContact O-N 3.11Å; A479-V482 PolarHBondContact O-N 2.79Å; A479-V482 VanDerWaalsContact O-N 3.12Å; E480-V482 PolarHBondContact O-N 2.96Å; V482-R484 PolarHBondContact O-N 3.2Å; V482-V485 WeakPolarHBondContact O-CG2 3.33Å; V482-G486 PolarHBondContact O-N 2.93Å; V482-I517 HydrophobicContact CG2-CD1 3.63Å; V482-I517 HydrophobicContact CG2-CG1 4.34Å
483	H	82.4	Confident	84.2	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-62.3	-40.8	176.1	-70.1	-71.8	0	0	0	113.2	T171 D285 A458 R459 A479 E480 Y481 R487	T171-H483 WeakPolarHBondContact CG2-ND1 3.24Å; D285-H483 IonicContact OD1-CE1 3.76Å; D285-H483 IonicContact OD2-CE1 2.78Å; D285-H483 IonicContact OD2-NE2 3.22Å; A458-H483 CarbonylContact O-C 3.55Å; R459-H483 HydrophobicContact CG-CB 3.72Å; R459-H483 PolarHBondContact NE-CD2 3.16Å; R459-H483 PolarHBondContact NE-NE2 3.06Å; R459-H483 PolarHBondContact NH1-NE2 2.83Å; A479-H483 PolarHBondContact O-CD2 3.01Å; A479-H483 PolarHBondContact O-N 3.21Å; E480-H483 PolarHBondContact O-N 3.33Å; Y481-H483 PolarHBondContact O-N 2.9Å; H483-R487 PolarHBondContact O-NE 3.02Å; H483-R487 PolarHBondContact O-NH2 3.35Å; H483-R487 VanDerWaalsContact O-NH2 3.1Å
484	R	88.7	Confident	83.7	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-64.8	-51.9	176.8	-75.1	172.2	172.6	-170	0.1	111.4	F395 D455 A458 T473 E480 Y481 V482 G486 R487	F395-R484 HydrophobicContact CD1-CG 4.13Å; F395-R484 HydrophobicContact CD2-CB 3.97Å; F395-R484 HydrophobicContact CD2-CG 3.85Å; F395-R484 HydrophobicContact CE1-CG 4.16Å; F395-R484 HydrophobicContact CE2-CB 3.8Å; F395-R484 HydrophobicContact CE2-CG 3.86Å; F395-R484 HydrophobicContact CG-CG 3.99Å; F395-R484 HydrophobicContact CZ-CB 4.32Å; F395-R484 HydrophobicContact CZ-CG 4.03Å; D455-R484 VanDerWaalsContact CG-NH2 3.34Å; D455-R484 IonicContact OD1-CZ 2.69Å; D455-R484 VanDerWaalsContact OD1-CZ 3.29Å; D455-R484 IonicContact OD1-NE 3.08Å; D455-R484 PolarHBondContact OD1-NE 2.92Å; D455-R484 IonicContact OD1-NH2 2.6Å; D455-R484 PolarHBondContact OD1-NH2 3.1Å; D455-R484 IonicContact OD2-CZ 2.71Å; D455-R484 IonicContact OD2-NH2 2.72Å; D455-R484 PolarHBondContact OD2-NH2 2.9Å; A458-R484 HydrophobicContact CB-CG 3.77Å; T473-R484 PolarHBondContact O-NH1 2.95Å; E480-R484 WeakPolarHBondContact O-CB 3.25Å; E480-R484 VanDerWaalsContact O-CG 3.3Å; E480-R484 WeakPolarHBondContact O-CG 3.49Å; E480-R484 PolarHBondContact O-N 2.95Å; E480-R484 IonicContact OE1-CZ 2.92Å; E480-R484 IonicContact OE1-NE 3.79Å; E480-R484 PolarHBondContact OE1-NE 3.34Å; E480-R484 IonicContact OE1-NH1 3Å; E480-R484 IonicContact OE1-NH2 3.66Å; E480-R484 PolarHBondContact OE1-NH2 3.49Å; Y481-R484 WeakPolarHBondContact O-CB 3.24Å; Y481-R484 PolarHBondContact O-N 3.43Å; V482-R484 PolarHBondContact O-N 3.2Å; R484-G486 VanDerWaalsContact C-N 3.28Å; R484-G486 PolarHBondContact O-N 3.2Å; R484-R487 WeakPolarHBondContact O-CB 3.44Å; R484-R487 WeakPolarHBondContact O-CG 3.39Å; R484-R487 PolarHBondContact O-N 3.34Å; R484-R487 VanDerWaalsContact O-N 3.09Å
485	V	88.1	Confident	83.6	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.3	-32.5	179.2	-56.4	0	0	0	0	111.8	L360 Y481 V482 R487 T488	L360-V485 HydrophobicContact CD1-CB 4.44Å; L360-V485 HydrophobicContact CD2-CB 3.83Å; L360-V485 HydrophobicContact CD2-CG2 3.57Å; Y481-V485 HydrophobicContact CD1-CG1 4.24Å; Y481-V485 HydrophobicContact CD1-CG2 4.29Å; Y481-V485 HydrophobicContact CE1-CG1 3.81Å; Y481-V485 HydrophobicContact CE1-CG2 4.09Å; Y481-V485 HydrophobicContact CE2-CG1 4.49Å; Y481-V485 PolarHBondContact O-N 2.85Å; V482-V485 WeakPolarHBondContact O-CG2 3.33Å; V485-R487 PolarHBondContact O-N 2.87Å; V485-T488 WeakPolarHBondContact O-CG2 3.21Å; V485-T488 PolarHBondContact O-N 2.96Å
486	G	81.7	Confident	83.6	Confident	3 Å²	3	28 Å²	28	3%	0.031	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	13	169.2	0	0	0	0	0	115.8	T171 V482 R484 R490	T171-G486 PolarHBondContact OG1-O 3.2Å; V482-G486 PolarHBondContact O-N 2.93Å; R484-G486 VanDerWaalsContact C-N 3.28Å; R484-G486 PolarHBondContact O-N 3.2Å; G486-R490 VanDerWaalsContact O-CZ 3.31Å; G486-R490 PolarHBondContact O-NE 2.61Å; G486-R490 PolarHBondContact O-NH2 3.11Å
487	R	84.9	Confident	83.9	Confident	2 Å²	2	26 Å²	26	1%	0.008	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-22.2	159.3	-64.3	-43.9	98.1	172.4	5.3	112.9	T171 I393 F395 A457 A458 L461 I469 H483 R484 V485	T171-R487 PolarHBondContact OG1-NH2 3.31Å; I393-R487 HydrophobicContact CD1-CB 4.1Å; I393-R487 HydrophobicContact CD1-CG 4.42Å; F395-R487 HydrophobicContact CE2-CG 4.37Å; F395-R487 HydrophobicContact CZ-CG 4.06Å; A457-R487 WeakPolarHBondContact O-CD 3.33Å; A458-R487 PolarHBondContact O-NE 3.12Å; A458-R487 VanDerWaalsContact O-NE 3.1Å; A458-R487 PolarHBondContact O-NH2 3.45Å; L461-R487 PolarHBondContact O-NH1 2.88Å; I469-R487 HydrophobicContact CD1-CB 3.57Å; I469-R487 HydrophobicContact CG1-CB 4.31Å; H483-R487 PolarHBondContact O-NE 3.02Å; H483-R487 PolarHBondContact O-NH2 3.35Å; H483-R487 VanDerWaalsContact O-NH2 3.1Å; R484-R487 WeakPolarHBondContact O-CB 3.44Å; R484-R487 WeakPolarHBondContact O-CG 3.39Å; R484-R487 PolarHBondContact O-N 3.34Å; R484-R487 VanDerWaalsContact O-N 3.09Å; V485-R487 PolarHBondContact O-N 2.87Å
488	T	87.1	Confident	84.4	Confident	3 Å²	3	24.3 Å²	24.3	2%	0.018	13%	0.133	C	C	.	.	S	Bend	trans	-107.6	-174.4	170.3	-168.2	0	0	0	0	110.9	L360 V466 I469 V485 R490 G495	L360-T488 HydrophobicContact CD1-CG2 3.55Å; V466-T488 WeakPolarHBondContact O-CB 3.17Å; V466-T488 PolarHBondContact O-OG1 3.29Å; I469-T488 HydrophobicContact CG1-CG2 3.59Å; V485-T488 WeakPolarHBondContact O-CG2 3.21Å; V485-T488 PolarHBondContact O-N 2.96Å; T488-R490 WeakPolarHBondContact O-CG 3.22Å; T488-R490 PolarHBondContact O-N 3.45Å; T488-R490 VanDerWaalsContact O-N 3.17Å; T488-G495 WeakPolarHBondContact OG1-CA 3.28Å
489	A	81.9	Confident	85	Confident	4 Å²	4	24 Å²	24	3%	0.033	13%	0.131	C	C	.	.	S	Bend	trans	52.1	35.7	178.9	0	0	0	0	0	114.8	P357 L360 G493	P357-A489 HydrophobicContact CB-CB 3.77Å; P357-A489 WeakPolarHBondContact CB-O 3.33Å; P357-A489 HydrophobicContact CG-CB 4.02Å; L360-A489 HydrophobicContact CB-CB 3.79Å; L360-A489 HydrophobicContact CD1-CB 4.04Å; A489-G493 CarbonylContact C-O 3.59Å; A489-G493 WeakPolarHBondContact CA-O 3.22Å
490	R	75.5	Confident	85.7	Confident	38 Å²	38	23.3 Å²	23.3	14%	0.143	13%	0.125	C	C	.	.			trans	-88.8	145.7	-173.5	-67.5	-168	163.1	-159.5	0.5	112.8	L461 D462 G486 T488 G492 G493	L461-R490 PolarHBondContact O-NH1 2.71Å; L461-R490 PolarHBondContact O-NH2 3.22Å; L461-R490 VanDerWaalsContact O-NH2 3.09Å; D462-R490 VanDerWaalsContact CA-NH1 3.33Å; D462-R490 IonicContact OD1-CZ 3.61Å; D462-R490 IonicContact OD1-NH1 3.87Å; D462-R490 PolarHBondContact OD1-NH1 3.22Å; G486-R490 VanDerWaalsContact O-CZ 3.31Å; G486-R490 PolarHBondContact O-NE 2.61Å; G486-R490 PolarHBondContact O-NH2 3.11Å; T488-R490 WeakPolarHBondContact O-CG 3.22Å; T488-R490 PolarHBondContact O-N 3.45Å; T488-R490 VanDerWaalsContact O-N 3.17Å; R490-G492 PolarHBondContact O-N 3.08Å; R490-G493 PolarHBondContact O-N 2.76Å
491	I	69.6	Low	86.2	Confident	90 Å²	90	22.3 Å²	22.3	46%	0.462	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	47.3	166.2	-54.1	176.2	0	0	0	110.2	F121 G493	F121-I491 HydrophobicContact CE1-CG2 4.33Å; F121-I491 HydrophobicContact CE2-CG2 4.16Å; F121-I491 WeakPolarHBondContact CE2-O 3.36Å; F121-I491 HydrophobicContact CZ-CG2 3.49Å; F121-I491 VanDerWaalsContact CZ-CG2 3.49Å; I491-G493 PolarHBondContact O-N 3.27Å
492	G	67.5	Low	86.4	Confident	43 Å²	43	22.6 Å²	22.6	44%	0.443	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	-0.1	-178.2	0	0	0	0	0	116.3	R490	R490-G492 PolarHBondContact O-N 3.08Å
493	G	75.6	Confident	86.8	Confident	32 Å²	32	22.8 Å²	22.8	33%	0.33	12%	0.123	S	C	.	.			trans	-72.9	156.6	172.2	0	0	0	0	0	112.8	A489 R490 I491	A489-G493 CarbonylContact C-O 3.59Å; A489-G493 WeakPolarHBondContact CA-O 3.22Å; R490-G493 PolarHBondContact O-N 2.76Å; I491-G493 PolarHBondContact O-N 3.27Å
494	R	85.3	Confident	87.2	Confident	199 Å²	199	24 Å²	24	75%	0.751	13%	0.133	S	C	*	.			trans	-76.4	154.9	171.6	-77.6	176.8	175	168.5	2.6	111.9	E359	E359-R494 HydrophobicContact CB-CG 4.19Å; E359-R494 WeakPolarHBondContact OE2-CG 3.46Å; E359-R494 IonicContact OE2-CZ 3.43Å; E359-R494 IonicContact OE2-NE 2.7Å; E359-R494 PolarHBondContact OE2-NE 3.41Å; E359-R494 IonicContact OE2-NH2 3.25Å; E359-R494 PolarHBondContact OE2-NH2 2.97Å
495	G	90.1	Very high	87.5	Confident	1 Å²	1	24 Å²	24	1%	0.01	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	151.6	175.9	0	0	0	0	0	113.3	E359 L360 Q361 T488	E359-G495 PolarHBondContact O-N 2.7Å; L360-G495 WeakPolarHBondContact CA-O 3.25Å; Q361-G495 PolarHBondContact N-O 3.34Å; T488-G495 WeakPolarHBondContact OG1-CA 3.28Å
496	N	93.4	Very high	87.7	Confident	38 Å²	38	24.2 Å²	24.2	20%	0.203	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	149.3	177.7	-52.3	-78.3	0	0	0	110.2	Q361 F363 T467 W468 I469	Q361-N496 CarbonylContact O-C 3.55Å; Q361-N496 WeakPolarHBondContact O-CA 3.31Å; F363-N496 HydrophobicContact CE2-CB 4.44Å; T467-N496 PolarHBondContact O-N 2.75Å; T467-N496 PolarHBondContact O-ND2 3.09Å; W468-N496 CarbonylContact C-O 3.24Å; W468-N496 VanDerWaalsContact CA-O 3.31Å; W468-N496 WeakPolarHBondContact CA-O 3.37Å; W468-N496 HydrophobicContact CD2-CB 3.53Å; W468-N496 HydrophobicContact CE3-CB 3.33Å; W468-N496 HydrophobicContact CG-CB 4.37Å; W468-N496 HydrophobicContact CH2-CB 3.58Å; W468-N496 HydrophobicContact CZ2-CB 3.76Å; W468-N496 HydrophobicContact CZ3-CB 3.37Å; I469-N496 PolarHBondContact N-O 2.76Å
497	S	95.3	Very high	88.1	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	145.2	174.3	57.1	0	0	0	0	111.3	Q361 F363 I469	Q361-S497 PolarHBondContact O-N 2.8Å; Q361-S497 PolarHBondContact O-OG 3Å; F363-S497 WeakPolarHBondContact CA-O 3.21Å; F363-S497 WeakPolarHBondContact CB-O 3.43Å; F363-S497 WeakPolarHBondContact CD2-O 3.49Å; F363-S497 PolarHBondContact N-O 2.92Å; I469-S497 CarbonylContact O-C 3.51Å; I469-S497 WeakPolarHBondContact O-CA 3.46Å
498	L	97.3	Very high	88.5	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	114.5	-178.3	-179	59.9	0	0	0	110.6	F363 V365 F379 W468 I469 V470 Q471 F500 M522	F363-L498 HydrophobicContact CB-CD1 3.73Å; F363-L498 CarbonylContact O-C 3.35Å; F363-L498 WeakPolarHBondContact O-CA 3.24Å; V365-L498 HydrophobicContact CB-CD1 4.04Å; V365-L498 HydrophobicContact CG1-CD1 3.77Å; V365-L498 HydrophobicContact CG1-CD2 4.29Å; V365-L498 HydrophobicContact CG1-CG 4.09Å; F379-L498 HydrophobicContact CD1-CD2 4.23Å; F379-L498 HydrophobicContact CD2-CD2 3.52Å; F379-L498 HydrophobicContact CE1-CD2 4.18Å; F379-L498 HydrophobicContact CE2-CD2 3.45Å; F379-L498 VanDerWaalsContact CE2-CD2 3.45Å; F379-L498 HydrophobicContact CG-CD2 3.92Å; F379-L498 HydrophobicContact CZ-CD2 3.8Å; W468-L498 HydrophobicContact CE3-CB 4.45Å; W468-L498 HydrophobicContact CZ3-CB 4.14Å; I469-L498 PolarHBondContact O-N 3.34Å; V470-L498 CarbonylContact C-O 3.57Å; V470-L498 WeakPolarHBondContact CA-O 3.29Å; Q471-L498 PolarHBondContact N-O 2.85Å; L498-F500 HydrophobicContact CD2-CD2 4.47Å; L498-F500 HydrophobicContact CD2-CE2 3.68Å; L498-F500 HydrophobicContact CD2-CZ 4.4Å; L498-F500 HydrophobicContact CG-CD2 4.21Å; L498-F500 HydrophobicContact CG-CE2 3.91Å; L498-M522 HydrophobicContact CD1-CB 4.38Å; L498-M522 HydrophobicContact CD1-SD 3.91Å; L498-M522 HydrophobicContact CD2-SD 4.06Å
499	L	97.5	Very high	88.7	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	125.5	176.8	178.7	65.8	0	0	0	110.9	F363 V364 V365 Q471 P474 Y481 L501 F508 L512	F363-L499 PolarHBondContact O-N 3.18Å; V364-L499 WeakPolarHBondContact CA-O 3.12Å; V364-L499 HydrophobicContact CB-CB 4.41Å; V364-L499 HydrophobicContact CG2-CB 4.26Å; V364-L499 HydrophobicContact CG2-CD2 4.25Å; V364-L499 HydrophobicContact CG2-CG 4.37Å; V365-L499 PolarHBondContact N-O 2.61Å; Q471-L499 HydrophobicContact CB-CD1 3.74Å; P474-L499 HydrophobicContact CB-CD1 4.28Å; P474-L499 HydrophobicContact CG-CD1 4.47Å; Y481-L499 HydrophobicContact CE2-CB 4.5Å; Y481-L499 HydrophobicContact CE2-CD2 4.17Å; L499-L501 HydrophobicContact CD2-CD1 4.08Å; L499-L501 HydrophobicContact CD2-CD2 4.19Å; L499-L501 HydrophobicContact CD2-CG 4.07Å; L499-L501 HydrophobicContact CG-CD2 4.27Å; L499-L501 HydrophobicContact CG-CG 4.08Å; L499-F508 HydrophobicContact CD2-CD1 4.03Å; L499-F508 HydrophobicContact CD2-CE1 4.19Å; L499-L512 HydrophobicContact CD2-CD1 3.87Å
500	F	97.4	Very high	89.1	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	113.8	173.9	-80.5	-122.1	0	0	0	110	V365 V367 R372 C375 L376 V470 Q471 Y472 L498	V365-F500 HydrophobicContact CG1-CD1 4.33Å; V365-F500 HydrophobicContact CG1-CD2 3.93Å; V365-F500 HydrophobicContact CG1-CE1 4.47Å; V365-F500 HydrophobicContact CG1-CE2 4.05Å; V365-F500 HydrophobicContact CG1-CG 4.06Å; V365-F500 HydrophobicContact CG1-CZ 4.32Å; V367-F500 HydrophobicContact CG2-CD1 4.05Å; V367-F500 HydrophobicContact CG2-CE1 4.32Å; R372-F500 HydrophobicContact CG-CD1 4.16Å; R372-F500 PolarHBondContact NH2-O 3.41Å; C375-F500 HydrophobicContact CB-CE1 3.95Å; L376-F500 HydrophobicContact CB-CE1 4.16Å; L376-F500 HydrophobicContact CB-CZ 4.24Å; L376-F500 HydrophobicContact CD1-CZ 4.31Å; V470-F500 HydrophobicContact CG1-CD2 3.78Å; V470-F500 HydrophobicContact CG1-CE2 3.49Å; V470-F500 VanDerWaalsContact CG1-CE2 3.49Å; V470-F500 HydrophobicContact CG1-CZ 4.41Å; Q471-F500 PolarHBondContact O-N 3.04Å; Y472-F500 HydrophobicContact CD2-CB 4.44Å; Y472-F500 AromaticContact CD2-CD1 3.68Å; Y472-F500 HydrophobicContact CD2-CD1 3.68Å; Y472-F500 HydrophobicContact CD2-CD2 4.48Å; Y472-F500 AromaticContact CD2-CE1 3.97Å; Y472-F500 HydrophobicContact CD2-CE1 3.97Å; Y472-F500 AromaticContact CD2-CG 3.97Å; Y472-F500 HydrophobicContact CD2-CG 3.97Å; Y472-F500 AromaticContact CE2-CD1 3.89Å; Y472-F500 HydrophobicContact CE2-CD1 3.89Å; Y472-F500 HydrophobicContact CE2-CE1 4.08Å; L498-F500 HydrophobicContact CD2-CD2 4.47Å; L498-F500 HydrophobicContact CD2-CE2 3.68Å; L498-F500 HydrophobicContact CD2-CZ 4.4Å; L498-F500 HydrophobicContact CG-CD2 4.21Å; L498-F500 HydrophobicContact CG-CE2 3.91Å
501	L	96.1	Very high	89.7	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	150	169.4	-61.5	172.4	0	0	0	109.1	V364 V365 L366 V367 P474 L499 E505 F508 I509 F603	V364-L501 HydrophobicContact CG2-CD1 3.7Å; V364-L501 HydrophobicContact CG2-CG 4.15Å; V365-L501 PolarHBondContact O-N 3.29Å; V365-L501 VanDerWaalsContact O-N 3.1Å; L366-L501 CarbonylContact C-O 3.5Å; L366-L501 WeakPolarHBondContact CA-O 3.39Å; L366-L501 HydrophobicContact CD2-CB 3.74Å; L366-L501 HydrophobicContact CD2-CD1 4.32Å; V367-L501 PolarHBondContact N-O 3.23Å; P474-L501 HydrophobicContact CB-CD2 4.2Å; P474-L501 HydrophobicContact CG-CD2 3.61Å; L499-L501 HydrophobicContact CD2-CD1 4.08Å; L499-L501 HydrophobicContact CD2-CD2 4.19Å; L499-L501 HydrophobicContact CD2-CG 4.07Å; L499-L501 HydrophobicContact CG-CD2 4.27Å; L499-L501 HydrophobicContact CG-CG 4.08Å; L501-E505 HydrophobicContact CB-CB 4.04Å; L501-E505 HydrophobicContact CD2-CB 3.9Å; L501-F508 HydrophobicContact CD1-CB 4.41Å; L501-F508 HydrophobicContact CD2-CB 4.21Å; L501-F508 HydrophobicContact CD2-CD1 4.1Å; L501-I509 HydrophobicContact CD1-CD1 4.03Å; L501-I509 HydrophobicContact CD1-CG1 3.67Å; L501-F603 HydrophobicContact CD2-CZ 4.45Å
502	T	94.6	Very high	90.7	Very high	7 Å²	7	25.7 Å²	25.7	4%	0.043	15%	0.147	C	C	.	.			trans	-81.3	162.5	160	69.4	0	0	0	0	109.6	V367 R372 A504 E505 A506	V367-T502 WeakPolarHBondContact O-CA 3.08Å; R372-T502 VanDerWaalsContact NH1-CG2 3.31Å; T502-A504 PolarHBondContact O-N 3.3Å; T502-A504 VanDerWaalsContact O-N 3.09Å; T502-E505 PolarHBondContact N-OE2 3.35Å; T502-E505 WeakPolarHBondContact O-CA 3.33Å; T502-E505 WeakPolarHBondContact O-CB 3.31Å; T502-E505 PolarHBondContact O-N 2.85Å; T502-E505 VanDerWaalsContact OG1-CD 3.32Å; T502-E505 WeakPolarHBondContact OG1-CG 3.41Å; T502-E505 PolarHBondContact OG1-OE2 3.45Å; T502-A506 PolarHBondContact O-N 3.39Å
503	P	93	Very high	91.7	Very high	13 Å²	13	24.1 Å²	24.1	8%	0.084	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-53.6	-27.5	173.2	-33.6	40.9	0	0	0	115.2	P103 E104 I105 P368 E505	P103-P503 HydrophobicContact CB-CB 4.32Å; P103-P503 HydrophobicContact CG-CB 4.25Å; P103-P503 HydrophobicContact CG-CG 4.08Å; E104-P503 VanDerWaalsContact O-CB 3.31Å; E104-P503 WeakPolarHBondContact O-CB 3.38Å; I105-P503 HydrophobicContact CG1-CG 4.2Å; P368-P503 HydrophobicContact CG-CG 4.26Å; P503-E505 VanDerWaalsContact C-N 3.28Å; P503-E505 PolarHBondContact O-N 2.68Å
504	A	91.1	Very high	92.2	Very high	27 Å²	27	26.8 Å²	26.8	22%	0.223	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-81	-4.9	175.6	0	0	0	0	0	114	T502 R607	T502-A504 PolarHBondContact O-N 3.3Å; T502-A504 VanDerWaalsContact O-N 3.09Å; A504-R607 HydrophobicContact CB-CB 4.32Å; A504-R607 PolarHBondContact O-NE 2.82Å; A504-R607 PolarHBondContact O-NH2 2.8Å; A504-R607 VanDerWaalsContact O-NH2 3.08Å
505	E	93.6	Very high	92.2	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.005	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-111	0.9	-178.3	-63.3	166.3	158.2	0	0	112.1	R372 L501 T502 P503 D507 F508 Y592 V602 F603	R372-E505 IonicContact NH1-OE2 2.74Å; R372-E505 PolarHBondContact NH1-OE2 3Å; L501-E505 HydrophobicContact CB-CB 4.04Å; L501-E505 HydrophobicContact CD2-CB 3.9Å; T502-E505 PolarHBondContact N-OE2 3.35Å; T502-E505 WeakPolarHBondContact O-CA 3.33Å; T502-E505 WeakPolarHBondContact O-CB 3.31Å; T502-E505 PolarHBondContact O-N 2.85Å; T502-E505 VanDerWaalsContact OG1-CD 3.32Å; T502-E505 WeakPolarHBondContact OG1-CG 3.41Å; T502-E505 PolarHBondContact OG1-OE2 3.45Å; P503-E505 VanDerWaalsContact C-N 3.28Å; P503-E505 PolarHBondContact O-N 2.68Å; E505-D507 PolarHBondContact O-N 2.75Å; E505-D507 VanDerWaalsContact O-N 3.17Å; E505-F508 VanDerWaalsContact O-CB 3.28Å; E505-F508 WeakPolarHBondContact O-CB 3.29Å; E505-F508 PolarHBondContact O-N 2.89Å; E505-Y592 VanDerWaalsContact OE1-CE2 3.26Å; E505-Y592 WeakPolarHBondContact OE1-CE2 3.21Å; E505-Y592 PolarHBondContact OE1-OH 2.72Å; E505-V602 HydrophobicContact CB-CG1 4.3Å; E505-F603 HydrophobicContact CB-CD1 4.43Å; E505-F603 HydrophobicContact CB-CE1 3.84Å; E505-F603 HydrophobicContact CG-CD1 3.79Å; E505-F603 HydrophobicContact CG-CE1 3.63Å
506	A	92.4	Very high	91.9	Very high	5 Å²	5	22 Å²	22	4%	0.041	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-30.2	-176.4	0	0	0	0	0	113.5	P106 L366 T502 F508 I509	P106-A506 HydrophobicContact CG-CB 3.87Å; L366-A506 HydrophobicContact CD1-CB 4.21Å; L366-A506 HydrophobicContact CD2-CB 4.14Å; T502-A506 PolarHBondContact O-N 3.39Å; A506-F508 PolarHBondContact O-N 3.46Å; A506-I509 WeakPolarHBondContact O-CB 3.48Å; A506-I509 WeakPolarHBondContact O-CG1 3.26Å; A506-I509 PolarHBondContact O-N 3.49Å
507	D	91	Very high	91.5	Very high	74 Å²	74	20.3 Å²	20.3	40%	0.396	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-24	175.1	-51.9	-39.8	0	0	0	112.9	E505 I509 T510 E511 V602 R607	E505-D507 PolarHBondContact O-N 2.75Å; E505-D507 VanDerWaalsContact O-N 3.17Å; D507-I509 PolarHBondContact O-N 3.26Å; D507-T510 WeakPolarHBondContact O-CB 3.49Å; D507-T510 PolarHBondContact O-N 3.19Å; D507-E511 PolarHBondContact O-N 3.4Å; D507-V602 HydrophobicContact CB-CB 4.47Å; D507-V602 HydrophobicContact CB-CG1 4.08Å; D507-V602 HydrophobicContact CB-CG2 3.74Å; D507-R607 IonicContact OD2-CZ 2.99Å; D507-R607 IonicContact OD2-NH1 3.39Å; D507-R607 PolarHBondContact OD2-NH1 3.18Å; D507-R607 IonicContact OD2-NH2 3.8Å; D507-R607 PolarHBondContact OD2-NH2 3.31Å
508	F	92.4	Very high	91.1	Very high	1 Å²	1	22.5 Å²	22.5	0%	0.004	13%	0.131	C	C	.	.	H	α-helix	trans	-65.9	-20.6	176.1	-169.8	-114.3	0	0	0	113.7	P475 L499 L501 E505 A506 T510 E511 L512 L599 V602 F603	P475-F508 HydrophobicContact CG-CE1 4.15Å; P475-F508 HydrophobicContact CG-CZ 4Å; L499-F508 HydrophobicContact CD2-CD1 4.03Å; L499-F508 HydrophobicContact CD2-CE1 4.19Å; L501-F508 HydrophobicContact CD1-CB 4.41Å; L501-F508 HydrophobicContact CD2-CB 4.21Å; L501-F508 HydrophobicContact CD2-CD1 4.1Å; E505-F508 VanDerWaalsContact O-CB 3.28Å; E505-F508 WeakPolarHBondContact O-CB 3.29Å; E505-F508 PolarHBondContact O-N 2.89Å; A506-F508 PolarHBondContact O-N 3.46Å; F508-T510 VanDerWaalsContact C-N 3.32Å; F508-E511 HydrophobicContact CD2-CB 4.15Å; F508-E511 HydrophobicContact CD2-CG 4.5Å; F508-E511 PolarHBondContact O-N 3.05Å; F508-L512 HydrophobicContact CD1-CD1 4.05Å; F508-L512 HydrophobicContact CD1-CG 4.18Å; F508-L512 HydrophobicContact CE1-CD1 3.86Å; F508-L512 HydrophobicContact CE1-CD2 4.02Å; F508-L512 HydrophobicContact CE1-CG 3.89Å; F508-L512 HydrophobicContact CZ-CD2 4.1Å; F508-L512 HydrophobicContact CZ-CG 4.3Å; F508-L512 PolarHBondContact O-N 3.41Å; F508-L599 HydrophobicContact CD2-CD2 4.28Å; F508-L599 HydrophobicContact CE2-CD1 4.11Å; F508-L599 HydrophobicContact CE2-CD2 4.18Å; F508-V602 HydrophobicContact CB-CG1 4.19Å; F508-F603 HydrophobicContact CB-CE2 4.39Å; F508-F603 HydrophobicContact CB-CZ 3.94Å; F508-F603 HydrophobicContact CD1-CZ 4.23Å; F508-F603 AromaticContact CD2-CE2 3.54Å; F508-F603 HydrophobicContact CD2-CE2 3.54Å; F508-F603 AromaticContact CD2-CZ 3.8Å; F508-F603 HydrophobicContact CD2-CZ 3.8Å; F508-F603 AromaticContact CE2-CE2 3.91Å; F508-F603 HydrophobicContact CE2-CE2 3.91Å; F508-F603 HydrophobicContact CE2-CZ 4.35Å; F508-F603 AromaticContact CG-CE2 3.98Å; F508-F603 HydrophobicContact CG-CE2 3.98Å; F508-F603 AromaticContact CG-CZ 3.73Å; F508-F603 HydrophobicContact CG-CZ 3.73Å
509	I	91.9	Very high	90.8	Very high	6 Å²	6	23.5 Å²	23.5	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-66.2	-38.9	175.2	-61.3	170.7	0	0	0	110	I108 V364 L501 A506 D507 E511 L512 A513 V519	I108-I509 HydrophobicContact CB-CD1 4.3Å; I108-I509 HydrophobicContact CD1-CD1 4.02Å; I108-I509 HydrophobicContact CG1-CD1 3.82Å; I108-I509 HydrophobicContact CG2-CD1 3.63Å; I108-I509 HydrophobicContact CG2-CG2 4.1Å; V364-I509 HydrophobicContact CG1-CD1 4Å; V364-I509 HydrophobicContact CG2-CD1 3.99Å; V364-I509 HydrophobicContact CG2-CG1 4.28Å; L501-I509 HydrophobicContact CD1-CD1 4.03Å; L501-I509 HydrophobicContact CD1-CG1 3.67Å; A506-I509 WeakPolarHBondContact O-CB 3.48Å; A506-I509 WeakPolarHBondContact O-CG1 3.26Å; A506-I509 PolarHBondContact O-N 3.49Å; D507-I509 PolarHBondContact O-N 3.26Å; I509-E511 VanDerWaalsContact C-N 3.32Å; I509-E511 PolarHBondContact O-N 3.24Å; I509-L512 PolarHBondContact O-N 3.17Å; I509-A513 WeakPolarHBondContact O-CB 3.49Å; I509-A513 PolarHBondContact O-N 3.35Å; I509-V519 HydrophobicContact CG1-CG2 4.47Å; I509-V519 HydrophobicContact CG2-CG2 3.81Å
510	T	89.8	Confident	90.5	Very high	58 Å²	58	26.7 Å²	26.7	36%	0.356	16%	0.159	S	C	.	.	H	α-helix	trans	-64.5	-37.3	173.3	-48.1	0	0	0	0	111.4	D507 F508 A513 N514	D507-T510 WeakPolarHBondContact O-CB 3.49Å; D507-T510 PolarHBondContact O-N 3.19Å; F508-T510 VanDerWaalsContact C-N 3.32Å; T510-A513 WeakPolarHBondContact O-CB 3.32Å; T510-A513 PolarHBondContact O-N 3.24Å; T510-N514 PolarHBondContact O-N 3.17Å; T510-N514 PolarHBondContact O-ND2 3.33Å; T510-N514 PolarHBondContact O-OD1 3Å
511	E	89.1	Confident	90.4	Very high	32 Å²	32	30.2 Å²	30.2	15%	0.15	18%	0.176	C	C	.	.	H	α-helix	trans	-66.2	-40.7	176.3	-169.8	77.9	141.5	0	0	112.5	D507 F508 I509 A513 N514 H515 H598 L599	D507-E511 PolarHBondContact O-N 3.4Å; F508-E511 HydrophobicContact CD2-CB 4.15Å; F508-E511 HydrophobicContact CD2-CG 4.5Å; F508-E511 PolarHBondContact O-N 3.05Å; I509-E511 VanDerWaalsContact C-N 3.32Å; I509-E511 PolarHBondContact O-N 3.24Å; E511-A513 VanDerWaalsContact C-N 3.31Å; E511-A513 PolarHBondContact O-N 3.14Å; E511-N514 WeakPolarHBondContact O-CB 3.47Å; E511-N514 PolarHBondContact O-N 3.22Å; E511-N514 PolarHBondContact OE2-ND2 3.36Å; E511-H515 PolarHBondContact O-CD2 3.07Å; E511-H598 IonicContact OE1-CD2 3.97Å; E511-H598 PolarHBondContact OE1-CD2 3.3Å; E511-L599 HydrophobicContact CG-CD2 3.82Å; E511-L599 WeakPolarHBondContact OE1-CD2 3.21Å
512	L	89.9	Confident	90.3	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.3	-39.4	172.4	-68.9	176	0	0	0	111.4	A478 Y481 L499 F508 I509 N514 H515 I517 V519	A478-L512 HydrophobicContact CB-CD2 4.26Å; Y481-L512 HydrophobicContact CD1-CD2 4.26Å; Y481-L512 HydrophobicContact CD2-CD1 3.89Å; Y481-L512 HydrophobicContact CD2-CD2 3.86Å; Y481-L512 HydrophobicContact CE2-CD1 3.73Å; Y481-L512 HydrophobicContact CE2-CD2 4.42Å; Y481-L512 HydrophobicContact CG-CD2 3.78Å; L499-L512 HydrophobicContact CD2-CD1 3.87Å; F508-L512 HydrophobicContact CD1-CD1 4.05Å; F508-L512 HydrophobicContact CD1-CG 4.18Å; F508-L512 HydrophobicContact CE1-CD1 3.86Å; F508-L512 HydrophobicContact CE1-CD2 4.02Å; F508-L512 HydrophobicContact CE1-CG 3.89Å; F508-L512 HydrophobicContact CZ-CD2 4.1Å; F508-L512 HydrophobicContact CZ-CG 4.3Å; F508-L512 PolarHBondContact O-N 3.41Å; I509-L512 PolarHBondContact O-N 3.17Å; L512-N514 PolarHBondContact O-N 2.99Å; L512-H515 CarbonylContact O-C 3.39Å; L512-H515 PolarHBondContact O-N 3.21Å; L512-H515 VanDerWaalsContact O-N 3.1Å; L512-I517 CarbonylContact C-O 3.54Å; L512-I517 HydrophobicContact CB-CB 4.1Å; L512-I517 HydrophobicContact CB-CG2 4.28Å; L512-I517 HydrophobicContact CD2-CD1 3.92Å; L512-I517 WeakPolarHBondContact O-CB 3.43Å; L512-I517 PolarHBondContact O-N 2.86Å; L512-V519 HydrophobicContact CD1-CG1 4.45Å
513	A	88.3	Confident	90.2	Very high	10 Å²	10	37.2 Å²	37.2	8%	0.083	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-38.1	176.5	0	0	0	0	0	113.2	P111 V113 I509 T510 E511 H515 N516	P111-A513 HydrophobicContact CB-CB 4.09Å; P111-A513 HydrophobicContact CG-CB 3.27Å; V113-A513 HydrophobicContact CG2-CB 3.95Å; I509-A513 WeakPolarHBondContact O-CB 3.49Å; I509-A513 PolarHBondContact O-N 3.35Å; T510-A513 WeakPolarHBondContact O-CB 3.32Å; T510-A513 PolarHBondContact O-N 3.24Å; E511-A513 VanDerWaalsContact C-N 3.31Å; E511-A513 PolarHBondContact O-N 3.14Å; A513-H515 PolarHBondContact O-N 3.13Å; A513-N516 PolarHBondContact O-N 3.24Å
514	N	87.6	Confident	90.2	Very high	89 Å²	89	37.6 Å²	37.6	48%	0.476	21%	0.207	S	C	.	.	H	α-helix	trans	-56.4	-21.8	172.9	-65.5	-25.3	0	0	0	113	T510 E511 L512	T510-N514 PolarHBondContact O-N 3.17Å; T510-N514 PolarHBondContact O-ND2 3.33Å; T510-N514 PolarHBondContact O-OD1 3Å; E511-N514 WeakPolarHBondContact O-CB 3.47Å; E511-N514 PolarHBondContact O-N 3.22Å; E511-N514 PolarHBondContact OE2-ND2 3.36Å; L512-N514 PolarHBondContact O-N 2.99Å
515	H	83.4	Confident	90.2	Very high	42 Å²	42	40.1 Å²	40.1	19%	0.194	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	16	-179.5	-76.1	-72.9	0	0	0	114.1	E352 F354 A478 E511 L512 A513 I517	E352-H515 PolarHBondContact O-ND1 2.99Å; F354-H515 HydrophobicContact CD2-CB 3.83Å; F354-H515 HydrophobicContact CE2-CB 3.94Å; F354-H515 AromaticContact CE2-CG 3.79Å; F354-H515 AromaticContact CE2-ND1 3.49Å; F354-H515 WeakPolarHBondContact CE2-ND1 3.48Å; F354-H515 PolarHBondContact N-O 3.33Å; A478-H515 HydrophobicContact CB-CB 3.96Å; A478-H515 VanDerWaalsContact CB-CD2 3.43Å; A478-H515 WeakPolarHBondContact CB-CD2 3.4Å; E511-H515 PolarHBondContact O-CD2 3.07Å; L512-H515 CarbonylContact O-C 3.39Å; L512-H515 PolarHBondContact O-N 3.21Å; L512-H515 VanDerWaalsContact O-N 3.1Å; A513-H515 PolarHBondContact O-N 3.13Å; H515-I517 HydrophobicContact CB-CD1 4.39Å
516	N	84.1	Confident	90.2	Very high	57 Å²	57	44.1 Å²	44.1	31%	0.305	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	23.6	-177.6	-59.2	-28.2	0	0	0	116.2	V113 A513	V113-N516 HydrophobicContact CG1-CB 4.16Å; V113-N516 VanDerWaalsContact CG1-OD1 3.28Å; V113-N516 WeakPolarHBondContact CG1-OD1 3.38Å; A513-N516 PolarHBondContact O-N 3.24Å
517	I	86	Confident	90.2	Very high	2 Å²	2	44 Å²	44	1%	0.01	23%	0.234	C	C	.	.			trans	-101	113.2	177	-56.2	166.2	0	0	0	109.2	F354 A478 Y481 V482 L512 H515 V519	F354-I517 HydrophobicContact CD2-CD1 4.11Å; A478-I517 HydrophobicContact CB-CD1 4.2Å; Y481-I517 HydrophobicContact CD1-CD1 4.01Å; Y481-I517 HydrophobicContact CD1-CG2 4.07Å; Y481-I517 HydrophobicContact CE1-CG2 3.54Å; V482-I517 HydrophobicContact CG2-CD1 3.63Å; V482-I517 HydrophobicContact CG2-CG1 4.34Å; L512-I517 CarbonylContact C-O 3.54Å; L512-I517 HydrophobicContact CB-CB 4.1Å; L512-I517 HydrophobicContact CB-CG2 4.28Å; L512-I517 HydrophobicContact CD2-CD1 3.92Å; L512-I517 WeakPolarHBondContact O-CB 3.43Å; L512-I517 PolarHBondContact O-N 2.86Å; H515-I517 HydrophobicContact CB-CD1 4.39Å; I517-V519 HydrophobicContact CG2-CG1 4.45Å
518	S	86.8	Confident	90.4	Very high	48 Å²	48	40.7 Å²	40.7	34%	0.336	22%	0.217	S	C	.	.			trans	-96.9	142.5	174.2	-172.5	0	0	0	0	111.6	Q115 Q362	Q115-S518 PolarHBondContact OE1-O 2.83Å; Q362-S518 PolarHBondContact NE2-O 3.01Å
519	V	90.5	Very high	90.3	Very high	20 Å²	20	42.7 Å²	42.7	12%	0.121	23%	0.231	C	C	.	.			trans	-133.9	137.3	-179.7	-62.3	0	0	0	0	111.3	Q362 V364 Y481 I509 L512 I517	Q362-V519 HydrophobicContact CB-CG1 4.1Å; V364-V519 HydrophobicContact CB-CB 4.37Å; V364-V519 HydrophobicContact CB-CG2 4.1Å; V364-V519 HydrophobicContact CG1-CB 4.17Å; V364-V519 HydrophobicContact CG1-CG2 3.67Å; Y481-V519 WeakPolarHBondContact OH-CG1 3.48Å; I509-V519 HydrophobicContact CG1-CG2 4.47Å; I509-V519 HydrophobicContact CG2-CG2 3.81Å; L512-V519 HydrophobicContact CD1-CG1 4.45Å; I517-V519 HydrophobicContact CG2-CG1 4.45Å
520	S	92.3	Very high	90.2	Very high	69 Å²	69	42.4 Å²	42.4	48%	0.483	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	139.3	177.9	-65.3	0	0	0	0	111.5	Q362 F363 V364	Q362-S520 PolarHBondContact O-N 2.79Å; F363-S520 CarbonylContact C-O 3.36Å; F363-S520 VanDerWaalsContact CA-O 3.23Å; F363-S520 WeakPolarHBondContact CA-O 3.47Å; V364-S520 PolarHBondContact N-O 3.21Å
521	E	93.6	Very high	90.2	Very high	74 Å²	74	39.6 Å²	39.6	35%	0.346	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	131.7	173.5	-179.9	178.7	179.9	0	0	111.6	I108 R110 K523	I108-E521 HydrophobicContact CD1-CB 3.87Å; I108-E521 HydrophobicContact CD1-CG 3.71Å; R110-E521 IonicContact NH2-OE2 2.74Å; R110-E521 PolarHBondContact NH2-OE2 3.09Å; R110-E521 VanDerWaalsContact NH2-OE2 3.08Å; E521-K523 HydrophobicContact CG-CG 4.48Å
522	M	94.4	Very high	90.2	Very high	36 Å²	36	40.8 Å²	40.8	18%	0.177	22%	0.219	C	C	.	.			trans	-117.1	123.2	165.2	-179.8	-179.4	-71.7	0	0	107.7	F363 V364 V365 F379 W468 L498 V527	F363-M522 HydrophobicContact CB-CB 4.41Å; F363-M522 HydrophobicContact CB-CE 4.18Å; F363-M522 HydrophobicContact CD1-CE 4.05Å; F363-M522 HydrophobicContact CD2-CE 4.23Å; F363-M522 HydrophobicContact CG-CE 3.9Å; V364-M522 PolarHBondContact O-N 3.07Å; V365-M522 WeakPolarHBondContact CG2-O 3.4Å; F379-M522 HydrophobicContact CE2-SD 4.41Å; W468-M522 HydrophobicContact CH2-CE 4.16Å; L498-M522 HydrophobicContact CD1-CB 4.38Å; L498-M522 HydrophobicContact CD1-SD 3.91Å; L498-M522 HydrophobicContact CD2-SD 4.06Å; M522-V527 HydrophobicContact CG-CG2 3.76Å; M522-V527 HydrophobicContact SD-CG2 3.55Å; M522-V527 VanDerWaalsContact SD-CG2 3.55Å
523	K	93.4	Very high	90.1	Very high	118 Å²	118	46.1 Å²	46.1	51%	0.513	24%	0.242	S	C	.	.			trans	-80.9	142.5	-172.4	-55	175.1	179	175	0	110.8	E521 Q525 D526 V527	E521-K523 HydrophobicContact CG-CG 4.48Å; K523-Q525 PolarHBondContact O-N 2.93Å; K523-Q525 VanDerWaalsContact O-N 3.16Å; K523-D526 WeakPolarHBondContact CB-OD2 3.44Å; K523-D526 WeakPolarHBondContact O-CB 3.48Å; K523-D526 PolarHBondContact O-N 3.28Å; K523-V527 PolarHBondContact O-N 3.48Å
524	L	93.5	Very high	89.9	Confident	20 Å²	20	46.8 Å²	46.8	11%	0.105	24%	0.244	C	C	.	.	H	α-helix	trans	-56.5	-32	177.4	176.1	59.5	0	0	0	113.2	I105 V365 V367 V371 C375 L528	I105-L524 HydrophobicContact CD1-CD2 4.4Å; V365-L524 HydrophobicContact CG2-CB 4.46Å; V367-L524 HydrophobicContact CG1-CD1 3.88Å; V367-L524 HydrophobicContact CG1-CD2 4.31Å; V367-L524 HydrophobicContact CG2-CD1 4.24Å; V371-L524 HydrophobicContact CG1-CD1 4.36Å; C375-L524 HydrophobicContact CB-CD1 3.93Å; C375-L524 VanDerWaalsContact SG-CD1 3.56Å; L524-L528 HydrophobicContact CD1-CD1 3.83Å; L524-L528 HydrophobicContact CD1-CG 4.03Å; L524-L528 HydrophobicContact CG-CD1 3.97Å; L524-L528 WeakPolarHBondContact O-CB 3.24Å; L524-L528 VanDerWaalsContact O-CG 3.26Å; L524-L528 WeakPolarHBondContact O-CG 3.5Å; L524-L528 PolarHBondContact O-N 2.96Å; L524-L528 VanDerWaalsContact O-N 3.16Å
525	Q	91.2	Very high	89.7	Confident	81 Å²	81	47.4 Å²	47.4	38%	0.379	25%	0.247	S	C	.	.	H	α-helix	trans	-69	-38	177.6	-63.5	-170.5	10.9	0	0	112.1	K523 L528 S529 Q553	K523-Q525 PolarHBondContact O-N 2.93Å; K523-Q525 VanDerWaalsContact O-N 3.16Å; Q525-L528 PolarHBondContact O-N 2.88Å; Q525-S529 WeakPolarHBondContact O-CB 3.4Å; Q525-S529 PolarHBondContact O-N 3.19Å; Q525-Q553 VanDerWaalsContact NE2-NE2 3.2Å
526	D	91.6	Very high	89.8	Confident	85 Å²	85	47.5 Å²	47.5	46%	0.455	26%	0.255	S	S	.	.	H	α-helix	trans	-65.6	-46.9	-178.1	-48.9	-17.8	0	0	0	109.2	K523 L528 S529	K523-D526 WeakPolarHBondContact CB-OD2 3.44Å; K523-D526 WeakPolarHBondContact O-CB 3.48Å; K523-D526 PolarHBondContact O-N 3.28Å; D526-L528 PolarHBondContact O-N 2.76Å; D526-S529 VanDerWaalsContact O-CB 3.31Å; D526-S529 WeakPolarHBondContact O-CB 3.47Å; D526-S529 PolarHBondContact O-N 2.99Å; D526-S529 VanDerWaalsContact O-N 3.15Å; D526-S529 PolarHBondContact O-OG 3.39Å
527	V	93.8	Very high	89.9	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-40.9	175.6	-177.8	0	0	0	0	112.4	F379 M522 K523 S529 C530	F379-V527 HydrophobicContact CB-CG1 3.87Å; F379-V527 HydrophobicContact CD2-CG1 4.22Å; M522-V527 HydrophobicContact CG-CG2 3.76Å; M522-V527 HydrophobicContact SD-CG2 3.55Å; M522-V527 VanDerWaalsContact SD-CG2 3.55Å; K523-V527 PolarHBondContact O-N 3.48Å; V527-S529 VanDerWaalsContact C-N 3.31Å; V527-C530 PolarHBondContact O-SG 3.17Å; V527-C530 VanDerWaalsContact O-SG 3.33Å
528	L	94.3	Very high	89.8	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-76	-18.2	178.5	-67.6	175.2	0	0	0	113	F99 V371 V374 A378 L524 Q525 D526 C530 L531 I556 A560	F99-L528 HydrophobicContact CE1-CD1 4.38Å; F99-L528 HydrophobicContact CZ-CD1 4.16Å; V371-L528 HydrophobicContact CG1-CD1 4.05Å; V374-L528 HydrophobicContact CB-CD2 4.48Å; V374-L528 HydrophobicContact CG1-CD2 3.96Å; A378-L528 HydrophobicContact CB-CD2 3.99Å; L524-L528 HydrophobicContact CD1-CD1 3.83Å; L524-L528 HydrophobicContact CD1-CG 4.03Å; L524-L528 HydrophobicContact CG-CD1 3.97Å; L524-L528 WeakPolarHBondContact O-CB 3.24Å; L524-L528 VanDerWaalsContact O-CG 3.26Å; L524-L528 WeakPolarHBondContact O-CG 3.5Å; L524-L528 PolarHBondContact O-N 2.96Å; L524-L528 VanDerWaalsContact O-N 3.16Å; Q525-L528 PolarHBondContact O-N 2.88Å; D526-L528 PolarHBondContact O-N 2.76Å; L528-C530 PolarHBondContact O-N 3.26Å; L528-L531 HydrophobicContact CD2-CD1 4.34Å; L528-L531 WeakPolarHBondContact O-CB 3.24Å; L528-L531 WeakPolarHBondContact O-CG 3.14Å; L528-L531 PolarHBondContact O-N 2.96Å; L528-I556 HydrophobicContact CB-CG2 3.56Å; L528-A560 HydrophobicContact CD1-CB 4.2Å; L528-A560 HydrophobicContact CD2-CB 4.11Å
529	S	91.8	Very high	89.2	Confident	43 Å²	43	46.7 Å²	46.7	30%	0.301	25%	0.247	S	C	.	.	H	α-helix	trans	-63.2	-22.7	178.7	80.4	0	0	0	0	112.9	Q525 D526 V527 L531 M532	Q525-S529 WeakPolarHBondContact O-CB 3.4Å; Q525-S529 PolarHBondContact O-N 3.19Å; D526-S529 VanDerWaalsContact O-CB 3.31Å; D526-S529 WeakPolarHBondContact O-CB 3.47Å; D526-S529 PolarHBondContact O-N 2.99Å; D526-S529 VanDerWaalsContact O-N 3.15Å; D526-S529 PolarHBondContact O-OG 3.39Å; V527-S529 VanDerWaalsContact C-N 3.31Å; S529-L531 PolarHBondContact O-N 3.47Å; S529-L531 VanDerWaalsContact O-N 3.16Å; S529-M532 WeakPolarHBondContact O-CB 3.14Å; S529-M532 WeakPolarHBondContact O-CG 3.38Å; S529-M532 PolarHBondContact O-N 2.9Å
530	C	89.7	Confident	88.2	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-59.3	-27.4	176.3	82.2	0	0	0	0	112.8	A378 E382 F386 V527 L528 M532 K533	A378-C530 PolarHBondContact O-SG 3Å; E382-C530 HydrophobicContact CB-CB 3.68Å; E382-C530 HydrophobicContact CG-CB 4.03Å; E382-C530 WeakPolarHBondContact OE1-CB 3.43Å; F386-C530 HydrophobicContact CD2-CB 4.07Å; F386-C530 HydrophobicContact CE2-CB 4.43Å; F386-C530 WeakPolarHBondContact CE2-O 3.38Å; V527-C530 PolarHBondContact O-SG 3.17Å; V527-C530 VanDerWaalsContact O-SG 3.33Å; L528-C530 PolarHBondContact O-N 3.26Å; C530-M532 PolarHBondContact O-N 3.39Å; C530-K533 HydrophobicContact CB-CD 4.46Å; C530-K533 WeakPolarHBondContact O-CB 3.28Å; C530-K533 WeakPolarHBondContact O-CG 3.31Å; C530-K533 PolarHBondContact O-N 2.92Å
531	L	89.9	Confident	86.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-68.2	-14.8	178.4	-56.4	179.4	0	0	0	112.6	V374 A378 L381 L528 S529 K533 F537 R559 A560 L563	V374-L531 HydrophobicContact CG1-CD1 4.33Å; A378-L531 HydrophobicContact CB-CD1 4.29Å; A378-L531 HydrophobicContact CB-CD2 3.98Å; A378-L531 HydrophobicContact CB-CG 4.09Å; L381-L531 HydrophobicContact CD1-CD2 4.1Å; L528-L531 HydrophobicContact CD2-CD1 4.34Å; L528-L531 WeakPolarHBondContact O-CB 3.24Å; L528-L531 WeakPolarHBondContact O-CG 3.14Å; L528-L531 PolarHBondContact O-N 2.96Å; S529-L531 PolarHBondContact O-N 3.47Å; S529-L531 VanDerWaalsContact O-N 3.16Å; L531-K533 PolarHBondContact O-N 2.99Å; L531-F537 HydrophobicContact CB-CD2 4.35Å; L531-F537 HydrophobicContact CD2-CD2 3.86Å; L531-F537 HydrophobicContact CD2-CE2 4.08Å; L531-F537 HydrophobicContact CD2-CG 4.35Å; L531-R559 HydrophobicContact CB-CB 3.9Å; L531-R559 HydrophobicContact CD1-CB 4.47Å; L531-R559 WeakPolarHBondContact O-CD 3.12Å; L531-A560 HydrophobicContact CD1-CB 4.16Å; L531-L563 HydrophobicContact CD1-CD2 4.12Å; L531-L563 HydrophobicContact CD2-CD2 3.71Å
532	M	88.4	Confident	85	Confident	56 Å²	56	60.9 Å²	60.9	28%	0.276	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-69.8	-21.7	171	-57	-67.9	-64.1	0	0	112.3	S529 C530 D534 L552 D555 I556	S529-M532 WeakPolarHBondContact O-CB 3.14Å; S529-M532 WeakPolarHBondContact O-CG 3.38Å; S529-M532 PolarHBondContact O-N 2.9Å; C530-M532 PolarHBondContact O-N 3.39Å; M532-D534 PolarHBondContact O-N 3.34Å; M532-L552 HydrophobicContact CE-CD1 3.73Å; M532-L552 HydrophobicContact SD-CD1 4.45Å; M532-D555 HydrophobicContact CE-CB 4.09Å; M532-D555 WeakPolarHBondContact CE-OD2 3.46Å; M532-D555 HydrophobicContact SD-CB 4.08Å; M532-I556 HydrophobicContact CG-CG1 3.83Å; M532-I556 HydrophobicContact SD-CG1 3.71Å
533	K	86.6	Confident	83.3	Confident	112 Å²	112	64.4 Å²	64.4	49%	0.487	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-77.1	-0.4	-177.3	-55.4	171.2	-179.4	168.8	0	113.2	E382 F386 C530 L531	E382-K533 IonicContact OE1-NZ 3.13Å; E382-K533 PolarHBondContact OE1-NZ 2.83Å; F386-K533 HydrophobicContact CB-CD 3.71Å; F386-K533 HydrophobicContact CD1-CB 3.96Å; F386-K533 HydrophobicContact CD1-CD 4.4Å; F386-K533 HydrophobicContact CD2-CB 4.35Å; F386-K533 HydrophobicContact CD2-CD 4.03Å; F386-K533 HydrophobicContact CE1-CB 4.01Å; F386-K533 HydrophobicContact CE2-CB 4.42Å; F386-K533 HydrophobicContact CG-CB 4.15Å; F386-K533 HydrophobicContact CG-CD 3.82Å; F386-K533 HydrophobicContact CZ-CB 4.27Å; C530-K533 HydrophobicContact CB-CD 4.46Å; C530-K533 WeakPolarHBondContact O-CB 3.28Å; C530-K533 WeakPolarHBondContact O-CG 3.31Å; C530-K533 PolarHBondContact O-N 2.92Å; L531-K533 PolarHBondContact O-N 2.99Å
534	D	84.4	Confident	81.3	Confident	25 Å²	25	64.8 Å²	64.8	13%	0.134	31%	0.308	C	S	.	.			trans	-145.2	123.8	-174	-173.6	-8.7	0	0	0	111.2	K385 F386 M532 A536 F537 R559	K385-D534 IonicContact NZ-OD2 2.78Å; K385-D534 PolarHBondContact NZ-OD2 3.25Å; F386-D534 HydrophobicContact CE1-CB 3.91Å; F386-D534 HydrophobicContact CZ-CB 3.59Å; M532-D534 PolarHBondContact O-N 3.34Å; D534-A536 VanDerWaalsContact C-N 3.26Å; D534-A536 PolarHBondContact O-N 3.14Å; D534-A536 VanDerWaalsContact OD1-CB 3.26Å; D534-A536 WeakPolarHBondContact OD1-CB 3.26Å; D534-A536 PolarHBondContact OD1-N 2.77Å; D534-F537 HydrophobicContact CB-CD2 3.87Å; D534-F537 HydrophobicContact CB-CE2 3.94Å; D534-F537 WeakPolarHBondContact OD2-CE2 3.33Å; D534-R559 PolarHBondContact O-NH1 2.93Å; D534-R559 VanDerWaalsContact O-NH1 3.14Å
535	D	84.9	Confident	79.3	Confident	101 Å²	101	68.4 Å²	68.4	54%	0.54	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-75.7	-10.8	179.4	-87	-21.4	0	0	0	113.1	F537 K538 R559	D535-F537 PolarHBondContact O-N 3.42Å; D535-K538 HydrophobicContact CB-CD 4.35Å; D535-K538 WeakPolarHBondContact O-CB 3.39Å; D535-K538 PolarHBondContact O-N 2.89Å; D535-K538 WeakPolarHBondContact OD1-CD 3.39Å; D535-K538 WeakPolarHBondContact OD1-CE 3.26Å; D535-K538 IonicContact OD1-NZ 3.5Å; D535-K538 PolarHBondContact OD1-NZ 2.74Å; D535-K538 IonicContact OD2-NZ 2.75Å; D535-K538 PolarHBondContact OD2-NZ 3.25Å; D535-R559 IonicContact OD1-NH1 3.75Å
536	A	84	Confident	78	Confident	44 Å²	44	73.2 Å²	73.2	36%	0.364	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-69.9	-10.7	173.6	0	0	0	0	0	114	H416 D534 Q566	H416-A536 VanDerWaalsContact ND1-CB 3.34Å; H416-A536 WeakPolarHBondContact ND1-CB 3.27Å; D534-A536 VanDerWaalsContact C-N 3.26Å; D534-A536 PolarHBondContact O-N 3.14Å; D534-A536 VanDerWaalsContact OD1-CB 3.26Å; D534-A536 WeakPolarHBondContact OD1-CB 3.26Å; D534-A536 PolarHBondContact OD1-N 2.77Å; A536-Q566 PolarHBondContact O-NE2 3.18Å
537	F	86.6	Confident	76.6	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-105.8	4.7	170.7	-49.6	-57.5	0	0	0	113	L381 H416 L531 D534 D535 R559 V562 L563	L381-F537 HydrophobicContact CD1-CE2 3.84Å; L381-F537 HydrophobicContact CD1-CZ 3.64Å; H416-F537 HydrophobicContact CB-CZ 4.22Å; L531-F537 HydrophobicContact CB-CD2 4.35Å; L531-F537 HydrophobicContact CD2-CD2 3.86Å; L531-F537 HydrophobicContact CD2-CE2 4.08Å; L531-F537 HydrophobicContact CD2-CG 4.35Å; D534-F537 HydrophobicContact CB-CD2 3.87Å; D534-F537 HydrophobicContact CB-CE2 3.94Å; D534-F537 WeakPolarHBondContact OD2-CE2 3.33Å; D535-F537 PolarHBondContact O-N 3.42Å; F537-R559 HydrophobicContact CB-CB 4.08Å; F537-R559 VanDerWaalsContact O-CA 3.26Å; F537-R559 WeakPolarHBondContact O-CA 3.48Å; F537-R559 WeakPolarHBondContact O-CB 3.25Å; F537-R559 VanDerWaalsContact O-CG 3.31Å; F537-R559 WeakPolarHBondContact O-CG 3.34Å; F537-V562 WeakPolarHBondContact O-CB 3.46Å; F537-L563 HydrophobicContact CD1-CB 4.1Å; F537-L563 HydrophobicContact CD1-CD1 4.34Å; F537-L563 HydrophobicContact CE1-CB 4.49Å; F537-L563 HydrophobicContact CE1-CD1 3.88Å
538	K	83.4	Confident	75.7	Confident	77 Å²	77	78.5 Å²	78.5	34%	0.335	40%	0.395	S	S	.	.			trans	-62.9	134.7	-175.1	-163.8	178.3	-152.9	138.4	0	111.5	D535 H544	D535-K538 HydrophobicContact CB-CD 4.35Å; D535-K538 WeakPolarHBondContact O-CB 3.39Å; D535-K538 PolarHBondContact O-N 2.89Å; D535-K538 WeakPolarHBondContact OD1-CD 3.39Å; D535-K538 WeakPolarHBondContact OD1-CE 3.26Å; D535-K538 IonicContact OD1-NZ 3.5Å; D535-K538 PolarHBondContact OD1-NZ 2.74Å; D535-K538 IonicContact OD2-NZ 2.75Å; D535-K538 PolarHBondContact OD2-NZ 3.25Å; K538-H544 VanDerWaalsContact CE-NE2 3.27Å; K538-H544 WeakPolarHBondContact CE-NE2 3.41Å
539	G	74.9	Confident	75	Confident	14 Å²	14	83.1 Å²	83.1	14%	0.144	43%	0.425	C	S	.	.			trans	-69.6	175.4	176.5	0	0	0	0	0	114	E558	G539-E558 WeakPolarHBondContact CA-OE1 3.48Å
540	R	68.7	Low	74.5	Confident	248 Å²	248	91.1 Å²	91.1	94%	0.936	45%	0.449	S	S	*	.	S	Bend	trans	-92	-9.6	167.6	-66.2	-168.9	-178.5	-151.8	1.8	112.2	E558	R540-E558 PolarHBondContact N-OE1 3.21Å
541	G	62.7	Low	74.1	Confident	7 Å²	7	92.4 Å²	92.4	7%	0.072	46%	0.459	C	S	.	.	S	Bend	trans	-67.9	136.4	178.2	0	0	0	0	0	113.5	Y543 H544 E558	G541-Y543 PolarHBondContact O-N 3.17Å; G541-H544 PolarHBondContact O-CE1 3.34Å; G541-H544 VanDerWaalsContact O-CE1 3.29Å; G541-H544 PolarHBondContact O-ND1 2.71Å; G541-E558 PolarHBondContact N-OE1 3.11Å
542	K	57.1	Low	73.8	Confident	206 Å²	206	96.9 Å²	96.9	90%	0.896	48%	0.483	S	S	*	.			trans	-75.5	31.1	179.8	-63.3	-172.8	177.4	-176.5	0	114.1	H544	K542-H544 PolarHBondContact O-N 2.96Å
543	Y	57.3	Low	73.7	Confident	110 Å²	110	97.4 Å²	97.4	43%	0.431	49%	0.485	S	S	.	.			trans	-75.5	29.5	-179.2	-57.9	-69.2	0	0	0	113.8	G541 S545 Q554 E558	G541-Y543 PolarHBondContact O-N 3.17Å; Y543-S545 PolarHBondContact O-N 3.4Å; Y543-Q554 HydrophobicContact CE2-CG 4.27Å; Y543-E558 WeakPolarHBondContact CE2-OE2 3.49Å
544	H	51.7	Low	73.6	Confident	126 Å²	126	94.9 Å²	94.9	58%	0.583	48%	0.475	S	S	*	.			trans	-84.7	17.8	-169.1	-67.4	36.3	0	0	0	113.6	K538 G541 K542	K538-H544 VanDerWaalsContact CE-NE2 3.27Å; K538-H544 WeakPolarHBondContact CE-NE2 3.41Å; G541-H544 PolarHBondContact O-CE1 3.34Å; G541-H544 VanDerWaalsContact O-CE1 3.29Å; G541-H544 PolarHBondContact O-ND1 2.71Å; K542-H544 PolarHBondContact O-N 2.96Å
545	S	52	Low	73.8	Confident	96 Å²	96	94.5 Å²	94.5	67%	0.671	47%	0.473	S	S	*	.			trans	-117.3	122.2	-176.8	-170.1	0	0	0	0	111.2	Y543	Y543-S545 PolarHBondContact O-N 3.4Å
546	Q	63.9	Low	74	Confident	182 Å²	182	90.4 Å²	90.4	85%	0.85	45%	0.451	S	S	*	.			trans	-68.9	126.8	179	-72.4	-84.3	16	0	0	111.2
547	T	61.5	Low	74.4	Confident	138 Å²	138	92.9 Å²	92.9	85%	0.847	45%	0.451	S	S	*	.			trans	-178.5	-41.1	147.4	15.6	0	0	0	0	113.5
548	S	76.1	Confident	74.6	Confident	58 Å²	58	94.4 Å²	94.4	41%	0.406	46%	0.458	S	S	.	.			trans	-103	137.7	-169.3	81.6	0	0	0	0	114.4	R550 A551 L552	S548-R550 PolarHBondContact O-N 3.47Å; S548-A551 PolarHBondContact O-N 3.36Å; S548-A551 VanDerWaalsContact O-N 3.09Å; S548-A551 WeakPolarHBondContact OG-CB 3.49Å; S548-A551 PolarHBondContact OG-N 3.44Å; S548-L552 PolarHBondContact O-N 2.99Å
549	P	78.6	Confident	75	Confident	102 Å²	102	91.4 Å²	91.4	66%	0.662	44%	0.444	S	S	*	.	H	α-helix	trans	-58.4	-31	174.4	-27.2	35.4	0	0	0	113.9	L552 Q553	P549-L552 PolarHBondContact O-N 2.95Å; P549-Q553 WeakPolarHBondContact O-CG 3.47Å; P549-Q553 PolarHBondContact O-N 3.2Å
550	R	82.2	Confident	75.9	Confident	212 Å²	212	90.7 Å²	90.7	80%	0.8	44%	0.437	S	S	*	.	H	α-helix	trans	-67	-35.7	176.6	-70.7	-176.4	177.3	178.1	-0.1	112.5	S548 Q554	S548-R550 PolarHBondContact O-N 3.47Å; R550-Q554 WeakPolarHBondContact O-CB 3.47Å; R550-Q554 PolarHBondContact O-N 2.87Å
551	A	81.6	Confident	77.1	Confident	26 Å²	26	80.2 Å²	80.2	22%	0.215	40%	0.401	C	S	.	.	H	α-helix	trans	-68	-44	175.5	0	0	0	0	0	111.4	S548 Q553 Q554 D555	S548-A551 PolarHBondContact O-N 3.36Å; S548-A551 VanDerWaalsContact O-N 3.09Å; S548-A551 WeakPolarHBondContact OG-CB 3.49Å; S548-A551 PolarHBondContact OG-N 3.44Å; A551-Q553 PolarHBondContact O-N 3.08Å; A551-Q554 WeakPolarHBondContact O-CA 2.93Å; A551-Q554 WeakPolarHBondContact O-CB 3.1Å; A551-Q554 PolarHBondContact O-N 3.14Å; A551-D555 PolarHBondContact O-N 3.37Å
552	L	83.6	Confident	78.6	Confident	95 Å²	95	81.7 Å²	81.7	50%	0.497	41%	0.408	S	S	.	.	H	α-helix	trans	-60.1	-45.3	175.5	179	61	0	0	0	111.9	M532 S548 P549 Q554 D555 I556	M532-L552 HydrophobicContact CE-CD1 3.73Å; M532-L552 HydrophobicContact SD-CD1 4.45Å; S548-L552 PolarHBondContact O-N 2.99Å; P549-L552 PolarHBondContact O-N 2.95Å; L552-Q554 PolarHBondContact O-N 2.95Å; L552-D555 PolarHBondContact O-N 2.63Å; L552-I556 HydrophobicContact CD1-CD1 4.19Å; L552-I556 HydrophobicContact CD1-CG1 4.43Å; L552-I556 HydrophobicContact CG-CD1 4.07Å; L552-I556 VanDerWaalsContact O-CG1 3.32Å; L552-I556 WeakPolarHBondContact O-CG1 3.35Å; L552-I556 PolarHBondContact O-N 2.85Å; L552-I556 VanDerWaalsContact O-N 3.07Å
553	Q	85.1	Confident	80.3	Confident	67 Å²	67	71.9 Å²	71.9	31%	0.313	37%	0.365	S	S	.	.	H	α-helix	trans	-58.4	-29.1	173.2	-76.3	-177.5	-15.1	0	0	113.1	Q525 P549 A551 R557	Q525-Q553 VanDerWaalsContact NE2-NE2 3.2Å; P549-Q553 WeakPolarHBondContact O-CG 3.47Å; P549-Q553 PolarHBondContact O-N 3.2Å; A551-Q553 PolarHBondContact O-N 3.08Å; Q553-R557 WeakPolarHBondContact O-CD 3.49Å; Q553-R557 WeakPolarHBondContact O-CG 3.3Å; Q553-R557 PolarHBondContact O-N 3.26Å
554	Q	86.2	Confident	82.1	Confident	59 Å²	59	66.8 Å²	66.8	28%	0.276	35%	0.346	S	S	.	.	H	α-helix	trans	-83	-37.7	-179.4	-169.8	57.1	29.7	0	0	112.8	Y543 R550 A551 L552 R557 E558	Y543-Q554 HydrophobicContact CE2-CG 4.27Å; R550-Q554 WeakPolarHBondContact O-CB 3.47Å; R550-Q554 PolarHBondContact O-N 2.87Å; A551-Q554 WeakPolarHBondContact O-CA 2.93Å; A551-Q554 WeakPolarHBondContact O-CB 3.1Å; A551-Q554 PolarHBondContact O-N 3.14Å; L552-Q554 PolarHBondContact O-N 2.95Å; Q554-R557 PolarHBondContact O-N 3.03Å; Q554-E558 PolarHBondContact O-N 3.45Å
555	D	86.9	Confident	84.1	Confident	17 Å²	17	63.6 Å²	63.6	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-62.4	-47.6	170	-170.5	1.5	0	0	0	109.9	M532 A551 L552 R557 E558 R559	M532-D555 HydrophobicContact CE-CB 4.09Å; M532-D555 WeakPolarHBondContact CE-OD2 3.46Å; M532-D555 HydrophobicContact SD-CB 4.08Å; A551-D555 PolarHBondContact O-N 3.37Å; L552-D555 PolarHBondContact O-N 2.63Å; D555-R557 PolarHBondContact O-N 3.38Å; D555-R557 VanDerWaalsContact O-N 3.13Å; D555-E558 CarbonylContact O-C 3.48Å; D555-E558 WeakPolarHBondContact O-CA 3.35Å; D555-E558 PolarHBondContact O-N 3.31Å; D555-R559 WeakPolarHBondContact O-CG 3.4Å; D555-R559 PolarHBondContact O-N 3.22Å; D555-R559 VanDerWaalsContact OD1-CG 3.28Å; D555-R559 WeakPolarHBondContact OD1-CG 3.43Å; D555-R559 IonicContact OD1-CZ 2.96Å; D555-R559 IonicContact OD1-NE 3.08Å; D555-R559 PolarHBondContact OD1-NE 2.91Å; D555-R559 IonicContact OD1-NH2 3.05Å; D555-R559 IonicContact OD2-CZ 3.64Å; D555-R559 IonicContact OD2-NE 3.55Å; D555-R559 PolarHBondContact OD2-NE 3.22Å; D555-R559 IonicContact OD2-NH2 2.77Å; D555-R559 PolarHBondContact OD2-NH2 3.36Å
556	I	90.6	Very high	86.1	Confident	14 Å²	14	61.4 Å²	61.4	7%	0.072	32%	0.315	C	S	.	.	H	α-helix	trans	-53.2	-40.4	176	-67.1	169.6	0	0	0	111.9	L528 M532 L552 A560	L528-I556 HydrophobicContact CB-CG2 3.56Å; M532-I556 HydrophobicContact CG-CG1 3.83Å; M532-I556 HydrophobicContact SD-CG1 3.71Å; L552-I556 HydrophobicContact CD1-CD1 4.19Å; L552-I556 HydrophobicContact CD1-CG1 4.43Å; L552-I556 HydrophobicContact CG-CD1 4.07Å; L552-I556 VanDerWaalsContact O-CG1 3.32Å; L552-I556 WeakPolarHBondContact O-CG1 3.35Å; L552-I556 PolarHBondContact O-N 2.85Å; L552-I556 VanDerWaalsContact O-N 3.07Å; I556-A560 VanDerWaalsContact O-CB 3.24Å; I556-A560 WeakPolarHBondContact O-CB 3.27Å; I556-A560 PolarHBondContact O-N 3.38Å
557	R	91.6	Very high	87.6	Confident	97 Å²	97	52.8 Å²	52.8	37%	0.366	27%	0.274	S	S	.	.	H	α-helix	trans	-70.7	-33.5	174.8	-73.3	166.9	177.8	176.8	-0.9	113.3	F99 Q553 Q554 D555 T561	F99-R557 HydrophobicContact CD1-CG 4.09Å; F99-R557 HydrophobicContact CD2-CB 3.88Å; F99-R557 HydrophobicContact CD2-CG 3.96Å; F99-R557 HydrophobicContact CE1-CG 4.08Å; F99-R557 HydrophobicContact CE2-CB 3.81Å; F99-R557 HydrophobicContact CE2-CG 3.95Å; F99-R557 WeakPolarHBondContact CE2-O 3.34Å; F99-R557 HydrophobicContact CG-CB 4.43Å; F99-R557 HydrophobicContact CG-CG 4.04Å; F99-R557 HydrophobicContact CZ-CB 4.3Å; F99-R557 HydrophobicContact CZ-CG 4.01Å; Q553-R557 WeakPolarHBondContact O-CD 3.49Å; Q553-R557 WeakPolarHBondContact O-CG 3.3Å; Q553-R557 PolarHBondContact O-N 3.26Å; Q554-R557 PolarHBondContact O-N 3.03Å; D555-R557 PolarHBondContact O-N 3.38Å; D555-R557 VanDerWaalsContact O-N 3.13Å; R557-T561 WeakPolarHBondContact O-CB 3.25Å; R557-T561 PolarHBondContact O-N 3.15Å; R557-T561 PolarHBondContact O-OG1 2.67Å
558	E	90.6	Very high	89.1	Confident	32 Å²	32	46.9 Å²	46.9	15%	0.15	24%	0.237	C	C	.	.	H	α-helix	trans	-70.6	-42.7	175.1	-160.8	171.3	154	0	0	110.9	G539 R540 G541 Y543 Q554 D555 T561 V562	G539-E558 WeakPolarHBondContact CA-OE1 3.48Å; R540-E558 PolarHBondContact N-OE1 3.21Å; G541-E558 PolarHBondContact N-OE1 3.11Å; Y543-E558 WeakPolarHBondContact CE2-OE2 3.49Å; Q554-E558 PolarHBondContact O-N 3.45Å; D555-E558 CarbonylContact O-C 3.48Å; D555-E558 WeakPolarHBondContact O-CA 3.35Å; D555-E558 PolarHBondContact O-N 3.31Å; E558-T561 CarbonylContact O-C 3.54Å; E558-T561 WeakPolarHBondContact O-CA 3.37Å; E558-T561 WeakPolarHBondContact O-CB 3.42Å; E558-T561 PolarHBondContact O-N 2.93Å; E558-V562 PolarHBondContact O-N 2.95Å
559	R	92	Very high	90	Very high	13 Å²	13	47.7 Å²	47.7	5%	0.049	24%	0.237	C	C	.	.	H	α-helix	trans	-66.4	-41.8	175.6	-54.8	-162.6	-174	-143.5	4.2	113.3	L531 D534 D535 F537 D555 T561 V562 L563	L531-R559 HydrophobicContact CB-CB 3.9Å; L531-R559 HydrophobicContact CD1-CB 4.47Å; L531-R559 WeakPolarHBondContact O-CD 3.12Å; D534-R559 PolarHBondContact O-NH1 2.93Å; D534-R559 VanDerWaalsContact O-NH1 3.14Å; D535-R559 IonicContact OD1-NH1 3.75Å; F537-R559 HydrophobicContact CB-CB 4.08Å; F537-R559 VanDerWaalsContact O-CA 3.26Å; F537-R559 WeakPolarHBondContact O-CA 3.48Å; F537-R559 WeakPolarHBondContact O-CB 3.25Å; F537-R559 VanDerWaalsContact O-CG 3.31Å; F537-R559 WeakPolarHBondContact O-CG 3.34Å; D555-R559 WeakPolarHBondContact O-CG 3.4Å; D555-R559 PolarHBondContact O-N 3.22Å; D555-R559 VanDerWaalsContact OD1-CG 3.28Å; D555-R559 WeakPolarHBondContact OD1-CG 3.43Å; D555-R559 IonicContact OD1-CZ 2.96Å; D555-R559 IonicContact OD1-NE 3.08Å; D555-R559 PolarHBondContact OD1-NE 2.91Å; D555-R559 IonicContact OD1-NH2 3.05Å; D555-R559 IonicContact OD2-CZ 3.64Å; D555-R559 IonicContact OD2-NE 3.55Å; D555-R559 PolarHBondContact OD2-NE 3.22Å; D555-R559 IonicContact OD2-NH2 2.77Å; D555-R559 PolarHBondContact OD2-NH2 3.36Å; R559-T561 PolarHBondContact O-N 3.34Å; R559-V562 PolarHBondContact O-N 3.47Å; R559-V562 VanDerWaalsContact O-N 3.15Å; R559-L563 PolarHBondContact O-N 2.98Å
560	A	93.9	Very high	90.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-29.5	170.4	0	0	0	0	0	112.4	L98 F99 V374 L528 L531 I556 Q564	L98-A560 WeakPolarHBondContact CD2-O 3.15Å; F99-A560 HydrophobicContact CE2-CB 3.94Å; F99-A560 HydrophobicContact CZ-CB 3.77Å; V374-A560 HydrophobicContact CG1-CB 3.98Å; V374-A560 WeakPolarHBondContact CG1-O 3.38Å; L528-A560 HydrophobicContact CD1-CB 4.2Å; L528-A560 HydrophobicContact CD2-CB 4.11Å; L531-A560 HydrophobicContact CD1-CB 4.16Å; I556-A560 VanDerWaalsContact O-CB 3.24Å; I556-A560 WeakPolarHBondContact O-CB 3.27Å; I556-A560 PolarHBondContact O-N 3.38Å; A560-Q564 WeakPolarHBondContact O-CB 3.45Å; A560-Q564 PolarHBondContact O-N 3.04Å; A560-Q564 VanDerWaalsContact O-N 3.15Å
561	T	94.1	Very high	91.4	Very high	28 Å²	28	33.8 Å²	33.8	17%	0.172	17%	0.172	C	C	.	.	H	α-helix	trans	-71	-47.3	171.6	-61.5	0	0	0	0	111.6	S96 R557 E558 R559 L563 Q564 T565	S96-T561 PolarHBondContact OG-OG1 3.27Å; R557-T561 WeakPolarHBondContact O-CB 3.25Å; R557-T561 PolarHBondContact O-N 3.15Å; R557-T561 PolarHBondContact O-OG1 2.67Å; E558-T561 CarbonylContact O-C 3.54Å; E558-T561 WeakPolarHBondContact O-CA 3.37Å; E558-T561 WeakPolarHBondContact O-CB 3.42Å; E558-T561 PolarHBondContact O-N 2.93Å; R559-T561 PolarHBondContact O-N 3.34Å; T561-L563 VanDerWaalsContact C-N 3.31Å; T561-L563 PolarHBondContact O-N 3.43Å; T561-Q564 PolarHBondContact O-N 2.97Å; T561-T565 PolarHBondContact O-N 3.22Å; T561-T565 PolarHBondContact O-OG1 2.69Å
562	V	93.6	Very high	92	Very high	37 Å²	37	35.9 Å²	35.9	22%	0.224	18%	0.177	C	C	.	.	H	α-helix	trans	-56.6	-46.2	178.6	173.5	0	0	0	0	110.8	F537 E558 R559 T565 Q566	F537-V562 WeakPolarHBondContact O-CB 3.46Å; E558-V562 PolarHBondContact O-N 2.95Å; R559-V562 PolarHBondContact O-N 3.47Å; R559-V562 VanDerWaalsContact O-N 3.15Å; V562-T565 PolarHBondContact O-N 3.03Å; V562-Q566 WeakPolarHBondContact O-CG 3.43Å; V562-Q566 PolarHBondContact O-N 3.15Å
563	L	93.8	Very high	92.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64.6	-41.7	176.5	179	54.4	0	0	0	112.6	V374 A377 L381 L413 L531 F537 R559 T561 T565 Q566 L567	V374-L563 HydrophobicContact CG1-CB 4.26Å; V374-L563 HydrophobicContact CG1-CD2 3.97Å; V374-L563 HydrophobicContact CG1-CG 4.18Å; A377-L563 HydrophobicContact CB-CD2 3.97Å; L381-L563 HydrophobicContact CD1-CD2 4.26Å; L413-L563 HydrophobicContact CD2-CD1 3.97Å; L531-L563 HydrophobicContact CD1-CD2 4.12Å; L531-L563 HydrophobicContact CD2-CD2 3.71Å; F537-L563 HydrophobicContact CD1-CB 4.1Å; F537-L563 HydrophobicContact CD1-CD1 4.34Å; F537-L563 HydrophobicContact CE1-CB 4.49Å; F537-L563 HydrophobicContact CE1-CD1 3.88Å; R559-L563 PolarHBondContact O-N 2.98Å; T561-L563 VanDerWaalsContact C-N 3.31Å; T561-L563 PolarHBondContact O-N 3.43Å; L563-T565 VanDerWaalsContact C-N 3.31Å; L563-T565 PolarHBondContact O-N 3.07Å; L563-Q566 PolarHBondContact O-N 2.98Å; L563-L567 HydrophobicContact CD1-CD1 4.1Å; L563-L567 HydrophobicContact CD1-CG 4.26Å; L563-L567 HydrophobicContact CG-CD1 4.12Å; L563-L567 WeakPolarHBondContact O-CD1 3.37Å; L563-L567 VanDerWaalsContact O-CG 3.26Å; L563-L567 WeakPolarHBondContact O-CG 3.18Å; L563-L567 PolarHBondContact O-N 3.43Å
564	Q	95	Very high	93	Very high	3 Å²	3	35.5 Å²	35.5	1%	0.014	18%	0.184	C	C	.	.	H	α-helix	trans	-61.1	-40	173.1	-175.6	65.2	19.9	0	0	111.9	L98 V374 A560 T561 L567 E568 K615	L98-Q564 HydrophobicContact CD1-CG 4.17Å; L98-Q564 HydrophobicContact CD2-CB 3.87Å; L98-Q564 HydrophobicContact CD2-CG 4.31Å; V374-Q564 HydrophobicContact CG2-CB 3.66Å; V374-Q564 HydrophobicContact CG2-CG 4.23Å; A560-Q564 WeakPolarHBondContact O-CB 3.45Å; A560-Q564 PolarHBondContact O-N 3.04Å; A560-Q564 VanDerWaalsContact O-N 3.15Å; T561-Q564 PolarHBondContact O-N 2.97Å; Q564-L567 PolarHBondContact O-N 2.97Å; Q564-E568 HydrophobicContact CG-CG 4.46Å; Q564-E568 WeakPolarHBondContact CG-OE1 3.34Å; Q564-E568 PolarHBondContact NE2-OE1 2.9Å; Q564-E568 WeakPolarHBondContact O-CB 3.19Å; Q564-E568 WeakPolarHBondContact O-CG 3.45Å; Q564-E568 PolarHBondContact O-N 2.75Å; Q564-K615 PolarHBondContact NE2-O 3.26Å
565	T	93.6	Very high	93.4	Very high	60 Å²	60	37.6 Å²	37.6	37%	0.368	20%	0.201	S	C	.	.	H	α-helix	trans	-65.4	-44.9	177.3	-65.6	0	0	0	0	111.1	T561 V562 L563 L567 E568 D569	T561-T565 PolarHBondContact O-N 3.22Å; T561-T565 PolarHBondContact O-OG1 2.69Å; V562-T565 PolarHBondContact O-N 3.03Å; L563-T565 VanDerWaalsContact C-N 3.31Å; L563-T565 PolarHBondContact O-N 3.07Å; T565-L567 VanDerWaalsContact C-N 3.27Å; T565-L567 PolarHBondContact O-N 3.27Å; T565-E568 PolarHBondContact O-N 2.93Å; T565-D569 WeakPolarHBondContact CG2-OD2 3.48Å; T565-D569 VanDerWaalsContact O-CB 3.29Å; T565-D569 WeakPolarHBondContact O-CB 3.38Å; T565-D569 PolarHBondContact O-N 2.91Å
566	Q	93.6	Very high	93.7	Very high	50 Å²	50	41.5 Å²	41.5	23%	0.234	22%	0.218	C	C	.	.	H	α-helix	trans	-57.2	-39.1	174.1	-71.2	163.6	-12.9	0	0	112.6	V412 A536 V562 L563 F570	V412-Q566 HydrophobicContact CG1-CB 4.37Å; A536-Q566 PolarHBondContact O-NE2 3.18Å; V562-Q566 WeakPolarHBondContact O-CG 3.43Å; V562-Q566 PolarHBondContact O-N 3.15Å; L563-Q566 PolarHBondContact O-N 2.98Å; Q566-F570 PolarHBondContact O-N 3.29Å
567	L	94.8	Very high	93.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-71.1	-43	176.5	-66.9	163	0	0	0	112.2	L373 A377 L408 F409 V412 L563 Q564 T565 F570 V571	L373-L567 HydrophobicContact CD2-CB 4.35Å; L373-L567 HydrophobicContact CD2-CD1 4.2Å; L373-L567 HydrophobicContact CG-CD1 4.17Å; A377-L567 HydrophobicContact CB-CD1 4.46Å; L408-L567 HydrophobicContact CD1-CD2 3.83Å; L408-L567 HydrophobicContact CD2-CD2 4.05Å; L408-L567 HydrophobicContact CG-CD2 3.83Å; F409-L567 HydrophobicContact CD1-CD2 4.2Å; F409-L567 HydrophobicContact CE1-CD2 4.23Å; V412-L567 HydrophobicContact CB-CD2 4.08Å; V412-L567 HydrophobicContact CG1-CD2 3.96Å; V412-L567 HydrophobicContact CG1-CG 4.47Å; V412-L567 HydrophobicContact CG2-CD2 4.25Å; L563-L567 HydrophobicContact CD1-CD1 4.1Å; L563-L567 HydrophobicContact CD1-CG 4.26Å; L563-L567 HydrophobicContact CG-CD1 4.12Å; L563-L567 WeakPolarHBondContact O-CD1 3.37Å; L563-L567 VanDerWaalsContact O-CG 3.26Å; L563-L567 WeakPolarHBondContact O-CG 3.18Å; L563-L567 PolarHBondContact O-N 3.43Å; Q564-L567 PolarHBondContact O-N 2.97Å; T565-L567 VanDerWaalsContact C-N 3.27Å; T565-L567 PolarHBondContact O-N 3.27Å; L567-F570 PolarHBondContact O-N 3.36Å; L567-V571 WeakPolarHBondContact O-CG2 3.26Å; L567-V571 PolarHBondContact O-N 2.96Å
568	E	94.8	Very high	94	Very high	14 Å²	14	39.4 Å²	39.4	7%	0.065	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-40.5	175.3	-77	176	-163.5	0	0	112.2	Q564 T565 F570 V571 H572 K615	Q564-E568 HydrophobicContact CG-CG 4.46Å; Q564-E568 WeakPolarHBondContact CG-OE1 3.34Å; Q564-E568 PolarHBondContact NE2-OE1 2.9Å; Q564-E568 WeakPolarHBondContact O-CB 3.19Å; Q564-E568 WeakPolarHBondContact O-CG 3.45Å; Q564-E568 PolarHBondContact O-N 2.75Å; T565-E568 PolarHBondContact O-N 2.93Å; E568-F570 VanDerWaalsContact C-N 3.32Å; E568-F570 PolarHBondContact O-N 3.07Å; E568-V571 PolarHBondContact O-N 3.05Å; E568-H572 WeakPolarHBondContact O-CB 3.44Å; E568-H572 PolarHBondContact O-CD2 3.02Å; E568-H572 VanDerWaalsContact O-CD2 3.26Å; E568-H572 PolarHBondContact O-N 3.5Å; E568-K615 WeakPolarHBondContact OE1-CE 3.39Å; E568-K615 WeakPolarHBondContact OE1-CG 3.49Å; E568-K615 IonicContact OE1-NZ 3.95Å; E568-K615 PolarHBondContact OE1-NZ 3.26Å; E568-K615 IonicContact OE2-NZ 2.76Å; E568-K615 PolarHBondContact OE2-NZ 2.9Å
569	D	94.6	Very high	94.2	Very high	76 Å²	76	42.8 Å²	42.8	41%	0.406	23%	0.228	S	C	.	.	H	α-helix	trans	-67.2	-34.4	-179.8	-67.1	-7.2	0	0	0	111.3	T565 S573 R620	T565-D569 WeakPolarHBondContact CG2-OD2 3.48Å; T565-D569 VanDerWaalsContact O-CB 3.29Å; T565-D569 WeakPolarHBondContact O-CB 3.38Å; T565-D569 PolarHBondContact O-N 2.91Å; D569-S573 WeakPolarHBondContact O-CB 3.13Å; D569-S573 PolarHBondContact O-N 2.93Å; D569-R620 IonicContact OD1-CZ 2.88Å; D569-R620 IonicContact OD1-NH2 3.32Å; D569-R620 PolarHBondContact OD1-NH2 3.17Å
570	F	94.6	Very high	94.4	Very high	21 Å²	21	43.2 Å²	43.2	9%	0.092	23%	0.234	C	C	.	.	H	α-helix	trans	-69.1	-45.5	169.8	-175.9	-95.2	0	0	0	112.4	L408 S411 V412 Q566 L567 E568 H572 S573 W577	L408-F570 HydrophobicContact CD1-CB 4.36Å; L408-F570 HydrophobicContact CD1-CD1 3.56Å; L408-F570 HydrophobicContact CD1-CE1 4.34Å; L408-F570 HydrophobicContact CD1-CG 4.32Å; S411-F570 VanDerWaalsContact CB-CE2 3.46Å; S411-F570 WeakPolarHBondContact OG-CZ 3.48Å; V412-F570 HydrophobicContact CG2-CB 3.63Å; V412-F570 HydrophobicContact CG2-CD1 4.16Å; V412-F570 HydrophobicContact CG2-CD2 4.2Å; V412-F570 HydrophobicContact CG2-CG 3.71Å; Q566-F570 PolarHBondContact O-N 3.29Å; L567-F570 PolarHBondContact O-N 3.36Å; E568-F570 VanDerWaalsContact C-N 3.32Å; E568-F570 PolarHBondContact O-N 3.07Å; F570-H572 PolarHBondContact O-N 3.15Å; F570-S573 PolarHBondContact O-N 3.36Å; F570-S573 VanDerWaalsContact O-N 3.14Å; F570-S573 PolarHBondContact O-OG 3.05Å; F570-W577 AromaticContact CE1-CD2 3.91Å; F570-W577 HydrophobicContact CE1-CD2 3.91Å; F570-W577 AromaticContact CE1-CE2 3.86Å; F570-W577 HydrophobicContact CE1-CE3 4.32Å; F570-W577 HydrophobicContact CE1-CG 4.22Å; F570-W577 HydrophobicContact CE1-CZ2 4.27Å; F570-W577 HydrophobicContact CZ-CD2 4.18Å; F570-W577 AromaticContact CZ-CE2 3.63Å; F570-W577 HydrophobicContact CZ-CH2 4.49Å; F570-W577 AromaticContact CZ-CZ2 3.83Å; F570-W577 HydrophobicContact CZ-CZ2 3.83Å; F570-W577 AromaticContact CZ-NE1 3.69Å
571	V	95.1	Very high	94.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.4	-30.9	177.9	171	0	0	0	0	111.9	F404 L408 L567 E568 W577 V578 A581 L619	F404-V571 HydrophobicContact CE2-CG2 3.9Å; F404-V571 HydrophobicContact CZ-CG2 3.85Å; L408-V571 HydrophobicContact CD1-CG2 3.94Å; L408-V571 HydrophobicContact CD2-CG2 4.45Å; L567-V571 WeakPolarHBondContact O-CG2 3.26Å; L567-V571 PolarHBondContact O-N 2.96Å; E568-V571 PolarHBondContact O-N 3.05Å; V571-W577 CarbonylContact O-C 3.6Å; V571-W577 VanDerWaalsContact O-CB 3.31Å; V571-W577 WeakPolarHBondContact O-CB 3.26Å; V571-V578 WeakPolarHBondContact O-CG2 3.12Å; V571-V578 PolarHBondContact O-N 3.3Å; V571-A581 HydrophobicContact CG1-CB 3.74Å; V571-L619 HydrophobicContact CG1-CD2 4.39Å
572	H	95.1	Very high	94.5	Very high	70 Å²	70	46.6 Å²	46.6	32%	0.324	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	3.5	178.4	-74.5	-103.2	0	0	0	114.5	E568 F570 D574 G618 D621	E568-H572 WeakPolarHBondContact O-CB 3.44Å; E568-H572 PolarHBondContact O-CD2 3.02Å; E568-H572 VanDerWaalsContact O-CD2 3.26Å; E568-H572 PolarHBondContact O-N 3.5Å; F570-H572 PolarHBondContact O-N 3.15Å; H572-D574 VanDerWaalsContact C-N 3.3Å; H572-D574 PolarHBondContact O-N 2.93Å; H572-G618 PolarHBondContact CD2-O 3.43Å; H572-D621 IonicContact NE2-OD2 3.71Å
573	S	94.9	Very high	94.6	Very high	82 Å²	82	50.1 Å²	50.1	57%	0.573	26%	0.259	S	S	*	.	S	Bend	trans	-75.4	-18.4	178.1	83.6	0	0	0	0	113.6	D569 F570	D569-S573 WeakPolarHBondContact O-CB 3.13Å; D569-S573 PolarHBondContact O-N 2.93Å; F570-S573 PolarHBondContact O-N 3.36Å; F570-S573 VanDerWaalsContact O-N 3.14Å; F570-S573 PolarHBondContact O-OG 3.05Å
574	D	94	Very high	94.7	Very high	72 Å²	72	50.1 Å²	50.1	39%	0.385	26%	0.259	S	S	.	.	S	Bend	trans	-146.2	140	173.3	-175.8	-6.1	0	0	0	110	H572 H576 W577 V578	H572-D574 VanDerWaalsContact C-N 3.3Å; H572-D574 PolarHBondContact O-N 2.93Å; D574-H576 PolarHBondContact O-N 3.32Å; D574-H576 PolarHBondContact OD1-N 2.66Å; D574-H576 WeakPolarHBondContact OD2-CB 3.41Å; D574-W577 HydrophobicContact CB-CG 4.43Å; D574-W577 PolarHBondContact O-N 3.07Å; D574-V578 PolarHBondContact O-N 3.06Å
575	T	93.4	Very high	94.7	Very high	104 Å²	104	50.1 Å²	50.1	64%	0.638	26%	0.258	S	S	*	.	H	α-helix	trans	-44.2	-37.2	163.5	64.5	0	0	0	0	113.8	V578 Q579	T575-V578 PolarHBondContact O-N 3.22Å; T575-Q579 WeakPolarHBondContact O-CG 3.41Å; T575-Q579 PolarHBondContact O-N 3.19Å
576	H	94.6	Very high	94.8	Very high	98 Å²	98	50.9 Å²	50.9	45%	0.454	26%	0.258	S	S	.	.	H	α-helix	trans	-62.7	-44.3	176.9	179.8	-102.8	0	0	0	112	D574 Q579 A580	D574-H576 PolarHBondContact O-N 3.32Å; D574-H576 PolarHBondContact OD1-N 2.66Å; D574-H576 WeakPolarHBondContact OD2-CB 3.41Å; H576-Q579 WeakPolarHBondContact O-CB 3.08Å; H576-Q579 PolarHBondContact O-N 3.3Å; H576-A580 PolarHBondContact O-N 3.4Å
577	W	94.3	Very high	94.9	Very high	48 Å²	48	49 Å²	49	18%	0.182	25%	0.251	C	S	.	.	H	α-helix	trans	-67	-39.7	177.7	-62.5	129.3	0	0	0	112	L407 F570 V571 D574 Q579 A580 A581	L407-W577 HydrophobicContact CB-CH2 3.89Å; L407-W577 HydrophobicContact CB-CZ3 3.62Å; L407-W577 HydrophobicContact CD1-CH2 4.1Å; L407-W577 HydrophobicContact CD1-CZ3 3.73Å; L407-W577 HydrophobicContact CG-CH2 4.39Å; L407-W577 HydrophobicContact CG-CZ3 4.23Å; F570-W577 AromaticContact CE1-CD2 3.91Å; F570-W577 HydrophobicContact CE1-CD2 3.91Å; F570-W577 AromaticContact CE1-CE2 3.86Å; F570-W577 HydrophobicContact CE1-CE3 4.32Å; F570-W577 HydrophobicContact CE1-CG 4.22Å; F570-W577 HydrophobicContact CE1-CZ2 4.27Å; F570-W577 HydrophobicContact CZ-CD2 4.18Å; F570-W577 AromaticContact CZ-CE2 3.63Å; F570-W577 HydrophobicContact CZ-CH2 4.49Å; F570-W577 AromaticContact CZ-CZ2 3.83Å; F570-W577 HydrophobicContact CZ-CZ2 3.83Å; F570-W577 AromaticContact CZ-NE1 3.69Å; V571-W577 CarbonylContact O-C 3.6Å; V571-W577 VanDerWaalsContact O-CB 3.31Å; V571-W577 WeakPolarHBondContact O-CB 3.26Å; D574-W577 HydrophobicContact CB-CG 4.43Å; D574-W577 PolarHBondContact O-N 3.07Å; W577-Q579 VanDerWaalsContact C-N 3.3Å; W577-Q579 PolarHBondContact O-N 3.12Å; W577-A580 PolarHBondContact O-N 2.72Å; W577-A581 WeakPolarHBondContact O-CB 3.37Å; W577-A581 PolarHBondContact O-N 3.14Å
578	V	94.8	Very high	94.9	Very high	20 Å²	20	49.9 Å²	49.9	12%	0.121	25%	0.254	C	S	.	.	H	α-helix	trans	-60.7	-39.1	171.9	-178.8	0	0	0	0	111.4	V571 D574 T575 K582 L619	V571-V578 WeakPolarHBondContact O-CG2 3.12Å; V571-V578 PolarHBondContact O-N 3.3Å; D574-V578 PolarHBondContact O-N 3.06Å; T575-V578 PolarHBondContact O-N 3.22Å; V578-K582 HydrophobicContact CG1-CD 4.16Å; V578-K582 WeakPolarHBondContact O-CB 3.41Å; V578-K582 VanDerWaalsContact O-CG 3.28Å; V578-K582 WeakPolarHBondContact O-CG 3.41Å; V578-K582 PolarHBondContact O-N 3.1Å; V578-L619 HydrophobicContact CG1-CD2 4.16Å
579	Q	94.2	Very high	94.8	Very high	103 Å²	103	50.1 Å²	50.1	48%	0.481	26%	0.256	S	S	.	.	H	α-helix	trans	-68.2	-40.6	174.8	-73.6	-175.9	33.4	0	0	112.5	T575 H576 W577 K582 K583	T575-Q579 WeakPolarHBondContact O-CG 3.41Å; T575-Q579 PolarHBondContact O-N 3.19Å; H576-Q579 WeakPolarHBondContact O-CB 3.08Å; H576-Q579 PolarHBondContact O-N 3.3Å; W577-Q579 VanDerWaalsContact C-N 3.3Å; W577-Q579 PolarHBondContact O-N 3.12Å; Q579-K582 PolarHBondContact O-N 3.33Å; Q579-K583 WeakPolarHBondContact O-CG 3.34Å; Q579-K583 PolarHBondContact O-N 3.37Å
580	A	94.8	Very high	94.7	Very high	21 Å²	21	54.9 Å²	54.9	17%	0.174	27%	0.268	C	S	.	.	H	α-helix	trans	-61.7	-46.9	175.5	0	0	0	0	0	111.3	F404 H576 W577 K582 K583 A584	F404-A580 HydrophobicContact CD2-CB 4.27Å; H576-A580 PolarHBondContact O-N 3.4Å; W577-A580 PolarHBondContact O-N 2.72Å; A580-K582 PolarHBondContact O-N 3.09Å; A580-K583 PolarHBondContact O-N 3.22Å; A580-A584 WeakPolarHBondContact O-CB 3.44Å; A580-A584 PolarHBondContact O-N 3.38Å
581	A	95.9	Very high	94.6	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-58.3	-43.2	174.3	0	0	0	0	0	112.6	F404 V571 W577 A584 L585 F617 L619	F404-A581 HydrophobicContact CD2-CB 4.18Å; F404-A581 HydrophobicContact CE2-CB 3.55Å; F404-A581 HydrophobicContact CZ-CB 3.89Å; V571-A581 HydrophobicContact CG1-CB 3.74Å; W577-A581 WeakPolarHBondContact O-CB 3.37Å; W577-A581 PolarHBondContact O-N 3.14Å; A581-A584 PolarHBondContact O-N 3.04Å; A581-L585 WeakPolarHBondContact O-CB 3.42Å; A581-L585 PolarHBondContact O-N 2.84Å; A581-F617 WeakPolarHBondContact CB-O 3.39Å; A581-L619 HydrophobicContact CB-CD2 3.72Å; A581-L619 HydrophobicContact CB-CG 4.06Å
582	K	95.3	Very high	94.4	Very high	99 Å²	99	55 Å²	55	43%	0.43	27%	0.272	S	S	.	.	H	α-helix	trans	-64.5	-41.8	175.8	-75.4	172.1	-179.1	177.4	0	112.4	V578 Q579 A580 Q586 L619	V578-K582 HydrophobicContact CG1-CD 4.16Å; V578-K582 WeakPolarHBondContact O-CB 3.41Å; V578-K582 VanDerWaalsContact O-CG 3.28Å; V578-K582 WeakPolarHBondContact O-CG 3.41Å; V578-K582 PolarHBondContact O-N 3.1Å; Q579-K582 PolarHBondContact O-N 3.33Å; A580-K582 PolarHBondContact O-N 3.09Å; K582-Q586 WeakPolarHBondContact O-CB 3.29Å; K582-Q586 VanDerWaalsContact O-CG 3.29Å; K582-Q586 WeakPolarHBondContact O-CG 3.35Å; K582-Q586 PolarHBondContact O-N 2.68Å; K582-L619 HydrophobicContact CG-CD1 3.98Å; K582-L619 HydrophobicContact CG-CD2 4.16Å
583	K	95	Very high	94.2	Very high	112 Å²	112	55.2 Å²	55.2	49%	0.487	28%	0.279	S	S	.	.	H	α-helix	trans	-64.7	-44.2	174.9	-72.5	168.5	-177.1	171.1	0	111.5	Q579 A580 Q586 S587	Q579-K583 WeakPolarHBondContact O-CG 3.34Å; Q579-K583 PolarHBondContact O-N 3.37Å; A580-K583 PolarHBondContact O-N 3.22Å; K583-Q586 PolarHBondContact O-N 2.94Å; K583-S587 WeakPolarHBondContact O-CB 3.44Å; K583-S587 PolarHBondContact O-N 3.25Å; K583-S587 PolarHBondContact O-OG 3.47Å
584	A	96.2	Very high	94	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.4	-50.7	175.4	0	0	0	0	0	111.4	A401 F404 A580 A581 Q586 S587 F588 F617	A401-A584 HydrophobicContact CB-CB 4.36Å; F404-A584 HydrophobicContact CB-CB 3.63Å; F404-A584 HydrophobicContact CD1-CB 3.97Å; F404-A584 HydrophobicContact CG-CB 3.83Å; A580-A584 WeakPolarHBondContact O-CB 3.44Å; A580-A584 PolarHBondContact O-N 3.38Å; A581-A584 PolarHBondContact O-N 3.04Å; A584-Q586 PolarHBondContact O-N 3.49Å; A584-S587 PolarHBondContact O-N 2.81Å; A584-S587 PolarHBondContact O-OG 3.09Å; A584-F588 PolarHBondContact O-N 3.35Å; A584-F617 HydrophobicContact CB-CD1 3.69Å; A584-F617 HydrophobicContact CB-CE1 3.78Å
585	L	95.6	Very high	93.9	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-58.8	-44.7	175.2	176	62.3	0	0	0	112.5	A581 S587 F588 L589 T613 A614 F617 L619 P623 L626	A581-L585 WeakPolarHBondContact O-CB 3.42Å; A581-L585 PolarHBondContact O-N 2.84Å; L585-S587 PolarHBondContact O-N 3.02Å; L585-F588 PolarHBondContact O-N 3.5Å; L585-L589 HydrophobicContact CD1-CD1 3.96Å; L585-L589 HydrophobicContact CD1-CG 4.05Å; L585-L589 HydrophobicContact CG-CD1 4.03Å; L585-L589 HydrophobicContact CG-CG 4.49Å; L585-L589 VanDerWaalsContact O-CG 3.29Å; L585-L589 WeakPolarHBondContact O-CG 3.42Å; L585-L589 PolarHBondContact O-N 2.97Å; L585-T613 HydrophobicContact CD1-CG2 3.7Å; L585-A614 HydrophobicContact CD2-CB 4.01Å; L585-F617 HydrophobicContact CB-CD1 4.49Å; L585-F617 HydrophobicContact CB-CD2 3.97Å; L585-F617 HydrophobicContact CB-CE2 4.28Å; L585-F617 HydrophobicContact CB-CG 4.09Å; L585-F617 HydrophobicContact CD1-CD2 3.71Å; L585-F617 HydrophobicContact CD1-CE2 3.69Å; L585-F617 HydrophobicContact CG-CD2 4.37Å; L585-L619 HydrophobicContact CD2-CD1 3.88Å; L585-P623 HydrophobicContact CD2-CG 3.79Å; L585-L626 HydrophobicContact CD2-CD1 4.48Å
586	Q	94.9	Very high	93.6	Very high	77 Å²	77	51.3 Å²	51.3	36%	0.36	25%	0.253	S	S	.	.	H	α-helix	trans	-60.3	-43.4	176	-77.2	175.3	-5.1	0	0	112.2	K582 K583 A584 L589 R590 L626	K582-Q586 WeakPolarHBondContact O-CB 3.29Å; K582-Q586 VanDerWaalsContact O-CG 3.29Å; K582-Q586 WeakPolarHBondContact O-CG 3.35Å; K582-Q586 PolarHBondContact O-N 2.68Å; K583-Q586 PolarHBondContact O-N 2.94Å; A584-Q586 PolarHBondContact O-N 3.49Å; Q586-L589 PolarHBondContact O-N 2.96Å; Q586-R590 VanDerWaalsContact O-CG 3.31Å; Q586-R590 WeakPolarHBondContact O-CG 3.31Å; Q586-R590 PolarHBondContact O-N 3.46Å; Q586-L626 HydrophobicContact CG-CD2 3.68Å
587	S	95.4	Very high	93.3	Very high	11 Å²	11	50.9 Å²	50.9	8%	0.077	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-39.9	177.7	74.1	0	0	0	0	112.4	S398 E400 K583 A584 L585 R590 A591	S398-S587 WeakPolarHBondContact CB-OG 3.47Å; S398-S587 WeakPolarHBondContact OG-CB 3.35Å; S398-S587 PolarHBondContact OG-OG 2.98Å; E400-S587 VanDerWaalsContact OE2-CB 3.3Å; E400-S587 WeakPolarHBondContact OE2-CB 3.45Å; K583-S587 WeakPolarHBondContact O-CB 3.44Å; K583-S587 PolarHBondContact O-N 3.25Å; K583-S587 PolarHBondContact O-OG 3.47Å; A584-S587 PolarHBondContact O-N 2.81Å; A584-S587 PolarHBondContact O-OG 3.09Å; L585-S587 PolarHBondContact O-N 3.02Å; S587-R590 PolarHBondContact O-N 2.93Å; S587-A591 PolarHBondContact O-N 3.16Å
588	F	94.6	Very high	92.9	Very high	18 Å²	18	53.6 Å²	53.6	8%	0.079	28%	0.281	C	S	.	.	H	α-helix	trans	-62.5	-47.9	174.5	170.2	-95.6	0	0	0	111.5	T473 A584 L585 R590 A591 Y592 L608 T613 F617	T473-F588 HydrophobicContact CG2-CD2 4.46Å; T473-F588 HydrophobicContact CG2-CE2 3.91Å; A584-F588 PolarHBondContact O-N 3.35Å; L585-F588 PolarHBondContact O-N 3.5Å; F588-R590 VanDerWaalsContact C-N 3.3Å; F588-R590 PolarHBondContact O-N 2.89Å; F588-A591 PolarHBondContact O-N 3.27Å; F588-Y592 HydrophobicContact CE1-CD2 4.35Å; F588-Y592 AromaticContact CZ-CD2 3.93Å; F588-Y592 HydrophobicContact CZ-CD2 3.93Å; F588-Y592 HydrophobicContact CZ-CE2 4.41Å; F588-Y592 WeakPolarHBondContact O-CB 3.29Å; F588-Y592 PolarHBondContact O-N 3Å; F588-L608 HydrophobicContact CE1-CD1 4.16Å; F588-T613 HydrophobicContact CD1-CG2 4.03Å; F588-T613 HydrophobicContact CE1-CG2 3.71Å; F588-F617 HydrophobicContact CB-CE2 4.36Å; F588-F617 HydrophobicContact CB-CZ 3.68Å; F588-F617 HydrophobicContact CD1-CE2 4.24Å; F588-F617 HydrophobicContact CD1-CZ 4.3Å; F588-F617 HydrophobicContact CD2-CZ 4.43Å; F588-F617 HydrophobicContact CG-CE2 4.28Å; F588-F617 AromaticContact CG-CZ 3.88Å; F588-F617 HydrophobicContact CG-CZ 3.88Å
589	L	94.3	Very high	92.6	Very high	18 Å²	18	52.8 Å²	52.8	9%	0.094	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-34.9	178.7	-65.9	171.6	0	0	0	111.9	L585 Q586 Y592 T593 L605 L608 L610 T613 L626	L585-L589 HydrophobicContact CD1-CD1 3.96Å; L585-L589 HydrophobicContact CD1-CG 4.05Å; L585-L589 HydrophobicContact CG-CD1 4.03Å; L585-L589 HydrophobicContact CG-CG 4.49Å; L585-L589 VanDerWaalsContact O-CG 3.29Å; L585-L589 WeakPolarHBondContact O-CG 3.42Å; L585-L589 PolarHBondContact O-N 2.97Å; Q586-L589 PolarHBondContact O-N 2.96Å; L589-Y592 WeakPolarHBondContact O-CB 3.44Å; L589-Y592 PolarHBondContact O-N 3.3Å; L589-T593 PolarHBondContact O-N 3.21Å; L589-T593 VanDerWaalsContact O-N 3.14Å; L589-L605 HydrophobicContact CD2-CD1 3.87Å; L589-L608 HydrophobicContact CD2-CD1 4.23Å; L589-L610 HydrophobicContact CD1-CD2 4.13Å; L589-L610 HydrophobicContact CD2-CD2 3.82Å; L589-T613 HydrophobicContact CD2-CG2 4.46Å; L589-L626 HydrophobicContact CD1-CD1 3.72Å
590	R	92.6	Very high	92.3	Very high	176 Å²	176	50.9 Å²	50.9	66%	0.664	27%	0.266	S	S	*	.	H	α-helix	trans	-63	-49.9	171.3	-72.2	172.2	-173.2	-175.7	2.6	111.5	Q586 S587 F588 Y592 T593 T594	Q586-R590 VanDerWaalsContact O-CG 3.31Å; Q586-R590 WeakPolarHBondContact O-CG 3.31Å; Q586-R590 PolarHBondContact O-N 3.46Å; S587-R590 PolarHBondContact O-N 2.93Å; F588-R590 VanDerWaalsContact C-N 3.3Å; F588-R590 PolarHBondContact O-N 2.89Å; R590-Y592 PolarHBondContact O-N 3.06Å; R590-T593 WeakPolarHBondContact O-CA 3.34Å; R590-T593 PolarHBondContact O-N 3.11Å; R590-T593 PolarHBondContact O-OG1 3.03Å; R590-T594 PolarHBondContact O-N 3.21Å
591	A	91.4	Very high	91.9	Very high	21 Å²	21	56.5 Å²	56.5	17%	0.174	29%	0.289	C	S	.	.	H	α-helix	trans	-60.6	-34	175.5	0	0	0	0	0	112.4	S587 F588 T593 T594	S587-A591 PolarHBondContact O-N 3.16Å; F588-A591 PolarHBondContact O-N 3.27Å; A591-T593 PolarHBondContact O-N 2.79Å; A591-T594 PolarHBondContact O-N 2.7Å; A591-T594 PolarHBondContact O-OG1 2.59Å
592	Y	91	Very high	91.6	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.008	29%	0.29	C	S	.	.	H	α-helix	trans	-64.9	-28.3	173.3	-149.5	-91.9	0	0	0	112.8	E505 F588 L589 R590 T594 Y595 F603 L605 L608	E505-Y592 VanDerWaalsContact OE1-CE2 3.26Å; E505-Y592 WeakPolarHBondContact OE1-CE2 3.21Å; E505-Y592 PolarHBondContact OE1-OH 2.72Å; F588-Y592 HydrophobicContact CE1-CD2 4.35Å; F588-Y592 AromaticContact CZ-CD2 3.93Å; F588-Y592 HydrophobicContact CZ-CD2 3.93Å; F588-Y592 HydrophobicContact CZ-CE2 4.41Å; F588-Y592 WeakPolarHBondContact O-CB 3.29Å; F588-Y592 PolarHBondContact O-N 3Å; L589-Y592 WeakPolarHBondContact O-CB 3.44Å; L589-Y592 PolarHBondContact O-N 3.3Å; R590-Y592 PolarHBondContact O-N 3.06Å; Y592-T594 VanDerWaalsContact C-N 3.33Å; Y592-Y595 AromaticContact CD2-CE2 3.97Å; Y592-Y595 HydrophobicContact CD2-CE2 3.97Å; Y592-Y595 HydrophobicContact CE2-CE2 4.33Å; Y592-Y595 HydrophobicContact CG-CE2 4.4Å; Y592-F603 HydrophobicContact CE1-CB 4.11Å; Y592-F603 HydrophobicContact CE2-CB 4.37Å; Y592-F603 HydrophobicContact CE2-CD1 4.01Å; Y592-F603 AromaticContact CZ-CD1 3.96Å; Y592-L605 HydrophobicContact CD1-CD1 4.49Å; Y592-L608 HydrophobicContact CD1-CD1 3.63Å; Y592-L608 HydrophobicContact CD1-CG 4.28Å; Y592-L608 HydrophobicContact CD2-CD1 3.91Å; Y592-L608 HydrophobicContact CE1-CD1 3.56Å; Y592-L608 HydrophobicContact CE1-CD2 4.38Å; Y592-L608 HydrophobicContact CE1-CG 3.73Å; Y592-L608 HydrophobicContact CE2-CD1 3.86Å; Y592-L608 HydrophobicContact CE2-CD2 4.31Å; Y592-L608 HydrophobicContact CE2-CG 4.36Å; Y592-L608 HydrophobicContact CG-CD1 3.79Å
593	T	91.3	Very high	91.4	Very high	76 Å²	76	52 Å²	52	47%	0.466	27%	0.269	S	S	.	.	H	α-helix	trans	-74.7	-17.3	171.4	60.7	0	0	0	0	114	L589 R590 A591 K600 L605	L589-T593 PolarHBondContact O-N 3.21Å; L589-T593 VanDerWaalsContact O-N 3.14Å; R590-T593 WeakPolarHBondContact O-CA 3.34Å; R590-T593 PolarHBondContact O-N 3.11Å; R590-T593 PolarHBondContact O-OG1 3.03Å; A591-T593 PolarHBondContact O-N 2.79Å; T593-K600 PolarHBondContact O-NZ 2.87Å; T593-L605 HydrophobicContact CG2-CD2 3.93Å
594	T	90.9	Very high	91	Very high	113 Å²	113	50.1 Å²	50.1	69%	0.693	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-3.2	-176.6	56.5	0	0	0	0	115.9	R590 A591 Y592	R590-T594 PolarHBondContact O-N 3.21Å; A591-T594 PolarHBondContact O-N 2.7Å; A591-T594 PolarHBondContact O-OG1 2.59Å; Y592-T594 VanDerWaalsContact C-N 3.33Å
595	Y	90.9	Very high	90.6	Very high	17 Å²	17	53.3 Å²	53.3	7%	0.067	28%	0.279	C	S	.	.	S	Bend	trans	-53.6	141.9	173.8	-81.5	-89.7	0	0	0	112.8	P474 Y592 L599 K600 F603	P474-Y595 PolarHBondContact O-OH 3.44Å; P474-Y595 VanDerWaalsContact O-OH 3.07Å; Y592-Y595 AromaticContact CD2-CE2 3.97Å; Y592-Y595 HydrophobicContact CD2-CE2 3.97Å; Y592-Y595 HydrophobicContact CE2-CE2 4.33Å; Y592-Y595 HydrophobicContact CG-CE2 4.4Å; Y595-L599 HydrophobicContact CD1-CD1 4.04Å; Y595-K600 WeakPolarHBondContact O-CE 3.24Å; Y595-K600 PolarHBondContact O-NZ 3.24Å; Y595-F603 HydrophobicContact CD1-CB 4.02Å; Y595-F603 AromaticContact CD1-CD2 3.31Å; Y595-F603 HydrophobicContact CD1-CD2 3.31Å; Y595-F603 AromaticContact CD1-CE2 3.97Å; Y595-F603 HydrophobicContact CD1-CE2 3.97Å; Y595-F603 AromaticContact CD1-CG 3.82Å; Y595-F603 HydrophobicContact CD1-CG 3.82Å; Y595-F603 HydrophobicContact CD2-CB 3.65Å; Y595-F603 HydrophobicContact CD2-CD2 4.41Å; Y595-F603 HydrophobicContact CD2-CG 4.09Å; Y595-F603 HydrophobicContact CE1-CB 4.3Å; Y595-F603 HydrophobicContact CE1-CD1 4.3Å; Y595-F603 AromaticContact CE1-CD2 3.28Å; Y595-F603 HydrophobicContact CE1-CD2 3.28Å; Y595-F603 AromaticContact CE1-CE2 3.57Å; Y595-F603 HydrophobicContact CE1-CE2 3.57Å; Y595-F603 AromaticContact CE1-CG 3.71Å; Y595-F603 HydrophobicContact CE1-CG 3.71Å; Y595-F603 HydrophobicContact CE1-CZ 4.21Å; Y595-F603 HydrophobicContact CE2-CB 3.96Å; Y595-F603 HydrophobicContact CE2-CD1 4.36Å; Y595-F603 HydrophobicContact CE2-CD2 4.4Å; Y595-F603 AromaticContact CE2-CG 3.99Å; Y595-F603 HydrophobicContact CE2-CG 3.99Å; Y595-F603 HydrophobicContact CG-CB 3.67Å; Y595-F603 AromaticContact CG-CD2 3.9Å; Y595-F603 HydrophobicContact CG-CD2 3.9Å; Y595-F603 AromaticContact CG-CG 4Å; Y595-F603 HydrophobicContact CG-CG 4Å; Y595-F603 AromaticContact CZ-CD2 3.86Å; Y595-F603 AromaticContact CZ-CG 3.79Å
596	P	88.4	Confident	90.1	Very high	45 Å²	45	64.1 Å²	64.1	29%	0.292	32%	0.32	S	S	.	.			trans	-55.8	159.9	178.3	-29.3	36.6	0	0	0	115.4	S476 H598 L599 K600	S476-P596 WeakPolarHBondContact O-CD 3.47Å; S476-P596 WeakPolarHBondContact O-CG 3.34Å; P596-H598 VanDerWaalsContact CB-CE1 3.46Å; P596-H598 WeakPolarHBondContact CB-CE1 3.43Å; P596-H598 PolarHBondContact O-N 2.94Å; P596-L599 PolarHBondContact O-N 3.42Å; P596-L599 VanDerWaalsContact O-N 3.14Å; P596-K600 PolarHBondContact O-N 3.23Å
597	A	87	Confident	89.7	Confident	89 Å²	89	65.3 Å²	65.3	74%	0.736	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-44.1	-177.5	0	0	0	0	0	113.8	L599 K600	A597-L599 VanDerWaalsContact C-N 3.31Å; A597-L599 PolarHBondContact O-N 2.85Å; A597-K600 WeakPolarHBondContact O-CB 3.48Å; A597-K600 PolarHBondContact O-N 3.24Å; A597-K600 VanDerWaalsContact O-N 3.1Å
598	H	86.2	Confident	89.3	Confident	106 Å²	106	65.4 Å²	65.4	49%	0.491	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-62.7	-37	178.9	57.2	-90	0	0	0	112.1	E511 P596 K600 Q601	E511-H598 IonicContact OE1-CD2 3.97Å; E511-H598 PolarHBondContact OE1-CD2 3.3Å; P596-H598 VanDerWaalsContact CB-CE1 3.46Å; P596-H598 WeakPolarHBondContact CB-CE1 3.43Å; P596-H598 PolarHBondContact O-N 2.94Å; H598-K600 VanDerWaalsContact C-N 3.32Å; H598-K600 PolarHBondContact O-N 2.89Å; H598-Q601 WeakPolarHBondContact O-CG 3.44Å
599	L	89.6	Confident	89.1	Confident	2 Å²	2	70 Å²	70	1%	0.01	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-80.1	-5.3	176.3	-55.7	-175.4	0	0	0	114.3	S476 F508 E511 Y595 P596 A597 Q601 V602 F603	S476-L599 VanDerWaalsContact O-CD1 3.22Å; S476-L599 WeakPolarHBondContact O-CD1 3.49Å; F508-L599 HydrophobicContact CD2-CD2 4.28Å; F508-L599 HydrophobicContact CE2-CD1 4.11Å; F508-L599 HydrophobicContact CE2-CD2 4.18Å; E511-L599 HydrophobicContact CG-CD2 3.82Å; E511-L599 WeakPolarHBondContact OE1-CD2 3.21Å; Y595-L599 HydrophobicContact CD1-CD1 4.04Å; P596-L599 PolarHBondContact O-N 3.42Å; P596-L599 VanDerWaalsContact O-N 3.14Å; A597-L599 VanDerWaalsContact C-N 3.31Å; A597-L599 PolarHBondContact O-N 2.85Å; L599-Q601 PolarHBondContact O-N 3.42Å; L599-V602 PolarHBondContact O-N 3.36Å; L599-F603 HydrophobicContact CB-CD2 3.96Å; L599-F603 HydrophobicContact CD1-CD2 4.31Å; L599-F603 HydrophobicContact CD1-CE2 4.26Å; L599-F603 PolarHBondContact O-N 3.39Å
600	K	87.4	Confident	88.8	Confident	63 Å²	63	72.9 Å²	72.9	27%	0.274	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-65.7	-18.6	179	-72	-47.7	-162.3	-153	0	114.1	T593 Y595 P596 A597 H598 V602 H604	T593-K600 PolarHBondContact O-NZ 2.87Å; Y595-K600 WeakPolarHBondContact O-CE 3.24Å; Y595-K600 PolarHBondContact O-NZ 3.24Å; P596-K600 PolarHBondContact O-N 3.23Å; A597-K600 WeakPolarHBondContact O-CB 3.48Å; A597-K600 PolarHBondContact O-N 3.24Å; A597-K600 VanDerWaalsContact O-N 3.1Å; H598-K600 VanDerWaalsContact C-N 3.32Å; H598-K600 PolarHBondContact O-N 2.89Å; K600-V602 VanDerWaalsContact C-N 3.27Å; K600-H604 WeakPolarHBondContact O-CB 3.37Å
601	Q	86.9	Confident	88.6	Confident	139 Å²	139	65.7 Å²	65.7	65%	0.65	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-63.8	-36.2	169.4	63.5	-166.7	-7.9	0	0	111.6	H598 L599 R607	H598-Q601 WeakPolarHBondContact O-CG 3.44Å; L599-Q601 PolarHBondContact O-N 3.42Å; Q601-R607 PolarHBondContact O-NH1 2.92Å
602	V	89.4	Confident	88.7	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.024	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-66.4	178.2	-165.8	0	0	0	0	110.7	E505 D507 F508 L599 K600 H604	E505-V602 HydrophobicContact CB-CG1 4.3Å; D507-V602 HydrophobicContact CB-CB 4.47Å; D507-V602 HydrophobicContact CB-CG1 4.08Å; D507-V602 HydrophobicContact CB-CG2 3.74Å; F508-V602 HydrophobicContact CB-CG1 4.19Å; L599-V602 PolarHBondContact O-N 3.36Å; K600-V602 VanDerWaalsContact C-N 3.27Å; V602-H604 VanDerWaalsContact C-N 3.3Å; V602-H604 PolarHBondContact O-N 2.89Å
603	F	90.9	Very high	88.7	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.338	C	S	.	.	S	Bend	trans	-86.6	66.7	-174.5	-54.4	-65.5	0	0	0	111.6	P474 L501 E505 F508 Y592 Y595 L599	P474-F603 HydrophobicContact CB-CE1 3.9Å; P474-F603 HydrophobicContact CB-CE2 4.48Å; P474-F603 HydrophobicContact CB-CZ 3.61Å; P474-F603 HydrophobicContact CG-CE1 3.81Å; P474-F603 HydrophobicContact CG-CZ 4.01Å; L501-F603 HydrophobicContact CD2-CZ 4.45Å; E505-F603 HydrophobicContact CB-CD1 4.43Å; E505-F603 HydrophobicContact CB-CE1 3.84Å; E505-F603 HydrophobicContact CG-CD1 3.79Å; E505-F603 HydrophobicContact CG-CE1 3.63Å; F508-F603 HydrophobicContact CB-CE2 4.39Å; F508-F603 HydrophobicContact CB-CZ 3.94Å; F508-F603 HydrophobicContact CD1-CZ 4.23Å; F508-F603 AromaticContact CD2-CE2 3.54Å; F508-F603 HydrophobicContact CD2-CE2 3.54Å; F508-F603 AromaticContact CD2-CZ 3.8Å; F508-F603 HydrophobicContact CD2-CZ 3.8Å; F508-F603 AromaticContact CE2-CE2 3.91Å; F508-F603 HydrophobicContact CE2-CE2 3.91Å; F508-F603 HydrophobicContact CE2-CZ 4.35Å; F508-F603 AromaticContact CG-CE2 3.98Å; F508-F603 HydrophobicContact CG-CE2 3.98Å; F508-F603 AromaticContact CG-CZ 3.73Å; F508-F603 HydrophobicContact CG-CZ 3.73Å; Y592-F603 HydrophobicContact CE1-CB 4.11Å; Y592-F603 HydrophobicContact CE2-CB 4.37Å; Y592-F603 HydrophobicContact CE2-CD1 4.01Å; Y592-F603 AromaticContact CZ-CD1 3.96Å; Y595-F603 HydrophobicContact CD1-CB 4.02Å; Y595-F603 AromaticContact CD1-CD2 3.31Å; Y595-F603 HydrophobicContact CD1-CD2 3.31Å; Y595-F603 AromaticContact CD1-CE2 3.97Å; Y595-F603 HydrophobicContact CD1-CE2 3.97Å; Y595-F603 AromaticContact CD1-CG 3.82Å; Y595-F603 HydrophobicContact CD1-CG 3.82Å; Y595-F603 HydrophobicContact CD2-CB 3.65Å; Y595-F603 HydrophobicContact CD2-CD2 4.41Å; Y595-F603 HydrophobicContact CD2-CG 4.09Å; Y595-F603 HydrophobicContact CE1-CB 4.3Å; Y595-F603 HydrophobicContact CE1-CD1 4.3Å; Y595-F603 AromaticContact CE1-CD2 3.28Å; Y595-F603 HydrophobicContact CE1-CD2 3.28Å; Y595-F603 AromaticContact CE1-CE2 3.57Å; Y595-F603 HydrophobicContact CE1-CE2 3.57Å; Y595-F603 AromaticContact CE1-CG 3.71Å; Y595-F603 HydrophobicContact CE1-CG 3.71Å; Y595-F603 HydrophobicContact CE1-CZ 4.21Å; Y595-F603 HydrophobicContact CE2-CB 3.96Å; Y595-F603 HydrophobicContact CE2-CD1 4.36Å; Y595-F603 HydrophobicContact CE2-CD2 4.4Å; Y595-F603 AromaticContact CE2-CG 3.99Å; Y595-F603 HydrophobicContact CE2-CG 3.99Å; Y595-F603 HydrophobicContact CG-CB 3.67Å; Y595-F603 AromaticContact CG-CD2 3.9Å; Y595-F603 HydrophobicContact CG-CD2 3.9Å; Y595-F603 AromaticContact CG-CG 4Å; Y595-F603 HydrophobicContact CG-CG 4Å; Y595-F603 AromaticContact CZ-CD2 3.86Å; Y595-F603 AromaticContact CZ-CG 3.79Å; L599-F603 HydrophobicContact CB-CD2 3.96Å; L599-F603 HydrophobicContact CD1-CD2 4.31Å; L599-F603 HydrophobicContact CD1-CE2 4.26Å; L599-F603 PolarHBondContact O-N 3.39Å
604	H	87.1	Confident	88.8	Confident	73 Å²	73	62.8 Å²	62.8	34%	0.338	32%	0.315	S	S	.	.			trans	-99.8	128.9	174.9	-158.9	-111.7	0	0	0	112.4	K600 V602 R606 R607	K600-H604 WeakPolarHBondContact O-CB 3.37Å; V602-H604 VanDerWaalsContact C-N 3.3Å; V602-H604 PolarHBondContact O-N 2.89Å; H604-R606 WeakPolarHBondContact ND1-CB 3.41Å; H604-R606 PolarHBondContact ND1-N 3.49Å; H604-R606 PolarHBondContact O-N 3.21Å; H604-R606 VanDerWaalsContact O-N 3.08Å; H604-R607 HydrophobicContact CB-CG 4.26Å; H604-R607 WeakPolarHBondContact O-CB 3.46Å; H604-R607 PolarHBondContact O-N 3.05Å
605	L	86.6	Confident	88.9	Confident	67 Å²	67	59 Å²	59	35%	0.351	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-56.2	-31.6	-178.3	-174.2	67.1	0	0	0	112.8	L589 Y592 T593 R607 L608	L589-L605 HydrophobicContact CD2-CD1 3.87Å; Y592-L605 HydrophobicContact CD1-CD1 4.49Å; T593-L605 HydrophobicContact CG2-CD2 3.93Å; L605-R607 VanDerWaalsContact C-N 3.33Å; L605-R607 PolarHBondContact O-N 2.82Å; L605-L608 HydrophobicContact CD1-CD1 4.49Å; L605-L608 PolarHBondContact O-N 3.3Å
606	R	86.3	Confident	89	Confident	229 Å²	229	58.5 Å²	58.5	86%	0.864	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-74.4	-14.5	176.3	-55.2	-177.1	-170.4	169.5	0.8	114.5	H604 L608	H604-R606 WeakPolarHBondContact ND1-CB 3.41Å; H604-R606 PolarHBondContact ND1-N 3.49Å; H604-R606 PolarHBondContact O-N 3.21Å; H604-R606 VanDerWaalsContact O-N 3.08Å; R606-L608 VanDerWaalsContact C-N 3.33Å
607	R	85.8	Confident	89.4	Confident	102 Å²	102	56.8 Å²	56.8	39%	0.385	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-79.4	-16.2	170.3	-70.4	179.2	84	173.4	-3.1	111.6	A504 D507 Q601 H604 L605	A504-R607 HydrophobicContact CB-CB 4.32Å; A504-R607 PolarHBondContact O-NE 2.82Å; A504-R607 PolarHBondContact O-NH2 2.8Å; A504-R607 VanDerWaalsContact O-NH2 3.08Å; D507-R607 IonicContact OD2-CZ 2.99Å; D507-R607 IonicContact OD2-NH1 3.39Å; D507-R607 PolarHBondContact OD2-NH1 3.18Å; D507-R607 IonicContact OD2-NH2 3.8Å; D507-R607 PolarHBondContact OD2-NH2 3.31Å; Q601-R607 PolarHBondContact O-NH1 2.92Å; H604-R607 HydrophobicContact CB-CG 4.26Å; H604-R607 WeakPolarHBondContact O-CB 3.46Å; H604-R607 PolarHBondContact O-N 3.05Å; L605-R607 VanDerWaalsContact C-N 3.33Å; L605-R607 PolarHBondContact O-N 2.82Å
608	L	86.6	Confident	89.7	Confident	13 Å²	13	52.5 Å²	52.5	7%	0.068	24%	0.241	C	C	.	.	S	Bend	trans	-86.1	119.8	177	-66.4	-176.3	0	0	0	112.4	F588 L589 Y592 L605 R606 L610	F588-L608 HydrophobicContact CE1-CD1 4.16Å; L589-L608 HydrophobicContact CD2-CD1 4.23Å; Y592-L608 HydrophobicContact CD1-CD1 3.63Å; Y592-L608 HydrophobicContact CD1-CG 4.28Å; Y592-L608 HydrophobicContact CD2-CD1 3.91Å; Y592-L608 HydrophobicContact CE1-CD1 3.56Å; Y592-L608 HydrophobicContact CE1-CD2 4.38Å; Y592-L608 HydrophobicContact CE1-CG 3.73Å; Y592-L608 HydrophobicContact CE2-CD1 3.86Å; Y592-L608 HydrophobicContact CE2-CD2 4.31Å; Y592-L608 HydrophobicContact CE2-CG 4.36Å; Y592-L608 HydrophobicContact CG-CD1 3.79Å; L605-L608 HydrophobicContact CD1-CD1 4.49Å; L605-L608 PolarHBondContact O-N 3.3Å; R606-L608 VanDerWaalsContact C-N 3.33Å; L608-L610 PolarHBondContact O-N 3.22Å; L608-L610 VanDerWaalsContact O-N 3.09Å
609	H	89.5	Confident	90	Very high	115 Å²	115	47.7 Å²	47.7	53%	0.532	22%	0.219	S	C	.	.			trans	-75	97.1	169.4	-175.3	-88.7	0	0	0	110.4	G611 H612 T613	H609-G611 VanDerWaalsContact C-N 3.27Å; H609-G611 PolarHBondContact O-N 2.76Å; H609-G611 VanDerWaalsContact O-N 3.09Å; H609-H612 HydrophobicContact CB-CB 4.19Å; H609-H612 AromaticContact CE1-CD2 3.68Å; H609-H612 AromaticContact CE1-CE1 3.93Å; H609-H612 AromaticContact CE1-CG 3.87Å; H609-H612 AromaticContact CE1-NE2 3.77Å; H609-H612 AromaticContact CG-CG 3.88Å; H609-H612 AromaticContact CG-ND1 3.71Å; H609-H612 AromaticContact ND1-CD2 3.37Å; H609-H612 PolarHBondContact ND1-CD2 3.04Å; H609-H612 AromaticContact ND1-CE1 3.7Å; H609-H612 AromaticContact ND1-CG 3.1Å; H609-H612 PolarHBondContact ND1-N 3.48Å; H609-H612 AromaticContact ND1-ND1 3.33Å; H609-H612 PolarHBondContact ND1-ND1 2.96Å; H609-H612 AromaticContact ND1-NE2 3.78Å; H609-H612 WeakPolarHBondContact O-CA 3.36Å; H609-H612 WeakPolarHBondContact O-CB 3.4Å; H609-H612 PolarHBondContact O-N 3.38Å; H609-T613 PolarHBondContact O-N 3.21Å; H609-T613 PolarHBondContact O-OG1 3.39Å
610	L	89.4	Confident	90	Very high	79 Å²	79	53.9 Å²	53.9	41%	0.414	24%	0.242	S	C	.	.	H	α-helix	trans	-51.9	-37.1	-170	-63.6	178.8	0	0	0	114.7	L589 L608 H612 T613 A614	L589-L610 HydrophobicContact CD1-CD2 4.13Å; L589-L610 HydrophobicContact CD2-CD2 3.82Å; L608-L610 PolarHBondContact O-N 3.22Å; L608-L610 VanDerWaalsContact O-N 3.09Å; L610-H612 VanDerWaalsContact C-N 3.33Å; L610-H612 PolarHBondContact O-N 3.36Å; L610-T613 PolarHBondContact O-N 3.08Å; L610-A614 WeakPolarHBondContact O-CB 3.35Å; L610-A614 PolarHBondContact O-N 3.47Å
611	G	88.8	Confident	89.6	Confident	25 Å²	25	56.3 Å²	56.3	26%	0.258	26%	0.258	S	S	.	.	H	α-helix	trans	-70.5	-25.4	175.8	0	0	0	0	0	114.3	H609 K615	H609-G611 VanDerWaalsContact C-N 3.27Å; H609-G611 PolarHBondContact O-N 2.76Å; H609-G611 VanDerWaalsContact O-N 3.09Å; G611-K615 PolarHBondContact O-N 3.18Å
612	H	92.1	Very high	88.6	Confident	33 Å²	33	52.5 Å²	52.5	15%	0.153	25%	0.25	C	S	.	.	H	α-helix	trans	-80.9	-35	172.6	-69.7	170	0	0	0	111.3	H101 S369 K370 H609 L610 S616	H101-H612 PolarHBondContact O-CE1 2.81Å; S369-H612 CarbonylContact C-O 3.57Å; K370-H612 WeakPolarHBondContact CD-CD2 3.29Å; K370-H612 WeakPolarHBondContact CE-NE2 3.32Å; K370-H612 HydrophobicContact CG-CB 3.77Å; K370-H612 PolarHBondContact NZ-NE2 3.4Å; K370-H612 VanDerWaalsContact NZ-NE2 3.1Å; H609-H612 HydrophobicContact CB-CB 4.19Å; H609-H612 AromaticContact CE1-CD2 3.68Å; H609-H612 AromaticContact CE1-CE1 3.93Å; H609-H612 AromaticContact CE1-CG 3.87Å; H609-H612 AromaticContact CE1-NE2 3.77Å; H609-H612 AromaticContact CG-CG 3.88Å; H609-H612 AromaticContact CG-ND1 3.71Å; H609-H612 AromaticContact ND1-CD2 3.37Å; H609-H612 PolarHBondContact ND1-CD2 3.04Å; H609-H612 AromaticContact ND1-CE1 3.7Å; H609-H612 AromaticContact ND1-CG 3.1Å; H609-H612 PolarHBondContact ND1-N 3.48Å; H609-H612 AromaticContact ND1-ND1 3.33Å; H609-H612 PolarHBondContact ND1-ND1 2.96Å; H609-H612 AromaticContact ND1-NE2 3.78Å; H609-H612 WeakPolarHBondContact O-CA 3.36Å; H609-H612 WeakPolarHBondContact O-CB 3.4Å; H609-H612 PolarHBondContact O-N 3.38Å; L610-H612 VanDerWaalsContact C-N 3.33Å; L610-H612 PolarHBondContact O-N 3.36Å; H612-S616 PolarHBondContact O-N 3.24Å
613	T	92.2	Very high	87.4	Confident	4 Å²	4	53.7 Å²	53.7	3%	0.025	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-39.5	169.8	-46	0	0	0	0	111.1	L585 F588 L589 H609 L610 K615 S616 F617	L585-T613 HydrophobicContact CD1-CG2 3.7Å; F588-T613 HydrophobicContact CD1-CG2 4.03Å; F588-T613 HydrophobicContact CE1-CG2 3.71Å; L589-T613 HydrophobicContact CD2-CG2 4.46Å; H609-T613 PolarHBondContact O-N 3.21Å; H609-T613 PolarHBondContact O-OG1 3.39Å; L610-T613 PolarHBondContact O-N 3.08Å; T613-K615 VanDerWaalsContact C-N 3.33Å; T613-K615 PolarHBondContact O-N 2.64Å; T613-S616 WeakPolarHBondContact O-CA 3.28Å; T613-S616 WeakPolarHBondContact O-CB 3.31Å; T613-S616 PolarHBondContact O-N 3.18Å; T613-S616 PolarHBondContact O-OG 2.88Å; T613-F617 HydrophobicContact CG2-CE2 4.34Å; T613-F617 WeakPolarHBondContact O-CD2 3.37Å
614	A	93.5	Very high	85.7	Confident	0 Å²	0	63 Å²	63	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.2	-42.5	176.6	0	0	0	0	0	112.8	L585 L610 S616 F617 L619	L585-A614 HydrophobicContact CD2-CB 4.01Å; L610-A614 WeakPolarHBondContact O-CB 3.35Å; L610-A614 PolarHBondContact O-N 3.47Å; A614-S616 PolarHBondContact O-N 3.22Å; A614-F617 PolarHBondContact O-N 3.47Å; A614-L619 HydrophobicContact CB-CB 4.24Å; A614-L619 HydrophobicContact CB-CD1 4.42Å; A614-L619 WeakPolarHBondContact O-CB 3.45Å; A614-L619 PolarHBondContact O-N 3.2Å
615	K	92.8	Very high	84	Confident	35 Å²	35	63 Å²	63	15%	0.152	32%	0.321	C	S	.	.	H	α-helix	trans	-63	-25.2	175	-159.8	171.3	-174.3	66.1	0	113.2	K370 Q564 E568 G611 T613 F617 G618 L619	K370-K615 HydrophobicContact CB-CD 4.2Å; K370-K615 HydrophobicContact CD-CD 3.98Å; K370-K615 HydrophobicContact CG-CB 4.17Å; K370-K615 HydrophobicContact CG-CD 3.99Å; Q564-K615 PolarHBondContact NE2-O 3.26Å; E568-K615 WeakPolarHBondContact OE1-CE 3.39Å; E568-K615 WeakPolarHBondContact OE1-CG 3.49Å; E568-K615 IonicContact OE1-NZ 3.95Å; E568-K615 PolarHBondContact OE1-NZ 3.26Å; E568-K615 IonicContact OE2-NZ 2.76Å; E568-K615 PolarHBondContact OE2-NZ 2.9Å; G611-K615 PolarHBondContact O-N 3.18Å; T613-K615 VanDerWaalsContact C-N 3.33Å; T613-K615 PolarHBondContact O-N 2.64Å; K615-F617 PolarHBondContact O-N 3.46Å; K615-G618 PolarHBondContact O-N 3.18Å; K615-G618 VanDerWaalsContact O-N 3.11Å; K615-L619 WeakPolarHBondContact CA-O 3.33Å
616	S	93.6	Very high	82.2	Confident	6 Å²	6	62.3 Å²	62.3	4%	0.042	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-0.9	172.5	97.2	0	0	0	0	114.3	S369 H612 T613 A614	S369-S616 WeakPolarHBondContact O-CB 3.14Å; H612-S616 PolarHBondContact O-N 3.24Å; T613-S616 WeakPolarHBondContact O-CA 3.28Å; T613-S616 WeakPolarHBondContact O-CB 3.31Å; T613-S616 PolarHBondContact O-N 3.18Å; T613-S616 PolarHBondContact O-OG 2.88Å; A614-S616 PolarHBondContact O-N 3.22Å
617	F	95.2	Very high	79.7	Confident	8 Å²	8	56.3 Å²	56.3	4%	0.035	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	21.2	169.8	-66	-95.8	0	0	0	111.4	A401 F404 A581 A584 L585 F588 T613 A614 K615 L619	A401-F617 HydrophobicContact CB-CE1 4.37Å; F404-F617 AromaticContact CD1-CD1 3.9Å; F404-F617 HydrophobicContact CD1-CD1 3.9Å; F404-F617 HydrophobicContact CE1-CB 4.09Å; F404-F617 AromaticContact CE1-CD1 3.85Å; F404-F617 HydrophobicContact CE1-CD1 3.85Å; F404-F617 HydrophobicContact CE1-CG 4.42Å; F404-F617 HydrophobicContact CZ-CB 4.38Å; F404-F617 VanDerWaalsContact CZ-O 3.24Å; F404-F617 WeakPolarHBondContact CZ-O 3.45Å; A581-F617 WeakPolarHBondContact CB-O 3.39Å; A584-F617 HydrophobicContact CB-CD1 3.69Å; A584-F617 HydrophobicContact CB-CE1 3.78Å; L585-F617 HydrophobicContact CB-CD1 4.49Å; L585-F617 HydrophobicContact CB-CD2 3.97Å; L585-F617 HydrophobicContact CB-CE2 4.28Å; L585-F617 HydrophobicContact CB-CG 4.09Å; L585-F617 HydrophobicContact CD1-CD2 3.71Å; L585-F617 HydrophobicContact CD1-CE2 3.69Å; L585-F617 HydrophobicContact CG-CD2 4.37Å; F588-F617 HydrophobicContact CB-CE2 4.36Å; F588-F617 HydrophobicContact CB-CZ 3.68Å; F588-F617 HydrophobicContact CD1-CE2 4.24Å; F588-F617 HydrophobicContact CD1-CZ 4.3Å; F588-F617 HydrophobicContact CD2-CZ 4.43Å; F588-F617 HydrophobicContact CG-CE2 4.28Å; F588-F617 AromaticContact CG-CZ 3.88Å; F588-F617 HydrophobicContact CG-CZ 3.88Å; T613-F617 HydrophobicContact CG2-CE2 4.34Å; T613-F617 WeakPolarHBondContact O-CD2 3.37Å; A614-F617 PolarHBondContact O-N 3.47Å; K615-F617 PolarHBondContact O-N 3.46Å; F617-L619 PolarHBondContact O-N 3.03Å
618	G	93.4	Very high	77.3	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	13.9	179.8	0	0	0	0	0	114.8	H572 K615	H572-G618 PolarHBondContact CD2-O 3.43Å; K615-G618 PolarHBondContact O-N 3.18Å; K615-G618 VanDerWaalsContact O-N 3.11Å
619	L	93.2	Very high	74.6	Confident	5 Å²	5	59.9 Å²	59.9	3%	0.026	36%	0.359	C	S	.	.			trans	-82.2	125.6	174.4	-61.7	173.4	0	0	0	109.9	V571 V578 A581 K582 L585 A614 K615 F617	V571-L619 HydrophobicContact CG1-CD2 4.39Å; V578-L619 HydrophobicContact CG1-CD2 4.16Å; A581-L619 HydrophobicContact CB-CD2 3.72Å; A581-L619 HydrophobicContact CB-CG 4.06Å; K582-L619 HydrophobicContact CG-CD1 3.98Å; K582-L619 HydrophobicContact CG-CD2 4.16Å; L585-L619 HydrophobicContact CD2-CD1 3.88Å; A614-L619 HydrophobicContact CB-CB 4.24Å; A614-L619 HydrophobicContact CB-CD1 4.42Å; A614-L619 WeakPolarHBondContact O-CB 3.45Å; A614-L619 PolarHBondContact O-N 3.2Å; K615-L619 WeakPolarHBondContact CA-O 3.33Å; F617-L619 PolarHBondContact O-N 3.03Å
620	R	89.1	Confident	71.9	Confident	131 Å²	131	60.5 Å²	60.5	49%	0.494	37%	0.373	S	S	.	.	S	Bend	trans	-70.3	-36.2	175.6	-67.7	171.3	177.8	172.7	-1.6	112.5	D569	D569-R620 IonicContact OD1-CZ 2.88Å; D569-R620 IonicContact OD1-NH2 3.32Å; D569-R620 PolarHBondContact OD1-NH2 3.17Å
621	D	78.7	Confident	69.1	Low	114 Å²	114	60.8 Å²	60.8	61%	0.61	39%	0.387	S	S	*	.	S	Bend	trans	-101.1	149.3	-179	-54.7	-66.6	0	0	0	112.8	H572	H572-D621 IonicContact NE2-OD2 3.71Å
622	A	67.3	Low	66.4	Low	59 Å²	59	65.3 Å²	65.3	49%	0.488	41%	0.412	S	S	.	.			trans	-67.5	131.6	163.5	0	0	0	0	0	109.5	Q624	A622-Q624 PolarHBondContact O-N 3.48Å
623	P	63.1	Low	63.4	Low	29 Å²	29	74.9 Å²	74.9	19%	0.188	45%	0.447	C	S	.	.			trans	-71.2	102	-173.2	30.3	-38.9	0	0	0	111.5	L585 G625 L626	L585-P623 HydrophobicContact CD2-CG 3.79Å; P623-G625 PolarHBondContact O-N 3.06Å; P623-L626 HydrophobicContact CB-CD1 3.98Å; P623-L626 HydrophobicContact CB-CG 3.93Å; P623-L626 HydrophobicContact CG-CD1 3.38Å; P623-L626 HydrophobicContact CG-CG 3.81Å
624	Q	54.8	Low	60.4	Low	195 Å²	195	80.8 Å²	80.8	91%	0.911	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	133.5	168.5	-58.3	-177.9	10.8	0	0	109.3	A622	A622-Q624 PolarHBondContact O-N 3.48Å
625	G	52.4	Low	57.3	Low	73 Å²	73	90 Å²	90	75%	0.753	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	12.5	178.6	0	0	0	0	0	117.2	P623 S627	P623-G625 PolarHBondContact O-N 3.06Å; G625-S627 VanDerWaalsContact C-N 3.29Å; G625-S627 PolarHBondContact O-N 3.21Å
626	L	49	Very low	54.2	Low	54 Å²	54	91.7 Å²	91.7	28%	0.283	56%	0.558	S	S	.	*			trans	-84	9.6	171.8	-65.3	-165.3	0	0	0	115.3	L585 Q586 L589 P623	L585-L626 HydrophobicContact CD2-CD1 4.48Å; Q586-L626 HydrophobicContact CG-CD2 3.68Å; L589-L626 HydrophobicContact CD1-CD1 3.72Å; P623-L626 HydrophobicContact CB-CD1 3.98Å; P623-L626 HydrophobicContact CB-CG 3.93Å; P623-L626 HydrophobicContact CG-CD1 3.38Å; P623-L626 HydrophobicContact CG-CG 3.81Å
627	S	34.3	Very low	51.1	Low	102 Å²	102	94.7 Å²	94.7	71%	0.713	59%	0.589	S	S	*	*	S	Bend	trans	-61.9	133	169.9	-59.6	0	0	0	0	110.1	G625 G629	G625-S627 VanDerWaalsContact C-N 3.29Å; G625-S627 PolarHBondContact O-N 3.21Å; S627-G629 PolarHBondContact O-N 3.14Å
628	P	34.4	Very low	48	Very low	129 Å²	129	100.4 Å²	100.4	84%	0.838	63%	0.627	S	S	*	*			trans	-67.3	99.9	171.9	27.9	-32.8	0	0	0	108.9
629	G	30.8	Very low	44.9	Very low	61 Å²	61	111.8 Å²	111.8	63%	0.629	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-63.1	145.3	177.7	0	0	0	0	0	111.3	S627	S627-G629 PolarHBondContact O-N 3.14Å
630	P	31.4	Very low	41.7	Very low	128 Å²	128	119 Å²	119	83%	0.831	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-60.2	141.2	170.6	27.8	-34.1	0	0	0	109.5
631	A	32.1	Very low	38.7	Very low	85 Å²	85	124 Å²	124	70%	0.702	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-54.6	142.6	-177.5	0	0	0	0	0	111.7	R633	A631-R633 PolarHBondContact O-N 3.19Å
632	P	30.4	Very low	36.2	Very low	121 Å²	121	124.4 Å²	124.4	79%	0.786	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-60.2	123.3	-178.9	25.3	-34	0	0	0	109.8	C634	P632-C634 PolarHBondContact O-N 3.23Å
633	R	30.9	Very low	34.3	Very low	233 Å²	233	132.7 Å²	132.7	88%	0.879	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-67.7	117.7	171.5	-68.5	-177	178.4	-175.7	-0.2	107.9	A631 H635	A631-R633 PolarHBondContact O-N 3.19Å; R633-H635 PolarHBondContact O-N 2.92Å
634	C	29	Very low	32.5	Very low	129 Å²	129	138.6 Å²	138.6	87%	0.872	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-56.7	123.5	172.7	-59.9	0	0	0	0	109.5	P632 G636	P632-C634 PolarHBondContact O-N 3.23Å; C634-G636 PolarHBondContact O-N 2.98Å; C634-G636 VanDerWaalsContact O-N 3.07Å
635	H	28.3	Very low	31.2	Very low	192 Å²	192	139.6 Å²	139.6	89%	0.889	78%	0.778	S	S	*	*			trans	-70.4	102.5	172.8	-80.2	-94.4	0	0	0	109.3	R633	R633-H635 PolarHBondContact O-N 2.92Å
636	G	28.1	Very low	30	Very low	72 Å²	72	142.8 Å²	142.8	74%	0.742	78%	0.778	S	S	*	*			trans	-64.2	133.3	162.7	0	0	0	0	0	109.8	C634	C634-G636 PolarHBondContact O-N 2.98Å; C634-G636 VanDerWaalsContact O-N 3.07Å
637	G	28.4	Very low	29.1	Very low	68 Å²	68	148.5 Å²	148.5	70%	0.701	80%	0.803	S	S	*	*			trans	-66.3	154.9	176.1	0	0	0	0	0	112.3	W639	G637-W639 PolarHBondContact O-N 2.63Å
638	P	29.9	Very low	28.7	Very low	129 Å²	129	150.5 Å²	150.5	84%	0.838	81%	0.806	S	S	*	*			trans	-86.5	110.8	-167.6	32.7	-34.1	0	0	0	113
639	W	26.6	Very low	28.5	Very low	239 Å²	239	153.7 Å²	153.7	91%	0.905	81%	0.81	S	S	*	*			trans	-125.7	161.5	158	-86	67.4	0	0	0	110	G637	G637-W639 PolarHBondContact O-N 2.63Å
640	D	26.8	Very low	28.4	Very low	155 Å²	155	155.9 Å²	155.9	83%	0.829	82%	0.822	S	S	*	*			trans	63	90.3	176.9	-58	-17.2	0	0	0	117.6
641	R	25.8	Very low	28.2	Very low	237 Å²	237	153.3 Å²	153.3	89%	0.894	82%	0.818	S	S	*	*			trans	-84.5	143.1	170	-98.9	-177.8	172.2	179	-1.5	112
642	V	27.6	Very low	28.1	Very low	122 Å²	122	159.7 Å²	159.7	74%	0.739	83%	0.83	S	S	*	*			trans	78.3	147.3	137.1	169	0	0	0	0	119.2
643	R	26.1	Very low	27.9	Very low	233 Å²	233	165.5 Å²	165.5	88%	0.879	84%	0.836	S	S	*	*			trans	67.8	135.1	179.8	-80.5	171.6	169.4	167.2	-4.3	114.4
644	N	26.4	Very low	27.8	Very low	154 Å²	154	159.6 Å²	159.6	82%	0.824	84%	0.837	S	S	*	*			cis	-127.6	165.3	23.9	-141.3	-3.3	0	0	0	114.8
645	R	26.5	Very low	27.7	Very low	216 Å²	216	156.9 Å²	156.9	82%	0.815	83%	0.831	S	S	*	*			trans	-124.7	144	-179.5	-170.5	-174.9	-175.7	-179.4	4.1	109.7
646	N	26.4	Very low	27.6	Very low	140 Å²	140	153 Å²	153	75%	0.749	83%	0.825	S	S	*	*			trans	64.9	122.3	-180	-60	-7.7	0	0	0	116
647	Q	29.9	Very low	27.6	Very low	174 Å²	174	156.8 Å²	156.8	81%	0.813	83%	0.828	S	S	*	*				-157.1	144.1	105.9	-107.5	179.7	13.7	0	0	112.7
648	N	27.7	Very low	27.5	Very low	143 Å²	143	164.8 Å²	164.8	77%	0.765	84%	0.837	S	S	*	*			trans	54.2	111.1	151.7	-58.2	-4	0	0	0	121.2
649	Q	29.1	Very low	27.5	Very low	197 Å²	197	168.2 Å²	168.2	92%	0.921	84%	0.839	S	S	*	*			trans	-65	140.4	146.7	-57.9	168.5	-7.9	0	0	110.7
650	A	28.2	Very low	27.5	Very low	107 Å²	107	164 Å²	164	88%	0.884	83%	0.834	S	S	*	*			trans	-173.4	162.3	148.6	0	0	0	0	0	108.4
651	G	27.9	Very low	27.7	Very low	73 Å²	73	164.7 Å²	164.7	75%	0.753	83%	0.832	S	S	*	*			trans	151.1	-14.9	160.4	0	0	0	0	0	121.6
652	K	29.2	Very low	27.7	Very low	219 Å²	219	160 Å²	160	95%	0.952	83%	0.825	S	S	*	*			trans	62.5	-175.9	172	-63.8	-178.8	175	177.8	0	116.8
653	R	26.8	Very low	27.8	Very low	243 Å²	243	162.7 Å²	162.7	92%	0.917	83%	0.83	S	S	*	*			trans	-120	160.5	-168	-68.9	173.2	167	171.8	-5.9	111.7
654	A	28.9	Very low	27.9	Very low	109 Å²	109	158.8 Å²	158.8	90%	0.901	83%	0.826	S	S	*	*			trans	66.7	153.4	160.9	0	0	0	0	0	117.1
655	G	27.2	Very low	28.4	Very low	72 Å²	72	157.1 Å²	157.1	74%	0.742	82%	0.824	S	S	*	*			cis	168.6	178.5	-8.7	0	0	0	0	0	113.5
656	S	25.8	Very low	28.5	Very low	110 Å²	110	149.9 Å²	149.9	77%	0.769	82%	0.816	S	S	*	*			trans	62.9	107.8	160.6	-139	0	0	0	0	121.3
657	L	27.6	Very low	28.7	Very low	152 Å²	152	155.2 Å²	155.2	80%	0.796	83%	0.826	S	S	*	*				41.4	112.2	125.4	-71.6	164.7	0	0	0	121
658	R	27.9	Very low	28.6	Very low	236 Å²	236	156.5 Å²	156.5	89%	0.891	83%	0.829	S	S	*	*				169.3	161.6	95.7	-104.9	169.6	179.1	-160.5	-0.4	114.6
659	K	29.9	Very low	28.6	Very low	201 Å²	201	160.9 Å²	160.9	87%	0.874	84%	0.835	S	S	*	*			trans	-49.7	151.2	179	-54.9	171.1	173.7	179.7	0	115.1
660	N	26.7	Very low	28.5	Very low	150 Å²	150	160 Å²	160	80%	0.802	84%	0.835	S	S	*	*				-151.9	171.8	107.8	-135.4	-7.4	0	0	0	113.7
661	Q	29.4	Very low	28.5	Very low	170 Å²	170	163.2 Å²	163.2	79%	0.794	83%	0.832	S	S	*	*			trans	-73.3	170.2	170.8	-65	162.3	-25.5	0	0	109.7
662	N	26.4	Very low	28.8	Very low	140 Å²	140	168 Å²	168	75%	0.749	84%	0.839	S	S	*	*			cis	-162.7	-177.3	31.8	-165	4.9	0	0	0	111.7
663	Q	29.7	Very low	29	Very low	178 Å²	178	160.7 Å²	160.7	83%	0.832	83%	0.826	S	S	*	*			trans	81.7	148.1	164.3	-55.1	-176.6	10.6	0	0	118.9
664	N	27.6	Very low	29.1	Very low	151 Å²	151	157.3 Å²	157.3	81%	0.807	82%	0.82	S	S	*	*			trans	-125.1	173.2	-177.3	-141.9	16.6	0	0	0	105.9
665	P	37	Very low	29.1	Very low	119 Å²	119	163 Å²	163	77%	0.773	82%	0.818	S	S	*	*			cis	-130.8	160.8	4.4	40.8	-24.8	0	0	0	115.8
666	G	28.4	Very low	29.2	Very low	64 Å²	64	167.7 Å²	167.7	66%	0.66	82%	0.821	S	S	*	*			trans	168.9	126	165.3	0	0	0	0	0	115.9
667	R	31.8	Very low	29.6	Very low	251 Å²	251	166.3 Å²	166.3	95%	0.947	82%	0.816	S	S	*	*			trans	40.5	94.4	161.8	-68.7	179.5	168.5	178.6	-3.5	117.9
668	K	27.5	Very low	29.8	Very low	202 Å²	202	164.6 Å²	164.6	88%	0.878	81%	0.812	S	S	*	*			trans	-101.5	110.2	146.2	-66.1	178.8	-178.2	175.9	0	107
669	R	27.8	Very low	30	Very low	234 Å²	234	160.1 Å²	160.1	88%	0.883	81%	0.805	S	S	*	*				46	84.7	88.5	-83.7	-170.3	168.3	-178	-2	112.6
670	L	27.5	Very low	30.2	Very low	179 Å²	179	157.6 Å²	157.6	94%	0.937	80%	0.799	S	S	*	*			trans	-63	140.1	159.5	-75.9	164	0	0	0	109.6
671	H	27.7	Very low	30.4	Very low	174 Å²	174	160.9 Å²	160.9	81%	0.806	80%	0.8	S	S	*	*			trans	-87.1	172.3	-178.7	-111.4	-108.6	0	0	0	112.8	G673	H671-G673 PolarHBondContact O-N 2.9Å
672	L	34.8	Very low	30.6	Very low	175 Å²	175	157.4 Å²	157.4	92%	0.916	80%	0.795	S	S	*	*	S	Bend	trans	-53.8	102.2	177.7	-86.7	57.6	0	0	0	111.9
673	G	31.8	Very low	30.7	Very low	65 Å²	65	159.3 Å²	159.3	67%	0.67	80%	0.799	S	S	*	*			trans	-153.9	20	172.7	0	0	0	0	0	113.5	H671	H671-G673 PolarHBondContact O-N 2.9Å
674	H	30.4	Very low	30.9	Very low	172 Å²	172	161 Å²	161	80%	0.796	80%	0.804	S	S	*	*	S	Bend	trans	-147.1	30.6	-167.2	-112	55	0	0	0	114.7
675	R	28	Very low	30.8	Very low	227 Å²	227	159.3 Å²	159.3	86%	0.857	80%	0.804	S	S	*	*	S	Bend	trans	-123	-8.5	173.7	-65.6	-167.2	75.4	168.6	3.4	115.8
676	E	30.5	Very low	30.6	Very low	172 Å²	172	159.9 Å²	159.9	80%	0.804	81%	0.811	S	S	*	*	S	Bend	trans	-94.2	-23.2	177.5	-67.8	-179.7	123.5	0	0	113.3	V678	E676-V678 PolarHBondContact O-N 2.89Å
677	A	32.8	Very low	30.6	Very low	81 Å²	81	160.5 Å²	160.5	67%	0.669	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-5.3	-177.8	0	0	0	0	0	115.5
678	V	32.3	Very low	30.5	Very low	115 Å²	115	156.7 Å²	156.7	70%	0.697	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-17.8	-171.4	-177.6	0	0	0	0	113	E676	E676-V678 PolarHBondContact O-N 2.89Å
679	L	31.5	Very low	30.6	Very low	142 Å²	142	156.9 Å²	156.9	74%	0.743	82%	0.819	S	S	*	*	S	Bend	trans	-92.1	-1.1	-175.8	-83.7	162.5	0	0	0	115
680	I	34.3	Very low	30.6	Very low	149 Å²	149	149.2 Å²	149.2	76%	0.764	81%	0.813	S	S	*	*	S	Bend	trans	-107.8	28.8	-173.4	-46.4	-178.9	0	0	0	111.2
681	R	32.3	Very low	30.5	Very low	219 Å²	219	144.9 Å²	144.9	83%	0.826	81%	0.812	S	S	*	*	S	Bend	trans	-138.4	12.5	-175.2	-86.9	-170.5	171.1	171.5	-0	116.9
682	S	32.7	Very low	30.5	Very low	97 Å²	97	140.2 Å²	140.2	68%	0.678	81%	0.811	S	S	*	*	S	Bend	trans	-113.3	-2.6	-171.1	53.7	0	0	0	0	117.5
683	E	29.4	Very low	30.3	Very low	180 Å²	180	136.7 Å²	136.7	84%	0.841	81%	0.806	S	S	*	*	S	Bend	trans	-108.9	12.5	-173.6	-63.8	-163.2	154.6	0	0	115.7
684	F	32.8	Very low	30.3	Very low	214 Å²	214	144 Å²	144	94%	0.939	82%	0.819	S	S	*	*	S	Bend	trans	-124.8	50.8	175	-81.5	-78.3	0	0	0	113
685	S	26.7	Very low	30.3	Very low	114 Å²	114	145.6 Å²	145.6	80%	0.797	82%	0.824	S	S	*	*			trans	-161.2	70.4	168.9	-176	0	0	0	0	115.6
686	S	31.4	Very low	30.3	Very low	131 Å²	131	144.6 Å²	144.6	92%	0.916	83%	0.826	S	S	*	*			trans	-168.5	121.9	148.4	47	0	0	0	0	110.9
687	G	28.4	Very low	30.1	Very low	77 Å²	77	148.5 Å²	148.5	79%	0.794	83%	0.833	S	S	*	*			trans	-153.8	31.5	-173.8	0	0	0	0	0	113.6
688	L	29.6	Very low	29.9	Very low	172 Å²	172	152.5 Å²	152.5	90%	0.901	84%	0.836	S	S	*	*			trans	-145.4	89.7	-179.3	-73.5	177.4	0	0	0	110.2
689	E	29.2	Very low	29.8	Very low	205 Å²	205	158.2 Å²	158.2	96%	0.958	85%	0.845	S	S	*	*			trans	-104	111.7	158.7	-69.8	-162.2	143	0	0	109
690	G	28.5	Very low	29.7	Very low	74 Å²	74	157.4 Å²	157.4	76%	0.763	84%	0.841	S	S	*	*			trans	-100.8	125.1	170.3	0	0	0	0	0	109.8	G692	G690-G692 PolarHBondContact O-N 3.07Å; G690-G692 VanDerWaalsContact O-N 3.08Å
691	G	26.5	Very low	29.7	Very low	88 Å²	88	156.2 Å²	156.2	91%	0.907	84%	0.841	S	S	*	*			trans	-62.7	108.5	-177.8	0	0	0	0	0	113	A693	G691-A693 PolarHBondContact O-N 3.2Å
692	G	27.3	Very low	29.6	Very low	76 Å²	76	152.3 Å²	152.3	78%	0.784	84%	0.841	S	S	*	*			trans	-82.1	104.2	178.2	0	0	0	0	0	112.8	G690	G690-G692 PolarHBondContact O-N 3.07Å; G690-G692 VanDerWaalsContact O-N 3.08Å
693	A	30.3	Very low	29.6	Very low	100 Å²	100	156.1 Å²	156.1	83%	0.826	85%	0.848	S	S	*	*			trans	-70	133.4	171	0	0	0	0	0	111.3	G691 K695	G691-A693 PolarHBondContact O-N 3.2Å; A693-K695 PolarHBondContact O-N 2.68Å
694	K	31.4	Very low	29.9	Very low	218 Å²	218	156.1 Å²	156.1	95%	0.948	85%	0.849	S	S	*	*			trans	-65.6	130.2	178.9	-64.8	176.6	-179.4	175.2	0	110.9
695	K	29.6	Very low	30.1	Very low	206 Å²	206	155.2 Å²	155.2	90%	0.896	85%	0.847	S	S	*	*			trans	-131	128.4	161.3	-146.6	173.9	-173.1	-177.7	0	109.8	A693	A693-K695 PolarHBondContact O-N 2.68Å
696	K	29.4	Very low	30.9	Very low	206 Å²	206	158.5 Å²	158.5	90%	0.896	85%	0.85	S	S	*	*			trans	-68.1	141.5	179.8	-70.7	-179.3	176.2	179.7	0	110.1
697	R	26.3	Very low	31.3	Very low	254 Å²	254	163.9 Å²	163.9	96%	0.958	87%	0.868	S	S	*	*			trans	-72.7	131.9	155.5	-90.1	177	156.1	168	-7.6	108.4
698	K	27.8	Very low	31.4	Very low	165 Å²	165	168.2 Å²	168.2	72%	0.717	87%	0.872	S	S	*	*			trans	-115.9	136.2	151.5	-166.2	173	-176.1	-77.3	0	105.6	D700	K698-D700 IonicContact NZ-OD1 2.68Å; K698-D700 PolarHBondContact NZ-OD1 3.41Å; K698-D700 IonicContact NZ-OD2 2.63Å; K698-D700 PolarHBondContact NZ-OD2 3.48Å
699	R	29.5	Very low	31.5	Very low	235 Å²	235	168 Å²	168	89%	0.887	87%	0.871	S	S	*	*			trans	-89.6	140.5	161.3	-70.2	175.7	175.4	158	-5.7	105.8
700	D	29.6	Very low	31.6	Very low	126 Å²	126	165.9 Å²	165.9	67%	0.674	87%	0.866	S	S	*	*			trans	-135.8	154.3	152.9	-70.2	-59.3	0	0	0	106.9	K698	K698-D700 IonicContact NZ-OD1 2.68Å; K698-D700 PolarHBondContact NZ-OD1 3.41Å; K698-D700 IonicContact NZ-OD2 2.63Å; K698-D700 PolarHBondContact NZ-OD2 3.48Å
701	V	34.8	Very low	31.8	Very low	123 Å²	123	171.4 Å²	171.4	75%	0.745	87%	0.872	S	S	*	*			trans	-117.5	140.5	179.1	173.5	0	0	0	0	106.4
702	T	30.7	Very low	32.2	Very low	138 Å²	138	176.6 Å²	176.6	85%	0.847	87%	0.87	S	S	*	*			trans	-142.3	138.3	163.4	47.2	0	0	0	0	108.4
703	E	33.2	Very low	32.5	Very low	176 Å²	176	183.3 Å²	183.3	82%	0.822	88%	0.875	S	S	*	*			trans	-91.2	-158.6	178	-72.4	148.5	132.2	0	0	110.4
704	E	35.4	Very low	32.6	Very low	181 Å²	181	189.2 Å²	189.2	85%	0.846	88%	0.879	S	S	*	*			trans	-64.7	153.9	179.6	-61.7	141.6	153.8	0	0	113
705	E	36.5	Very low	32.7	Very low	195 Å²	195	187 Å²	187	91%	0.911	87%	0.873	S	S	*	*				-175.1	-179.8	114.6	-101.3	-179.6	172.7	0	0	111.2
706	E	42.8	Very low	33	Very low	182 Å²	182	185.4 Å²	185.4	85%	0.85	87%	0.872	S	S	*	*			trans	-99.9	145.1	-157.9	-55.6	176.9	119.3	0	0	114.8
707	D	40	Very low	33.3	Very low	244 Å²	244	183.5 Å²	183.5	100%	1.305	87%	0.869	S	S	*	*				167.7	0	129.7	-97	-19.1	0	0	0	112

Retrieved 707 of 707 residues in 124.7 ms (Link to these results)

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