A0A096LVJ1_POEFO Loading...

SUN domain-containing protein

AlphaFold DB , UniProt , Accession A0A096LVJ1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 645 aa.

Structure Viewer

Loading PAE data...

(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	47.3	Very low	44.8	Very low	206 Å²	206	131.6 Å²	131.6	100%	1.015	71%	0.705	S	S	*	*				0	-64.9	0	-77.9	172.7	172	0	0	113.8	A3 V4	M1-A3 VanDerWaalsContact C-N 3.26Å; M1-A3 PolarHBondContact O-N 3.15Å; M1-V4 PolarHBondContact O-N 2.93Å
2	R	38.4	Very low	44.6	Very low	236 Å²	236	127.1 Å²	127.1	89%	0.891	71%	0.713	S	S	*	*	H	α-helix	trans	-49	-38.7	-177.2	-85.6	-173	174.3	175.7	-1.5	115.4	V4	R2-V4 VanDerWaalsContact C-N 3.32Å; R2-V4 PolarHBondContact O-N 3.49Å
3	A	46.5	Very low	44.6	Very low	79 Å²	79	134 Å²	134	65%	0.653	72%	0.721	S	S	*	*	H	α-helix	trans	-68.8	-20	178.8	0	0	0	0	0	115.7	M1 T7	M1-A3 VanDerWaalsContact C-N 3.26Å; M1-A3 PolarHBondContact O-N 3.15Å; A3-T7 PolarHBondContact O-OG1 2.94Å; A3-T7 VanDerWaalsContact O-OG1 3.14Å
4	V	46.2	Very low	43.8	Very low	98 Å²	98	135.9 Å²	135.9	59%	0.594	73%	0.73	S	S	*	*	H	α-helix	trans	-87	-38.6	-175.3	-178.7	0	0	0	0	111.4	M1 R2 Q6 T7	M1-V4 PolarHBondContact O-N 2.93Å; R2-V4 VanDerWaalsContact C-N 3.32Å; R2-V4 PolarHBondContact O-N 3.49Å; V4-Q6 VanDerWaalsContact C-N 3.25Å; V4-Q6 PolarHBondContact O-N 3.49Å; V4-T7 PolarHBondContact O-N 3.42Å; V4-T7 PolarHBondContact O-OG1 2.94Å
5	I	47.8	Very low	43.5	Very low	124 Å²	124	134.3 Å²	134.3	64%	0.636	73%	0.733	S	S	*	*	H	α-helix	trans	-66	-33	178.4	-60.9	173.8	0	0	0	110.7	T7	I5-T7 VanDerWaalsContact C-N 3.27Å; I5-T7 PolarHBondContact O-N 3.33Å
6	Q	43.9	Very low	43.1	Very low	154 Å²	154	137 Å²	137	72%	0.72	74%	0.738	S	S	*	*	H	α-helix	trans	-72.8	-15.3	-178.5	-163.8	166.8	-1.2	0	0	113.8	V4	V4-Q6 VanDerWaalsContact C-N 3.25Å; V4-Q6 PolarHBondContact O-N 3.49Å
7	T	44.3	Very low	42.8	Very low	85 Å²	85	135.5 Å²	135.5	52%	0.521	74%	0.741	S	S	.	*	H	α-helix	trans	-87.8	-36.1	176.1	-4.5	0	0	0	0	112.5	A3 V4 I5 C9 L10	A3-T7 PolarHBondContact O-OG1 2.94Å; A3-T7 VanDerWaalsContact O-OG1 3.14Å; V4-T7 PolarHBondContact O-N 3.42Å; V4-T7 PolarHBondContact O-OG1 2.94Å; I5-T7 VanDerWaalsContact C-N 3.27Å; I5-T7 PolarHBondContact O-N 3.33Å; T7-C9 PolarHBondContact O-N 2.93Å; T7-L10 PolarHBondContact O-N 2.83Å
8	S	44.2	Very low	42.1	Very low	66 Å²	66	139.7 Å²	139.7	46%	0.462	75%	0.751	S	S	.	*	H	α-helix	trans	-64.5	-34.9	-175.7	-56.5	0	0	0	0	113.8	L10 L11	S8-L10 PolarHBondContact O-N 3.27Å; S8-L11 PolarHBondContact O-N 2.83Å
9	C	39.8	Very low	41.8	Very low	114 Å²	114	137.7 Å²	137.7	77%	0.77	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-9.4	179.6	-66.1	0	0	0	0	114.7	T7	T7-C9 PolarHBondContact O-N 2.93Å
10	L	44.3	Very low	41.2	Very low	145 Å²	145	141.1 Å²	141.1	76%	0.759	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-3.6	179.4	-77.3	166.9	0	0	0	114.1	T7 S8	T7-L10 PolarHBondContact O-N 2.83Å; S8-L10 PolarHBondContact O-N 3.27Å
11	L	50.1	Low	40.7	Very low	141 Å²	141	140.3 Å²	140.3	74%	0.738	76%	0.759	S	S	*	*	S	Bend	trans	-128.9	6.7	-172.4	-71.5	174.8	0	0	0	115.6	S8 R13	S8-L11 PolarHBondContact O-N 2.83Å; L11-R13 PolarHBondContact O-N 3.34Å
12	G	42.9	Very low	40.2	Very low	77 Å²	77	138.8 Å²	138.8	79%	0.794	75%	0.748	S	S	*	*			trans	54.5	54.8	163.7	0	0	0	0	0	115.6
13	R	43.8	Very low	40	Very low	217 Å²	217	135.8 Å²	135.8	82%	0.819	74%	0.744	S	S	*	*			trans	-130.1	141.6	173.7	-68.6	-174.9	178.7	-169.6	-2	111.4	L11	L11-R13 PolarHBondContact O-N 3.34Å
14	D	34.1	Very low	39.3	Very low	160 Å²	160	139.7 Å²	139.7	86%	0.856	75%	0.753	S	S	*	*			trans	-67.6	130.1	-171.5	-61.7	-70.6	0	0	0	113.7	H16	D14-H16 VanDerWaalsContact C-N 3.34Å; D14-H16 PolarHBondContact O-N 3.48Å; D14-H16 VanDerWaalsContact O-N 3.14Å
15	C	38.5	Very low	38.8	Very low	113 Å²	113	140.5 Å²	140.5	76%	0.764	76%	0.76	S	S	*	*			trans	-89.6	65.3	-178	-69.4	0	0	0	0	111.6
16	H	37.4	Very low	38.4	Very low	177 Å²	177	142.2 Å²	142.2	82%	0.819	77%	0.77	S	S	*	*			trans	-127.3	46.2	-176.4	-119.7	-72.4	0	0	0	114.6	D14	D14-H16 VanDerWaalsContact C-N 3.34Å; D14-H16 PolarHBondContact O-N 3.48Å; D14-H16 VanDerWaalsContact O-N 3.14Å
17	S	37.9	Very low	37.9	Very low	112 Å²	112	144.1 Å²	144.1	78%	0.783	78%	0.776	S	S	*	*			trans	-165.5	78.1	162.7	-83.1	0	0	0	0	113.1
18	F	30.5	Very low	37.5	Very low	210 Å²	210	148.8 Å²	148.8	92%	0.921	79%	0.79	S	S	*	*			trans	-158.3	128.8	151.8	-97.5	-68.5	0	0	0	110.1
19	P	36	Very low	37.2	Very low	103 Å²	103	150.8 Å²	150.8	67%	0.669	80%	0.804	S	S	*	*			trans	-80.2	179.4	174.4	32.8	-34.5	0	0	0	112.5
20	F	30.2	Very low	37.2	Very low	204 Å²	204	153.6 Å²	153.6	90%	0.895	81%	0.806	S	S	*	*			trans	73	67.8	179	-60.6	-79.3	0	0	0	116.9
21	C	30.4	Very low	36.8	Very low	126 Å²	126	151.3 Å²	151.3	85%	0.851	80%	0.801	S	S	*	*			trans	-136	91.6	155.1	-115.6	0	0	0	0	110.1
22	H	37.3	Very low	36.2	Very low	173 Å²	173	149 Å²	149	80%	0.801	80%	0.795	S	S	*	*			trans	-137.2	140.8	169.7	-97.2	-100.7	0	0	0	109.4
23	H	33.1	Very low	35.9	Very low	174 Å²	174	150.2 Å²	150.2	81%	0.806	79%	0.791	S	S	*	*	S	Bend	trans	63.9	120.8	-169	-46.9	-82.9	0	0	0	113.3
24	L	32	Very low	35.5	Very low	160 Å²	160	149.8 Å²	149.8	84%	0.838	79%	0.791	S	S	*	*			cis	-143.1	139.6	11.4	-95.4	121.3	0	0	0	111.3
25	P	36.4	Very low	35.6	Very low	115 Å²	115	145.5 Å²	145.5	75%	0.747	78%	0.778	S	S	*	*			trans	-85.7	139.6	169.1	34.4	-32	0	0	0	111.7
26	L	38.5	Very low	35.4	Very low	161 Å²	161	151.1 Å²	151.1	84%	0.843	78%	0.783	S	S	*	*	S	Bend	trans	179.9	-31.2	147.9	-104.6	162	0	0	0	112.9	F28	L26-F28 VanDerWaalsContact C-N 3.35Å; L26-F28 PolarHBondContact O-N 3.07Å
27	F	34.3	Very low	35.4	Very low	193 Å²	193	150.3 Å²	150.3	85%	0.846	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-4	-172.9	-96.3	-84	0	0	0	116.6
28	F	35.5	Very low	35.1	Very low	184 Å²	184	152.7 Å²	152.7	81%	0.807	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-17.7	-172.4	-112.2	-87.7	0	0	0	115.2	L26 Q30	L26-F28 VanDerWaalsContact C-N 3.35Å; L26-F28 PolarHBondContact O-N 3.07Å; F28-Q30 PolarHBondContact O-N 3.23Å
29	S	38.4	Very low	35.4	Very low	108 Å²	108	150 Å²	150	76%	0.755	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-29.2	-173.8	-166.1	0	0	0	0	113.9
30	Q	38.8	Very low	35.3	Very low	173 Å²	173	153.4 Å²	153.4	81%	0.808	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-13.9	-162.7	-146.3	161.5	12.2	0	0	114.4	F28	F28-Q30 PolarHBondContact O-N 3.23Å
31	C	36.3	Very low	35.5	Very low	97 Å²	97	148.9 Å²	148.9	66%	0.655	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-30.9	177.2	-69.5	0	0	0	0	113.9	S33 Y34	C31-S33 PolarHBondContact O-N 2.95Å; C31-Y34 PolarHBondContact O-N 3.26Å
32	C	38	Very low	35.5	Very low	93 Å²	93	152 Å²	152	63%	0.628	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-19.6	-175.1	-68.7	0	0	0	0	114.2
33	S	37.3	Very low	35.3	Very low	101 Å²	101	150.2 Å²	150.2	71%	0.706	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-30	178.8	-160.2	0	0	0	0	113.3	C31	C31-S33 PolarHBondContact O-N 2.95Å
34	Y	34.5	Very low	35.1	Very low	209 Å²	209	149 Å²	149	82%	0.82	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-26.5	-171.3	-147.3	-96.7	0	0	0	113.2	C31 R36	C31-Y34 PolarHBondContact O-N 3.26Å; Y34-R36 VanDerWaalsContact C-N 3.28Å; Y34-R36 PolarHBondContact O-N 3.49Å
35	A	36.8	Very low	34.9	Very low	69 Å²	69	148.3 Å²	148.3	57%	0.57	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-72.5	-17.4	-180	0	0	0	0	0	114	L37	A35-L37 PolarHBondContact O-N 2.84Å
36	R	34.6	Very low	34.5	Very low	232 Å²	232	149.8 Å²	149.8	88%	0.875	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-85.2	-5.3	-170.3	-140.3	179.6	-162.2	-166.3	4.9	115.1	Y34	Y34-R36 VanDerWaalsContact C-N 3.28Å; Y34-R36 PolarHBondContact O-N 3.49Å
37	L	36.2	Very low	34	Very low	160 Å²	160	153.3 Å²	153.3	84%	0.838	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-101.4	-9.4	-174.5	-150.1	73.8	0	0	0	114.2	A35	A35-L37 PolarHBondContact O-N 2.84Å
38	H	31.9	Very low	33.8	Very low	162 Å²	162	151.4 Å²	151.4	75%	0.75	77%	0.771	S	S	*	*	S	Bend	trans	-115	7	-166.2	-136.2	-60.3	0	0	0	115.3
39	I	36.8	Very low	33.7	Very low	152 Å²	152	148.6 Å²	148.6	78%	0.779	77%	0.772	S	S	*	*	S	Bend	trans	-122.5	51	179.6	-42.4	-179.2	0	0	0	110
40	Q	33	Very low	33.3	Very low	176 Å²	176	147.3 Å²	147.3	82%	0.822	77%	0.768	S	S	*	*	S	Bend	trans	-132.9	7.4	177	-155	66.6	45.6	0	0	112.8
41	T	34.9	Very low	32.9	Very low	109 Å²	109	146 Å²	146	67%	0.669	77%	0.766	S	S	*	*	S	Bend	trans	-140	62.2	-170.6	42.5	0	0	0	0	112.5
42	H	30.5	Very low	32.4	Very low	192 Å²	192	149.1 Å²	149.1	89%	0.889	77%	0.769	S	S	*	*			trans	178	69.6	144.8	-98.5	-67.1	0	0	0	110.6
43	V	33.3	Very low	31.9	Very low	135 Å²	135	151.3 Å²	151.3	82%	0.818	77%	0.774	S	S	*	*			trans	-124	103.6	159.5	176.3	0	0	0	0	106.8
44	N	28.1	Very low	31.6	Very low	147 Å²	147	155 Å²	155	79%	0.786	78%	0.78	S	S	*	*			trans	166.4	103.2	160.1	-88.1	-19.5	0	0	0	107.5
45	D	28	Very low	31.3	Very low	147 Å²	147	150.6 Å²	150.6	79%	0.786	78%	0.775	S	S	*	*				-173.9	152.4	109.4	-113.5	-33.8	0	0	0	113.9
46	L	27.9	Very low	30.8	Very low	145 Å²	145	155.2 Å²	155.2	76%	0.759	79%	0.786	S	S	*	*			trans	43	102	156.2	-55.3	171	0	0	0	118.6
47	R	28.7	Very low	30.4	Very low	235 Å²	235	148.3 Å²	148.3	89%	0.887	78%	0.779	S	S	*	*				85.8	122	52.8	-170.6	-179.2	-76.2	-176.7	-3.2	114.5
48	I	29.5	Very low	30.2	Very low	154 Å²	154	152.3 Å²	152.3	79%	0.79	78%	0.783	S	S	*	*			trans	-88.2	154.9	178.1	-17.1	178	0	0	0	111.1
49	P	34.8	Very low	30.3	Very low	125 Å²	125	156.4 Å²	156.4	81%	0.812	79%	0.792	S	S	*	*				-148.1	-154.5	91.1	36.6	-16.4	0	0	0	112.8
50	A	29	Very low	30	Very low	81 Å²	81	154.2 Å²	154.2	67%	0.669	79%	0.79	S	S	*	*				-169.7	165.8	-76.3	0	0	0	0	0	110
51	N	30.4	Very low	30	Very low	145 Å²	145	151.2 Å²	151.2	78%	0.775	79%	0.789	S	S	*	*			trans	64.4	160	167.2	-85.7	22.6	0	0	0	118
52	F	26.2	Very low	29.9	Very low	163 Å²	163	157.3 Å²	157.3	72%	0.715	80%	0.8	S	S	*	*			cis	-160.6	175.2	-26.2	-140.2	-127.2	0	0	0	109.3
53	D	27.7	Very low	30.1	Very low	139 Å²	139	155.8 Å²	155.8	74%	0.743	80%	0.797	S	S	*	*			trans	54.7	120	160.4	-71.4	-16.2	0	0	0	125.9
54	Q	30.5	Very low	30	Very low	179 Å²	179	155 Å²	155	84%	0.836	79%	0.792	S	S	*	*			trans	-49.6	150.7	147.4	162.4	-166.7	96.6	0	0	115.1
55	V	28.3	Very low	30.3	Very low	116 Å²	116	153.8 Å²	153.8	70%	0.703	80%	0.795	S	S	*	*			trans	177.7	152.2	140.3	140.5	0	0	0	0	114.3
56	M	26.9	Very low	30.3	Very low	165 Å²	165	150.9 Å²	150.9	81%	0.813	80%	0.8	S	S	*	*			trans	56.5	128.8	178.7	-58.8	-40.8	165.9	0	0	118.6
57	A	26.7	Very low	30.4	Very low	88 Å²	88	147.1 Å²	147.1	73%	0.727	80%	0.796	S	S	*	*			cis	85.9	98.6	19.1	0	0	0	0	0	117.8
58	R	31.5	Very low	30.3	Very low	244 Å²	244	145.7 Å²	145.7	92%	0.921	79%	0.792	S	S	*	*			trans	-141.4	121.3	149.2	-65.4	-173.7	176.2	179.3	-1.8	105.9
59	R	32.7	Very low	30.5	Very low	248 Å²	248	147 Å²	147	94%	0.936	79%	0.788	S	S	*	*				54	138.7	71.3	-77.4	-171.1	171.2	-170.3	-1.6	114.3
60	S	32	Very low	30.3	Very low	105 Å²	105	147.6 Å²	147.6	73%	0.734	78%	0.78	S	S	*	*			cis	171.7	113.4	-25.7	155.7	0	0	0	0	110.3
61	S	32.8	Very low	30.6	Very low	114 Å²	114	148.1 Å²	148.1	80%	0.797	78%	0.779	S	S	*	*			trans	-175.7	126.5	158.6	37.8	0	0	0	0	107.4
62	R	32.1	Very low	30.8	Very low	237 Å²	237	149.4 Å²	149.4	89%	0.894	79%	0.786	S	S	*	*			cis	57.2	111.7	46.2	-74.8	-164.2	175.2	-154.5	-0.4	114.2
63	L	35.2	Very low	31.4	Very low	160 Å²	160	149.4 Å²	149.4	84%	0.838	79%	0.788	S	S	*	*				-172.7	145.6	106.3	-92.1	166.7	0	0	0	111.5
64	V	31.8	Very low	31.7	Very low	118 Å²	118	150.9 Å²	150.9	72%	0.715	79%	0.79	S	S	*	*			trans	47.5	111.1	146.1	177.1	0	0	0	0	118
65	S	33.4	Very low	31.9	Very low	121 Å²	121	148.2 Å²	148.2	85%	0.846	79%	0.791	S	S	*	*				74.8	106.3	54.7	-55.6	0	0	0	0	115
66	G	28.3	Very low	32	Very low	86 Å²	86	150.3 Å²	150.3	89%	0.887	80%	0.799	S	S	*	*			trans	-158.2	146.4	167.1	0	0	0	0	0	109.5
67	G	29	Very low	32.2	Very low	66 Å²	66	147.9 Å²	147.9	68%	0.68	80%	0.798	S	S	*	*			trans	-155.6	-167.2	-176.6	0	0	0	0	0	111.8
68	Y	28.2	Very low	32.9	Very low	205 Å²	205	149.7 Å²	149.7	80%	0.804	81%	0.806	S	S	*	*			trans	69.6	140.3	-162.3	-65.8	-122.2	0	0	0	111.2
69	Y	32.2	Very low	33	Very low	181 Å²	181	143 Å²	143	71%	0.71	80%	0.796	S	S	*	*			cis	-159.5	166.6	-1.5	-120.4	-8.5	0	0	0	108.1
70	H	31.5	Very low	33.2	Very low	139 Å²	139	137.7 Å²	137.7	64%	0.644	79%	0.791	S	S	*	*			cis	-140.9	-110	-6.6	-165.3	-54.4	0	0	0	110
71	S	35.6	Very low	33.5	Very low	91 Å²	91	138.6 Å²	138.6	64%	0.636	79%	0.792	S	S	*	*			trans	-162.1	148.8	174.2	-49.8	0	0	0	0	107.7
72	D	34.7	Very low	33.4	Very low	172 Å²	172	140.1 Å²	140.1	92%	0.92	79%	0.791	S	S	*	*			trans	-143.4	158.2	167.6	-83.4	-55.7	0	0	0	109
73	E	37.7	Very low	33.6	Very low	164 Å²	164	136.3 Å²	136.3	77%	0.766	79%	0.787	S	S	*	*			trans	-101.4	173.6	-157.6	-78.6	-67.5	161.1	0	0	115.9
74	E	34.4	Very low	33.3	Very low	169 Å²	169	133.7 Å²	133.7	79%	0.79	78%	0.782	S	S	*	*			trans	51.9	118.2	151.5	-73.1	170.3	120.9	0	0	121
75	S	34.1	Very low	33.4	Very low	123 Å²	123	138.8 Å²	138.8	86%	0.86	79%	0.79	S	S	*	*				-170.8	138.8	112.5	-80.1	0	0	0	0	112.7
76	D	32.2	Very low	33.4	Very low	161 Å²	161	144.6 Å²	144.6	86%	0.861	79%	0.794	S	S	*	*			trans	-65.8	149.8	165.7	-74.4	-62.9	0	0	0	112.3
77	S	30.2	Very low	33.8	Very low	114 Å²	114	149.5 Å²	149.5	80%	0.797	79%	0.793	S	S	*	*				-174.4	131.9	126.3	-84.4	0	0	0	0	112.6
78	S	40.7	Very low	33.7	Very low	126 Å²	126	153.7 Å²	153.7	88%	0.881	80%	0.8	S	S	*	*			trans	-79.1	132	158.4	50.8	0	0	0	0	109.5
79	S	35.4	Very low	34.7	Very low	102 Å²	102	149.1 Å²	149.1	71%	0.713	80%	0.795	S	S	*	*			trans	-146.1	126.4	173	66.8	0	0	0	0	113.2
80	V	36.2	Very low	34.7	Very low	138 Å²	138	146.7 Å²	146.7	84%	0.836	80%	0.799	S	S	*	*			trans	-67.8	132.4	170.6	173.1	0	0	0	0	110.5
81	T	37.9	Very low	34.8	Very low	123 Å²	123	149.1 Å²	149.1	76%	0.755	81%	0.808	S	S	*	*			trans	-123.1	109.9	158.8	50.3	0	0	0	0	107.1
82	N	30.9	Very low	34.6	Very low	146 Å²	146	151.7 Å²	151.7	78%	0.781	82%	0.819	S	S	*	*				64.9	87.5	52.4	-146.7	-7.8	0	0	0	111.1
83	I	36.7	Very low	34.5	Very low	157 Å²	157	153.4 Å²	153.4	81%	0.805	82%	0.819	S	S	*	*			trans	-99.6	108.6	-175.3	-62.3	171.9	0	0	0	108.9
84	S	29	Very low	34.3	Very low	105 Å²	105	155.5 Å²	155.5	73%	0.734	83%	0.826	S	S	*	*			trans	-91.7	131.6	173.7	60.9	0	0	0	0	111.7
85	Y	32.8	Very low	34.2	Very low	226 Å²	226	157.9 Å²	157.9	89%	0.886	83%	0.833	S	S	*	*			trans	-69.5	137.6	170.7	-85.5	-102.9	0	0	0	111.5
86	R	33.6	Very low	34.1	Very low	243 Å²	243	161.6 Å²	161.6	92%	0.917	83%	0.834	S	S	*	*			trans	-107.7	113.1	163.9	-95.7	-166.4	172.9	-156.7	0.2	109.9
87	E	35.9	Very low	34	Very low	189 Å²	189	159.9 Å²	159.9	88%	0.883	84%	0.835	S	S	*	*			trans	-83.8	156.2	158.2	-62.9	-166.2	138.8	0	0	110.5
88	N	28.8	Very low	34	Very low	154 Å²	154	158.2 Å²	158.2	82%	0.824	84%	0.835	S	S	*	*			trans	-142.3	115.9	176.2	-171.4	36.1	0	0	0	110.4
89	P	48.2	Very low	33.6	Very low	108 Å²	108	156.1 Å²	156.1	70%	0.701	83%	0.834	S	S	*	*			trans	-100.4	145.1	-163.4	36.3	-35.4	0	0	0	115.1
90	V	31.5	Very low	33.3	Very low	130 Å²	130	163.4 Å²	163.4	79%	0.788	85%	0.846	S	S	*	*			trans	-134.5	91.8	166.6	-172.3	0	0	0	0	112.9
91	K	34.7	Very low	33.1	Very low	191 Å²	191	168.6 Å²	168.6	83%	0.83	85%	0.85	S	S	*	*			trans	38.8	113.5	135	-57.8	173.7	-175.9	174.3	0	119.2
92	V	31.2	Very low	32.7	Very low	144 Å²	144	168.6 Å²	168.6	87%	0.873	86%	0.855	S	S	*	*			trans	-99.2	140.8	153.3	-178.9	0	0	0	0	109.4
93	F	31.8	Very low	32.7	Very low	209 Å²	209	165.8 Å²	165.8	92%	0.917	85%	0.852	S	S	*	*			trans	-72.6	144.2	179.4	-76.6	-99.2	0	0	0	112.5
94	K	33.2	Very low	32.6	Very low	208 Å²	208	162.7 Å²	162.7	90%	0.904	84%	0.844	S	S	*	*			trans	-130.4	127.3	171.9	-152.2	172.6	-171.4	176.7	0	111.3
95	K	33.7	Very low	32.7	Very low	218 Å²	218	168.5 Å²	168.5	95%	0.948	85%	0.85	S	S	*	*			trans	-82.2	158.4	177.8	-165.2	172.6	177.7	-179.2	0	110.5
96	K	32.1	Very low	32.6	Very low	201 Å²	201	163.7 Å²	163.7	87%	0.874	84%	0.844	S	S	*	*			trans	-120.3	126.5	-159	172.3	-175.7	172.7	-177.6	0	115
97	S	30.2	Very low	32.4	Very low	126 Å²	126	156.6 Å²	156.6	88%	0.881	83%	0.832	S	S	*	*			trans	-171.8	152.9	153.1	47.2	0	0	0	0	108.6
98	G	30	Very low	32.3	Very low	78 Å²	78	152.3 Å²	152.3	80%	0.804	82%	0.823	S	S	*	*			cis	170.2	116.4	-13.8	0	0	0	0	0	113
99	G	30.9	Very low	32.4	Very low	83 Å²	83	152.2 Å²	152.2	86%	0.856	82%	0.823	S	S	*	*			trans	86	157.3	179.2	0	0	0	0	0	114.4
100	R	29.6	Very low	31.4	Very low	254 Å²	254	152.7 Å²	152.7	96%	0.958	83%	0.827	S	S	*	*			cis	-144.4	162.6	-2.2	-126.3	178.7	-177.4	177.1	0	109.3
101	R	32.4	Very low	31.6	Very low	247 Å²	247	151.4 Å²	151.4	93%	0.932	82%	0.824	S	S	*	*			trans	-97.6	148.8	176.2	-74.3	177.6	168.9	174.8	-5.2	111.9
102	S	29.1	Very low	31.4	Very low	124 Å²	124	147.9 Å²	147.9	87%	0.867	82%	0.823	S	S	*	*				-165.5	163.8	121	-158.5	0	0	0	0	112
103	A	30.7	Very low	31.4	Very low	87 Å²	87	145.8 Å²	145.8	72%	0.719	82%	0.821	S	S	*	*			trans	-115.4	-174.2	162.9	0	0	0	0	0	108.2
104	S	34.9	Very low	31.4	Very low	91 Å²	91	141.2 Å²	141.2	64%	0.636	82%	0.815	S	S	*	*			cis	-168.1	177.1	13.7	61.3	0	0	0	0	110.6
105	R	31.9	Very low	32.3	Very low	228 Å²	228	136.7 Å²	136.7	86%	0.86	81%	0.807	S	S	*	*			trans	72.8	155.4	158	-68.1	173.3	166	176.6	-6.1	116.8
106	T	29.5	Very low	32.2	Very low	124 Å²	124	135.2 Å²	135.2	76%	0.761	80%	0.804	S	S	*	*			cis	-153.5	154.9	-0.1	-0.4	0	0	0	0	114.7
107	S	30.5	Very low	32.6	Very low	94 Å²	94	131.9 Å²	131.9	66%	0.657	80%	0.8	S	S	*	*			trans	-9	128.8	155.6	59.7	0	0	0	0	124.8
108	S	33.9	Very low	33.8	Very low	99 Å²	99	131.6 Å²	131.6	69%	0.692	80%	0.795	S	S	*	*				60.4	143.4	121.5	73	0	0	0	0	126
109	N	31.2	Very low	34.4	Very low	152 Å²	152	134 Å²	134	81%	0.813	79%	0.794	S	S	*	*			trans	108.8	103.4	146.6	-70.8	-1.7	0	0	0	121.6
110	C	27.2	Very low	35.4	Very low	118 Å²	118	136.1 Å²	136.1	80%	0.797	79%	0.793	S	S	*	*				36.5	127.2	125.8	-159.4	0	0	0	0	122.4
111	S	34	Very low	35.7	Very low	103 Å²	103	132.6 Å²	132.6	72%	0.72	79%	0.787	S	S	*	*				177.7	132.3	113.5	-75.7	0	0	0	0	116
112	S	31	Very low	36.7	Very low	117 Å²	117	126.6 Å²	126.6	82%	0.818	78%	0.78	S	S	*	*			trans	42.7	141	142	66.1	0	0	0	0	125.8
113	A	30.9	Very low	36.5	Very low	100 Å²	100	124.2 Å²	124.2	83%	0.826	78%	0.775	S	S	*	*			trans	121.8	143.1	133.6	0	0	0	0	0	118.1
114	S	32.8	Very low	36.5	Very low	114 Å²	114	127.8 Å²	127.8	80%	0.797	78%	0.781	S	S	*	*			trans	-127.1	178.9	-179.1	-52	0	0	0	0	110.6
115	P	52.4	Low	36.1	Very low	112 Å²	112	129.9 Å²	129.9	73%	0.727	79%	0.79	S	S	*	*				-152.4	158.5	102.2	38.3	-20.5	0	0	0	118.5
116	E	30.3	Very low	36	Very low	188 Å²	188	124.2 Å²	124.2	88%	0.879	79%	0.792	S	S	*	*			trans	67	146	140.3	-69.7	171.3	169	0	0	124.9
117	T	42.4	Very low	36	Very low	131 Å²	131	122.3 Å²	122.3	80%	0.804	80%	0.797	S	S	*	*			trans	-157.8	159	179.5	48.8	0	0	0	0	112
118	P	54.2	Low	36.2	Very low	119 Å²	119	123.7 Å²	123.7	77%	0.773	81%	0.807	S	S	*	*			trans	-135.5	139.9	134.5	11.2	11.6	0	0	0	112.9
119	V	41.9	Very low	36.5	Very low	130 Å²	130	123.5 Å²	123.5	79%	0.788	81%	0.812	S	S	*	*				76.5	124.6	65.2	172.6	0	0	0	0	111.6
120	P	53.7	Low	37.2	Very low	127 Å²	127	122.3 Å²	122.3	83%	0.825	81%	0.812	S	S	*	*				-141.8	179.2	60.9	38.7	-17.9	0	0	0	120
121	E	34.8	Very low	37.5	Very low	179 Å²	179	123.4 Å²	123.4	84%	0.836	82%	0.815	S	S	*	*			trans	-90.2	-165.8	-174.3	-71.6	-155.7	140.4	0	0	115.1
122	P	53.1	Low	37.8	Very low	122 Å²	122	126.4 Å²	126.4	79%	0.792	82%	0.823	S	S	*	*			cis	-132.9	171.7	-7.7	19.5	6.3	0	0	0	117.4
123	G	24.5	Very low	37.8	Very low	74 Å²	74	126.4 Å²	126.4	76%	0.763	82%	0.823	S	S	*	*			trans	175.7	69	169.3	0	0	0	0	0	121
124	L	30.6	Very low	38.5	Very low	161 Å²	161	127.2 Å²	127.2	84%	0.843	82%	0.819	S	S	*	*			trans	53.4	120.2	151.5	-66.3	172.6	0	0	0	123.6
125	T	28.3	Very low	38.7	Very low	135 Å²	135	130.2 Å²	130.2	83%	0.828	83%	0.826	S	S	*	*			trans	66.2	126.8	135.9	57.9	0	0	0	0	123.4
126	A	29.8	Very low	37.7	Very low	109 Å²	109	136.4 Å²	136.4	90%	0.901	84%	0.835	S	S	*	*			trans	-144.1	152.6	147.5	0	0	0	0	0	109.9
127	G	28.5	Very low	37.9	Very low	84 Å²	84	132.9 Å²	132.9	87%	0.866	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-101.8	172.4	-169.5	0	0	0	0	0	116.4
128	S	34.2	Very low	37.4	Very low	124 Å²	124	133.3 Å²	133.3	87%	0.867	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-95.3	165.4	-175.5	51.4	0	0	0	0	114.8
129	A	40.8	Very low	36.1	Very low	95 Å²	95	134.2 Å²	134.2	79%	0.785	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-84.8	154.6	175.4	0	0	0	0	0	113.4
130	P	46.7	Very low	35.6	Very low	126 Å²	126	137.6 Å²	137.6	82%	0.818	84%	0.84	S	S	*	*			trans	-109.8	177.8	174.8	40.1	-33	0	0	0	114.7
131	T	33	Very low	34.7	Very low	141 Å²	141	135.3 Å²	135.3	87%	0.865	83%	0.833	S	S	*	*			trans	-131.7	165.1	-174.1	-47.6	0	0	0	0	112.5
132	L	40.6	Very low	34.9	Very low	167 Å²	167	132.9 Å²	132.9	87%	0.874	83%	0.832	S	S	*	*			trans	-55.6	148.7	-173.9	-67.9	154.7	0	0	0	117
133	S	31.1	Very low	34	Very low	117 Å²	117	133.9 Å²	133.9	82%	0.818	84%	0.836	S	S	*	*			trans	-168.1	-171.4	142.6	63.4	0	0	0	0	110.2
134	P	44.8	Very low	34.5	Very low	117 Å²	117	134.1 Å²	134.1	76%	0.76	83%	0.831	S	S	*	*				-125.1	-173	-110.2	34.5	-12.4	0	0	0	116.7
135	L	36.7	Very low	34.8	Very low	177 Å²	177	132.8 Å²	132.8	93%	0.927	83%	0.832	S	S	*	*			trans	-58.5	149.7	-173.9	-74.3	79.3	0	0	0	115.6
136	R	32.2	Very low	35.1	Very low	242 Å²	242	132.8 Å²	132.8	91%	0.913	83%	0.832	S	S	*	*			trans	-149.7	138	152.5	-157.7	172.1	-169	161.3	3.4	111.3
137	S	33.5	Very low	35.5	Very low	113 Å²	113	133.4 Å²	133.4	79%	0.79	83%	0.827	S	S	*	*			trans	-104.6	140.4	178.3	49.9	0	0	0	0	112
138	V	32.7	Very low	35.9	Very low	141 Å²	141	140.9 Å²	140.9	86%	0.855	83%	0.829	S	S	*	*			trans	-142.3	147.6	169.2	-176.1	0	0	0	0	109.2
139	T	26.4	Very low	36.1	Very low	137 Å²	137	141 Å²	141	84%	0.84	83%	0.827	S	S	*	*			trans	-83.7	151.1	-162.1	-41.9	0	0	0	0	114.7
140	F	31.8	Very low	35.6	Very low	201 Å²	201	141.3 Å²	141.3	88%	0.882	83%	0.829	S	S	*	*			trans	-73.5	146	171.2	-133.2	-96.1	0	0	0	112
141	A	34.4	Very low	35	Very low	80 Å²	80	143.7 Å²	143.7	66%	0.661	83%	0.834	S	S	*	*			trans	-141.6	139.6	169.5	0	0	0	0	0	110.4
142	P	39	Very low	34.9	Very low	128 Å²	128	143.4 Å²	143.4	83%	0.831	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-88.7	135.7	-174.3	33.8	-33.9	0	0	0	113.1
143	T	33.8	Very low	34.6	Very low	143 Å²	143	141.6 Å²	141.6	88%	0.877	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-85.2	130.6	173.7	-46.8	0	0	0	0	111
144	A	35.9	Very low	34.6	Very low	79 Å²	79	141.6 Å²	141.6	65%	0.653	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-77.5	155.5	176.6	0	0	0	0	0	112.6
145	P	37.3	Very low	34.2	Very low	133 Å²	133	141.6 Å²	141.6	86%	0.864	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-81.9	148.8	-176.7	32.9	-35.7	0	0	0	113.7
146	T	34.1	Very low	34.3	Very low	135 Å²	135	139.2 Å²	139.2	83%	0.828	83%	0.826	S	S	*	*			trans	-119.6	142.3	178.1	-41.1	0	0	0	0	109.2
147	P	38.3	Very low	34.3	Very low	122 Å²	122	136.8 Å²	136.8	79%	0.792	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-89.7	167.9	-154.3	34.2	-37.9	0	0	0	116.8
148	R	37.5	Very low	34	Very low	241 Å²	241	138.8 Å²	138.8	91%	0.909	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-65.1	147.6	174.7	-70.1	-178	172.6	-175	-2.7	113.3
149	P	38.5	Very low	33.9	Very low	127 Å²	127	139.9 Å²	139.9	83%	0.825	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-64.9	157.9	153.5	-17.9	32.6	0	0	0	112.5
150	A	30.4	Very low	34	Very low	100 Å²	100	139 Å²	139	83%	0.826	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-91.1	162.5	-173.7	0	0	0	0	0	114.4
151	L	32.8	Very low	33.7	Very low	176 Å²	176	134.3 Å²	134.3	92%	0.921	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-79.3	143.5	171.4	-66.1	163.7	0	0	0	111
152	T	31.5	Very low	33.4	Very low	135 Å²	135	139.3 Å²	139.3	83%	0.828	82%	0.816	S	S	*	*			trans	-118.7	140.7	166.5	45.9	0	0	0	0	110.8
153	P	33.6	Very low	32.8	Very low	129 Å²	129	141.3 Å²	141.3	84%	0.838	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-89.2	155.5	-166.7	35.3	-37	0	0	0	114.8
154	S	31.7	Very low	32.3	Very low	118 Å²	118	138.8 Å²	138.8	83%	0.825	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-80.4	142.2	173.7	-46.7	0	0	0	0	112.8
155	P	35.8	Very low	31.9	Very low	117 Å²	117	145.6 Å²	145.6	76%	0.76	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77.9	161	164	33.1	-33.4	0	0	0	112
156	P	38.5	Very low	31.3	Very low	126 Å²	126	143.6 Å²	143.6	82%	0.818	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-90.4	167.9	-163.2	35.6	-37.7	0	0	0	115.9
157	Q	33.3	Very low	31	Very low	192 Å²	192	145.4 Å²	145.4	90%	0.897	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-59.7	154.3	169.3	-65.6	174.6	-29.5	0	0	112.3
158	N	27.3	Very low	30.5	Very low	155 Å²	155	145.7 Å²	145.7	83%	0.829	80%	0.802	S	S	*	*			trans	-141.8	138.4	162.4	-130	-22	0	0	0	113.7
159	H	30.6	Very low	30.5	Very low	163 Å²	163	139.4 Å²	139.4	76%	0.755	79%	0.792	S	S	*	*			trans	-40	134.8	-172.1	-75.2	-81.1	0	0	0	121.2
160	T	27.4	Very low	29.9	Very low	118 Å²	118	141.6 Å²	141.6	72%	0.724	79%	0.791	S	S	*	*			trans	23.1	125	130.3	27.8	0	0	0	0	120.4
161	S	26.3	Very low	29.7	Very low	104 Å²	104	147.4 Å²	147.4	73%	0.727	79%	0.792	S	S	*	*				162.7	147.3	114.7	-77.6	0	0	0	0	116.9
162	K	28.3	Very low	29.3	Very low	184 Å²	184	144.6 Å²	144.6	80%	0.8	79%	0.787	S	S	*	*			trans	65.3	93.3	144.5	-69.3	171.1	-176.5	178.8	0	122.4
163	Q	26.5	Very low	29	Very low	170 Å²	170	143 Å²	143	79%	0.794	78%	0.781	S	S	*	*				59.8	105.8	95.5	-164.8	176.1	10	0	0	121.6
164	C	23.5	Very low	28.6	Very low	91 Å²	91	142.5 Å²	142.5	62%	0.615	78%	0.781	S	S	*	*			trans	79.3	149	137.8	-68.1	0	0	0	0	123.7
165	Y	26.5	Very low	29.2	Very low	221 Å²	221	143.1 Å²	143.1	87%	0.867	78%	0.782	S	S	*	*			trans	66.1	148.9	165.7	-54	-64.4	0	0	0	117.1
166	S	25.3	Very low	28.8	Very low	91 Å²	91	141 Å²	141	64%	0.636	78%	0.781	S	S	*	*			cis	-177.2	155.7	-35.3	49.5	0	0	0	0	106.5
167	M	26.2	Very low	28.3	Very low	173 Å²	173	144.1 Å²	144.1	85%	0.852	79%	0.785	S	S	*	*			trans	148.6	117.3	149.3	-83.2	-73.3	168.6	0	0	110.7
168	T	28.4	Very low	27.9	Very low	129 Å²	129	141 Å²	141	79%	0.791	78%	0.783	S	S	*	*			trans	-81.6	157.6	144	44.5	0	0	0	0	108.3
169	P	38.5	Very low	27.8	Very low	109 Å²	109	137.2 Å²	137.2	71%	0.708	78%	0.78	S	S	*	*				-144.6	157.9	109.6	33.6	-17.6	0	0	0	115.1
170	E	25.3	Very low	27.7	Very low	172 Å²	172	134 Å²	134	80%	0.804	78%	0.782	S	S	*	*			trans	49.2	135.1	150.2	-60.8	-168.3	130.5	0	0	121.5
171	R	26.8	Very low	27.5	Very low	222 Å²	222	140.3 Å²	140.3	84%	0.838	79%	0.793	S	S	*	*			cis	97.3	88.2	28.3	-170.7	-166.4	-172	-175.2	4.3	114.2
172	S	24	Very low	27.6	Very low	117 Å²	117	143.1 Å²	143.1	82%	0.818	80%	0.798	S	S	*	*			trans	178.3	167.1	149.7	39.9	0	0	0	0	110.4
173	S	25.6	Very low	28.5	Very low	101 Å²	101	139.4 Å²	139.4	71%	0.706	79%	0.793	S	S	*	*				-170.9	102.8	-64.9	46.2	0	0	0	0	111.8
174	S	25.7	Very low	29.2	Very low	120 Å²	120	137.4 Å²	137.4	84%	0.839	80%	0.795	S	S	*	*			trans	62.1	-178.5	156.7	-48.9	0	0	0	0	117.2
175	P	43.5	Very low	29.4	Very low	130 Å²	130	143.9 Å²	143.9	84%	0.844	81%	0.807	S	S	*	*			cis	-123.4	175.7	-21.9	25.5	-4	0	0	0	114.3
176	G	27.3	Very low	29.3	Very low	72 Å²	72	138.8 Å²	138.8	74%	0.742	80%	0.803	S	S	*	*			trans	-152.5	150.5	165.7	0	0	0	0	0	110.8
177	H	28.3	Very low	29.4	Very low	192 Å²	192	142.8 Å²	142.8	89%	0.889	81%	0.809	S	S	*	*			trans	-141.3	171.9	-161.3	-122.5	10.9	0	0	0	115.4
178	C	25	Very low	29.5	Very low	128 Å²	128	141.8 Å²	141.8	87%	0.865	81%	0.806	S	S	*	*			trans	71.6	146.9	-176.4	-52.1	0	0	0	0	115.3
179	G	25.3	Very low	29.2	Very low	75 Å²	75	142.7 Å²	142.7	77%	0.773	80%	0.799	S	S	*	*			cis	119.6	137.1	1.5	0	0	0	0	0	112
180	A	27	Very low	28.6	Very low	96 Å²	96	146.2 Å²	146.2	79%	0.793	81%	0.806	S	S	*	*			cis	-167.6	-174.2	-3.1	0	0	0	0	0	110.7
181	R	24.9	Very low	28.6	Very low	250 Å²	250	145.4 Å²	145.4	94%	0.943	80%	0.802	S	S	*	*			trans	107.9	148	159.8	-59.5	-177.3	178.7	-120.9	-0.8	120.1
182	L	27	Very low	28.6	Very low	162 Å²	162	139.7 Å²	139.7	85%	0.848	80%	0.796	S	S	*	*			trans	-156.9	177	179.7	-89.7	169.7	0	0	0	105.8
183	P	48.8	Very low	28.9	Very low	107 Å²	107	143.2 Å²	143.2	70%	0.695	80%	0.799	S	S	*	*			cis	-119.5	-141.5	-25.6	30.4	-6.3	0	0	0	109.2
184	P	40.9	Very low	29.1	Very low	128 Å²	128	144 Å²	144	83%	0.831	81%	0.805	S	S	*	*				-132.7	-162.8	58	34.1	-12.8	0	0	0	114.5
185	R	26.3	Very low	29.1	Very low	227 Å²	227	142 Å²	142	86%	0.857	80%	0.803	S	S	*	*			trans	-145.5	147.9	-156.5	172.4	-170.3	-174.8	-178.9	6.8	111.8
186	S	25.6	Very low	28.5	Very low	114 Å²	114	142 Å²	142	80%	0.797	80%	0.8	S	S	*	*			trans	-125	152.6	168.5	53.3	0	0	0	0	113
187	K	26.7	Very low	28.5	Very low	175 Å²	175	145.6 Å²	145.6	76%	0.761	80%	0.803	S	S	*	*			trans	-102.1	178.8	169.5	-54.2	-179.5	179.1	178.2	0	107.9
188	I	28.1	Very low	28.5	Very low	151 Å²	151	140.8 Å²	140.8	77%	0.774	79%	0.791	S	S	*	*			cis	-155.6	169.6	14.7	-153.4	152.4	0	0	0	106.3
189	K	23	Very low	28.9	Very low	148 Å²	148	140.9 Å²	140.9	64%	0.643	79%	0.793	S	S	*	*			cis	-166.3	172.3	38.8	-151.9	-159.2	174.3	174	0	111.1
190	E	26.4	Very low	29	Very low	183 Å²	183	140.5 Å²	140.5	86%	0.855	79%	0.789	S	S	*	*			trans	-110.7	155.6	151.9	-69.6	-179	111	0	0	110.6
191	Q	23.6	Very low	29	Very low	156 Å²	156	146.9 Å²	146.9	73%	0.729	79%	0.794	S	S	*	*			trans	-158.9	142.8	153.2	-161.7	162.1	-5.4	0	0	111.5
192	S	28.4	Very low	29.4	Very low	101 Å²	101	140 Å²	140	71%	0.706	79%	0.785	S	S	*	*			trans	-136.7	136.7	176.8	52.1	0	0	0	0	110
193	Q	30.1	Very low	29.7	Very low	191 Å²	191	137.5 Å²	137.5	89%	0.893	78%	0.781	S	S	*	*			trans	-175.4	164.1	153	-106.6	154.7	1.8	0	0	113.5
194	S	28.6	Very low	28.7	Very low	118 Å²	118	136.9 Å²	136.9	83%	0.825	79%	0.785	S	S	*	*			trans	-73.1	156.4	-171.8	49.4	0	0	0	0	116.6
195	G	26.5	Very low	28.3	Very low	78 Å²	78	140.2 Å²	140.2	80%	0.804	79%	0.789	S	S	*	*			trans	-163.9	134.8	161.5	0	0	0	0	0	111.4
196	V	30.6	Very low	28.4	Very low	129 Å²	129	132.8 Å²	132.8	78%	0.782	78%	0.783	S	S	*	*			trans	-106.8	141.4	-172	-178	0	0	0	0	110.7
197	D	27.6	Very low	29.1	Very low	149 Å²	149	133 Å²	133	80%	0.797	78%	0.781	S	S	*	*			trans	155.6	162.6	139.1	-88.1	-32.7	0	0	0	113.1
198	S	29	Very low	29.1	Very low	91 Å²	91	135.2 Å²	135.2	64%	0.636	79%	0.787	S	S	*	*			cis	-179.6	111.9	-38.6	-95.3	0	0	0	0	110.9
199	S	32.8	Very low	29	Very low	129 Å²	129	139.5 Å²	139.5	90%	0.902	79%	0.793	S	S	*	*			trans	165.5	145.7	160.8	36.2	0	0	0	0	108.7
200	G	27.2	Very low	29.4	Very low	68 Å²	68	141.3 Å²	141.3	70%	0.701	80%	0.801	S	S	*	*			cis	113.5	118.1	20.6	0	0	0	0	0	107.6
201	Y	27	Very low	29.7	Very low	229 Å²	229	138.5 Å²	138.5	90%	0.898	80%	0.799	S	S	*	*			cis	-130.8	163.4	26.5	-61.7	-113	0	0	0	110.3
202	S	32.7	Very low	29.7	Very low	106 Å²	106	135.7 Å²	135.7	74%	0.741	80%	0.797	S	S	*	*			cis	71.8	142.8	34.8	-111.4	0	0	0	0	117.1
203	S	33	Very low	30.2	Very low	110 Å²	110	137 Å²	137	77%	0.769	80%	0.803	S	S	*	*			cis	-176.4	155.8	-26.7	-95.7	0	0	0	0	110.5
204	A	29	Very low	30.3	Very low	94 Å²	94	132.2 Å²	132.2	78%	0.777	80%	0.795	S	S	*	*			trans	-168.4	111	158.3	0	0	0	0	0	108.5
205	E	32.3	Very low	30.7	Very low	198 Å²	198	132.9 Å²	132.9	93%	0.925	80%	0.797	S	S	*	*				62.3	130.7	72.1	-63.5	-161.7	179.7	0	0	114.4
206	G	29.1	Very low	30.8	Very low	71 Å²	71	134.2 Å²	134.2	73%	0.732	79%	0.794	S	S	*	*			cis	-177.1	-158.7	-0.5	0	0	0	0	0	108.8
207	P	39.7	Very low	30.6	Very low	117 Å²	117	135.2 Å²	135.2	76%	0.76	80%	0.801	S	S	*	*			cis	-136	158.3	-12.9	39.1	-21.2	0	0	0	116.6
208	Y	26.7	Very low	30.7	Very low	222 Å²	222	134.3 Å²	134.3	87%	0.871	80%	0.801	S	S	*	*			trans	39.8	136.5	146.5	-72.3	-102.2	0	0	0	122.7
209	R	26.9	Very low	30.5	Very low	242 Å²	242	141.8 Å²	141.8	91%	0.913	82%	0.815	S	S	*	*				-157.5	166.3	59.2	-84.2	-169.7	173.7	-151.1	-0.3	115.5
210	K	29.4	Very low	30.3	Very low	185 Å²	185	140.6 Å²	140.6	80%	0.804	81%	0.807	S	S	*	*			trans	-129.3	169.1	162.9	-128.5	-179.3	-178.1	177.4	0	108.1
211	P	33.8	Very low	31.4	Very low	125 Å²	125	143.1 Å²	143.1	81%	0.812	81%	0.811	S	S	*	*				-148.2	-163.4	59.9	40.4	-17.5	0	0	0	116.5
212	S	23.1	Very low	31.8	Very low	97 Å²	97	138.2 Å²	138.2	68%	0.678	81%	0.807	S	S	*	*			trans	-96.2	-162.8	-173.1	-32	0	0	0	0	113.4
213	P	40	Very low	31.5	Very low	129 Å²	129	136.8 Å²	136.8	84%	0.838	81%	0.809	S	S	*	*			cis	-134.3	-161.9	-13.2	37.3	-14.8	0	0	0	115.3
214	A	31.3	Very low	31.7	Very low	89 Å²	89	139.8 Å²	139.8	74%	0.736	82%	0.816	S	S	*	*			trans	-77.4	176.2	-173.9	0	0	0	0	0	116.6
215	P	37.2	Very low	31.8	Very low	133 Å²	133	140.9 Å²	140.9	86%	0.864	82%	0.818	S	S	*	*				-145.3	-167.4	91.8	41.3	-24.7	0	0	0	116.2
216	S	29.1	Very low	32.2	Very low	106 Å²	106	135.6 Å²	135.6	74%	0.741	82%	0.816	S	S	*	*			trans	-103.9	161.8	-163.2	54.9	0	0	0	0	117
217	T	26	Very low	32.3	Very low	150 Å²	150	137.1 Å²	137.1	92%	0.92	82%	0.822	S	S	*	*			trans	-156.6	160.3	151.6	-19.5	0	0	0	0	112.5
218	T	29.1	Very low	32.2	Very low	130 Å²	130	135.7 Å²	135.7	80%	0.798	82%	0.821	S	S	*	*			trans	-121.6	137.2	-164.5	-44.7	0	0	0	0	113.1
219	R	24.8	Very low	32.7	Very low	247 Å²	247	131.5 Å²	131.5	93%	0.932	82%	0.821	S	S	*	*			trans	-161.8	151.2	153.4	-137.4	169.9	178.8	167.4	-1.3	113.2
220	S	28.6	Very low	33.2	Very low	105 Å²	105	124.8 Å²	124.8	73%	0.734	81%	0.81	S	S	*	*			trans	-113.3	-173.7	-174.8	-37.7	0	0	0	0	111.9
221	P	51.3	Low	33.9	Very low	120 Å²	120	121.6 Å²	121.6	78%	0.779	81%	0.809	S	S	*	*				-90.2	178.2	-123.6	42.3	-38.6	0	0	0	115.1
222	P	35.5	Very low	34.4	Very low	127 Å²	127	117.1 Å²	117.1	83%	0.825	79%	0.785	S	S	*	*				-146	165.8	118.6	39.8	-27.3	0	0	0	115.8
223	G	26.6	Very low	35.3	Very low	75 Å²	75	121.4 Å²	121.4	77%	0.773	79%	0.788	S	S	*	*			trans	96.9	107	137.9	0	0	0	0	0	118.2
224	N	35.8	Very low	35.5	Very low	174 Å²	174	125.6 Å²	125.6	93%	0.93	79%	0.787	S	S	*	*			trans	-83.7	126.1	166.5	-128.7	2.5	0	0	0	110.2
225	S	31.1	Very low	36.1	Very low	117 Å²	117	124.8 Å²	124.8	82%	0.818	78%	0.776	S	S	*	*			trans	-156.9	141.6	154	58.8	0	0	0	0	110.3
226	G	41.8	Very low	36.7	Very low	86 Å²	86	128.5 Å²	128.5	89%	0.887	77%	0.773	S	S	*	*			trans	-85.6	136.3	-170	0	0	0	0	0	113.8
227	A	31.3	Very low	37.8	Very low	103 Å²	103	128 Å²	128	85%	0.851	76%	0.761	S	S	*	*			trans	-146.7	151.5	169.5	0	0	0	0	0	111.1
228	A	37.3	Very low	38.9	Very low	88 Å²	88	124.4 Å²	124.4	73%	0.727	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-76.3	161.7	-175.3	0	0	0	0	0	113.6
229	P	36.2	Very low	40.1	Very low	134 Å²	134	119.6 Å²	119.6	87%	0.87	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-54.8	137.8	175.2	-26.3	35.8	0	0	0	113.1
230	S	37.8	Very low	41.5	Very low	100 Å²	100	110.9 Å²	110.9	70%	0.699	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-82	159.4	-158.5	71.9	0	0	0	0	115.4	G232	S230-G232 PolarHBondContact O-N 2.89Å
231	P	44.7	Very low	42.3	Very low	119 Å²	119	112.3 Å²	112.3	77%	0.773	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	1	-178	-20.6	33.9	0	0	0	116.2	Y233 R234	P231-Y233 VanDerWaalsContact C-N 3.26Å; P231-Y233 PolarHBondContact O-N 3.27Å; P231-Y233 VanDerWaalsContact O-N 3.09Å; P231-R234 PolarHBondContact O-N 3.39Å
232	G	43.8	Very low	42.5	Very low	31 Å²	31	109 Å²	109	32%	0.32	67%	0.672	S	S	.	*	H	α-helix	trans	-66.2	-14.6	-162.1	0	0	0	0	0	116.8	S230 S235	S230-G232 PolarHBondContact O-N 2.89Å; G232-S235 PolarHBondContact O-OG 3.4Å
233	Y	42.6	Very low	43.4	Very low	187 Å²	187	108.1 Å²	108.1	73%	0.733	66%	0.66	S	S	*	*	H	α-helix	trans	-76.6	-42.6	179.3	-166.8	-108.5	0	0	0	112.4	P231 I237	P231-Y233 VanDerWaalsContact C-N 3.26Å; P231-Y233 PolarHBondContact O-N 3.27Å; P231-Y233 VanDerWaalsContact O-N 3.09Å; Y233-I237 HydrophobicContact CD1-CD1 3.98Å; Y233-I237 HydrophobicContact CE1-CD1 3.62Å; Y233-I237 PolarHBondContact O-N 2.96Å
234	R	42.7	Very low	44.8	Very low	216 Å²	216	110.1 Å²	110.1	82%	0.815	65%	0.652	S	S	*	*	H	α-helix	trans	-70.3	-33.6	179.9	-76.3	-172.3	173.3	-167.7	-1.7	112.8	P231 I237 S238	P231-R234 PolarHBondContact O-N 3.39Å; R234-I237 PolarHBondContact O-N 2.95Å; R234-S238 WeakPolarHBondContact O-CB 3.22Å; R234-S238 PolarHBondContact O-N 3Å
235	S	45.1	Very low	45.6	Very low	73 Å²	73	107.1 Å²	107.1	51%	0.51	63%	0.634	S	S	.	*	H	α-helix	trans	-67.3	-37.1	178.2	58.7	0	0	0	0	112.6	G232 S238 G239	G232-S235 PolarHBondContact O-OG 3.4Å; S235-S238 PolarHBondContact O-N 3.31Å; S235-G239 PolarHBondContact O-N 2.96Å
236	R	49.4	Very low	46.7	Very low	211 Å²	211	106.1 Å²	106.1	80%	0.796	62%	0.62	S	S	*	*	H	α-helix	trans	-64.9	-41.4	175.6	-73	-178.8	173.7	-168.9	-1.7	112.6	G239 A240	R236-G239 PolarHBondContact O-N 3.05Å; R236-A240 PolarHBondContact O-N 2.96Å
237	I	52.6	Low	47.3	Very low	96 Å²	96	105.1 Å²	105.1	49%	0.492	60%	0.599	S	S	.	*	H	α-helix	trans	-67.1	-43.5	175.8	-63.4	171	0	0	0	110.7	Y233 R234 G239 A240 F241	Y233-I237 HydrophobicContact CD1-CD1 3.98Å; Y233-I237 HydrophobicContact CE1-CD1 3.62Å; Y233-I237 PolarHBondContact O-N 2.96Å; R234-I237 PolarHBondContact O-N 2.95Å; I237-G239 PolarHBondContact O-N 3.36Å; I237-A240 PolarHBondContact O-N 3.48Å; I237-F241 PolarHBondContact O-N 3.11Å
238	S	48.7	Very low	48.2	Very low	73 Å²	73	102.4 Å²	102.4	51%	0.51	58%	0.577	S	S	.	*	H	α-helix	trans	-61.7	-40.7	175.8	-172.2	0	0	0	0	112.5	R234 S235 F241 S242	R234-S238 WeakPolarHBondContact O-CB 3.22Å; R234-S238 PolarHBondContact O-N 3Å; S235-S238 PolarHBondContact O-N 3.31Å; S238-F241 PolarHBondContact O-N 3.28Å; S238-S242 WeakPolarHBondContact O-CB 3.5Å; S238-S242 PolarHBondContact O-N 2.87Å; S238-S242 PolarHBondContact O-OG 3.06Å
239	G	54.7	Low	48.8	Very low	29 Å²	29	101.1 Å²	101.1	30%	0.299	56%	0.563	S	S	.	*	H	α-helix	trans	-63.7	-43.2	175.1	0	0	0	0	0	112.9	S235 R236 I237 S242 N243	S235-G239 PolarHBondContact O-N 2.96Å; R236-G239 PolarHBondContact O-N 3.05Å; I237-G239 PolarHBondContact O-N 3.36Å; G239-S242 PolarHBondContact O-N 3Å; G239-N243 WeakPolarHBondContact O-CB 3.44Å; G239-N243 VanDerWaalsContact O-CG 3.29Å; G239-N243 PolarHBondContact O-N 3.39Å
240	A	53.2	Low	50	Low	64 Å²	64	99.5 Å²	99.5	53%	0.529	55%	0.55	S	S	.	.	H	α-helix	trans	-61.5	-44.1	174.6	0	0	0	0	0	112.1	R236 I237 N243 L244	R236-A240 PolarHBondContact O-N 2.96Å; I237-A240 PolarHBondContact O-N 3.48Å; A240-N243 PolarHBondContact O-N 3.42Å; A240-L244 PolarHBondContact O-N 2.98Å
241	F	47	Very low	50.6	Low	135 Å²	135	101 Å²	101	59%	0.592	55%	0.547	S	S	*	.	H	α-helix	trans	-66.4	-38.5	177.4	-161.5	-93.7	0	0	0	112.3	I237 S238 L244 M245	I237-F241 PolarHBondContact O-N 3.11Å; S238-F241 PolarHBondContact O-N 3.28Å; F241-L244 PolarHBondContact O-N 3.15Å; F241-M245 HydrophobicContact CD1-CG 4.08Å; F241-M245 HydrophobicContact CE1-CG 3.91Å; F241-M245 HydrophobicContact CE1-SD 4.45Å; F241-M245 WeakPolarHBondContact O-CB 3.28Å; F241-M245 WeakPolarHBondContact O-CG 3.49Å; F241-M245 PolarHBondContact O-N 2.98Å
242	S	55.3	Low	51.2	Low	52 Å²	52	97.6 Å²	97.6	36%	0.364	53%	0.53	S	S	.	.	H	α-helix	trans	-64.8	-41.3	175.3	-58.4	0	0	0	0	111.8	S238 G239 L244 M245 N246	S238-S242 WeakPolarHBondContact O-CB 3.5Å; S238-S242 PolarHBondContact O-N 2.87Å; S238-S242 PolarHBondContact O-OG 3.06Å; G239-S242 PolarHBondContact O-N 3Å; S242-L244 VanDerWaalsContact C-N 3.35Å; S242-M245 PolarHBondContact O-N 3.13Å; S242-N246 WeakPolarHBondContact O-CB 3.34Å; S242-N246 VanDerWaalsContact O-CG 3.28Å; S242-N246 PolarHBondContact O-N 3.3Å; S242-N246 PolarHBondContact O-ND2 3.13Å
243	N	53.7	Low	51.7	Low	108 Å²	108	99.1 Å²	99.1	58%	0.578	54%	0.539	S	S	*	.	H	α-helix	trans	-67.4	-34.9	175.4	-71.6	-13	0	0	0	112.1	G239 A240 S247	G239-N243 WeakPolarHBondContact O-CB 3.44Å; G239-N243 VanDerWaalsContact O-CG 3.29Å; G239-N243 PolarHBondContact O-N 3.39Å; A240-N243 PolarHBondContact O-N 3.42Å; N243-S247 WeakPolarHBondContact O-CB 3.16Å; N243-S247 PolarHBondContact O-N 3.2Å; N243-S247 PolarHBondContact O-OG 3Å
244	L	56.3	Low	52.2	Low	116 Å²	116	95.8 Å²	95.8	61%	0.607	53%	0.53	S	S	*	.	H	α-helix	trans	-66.5	-44.5	173.2	-170.8	68.1	0	0	0	111.5	A240 F241 S242 S247 A248	A240-L244 PolarHBondContact O-N 2.98Å; F241-L244 PolarHBondContact O-N 3.15Å; S242-L244 VanDerWaalsContact C-N 3.35Å; L244-S247 WeakPolarHBondContact O-CB 3.4Å; L244-S247 PolarHBondContact O-N 3.02Å; L244-A248 WeakPolarHBondContact O-CB 3.35Å; L244-A248 PolarHBondContact O-N 3.35Å
245	M	52.8	Low	52.6	Low	111 Å²	111	88 Å²	88	55%	0.547	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-40.3	175.1	-76.8	-65	-65.7	0	0	112.7	F241 S242 A248 S249	F241-M245 HydrophobicContact CD1-CG 4.08Å; F241-M245 HydrophobicContact CE1-CG 3.91Å; F241-M245 HydrophobicContact CE1-SD 4.45Å; F241-M245 WeakPolarHBondContact O-CB 3.28Å; F241-M245 WeakPolarHBondContact O-CG 3.49Å; F241-M245 PolarHBondContact O-N 2.98Å; S242-M245 PolarHBondContact O-N 3.13Å; M245-A248 PolarHBondContact O-N 2.66Å; M245-S249 PolarHBondContact O-N 3.18Å; M245-S249 PolarHBondContact O-OG 3.24Å
246	N	53.8	Low	53	Low	97 Å²	97	90.7 Å²	90.7	52%	0.519	52%	0.516	S	S	.	.	H	α-helix	trans	-68.8	-34.2	174.5	-72.3	-23.5	0	0	0	112.2	S242 S249 V250	S242-N246 WeakPolarHBondContact O-CB 3.34Å; S242-N246 VanDerWaalsContact O-CG 3.28Å; S242-N246 PolarHBondContact O-N 3.3Å; S242-N246 PolarHBondContact O-ND2 3.13Å; N246-S249 WeakPolarHBondContact CA-OG 3.41Å; N246-S249 PolarHBondContact O-OG 2.92Å; N246-S249 VanDerWaalsContact O-OG 3.05Å; N246-V250 WeakPolarHBondContact O-CG2 3.3Å; N246-V250 PolarHBondContact O-N 2.83Å; N246-V250 VanDerWaalsContact O-N 3.1Å
247	S	54.1	Low	53.1	Low	65 Å²	65	89.6 Å²	89.6	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-66.4	-41.7	171.9	-56.9	0	0	0	0	111.1	N243 L244 M251	N243-S247 WeakPolarHBondContact O-CB 3.16Å; N243-S247 PolarHBondContact O-N 3.2Å; N243-S247 PolarHBondContact O-OG 3Å; L244-S247 WeakPolarHBondContact O-CB 3.4Å; L244-S247 PolarHBondContact O-N 3.02Å; S247-M251 WeakPolarHBondContact O-CG 3.44Å; S247-M251 PolarHBondContact O-N 2.76Å
248	A	50.5	Low	53	Low	45 Å²	45	91.8 Å²	91.8	37%	0.372	52%	0.518	S	S	.	.	H	α-helix	trans	-65.9	-39.6	176.1	0	0	0	0	0	112.6	L244 M245 M251 A252	L244-A248 WeakPolarHBondContact O-CB 3.35Å; L244-A248 PolarHBondContact O-N 3.35Å; M245-A248 PolarHBondContact O-N 2.66Å; A248-M251 PolarHBondContact O-N 3.43Å; A248-A252 WeakPolarHBondContact O-CB 3.26Å; A248-A252 PolarHBondContact O-N 2.88Å
249	S	51	Low	53.1	Low	62 Å²	62	92.3 Å²	92.3	43%	0.434	52%	0.518	S	S	.	.	H	α-helix	trans	-69.1	-37.6	177.8	70.1	0	0	0	0	112.4	M245 N246 A252 A253	M245-S249 PolarHBondContact O-N 3.18Å; M245-S249 PolarHBondContact O-OG 3.24Å; N246-S249 WeakPolarHBondContact CA-OG 3.41Å; N246-S249 PolarHBondContact O-OG 2.92Å; N246-S249 VanDerWaalsContact O-OG 3.05Å; S249-A252 PolarHBondContact O-N 3.25Å; S249-A253 WeakPolarHBondContact O-CB 3.23Å; S249-A253 PolarHBondContact O-N 2.79Å
250	V	59.6	Low	52.9	Low	99 Å²	99	96.4 Å²	96.4	60%	0.6	53%	0.532	S	S	*	.	H	α-helix	trans	-64.5	-42.3	171.6	170.8	0	0	0	0	111.3	N246 A253 H254	N246-V250 WeakPolarHBondContact O-CG2 3.3Å; N246-V250 PolarHBondContact O-N 2.83Å; N246-V250 VanDerWaalsContact O-N 3.1Å; V250-A253 PolarHBondContact O-N 2.95Å; V250-H254 WeakPolarHBondContact O-CB 3.34Å; V250-H254 PolarHBondContact O-N 3.47Å
251	M	52.2	Low	52.6	Low	131 Å²	131	100.1 Å²	100.1	65%	0.645	54%	0.538	S	S	*	.	H	α-helix	trans	-64.5	-40.9	173.6	-72.8	-168.9	-64.3	0	0	112.5	S247 A248 H254 A255	S247-M251 WeakPolarHBondContact O-CG 3.44Å; S247-M251 PolarHBondContact O-N 2.76Å; A248-M251 PolarHBondContact O-N 3.43Å; M251-H254 PolarHBondContact O-N 2.83Å; M251-A255 WeakPolarHBondContact O-CB 3.43Å; M251-A255 PolarHBondContact O-N 3Å
252	A	56.6	Low	52.6	Low	49 Å²	49	99.9 Å²	99.9	41%	0.405	54%	0.542	S	S	.	.	H	α-helix	trans	-63.9	-42	176	0	0	0	0	0	111.9	A248 S249 H254 A255 H256	A248-A252 WeakPolarHBondContact O-CB 3.26Å; A248-A252 PolarHBondContact O-N 2.88Å; S249-A252 PolarHBondContact O-N 3.25Å; A252-H254 VanDerWaalsContact C-N 3.33Å; A252-H254 PolarHBondContact O-N 3.15Å; A252-A255 PolarHBondContact O-N 2.91Å; A252-H256 PolarHBondContact O-CD2 2.73Å; A252-H256 PolarHBondContact O-N 2.9Å
253	A	54.8	Low	52.2	Low	62 Å²	62	100.7 Å²	100.7	51%	0.512	55%	0.545	S	S	.	.	H	α-helix	trans	-62.3	-40.3	172.8	0	0	0	0	0	111.7	S249 V250 H256 R257	S249-A253 WeakPolarHBondContact O-CB 3.23Å; S249-A253 PolarHBondContact O-N 2.79Å; V250-A253 PolarHBondContact O-N 2.95Å; A253-H256 PolarHBondContact O-N 3.36Å; A253-R257 WeakPolarHBondContact O-CB 3.35Å; A253-R257 PolarHBondContact O-N 3.41Å
254	H	51.6	Low	52	Low	117 Å²	117	99.5 Å²	99.5	54%	0.542	55%	0.546	S	S	.	.	H	α-helix	trans	-70.8	-29.8	177.3	-152.3	-41.4	0	0	0	112.9	V250 M251 A252 K258	V250-H254 WeakPolarHBondContact O-CB 3.34Å; V250-H254 PolarHBondContact O-N 3.47Å; M251-H254 PolarHBondContact O-N 2.83Å; A252-H254 VanDerWaalsContact C-N 3.33Å; A252-H254 PolarHBondContact O-N 3.15Å; H254-K258 PolarHBondContact O-N 3.29Å
255	A	51.7	Low	52	Low	52 Å²	52	99.3 Å²	99.3	43%	0.43	55%	0.554	S	S	.	*	H	α-helix	trans	-70.7	-49.4	171	0	0	0	0	0	111.4	M251 A252 R257 K258 V259	M251-A255 WeakPolarHBondContact O-CB 3.43Å; M251-A255 PolarHBondContact O-N 3Å; A252-A255 PolarHBondContact O-N 2.91Å; A255-R257 VanDerWaalsContact C-N 3.28Å; A255-R257 PolarHBondContact O-N 3.21Å; A255-K258 WeakPolarHBondContact O-CA 3.47Å; A255-K258 WeakPolarHBondContact O-CB 3.17Å; A255-K258 PolarHBondContact O-N 3.06Å; A255-V259 WeakPolarHBondContact O-CG2 3.29Å; A255-V259 PolarHBondContact O-N 3.46Å
256	H	53.5	Low	52.2	Low	131 Å²	131	96.8 Å²	96.8	61%	0.606	55%	0.545	S	S	*	.	H	α-helix	trans	-56.3	-41.6	173.6	-93.9	-88.8	0	0	0	112.1	A252 A253 K258 V259 L260	A252-H256 PolarHBondContact O-CD2 2.73Å; A252-H256 PolarHBondContact O-N 2.9Å; A253-H256 PolarHBondContact O-N 3.36Å; H256-K258 VanDerWaalsContact C-N 3.31Å; H256-K258 PolarHBondContact O-N 3.5Å; H256-V259 PolarHBondContact O-N 3.48Å; H256-L260 WeakPolarHBondContact O-CB 3.29Å; H256-L260 PolarHBondContact O-N 3.02Å
257	R	51.8	Low	52.6	Low	187 Å²	187	102 Å²	102	71%	0.706	56%	0.557	S	S	*	*	H	α-helix	trans	-62.6	-34.7	175.5	-170.3	173	178.6	178.4	-0.6	112.5	A253 A255 H261	A253-R257 WeakPolarHBondContact O-CB 3.35Å; A253-R257 PolarHBondContact O-N 3.41Å; A255-R257 VanDerWaalsContact C-N 3.28Å; A255-R257 PolarHBondContact O-N 3.21Å; R257-H261 WeakPolarHBondContact O-CB 3.33Å; R257-H261 PolarHBondContact O-N 3.09Å
258	K	50.6	Low	53	Low	142 Å²	142	103.7 Å²	103.7	62%	0.617	56%	0.561	S	S	*	*	H	α-helix	trans	-72.4	-41.4	172.1	-86.5	-176	171.5	180	0	112.8	H254 A255 H256 H261 L262	H254-K258 PolarHBondContact O-N 3.29Å; A255-K258 WeakPolarHBondContact O-CA 3.47Å; A255-K258 WeakPolarHBondContact O-CB 3.17Å; A255-K258 PolarHBondContact O-N 3.06Å; H256-K258 VanDerWaalsContact C-N 3.31Å; H256-K258 PolarHBondContact O-N 3.5Å; K258-H261 WeakPolarHBondContact O-CB 3.31Å; K258-H261 PolarHBondContact O-N 3.02Å; K258-L262 PolarHBondContact O-N 3.3Å; K258-L262 VanDerWaalsContact O-N 3.11Å
259	V	51.3	Low	53.4	Low	85 Å²	85	111.4 Å²	111.4	52%	0.515	58%	0.58	S	S	.	*	H	α-helix	trans	-63.3	-44	177.2	173.1	0	0	0	0	111.1	A255 H256 H261 L262 T263	A255-V259 WeakPolarHBondContact O-CG2 3.29Å; A255-V259 PolarHBondContact O-N 3.46Å; H256-V259 PolarHBondContact O-N 3.48Å; V259-H261 VanDerWaalsContact C-N 3.27Å; V259-H261 PolarHBondContact O-N 3.04Å; V259-L262 WeakPolarHBondContact O-CB 3.39Å; V259-L262 PolarHBondContact O-N 3.42Å; V259-T263 PolarHBondContact O-N 2.93Å; V259-T263 PolarHBondContact O-OG1 3.32Å
260	L	50.4	Low	54.3	Low	114 Å²	114	112.1 Å²	112.1	60%	0.597	58%	0.582	S	S	*	*	H	α-helix	trans	-59.4	-38.4	173.4	-82.8	160.6	0	0	0	112.1	H256 L262 T263 S264	H256-L260 WeakPolarHBondContact O-CB 3.29Å; H256-L260 PolarHBondContact O-N 3.02Å; L260-L262 VanDerWaalsContact C-N 3.26Å; L260-L262 PolarHBondContact O-N 2.9Å; L260-T263 WeakPolarHBondContact CA-OG1 3.25Å; L260-T263 PolarHBondContact O-N 2.59Å; L260-T263 PolarHBondContact O-OG1 2.91Å; L260-S264 PolarHBondContact O-N 3.37Å; L260-S264 VanDerWaalsContact O-N 3.13Å
261	H	47.3	Very low	54.7	Low	142 Å²	142	111.4 Å²	111.4	66%	0.657	57%	0.571	S	S	*	*	H	α-helix	trans	-70.2	-17.2	175.9	-127.9	-71	0	0	0	114.7	R257 K258 V259 S264	R257-H261 WeakPolarHBondContact O-CB 3.33Å; R257-H261 PolarHBondContact O-N 3.09Å; K258-H261 WeakPolarHBondContact O-CB 3.31Å; K258-H261 PolarHBondContact O-N 3.02Å; V259-H261 VanDerWaalsContact C-N 3.27Å; V259-H261 PolarHBondContact O-N 3.04Å; H261-S264 PolarHBondContact O-OG 3.05Å
262	L	46.4	Very low	55.8	Low	130 Å²	130	112.2 Å²	112.2	68%	0.681	57%	0.571	S	S	*	*	H	α-helix	trans	-87.3	-34.4	170.6	-77.9	158.1	0	0	0	111.4	K258 V259 L260 S264	K258-L262 PolarHBondContact O-N 3.3Å; K258-L262 VanDerWaalsContact O-N 3.11Å; V259-L262 WeakPolarHBondContact O-CB 3.39Å; V259-L262 PolarHBondContact O-N 3.42Å; L260-L262 VanDerWaalsContact C-N 3.26Å; L260-L262 PolarHBondContact O-N 2.9Å; L262-S264 VanDerWaalsContact C-N 3.34Å; L262-S264 PolarHBondContact O-N 3.41Å
263	T	47.3	Very low	56.9	Low	69 Å²	69	112.5 Å²	112.5	42%	0.423	57%	0.573	S	S	.	*	H	α-helix	trans	-77.7	-14.3	177.8	57.6	0	0	0	0	115	V259 L260 K271	V259-T263 PolarHBondContact O-N 2.93Å; V259-T263 PolarHBondContact O-OG1 3.32Å; L260-T263 WeakPolarHBondContact CA-OG1 3.25Å; L260-T263 PolarHBondContact O-N 2.59Å; L260-T263 PolarHBondContact O-OG1 2.91Å; T263-K271 WeakPolarHBondContact O-CE 3.46Å; T263-K271 PolarHBondContact O-NZ 2.88Å
264	S	49.3	Very low	58.2	Low	84 Å²	84	115.7 Å²	115.7	59%	0.587	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-27.1	177	59.8	0	0	0	0	113.6	L260 H261 L262 V266	L260-S264 PolarHBondContact O-N 3.37Å; L260-S264 VanDerWaalsContact O-N 3.13Å; H261-S264 PolarHBondContact O-OG 3.05Å; L262-S264 VanDerWaalsContact C-N 3.34Å; L262-S264 PolarHBondContact O-N 3.41Å; S264-V266 VanDerWaalsContact C-N 3.35Å; S264-V266 PolarHBondContact O-N 3.43Å
265	S	56.1	Low	59.8	Low	111 Å²	111	116.3 Å²	116.3	78%	0.776	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	31.5	-177.2	-149.7	0	0	0	0	113.8
266	V	56.3	Low	61.5	Low	59 Å²	59	119.2 Å²	119.2	36%	0.358	60%	0.595	S	S	.	*	S	Bend	trans	-131	99.6	-178.6	-176.9	0	0	0	0	109.6	S264 D268 T270 K271	S264-V266 VanDerWaalsContact C-N 3.35Å; S264-V266 PolarHBondContact O-N 3.43Å; V266-D268 PolarHBondContact O-N 3.27Å; V266-T270 WeakPolarHBondContact CG1-OG1 3.42Å; V266-K271 HydrophobicContact CG1-CG 4.02Å; V266-K271 VanDerWaalsContact O-CE 3.22Å; V266-K271 WeakPolarHBondContact O-CE 3.47Å; V266-K271 PolarHBondContact O-NZ 2.91Å; V266-K271 VanDerWaalsContact O-NZ 3.08Å
267	R	62.8	Low	63.1	Low	206 Å²	206	115.7 Å²	115.7	78%	0.777	59%	0.589	S	S	*	*			trans	-57.4	123.6	-176	-177.4	170.3	69.3	178.9	1.4	111.4	R269 T270	R267-R269 PolarHBondContact O-N 2.84Å; R267-T270 PolarHBondContact O-N 2.86Å; R267-T270 PolarHBondContact O-OG1 2.86Å
268	D	61.1	Low	64.7	Low	100 Å²	100	111.8 Å²	111.8	54%	0.535	58%	0.581	S	S	.	*	H	α-helix	trans	-48.3	-25.7	-163.7	-69.4	-27.4	0	0	0	117.8	V266 T270 K271 K272	V266-D268 PolarHBondContact O-N 3.27Å; D268-T270 VanDerWaalsContact C-N 3.25Å; D268-T270 PolarHBondContact O-N 3.21Å; D268-K271 PolarHBondContact O-N 2.97Å; D268-K271 IonicContact OD1-NZ 3.29Å; D268-K272 WeakPolarHBondContact O-CG 3.49Å; D268-K272 PolarHBondContact O-N 3.26Å
269	R	59.7	Low	66.7	Low	207 Å²	207	109.8 Å²	109.8	78%	0.781	58%	0.577	S	S	*	*	H	α-helix	trans	-56.2	-37.6	172.5	-65.1	-172.3	-178.5	-174.3	0.6	112.4	R267 A273	R267-R269 PolarHBondContact O-N 2.84Å; R269-A273 WeakPolarHBondContact O-CB 3.32Å; R269-A273 PolarHBondContact O-N 2.88Å
270	T	69.8	Low	68.6	Low	78 Å²	78	110.7 Å²	110.7	48%	0.479	58%	0.578	S	S	.	*	H	α-helix	trans	-78.8	-31.7	178.4	54.7	0	0	0	0	112.9	V266 R267 D268 A273 L274	V266-T270 WeakPolarHBondContact CG1-OG1 3.42Å; R267-T270 PolarHBondContact O-N 2.86Å; R267-T270 PolarHBondContact O-OG1 2.86Å; D268-T270 VanDerWaalsContact C-N 3.25Å; D268-T270 PolarHBondContact O-N 3.21Å; T270-A273 PolarHBondContact O-N 3.03Å; T270-L274 WeakPolarHBondContact O-CB 3.36Å; T270-L274 PolarHBondContact O-N 3.24Å
271	K	68.9	Low	70.6	Confident	84 Å²	84	110.5 Å²	110.5	37%	0.365	58%	0.577	S	S	.	*	H	α-helix	trans	-61	-45.7	169.5	-67.7	174.2	178.6	149.2	0	110.9	T263 V266 D268 L274 L275	T263-K271 WeakPolarHBondContact O-CE 3.46Å; T263-K271 PolarHBondContact O-NZ 2.88Å; V266-K271 HydrophobicContact CG1-CG 4.02Å; V266-K271 VanDerWaalsContact O-CE 3.22Å; V266-K271 WeakPolarHBondContact O-CE 3.47Å; V266-K271 PolarHBondContact O-NZ 2.91Å; V266-K271 VanDerWaalsContact O-NZ 3.08Å; D268-K271 PolarHBondContact O-N 2.97Å; D268-K271 IonicContact OD1-NZ 3.29Å; K271-L274 PolarHBondContact O-N 2.92Å; K271-L275 PolarHBondContact O-N 2.95Å
272	K	75.4	Confident	72.5	Confident	148 Å²	148	108 Å²	108	64%	0.643	57%	0.568	S	S	*	*	H	α-helix	trans	-65.3	-39.9	176	-68.6	179.3	-178.8	-174.4	0	112.2	D268 L275 L276	D268-K272 WeakPolarHBondContact O-CG 3.49Å; D268-K272 PolarHBondContact O-N 3.26Å; K272-L275 PolarHBondContact O-N 2.55Å; K272-L276 WeakPolarHBondContact O-CB 3.43Å; K272-L276 WeakPolarHBondContact O-CG 3.45Å; K272-L276 PolarHBondContact O-N 2.99Å
273	A	79.5	Confident	74.6	Confident	54 Å²	54	105.8 Å²	105.8	45%	0.446	56%	0.556	S	S	.	*	H	α-helix	trans	-64.1	-42.2	174.6	0	0	0	0	0	112.8	R269 T270 L276 A277	R269-A273 WeakPolarHBondContact O-CB 3.32Å; R269-A273 PolarHBondContact O-N 2.88Å; T270-A273 PolarHBondContact O-N 3.03Å; A273-L276 PolarHBondContact O-N 2.78Å; A273-A277 WeakPolarHBondContact O-CB 3.41Å; A273-A277 PolarHBondContact O-N 2.79Å
274	L	81.9	Confident	76.7	Confident	129 Å²	129	107.6 Å²	107.6	68%	0.675	56%	0.562	S	S	*	*	H	α-helix	trans	-64.6	-41.1	176.5	-174.4	66.4	0	0	0	111.7	T270 K271 A277 L278	T270-L274 WeakPolarHBondContact O-CB 3.36Å; T270-L274 PolarHBondContact O-N 3.24Å; K271-L274 PolarHBondContact O-N 2.92Å; L274-A277 PolarHBondContact O-N 2.86Å; L274-L278 PolarHBondContact O-N 2.78Å
275	L	84.8	Confident	78.5	Confident	130 Å²	130	108.5 Å²	108.5	68%	0.681	56%	0.56	S	S	*	*	H	α-helix	trans	-65.8	-40.5	176.6	-155.4	79.4	0	0	0	111.9	K271 K272 L278 L279	K271-L275 PolarHBondContact O-N 2.95Å; K272-L275 PolarHBondContact O-N 2.55Å; L275-L278 PolarHBondContact O-N 2.85Å; L275-L279 WeakPolarHBondContact O-CB 3.44Å; L275-L279 PolarHBondContact O-N 3.18Å
276	L	87.6	Confident	79.9	Confident	114 Å²	114	106.2 Å²	106.2	60%	0.597	54%	0.543	S	S	*	.	H	α-helix	trans	-64.4	-42.5	173.8	-80.4	165.8	0	0	0	112	K272 A273 L278 L279 L280	K272-L276 WeakPolarHBondContact O-CB 3.43Å; K272-L276 WeakPolarHBondContact O-CG 3.45Å; K272-L276 PolarHBondContact O-N 2.99Å; A273-L276 PolarHBondContact O-N 2.78Å; L276-L278 VanDerWaalsContact C-N 3.35Å; L276-L278 PolarHBondContact O-N 3.3Å; L276-L279 PolarHBondContact O-N 3.02Å; L276-L280 WeakPolarHBondContact O-CB 3.39Å; L276-L280 PolarHBondContact O-N 2.91Å
277	A	85.9	Confident	81.3	Confident	56 Å²	56	107.6 Å²	107.6	46%	0.463	55%	0.548	S	S	.	.	H	α-helix	trans	-62.7	-40.9	176.2	0	0	0	0	0	112	A273 L274 L280 L281	A273-A277 WeakPolarHBondContact O-CB 3.41Å; A273-A277 PolarHBondContact O-N 2.79Å; L274-A277 PolarHBondContact O-N 2.86Å; A277-L280 PolarHBondContact O-N 2.85Å; A277-L281 WeakPolarHBondContact O-CB 3.49Å; A277-L281 PolarHBondContact O-N 3.07Å
278	L	87.4	Confident	82.2	Confident	105 Å²	105	107.4 Å²	107.4	55%	0.55	55%	0.547	S	S	.	.	H	α-helix	trans	-62.6	-44.2	174.2	-164	81.4	0	0	0	111.5	L274 L275 L276 L281 I282	L274-L278 PolarHBondContact O-N 2.78Å; L275-L278 PolarHBondContact O-N 2.85Å; L276-L278 VanDerWaalsContact C-N 3.35Å; L276-L278 PolarHBondContact O-N 3.3Å; L278-L281 PolarHBondContact O-N 2.95Å; L278-I282 HydrophobicContact CG-CD1 4.32Å; L278-I282 WeakPolarHBondContact O-CG1 3.47Å; L278-I282 PolarHBondContact O-N 3.45Å
279	L	90.9	Very high	83	Confident	100 Å²	100	107.6 Å²	107.6	52%	0.524	55%	0.547	S	S	.	.	H	α-helix	trans	-62	-43.1	177.1	-162.8	85.2	0	0	0	111.7	L275 L276 I282 I283	L275-L279 WeakPolarHBondContact O-CB 3.44Å; L275-L279 PolarHBondContact O-N 3.18Å; L276-L279 PolarHBondContact O-N 3.02Å; L279-I282 PolarHBondContact O-N 2.96Å; L279-I283 HydrophobicContact CD2-CD1 4.26Å; L279-I283 HydrophobicContact CG-CD1 4.15Å; L279-I283 VanDerWaalsContact O-CG1 3.29Å; L279-I283 WeakPolarHBondContact O-CG1 3.47Å; L279-I283 PolarHBondContact O-N 2.64Å
280	L	91.8	Very high	83.6	Confident	105 Å²	105	102.7 Å²	102.7	55%	0.55	54%	0.536	S	S	.	.	H	α-helix	trans	-63.1	-41.1	177.6	-124.5	164.5	0	0	0	111.7	L276 A277 I283 L284	L276-L280 WeakPolarHBondContact O-CB 3.39Å; L276-L280 PolarHBondContact O-N 2.91Å; A277-L280 PolarHBondContact O-N 2.85Å; L280-I283 PolarHBondContact O-N 2.76Å; L280-L284 HydrophobicContact CD2-CD1 4.22Å; L280-L284 HydrophobicContact CD2-CG 4.38Å; L280-L284 WeakPolarHBondContact O-CG 3.4Å; L280-L284 PolarHBondContact O-N 3.1Å
281	L	91.7	Very high	83.6	Confident	109 Å²	109	103.4 Å²	103.4	57%	0.571	54%	0.537	S	S	*	.	H	α-helix	trans	-65.1	-40.7	176.3	-168.3	153	0	0	0	111.6	A277 L278 L284 L285	A277-L281 WeakPolarHBondContact O-CB 3.49Å; A277-L281 PolarHBondContact O-N 3.07Å; L278-L281 PolarHBondContact O-N 2.95Å; L281-L284 PolarHBondContact O-N 2.91Å; L281-L285 WeakPolarHBondContact O-CB 3.25Å; L281-L285 PolarHBondContact O-N 2.79Å
282	I	87.9	Confident	83.5	Confident	89 Å²	89	103.1 Å²	103.1	46%	0.456	54%	0.543	S	S	.	.	H	α-helix	trans	-62.4	-45.7	173.3	-68.1	163.2	0	0	0	110.9	L278 L279 L284 L285 C286	L278-I282 HydrophobicContact CG-CD1 4.32Å; L278-I282 WeakPolarHBondContact O-CG1 3.47Å; L278-I282 PolarHBondContact O-N 3.45Å; L279-I282 PolarHBondContact O-N 2.96Å; I282-L284 PolarHBondContact O-N 3.26Å; I282-L285 PolarHBondContact O-N 3.06Å; I282-C286 PolarHBondContact O-N 2.8Å; I282-C286 PolarHBondContact O-SG 2.72Å; I282-C286 VanDerWaalsContact O-SG 3.33Å
283	I	90.8	Very high	82.8	Confident	85 Å²	85	103.4 Å²	103.4	44%	0.436	55%	0.545	S	S	.	.	H	α-helix	trans	-61.5	-44.8	178.9	-70.4	163.2	0	0	0	111.2	L279 L280 L285 C286 I287	L279-I283 HydrophobicContact CD2-CD1 4.26Å; L279-I283 HydrophobicContact CG-CD1 4.15Å; L279-I283 VanDerWaalsContact O-CG1 3.29Å; L279-I283 WeakPolarHBondContact O-CG1 3.47Å; L279-I283 PolarHBondContact O-N 2.64Å; L280-I283 PolarHBondContact O-N 2.76Å; I283-L285 VanDerWaalsContact C-N 3.33Å; I283-L285 PolarHBondContact O-N 3.39Å; I283-C286 PolarHBondContact O-N 3.4Å; I283-I287 HydrophobicContact CG2-CD1 3.87Å; I283-I287 WeakPolarHBondContact O-CG1 3.32Å; I283-I287 PolarHBondContact O-N 2.91Å
284	L	90.9	Very high	81.8	Confident	107 Å²	107	106.6 Å²	106.6	56%	0.56	55%	0.554	S	S	*	*	H	α-helix	trans	-60.7	-41.4	175.8	-74	167.2	0	0	0	112	L280 L281 I282 I287 W288	L280-L284 HydrophobicContact CD2-CD1 4.22Å; L280-L284 HydrophobicContact CD2-CG 4.38Å; L280-L284 WeakPolarHBondContact O-CG 3.4Å; L280-L284 PolarHBondContact O-N 3.1Å; L281-L284 PolarHBondContact O-N 2.91Å; I282-L284 PolarHBondContact O-N 3.26Å; L284-I287 PolarHBondContact O-N 3.41Å; L284-W288 WeakPolarHBondContact O-CB 3.28Å; L284-W288 PolarHBondContact O-N 3.32Å
285	L	87.8	Confident	80.4	Confident	102 Å²	102	104.7 Å²	104.7	53%	0.534	55%	0.548	S	S	.	.	H	α-helix	trans	-68.5	-36.8	178.6	-164	145.6	0	0	0	112	L281 I282 I283 W288 L289	L281-L285 WeakPolarHBondContact O-CB 3.25Å; L281-L285 PolarHBondContact O-N 2.79Å; I282-L285 PolarHBondContact O-N 3.06Å; I283-L285 VanDerWaalsContact C-N 3.33Å; I283-L285 PolarHBondContact O-N 3.39Å; L285-W288 PolarHBondContact O-N 3.41Å; L285-L289 HydrophobicContact CD2-CD1 4.31Å; L285-L289 PolarHBondContact O-N 3.48Å
286	C	84.4	Confident	78.9	Confident	63 Å²	63	103 Å²	103	43%	0.426	55%	0.546	S	S	.	.	H	α-helix	trans	-64.3	-42.7	170.8	-69.9	0	0	0	0	112.5	I282 I283 W288 L289 L290	I282-C286 PolarHBondContact O-N 2.8Å; I282-C286 PolarHBondContact O-SG 2.72Å; I282-C286 VanDerWaalsContact O-SG 3.33Å; I283-C286 PolarHBondContact O-N 3.4Å; C286-W288 VanDerWaalsContact C-N 3.34Å; C286-L289 PolarHBondContact O-N 2.71Å; C286-L290 WeakPolarHBondContact O-CB 3.36Å; C286-L290 VanDerWaalsContact O-CG 3.28Å; C286-L290 WeakPolarHBondContact O-CG 3.33Å; C286-L290 PolarHBondContact O-N 3.35Å; C286-L290 VanDerWaalsContact O-N 3.08Å
287	I	86.8	Confident	77.1	Confident	88 Å²	88	106.3 Å²	106.3	45%	0.451	56%	0.556	S	S	.	*	H	α-helix	trans	-61.9	-44	176	-69.8	164.8	0	0	0	110.3	I283 L284 L289 L290 L291	I283-I287 HydrophobicContact CG2-CD1 3.87Å; I283-I287 WeakPolarHBondContact O-CG1 3.32Å; I283-I287 PolarHBondContact O-N 2.91Å; L284-I287 PolarHBondContact O-N 3.41Å; I287-L289 VanDerWaalsContact C-N 3.32Å; I287-L289 PolarHBondContact O-N 2.87Å; I287-L290 PolarHBondContact O-N 3.42Å; I287-L291 HydrophobicContact CG2-CD1 3.97Å; I287-L291 HydrophobicContact CG2-CG 4.35Å; I287-L291 WeakPolarHBondContact O-CG 3.05Å; I287-L291 PolarHBondContact O-N 3.05Å
288	W	80.9	Confident	75.3	Confident	202 Å²	202	109.1 Å²	109.1	77%	0.765	57%	0.568	S	S	*	*	H	α-helix	trans	-62.8	-36.3	177.5	-159.4	80.8	0	0	0	112.7	L284 L285 C286 P292	L284-W288 WeakPolarHBondContact O-CB 3.28Å; L284-W288 PolarHBondContact O-N 3.32Å; L285-W288 PolarHBondContact O-N 3.41Å; C286-W288 VanDerWaalsContact C-N 3.34Å; W288-P292 VanDerWaalsContact O-CD 3.29Å; W288-P292 WeakPolarHBondContact O-CD 3.21Å
289	L	78.9	Confident	73.4	Confident	104 Å²	104	110.5 Å²	110.5	55%	0.545	58%	0.58	S	S	.	*	H	α-helix	trans	-69	-31.9	173.9	-119.9	79.5	0	0	0	113.9	L285 C286 I287 P292	L285-L289 HydrophobicContact CD2-CD1 4.31Å; L285-L289 PolarHBondContact O-N 3.48Å; C286-L289 PolarHBondContact O-N 2.71Å; I287-L289 VanDerWaalsContact C-N 3.32Å; I287-L289 PolarHBondContact O-N 2.87Å; L289-P292 WeakPolarHBondContact O-CG 3.48Å
290	L	72.6	Confident	71.2	Confident	105 Å²	105	116.9 Å²	116.9	55%	0.55	60%	0.597	S	S	.	*	H	α-helix	trans	-92.3	-26.8	-173	-69.2	170.6	0	0	0	113.7	C286 I287 F293 L294	C286-L290 WeakPolarHBondContact O-CB 3.36Å; C286-L290 VanDerWaalsContact O-CG 3.28Å; C286-L290 WeakPolarHBondContact O-CG 3.33Å; C286-L290 PolarHBondContact O-N 3.35Å; C286-L290 VanDerWaalsContact O-N 3.08Å; I287-L290 PolarHBondContact O-N 3.42Å; L290-F293 PolarHBondContact O-N 3.04Å; L290-F293 VanDerWaalsContact O-N 3.08Å; L290-L294 PolarHBondContact O-N 3.25Å
291	L	69.4	Low	68.8	Low	93 Å²	93	118 Å²	118	49%	0.487	61%	0.609	S	S	.	*	H	α-helix	trans	-47.1	-49.8	173.4	-86.1	162.5	0	0	0	114.5	I287 F293 L294 T295	I287-L291 HydrophobicContact CG2-CD1 3.97Å; I287-L291 HydrophobicContact CG2-CG 4.35Å; I287-L291 WeakPolarHBondContact O-CG 3.05Å; I287-L291 PolarHBondContact O-N 3.05Å; L291-F293 VanDerWaalsContact C-N 3.27Å; L291-F293 PolarHBondContact O-N 2.92Å; L291-L294 PolarHBondContact O-N 3.06Å; L291-T295 PolarHBondContact O-N 3.45Å; L291-T295 PolarHBondContact O-OG1 2.89Å
292	P	65.4	Low	66.1	Low	77 Å²	77	122 Å²	122	50%	0.5	62%	0.624	S	S	.	*	H	α-helix	trans	-67.5	-21.9	179.8	25.8	-35.3	0	0	0	114.4	W288 L289 T295	W288-P292 VanDerWaalsContact O-CD 3.29Å; W288-P292 WeakPolarHBondContact O-CD 3.21Å; L289-P292 WeakPolarHBondContact O-CG 3.48Å; P292-T295 PolarHBondContact O-OG1 3.14Å
293	F	61.4	Low	63.9	Low	154 Å²	154	123 Å²	123	68%	0.675	64%	0.637	S	S	*	*	H	α-helix	trans	-76.3	-35.1	174	-80.5	-86.6	0	0	0	112.2	L290 L291	L290-F293 PolarHBondContact O-N 3.04Å; L290-F293 VanDerWaalsContact O-N 3.08Å; L291-F293 VanDerWaalsContact C-N 3.27Å; L291-F293 PolarHBondContact O-N 2.92Å
294	L	57.6	Low	61.1	Low	121 Å²	121	125.8 Å²	125.8	63%	0.634	65%	0.648	S	S	*	*	H	α-helix	trans	-72.1	-40.1	179.8	-66.7	172.2	0	0	0	112.2	L290 L291 S296 F297	L290-L294 PolarHBondContact O-N 3.25Å; L291-L294 PolarHBondContact O-N 3.06Å; L294-S296 VanDerWaalsContact C-N 3.26Å; L294-S296 PolarHBondContact O-N 3.04Å; L294-F297 PolarHBondContact O-N 2.99Å
295	T	53.3	Low	58.4	Low	90 Å²	90	128 Å²	128	55%	0.552	66%	0.659	S	S	*	*	H	α-helix	trans	-63.5	-32.2	177.8	48.7	0	0	0	0	112.8	L291 P292 F297 V298	L291-T295 PolarHBondContact O-N 3.45Å; L291-T295 PolarHBondContact O-OG1 2.89Å; P292-T295 PolarHBondContact O-OG1 3.14Å; T295-F297 PolarHBondContact O-N 3.5Å; T295-V298 PolarHBondContact O-N 2.76Å
296	S	53.7	Low	55.9	Low	93 Å²	93	132.3 Å²	132.3	65%	0.65	67%	0.668	S	S	*	*	H	α-helix	trans	-68.5	-17.1	-178.5	-165.1	0	0	0	0	114.2	L294	L294-S296 VanDerWaalsContact C-N 3.26Å; L294-S296 PolarHBondContact O-N 3.04Å
297	F	48.9	Very low	53.6	Low	184 Å²	184	135.6 Å²	135.6	81%	0.807	69%	0.689	S	S	*	*	H	α-helix	trans	-86.7	-22.9	179.9	-99.4	-89.3	0	0	0	114.2	L294 T295	L294-F297 PolarHBondContact O-N 2.99Å; T295-F297 PolarHBondContact O-N 3.5Å
298	V	49.8	Very low	50.9	Low	116 Å²	116	135.8 Å²	135.8	70%	0.703	70%	0.698	S	S	*	*	H	α-helix	trans	-84.8	-21.1	-167.9	-178.2	0	0	0	0	113.2	T295 R300	T295-V298 PolarHBondContact O-N 2.76Å; V298-R300 VanDerWaalsContact C-N 3.33Å; V298-R300 PolarHBondContact O-N 2.82Å
299	V	45.6	Very low	48.9	Very low	133 Å²	133	132.4 Å²	132.4	81%	0.806	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-2.7	-168.2	-174.6	0	0	0	0	113.8
300	R	44.6	Very low	46.8	Very low	234 Å²	234	136 Å²	136	88%	0.883	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	25.7	-166	-143.7	-177.1	-177.2	163.7	3.8	117.4	V298	V298-R300 VanDerWaalsContact C-N 3.33Å; V298-R300 PolarHBondContact O-N 2.82Å
301	T	42.8	Very low	45.1	Very low	130 Å²	130	139.5 Å²	139.5	80%	0.798	72%	0.724	S	S	*	*			trans	-139.9	92.3	172.1	53.2	0	0	0	0	113.4
302	Q	35	Very low	43.3	Very low	191 Å²	191	142.1 Å²	142.1	89%	0.893	74%	0.744	S	S	*	*			trans	-151.2	112.3	160.4	-164.4	173.2	18.7	0	0	110.6
303	P	40.8	Very low	42.3	Very low	111 Å²	111	144 Å²	144	72%	0.721	76%	0.755	S	S	*	*			trans	-87.3	142.4	170	33.3	-31.2	0	0	0	111.5
304	E	31.8	Very low	41.8	Very low	144 Å²	144	144 Å²	144	67%	0.673	77%	0.767	S	S	*	*			trans	-75.7	131.3	173.3	-173.2	-174.7	155.9	0	0	110.4	R306	E304-R306 IonicContact OE1-CZ 3.67Å; E304-R306 IonicContact OE1-NE 2.97Å; E304-R306 PolarHBondContact OE1-NE 3.32Å; E304-R306 IonicContact OE1-NH2 3.94Å; E304-R306 PolarHBondContact OE1-NH2 3.38Å
305	I	35	Very low	42	Very low	152 Å²	152	142.3 Å²	142.3	78%	0.779	76%	0.761	S	S	*	*			trans	-118.7	121.6	173.5	-59.4	178.3	0	0	0	108.8
306	R	35.1	Very low	42.2	Very low	194 Å²	194	142.7 Å²	142.7	73%	0.732	76%	0.76	S	S	*	*			trans	-106.4	135.3	167.8	-62.8	-174.9	-172.3	-173.1	3.1	109.7	E304	E304-R306 IonicContact OE1-CZ 3.67Å; E304-R306 IonicContact OE1-NE 2.97Å; E304-R306 PolarHBondContact OE1-NE 3.32Å; E304-R306 IonicContact OE1-NH2 3.94Å; E304-R306 PolarHBondContact OE1-NH2 3.38Å
307	P	35.3	Very low	42.7	Very low	132 Å²	132	142.8 Å²	142.8	86%	0.857	76%	0.758	S	S	*	*			trans	-73.4	137.8	172.8	31	-33.2	0	0	0	110.3
308	S	30.6	Very low	43.5	Very low	92 Å²	92	140 Å²	140	64%	0.643	75%	0.752	S	S	*	*			trans	-133.8	132.3	164.4	52.2	0	0	0	0	109
309	T	39.5	Very low	44.5	Very low	131 Å²	131	138.9 Å²	138.9	80%	0.804	75%	0.745	S	S	*	*			trans	-76.1	129.7	-172.1	-47.4	0	0	0	0	110.6
310	F	35	Very low	45.7	Very low	180 Å²	180	135.9 Å²	135.9	79%	0.789	73%	0.727	S	S	*	*			trans	-120.2	133.7	171	-82.6	-85.9	0	0	0	110.9
311	H	35.7	Very low	47.1	Very low	177 Å²	177	128.1 Å²	128.1	82%	0.819	71%	0.708	S	S	*	*			trans	-80.5	138.6	170.9	-75.3	-99.4	0	0	0	110.2	T313	H311-T313 PolarHBondContact O-N 2.98Å
312	T	32.4	Very low	48.8	Very low	148 Å²	148	124.9 Å²	124.9	91%	0.908	70%	0.695	S	S	*	*			trans	-79.8	109.3	176.9	13.5	0	0	0	0	111.6
313	T	44.3	Very low	50.9	Low	117 Å²	117	118.4 Å²	118.4	72%	0.718	67%	0.674	S	S	*	*			trans	-100.4	140.2	151.3	49.5	0	0	0	0	108.8	H311 V315	H311-T313 PolarHBondContact O-N 2.98Å; T313-V315 PolarHBondContact O-N 3.15Å
314	V	51.2	Low	52.8	Low	153 Å²	153	117.2 Å²	117.2	93%	0.927	67%	0.665	S	S	*	*			trans	-67.8	119.5	178.6	-179.6	0	0	0	0	109.2
315	V	61.2	Low	55.2	Low	87 Å²	87	116.4 Å²	116.4	53%	0.527	66%	0.661	S	S	.	*			trans	-112.5	137.2	171.1	-174.7	0	0	0	0	107.9	T313 V320	T313-V315 PolarHBondContact O-N 3.15Å; V315-V320 HydrophobicContact CB-CG2 4.11Å; V315-V320 HydrophobicContact CG1-CG2 3.68Å
316	D	59	Low	57.5	Low	97 Å²	97	111.7 Å²	111.7	52%	0.519	64%	0.644	S	S	.	*			trans	-59.5	123.1	-178.4	-161.4	-41.7	0	0	0	111	D318 V319 V320	D316-D318 PolarHBondContact O-N 2.86Å; D316-D318 PolarHBondContact OD1-N 3.38Å; D316-V319 HydrophobicContact CB-CB 4.48Å; D316-V319 HydrophobicContact CB-CG2 4.05Å; D316-V319 PolarHBondContact O-N 3.11Å; D316-V319 VanDerWaalsContact O-N 3.12Å; D316-V320 PolarHBondContact O-N 2.89Å
317	P	62.8	Low	59.9	Low	95 Å²	95	110 Å²	110	62%	0.617	64%	0.642	S	S	*	*	H	α-helix	trans	-59.5	-31.6	-171.8	22.1	-34.3	0	0	0	113.7	V319 V320 S321	P317-V319 VanDerWaalsContact C-N 3.34Å; P317-V319 PolarHBondContact O-N 2.72Å; P317-V320 PolarHBondContact O-N 2.91Å; P317-S321 WeakPolarHBondContact O-CB 3.17Å; P317-S321 PolarHBondContact O-N 3.04Å
318	D	65.6	Low	62.3	Low	125 Å²	125	108.9 Å²	108.9	67%	0.668	63%	0.627	S	S	*	*	H	α-helix	trans	-70.2	-33.3	-179.8	-73.1	-17.9	0	0	0	111.8	D316 S321 A322	D316-D318 PolarHBondContact O-N 2.86Å; D316-D318 PolarHBondContact OD1-N 3.38Å; D318-S321 PolarHBondContact O-N 3.47Å; D318-A322 WeakPolarHBondContact O-CB 3.36Å; D318-A322 PolarHBondContact O-N 2.88Å
319	V	70.4	Confident	65	Low	93 Å²	93	109.6 Å²	109.6	56%	0.564	62%	0.62	S	S	*	*	H	α-helix	trans	-68.9	-40.1	174.7	-179.9	0	0	0	0	110.8	D316 P317 A323	D316-V319 HydrophobicContact CB-CB 4.48Å; D316-V319 HydrophobicContact CB-CG2 4.05Å; D316-V319 PolarHBondContact O-N 3.11Å; D316-V319 VanDerWaalsContact O-N 3.12Å; P317-V319 VanDerWaalsContact C-N 3.34Å; P317-V319 PolarHBondContact O-N 2.72Å; V319-A323 WeakPolarHBondContact O-CB 3.4Å; V319-A323 PolarHBondContact O-N 2.77Å
320	V	71.9	Confident	67.3	Low	71 Å²	71	108.7 Å²	108.7	43%	0.43	61%	0.61	S	S	.	*	H	α-helix	trans	-66.1	-43.8	175	-177.5	0	0	0	0	110.6	V315 D316 P317 A323 V324	V315-V320 HydrophobicContact CB-CG2 4.11Å; V315-V320 HydrophobicContact CG1-CG2 3.68Å; D316-V320 PolarHBondContact O-N 2.89Å; P317-V320 PolarHBondContact O-N 2.91Å; V320-A323 PolarHBondContact O-N 2.94Å; V320-V324 HydrophobicContact CG1-CG2 4.47Å; V320-V324 WeakPolarHBondContact O-CG2 3.42Å; V320-V324 PolarHBondContact O-N 3.14Å
321	S	74.3	Confident	69.9	Low	70 Å²	70	106.6 Å²	106.6	49%	0.49	60%	0.601	S	S	.	*	H	α-helix	trans	-58.6	-50.4	177.1	-171.3	0	0	0	0	111.7	P317 D318 A323 V324 Q325	P317-S321 WeakPolarHBondContact O-CB 3.17Å; P317-S321 PolarHBondContact O-N 3.04Å; D318-S321 PolarHBondContact O-N 3.47Å; S321-A323 PolarHBondContact O-N 2.98Å; S321-V324 PolarHBondContact O-N 2.82Å; S321-Q325 PolarHBondContact O-N 2.88Å
322	A	78.6	Confident	72.3	Confident	62 Å²	62	102.6 Å²	102.6	51%	0.512	59%	0.585	S	S	.	*	H	α-helix	trans	-60.8	-41.6	177.1	0	0	0	0	0	112.7	D318 Q325 A326	D318-A322 WeakPolarHBondContact O-CB 3.36Å; D318-A322 PolarHBondContact O-N 2.88Å; A322-Q325 PolarHBondContact O-N 2.9Å; A322-A326 WeakPolarHBondContact O-CB 3.45Å; A322-A326 PolarHBondContact O-N 2.86Å
323	A	78.3	Confident	75.2	Confident	56 Å²	56	100.3 Å²	100.3	46%	0.463	57%	0.571	S	S	.	*	H	α-helix	trans	-67.5	-35.7	177.8	0	0	0	0	0	113	V319 V320 S321 K327	V319-A323 WeakPolarHBondContact O-CB 3.4Å; V319-A323 PolarHBondContact O-N 2.77Å; V320-A323 PolarHBondContact O-N 2.94Å; S321-A323 PolarHBondContact O-N 2.98Å; A323-K327 PolarHBondContact O-N 2.81Å
324	V	81.6	Confident	77.3	Confident	86 Å²	86	96.9 Å²	96.9	52%	0.521	56%	0.555	S	S	.	*	H	α-helix	trans	-67.7	-44	173	168.7	0	0	0	0	110.7	V320 S321 K327 M328	V320-V324 HydrophobicContact CG1-CG2 4.47Å; V320-V324 WeakPolarHBondContact O-CG2 3.42Å; V320-V324 PolarHBondContact O-N 3.14Å; S321-V324 PolarHBondContact O-N 2.82Å; V324-K327 PolarHBondContact O-N 3.4Å; V324-M328 PolarHBondContact O-N 2.88Å
325	Q	80.8	Confident	79	Confident	127 Å²	127	94 Å²	94	59%	0.593	53%	0.534	S	S	*	.	H	α-helix	trans	-67.2	-39.3	179.6	-171.4	165.8	-30.4	0	0	112.3	S321 A322 K327 M328 Q329	S321-Q325 PolarHBondContact O-N 2.88Å; A322-Q325 PolarHBondContact O-N 2.9Å; Q325-K327 PolarHBondContact O-N 2.93Å; Q325-M328 WeakPolarHBondContact O-CB 3.43Å; Q325-M328 PolarHBondContact O-N 3.3Å; Q325-Q329 PolarHBondContact O-N 2.91Å; Q325-Q329 PolarHBondContact O-OE1 2.86Å
326	A	84.8	Confident	80.2	Confident	52 Å²	52	95.4 Å²	95.4	43%	0.43	53%	0.534	S	S	.	.	H	α-helix	trans	-57.7	-49.3	172.1	0	0	0	0	0	111.7	A322 M328 Q329 D330	A322-A326 WeakPolarHBondContact O-CB 3.45Å; A322-A326 PolarHBondContact O-N 2.86Å; A326-M328 VanDerWaalsContact C-N 3.3Å; A326-M328 PolarHBondContact O-N 3.5Å; A326-Q329 WeakPolarHBondContact O-CB 3.48Å; A326-Q329 PolarHBondContact O-N 3.4Å; A326-Q329 VanDerWaalsContact O-N 3.13Å; A326-D330 PolarHBondContact O-N 3.47Å
327	K	84.9	Confident	81.9	Confident	159 Å²	159	96.1 Å²	96.1	69%	0.691	54%	0.538	S	S	*	.	H	α-helix	trans	-64.4	-30.8	176.2	-76.5	-169.2	174.2	-173.7	0	113.7	A323 V324 Q325 F331	A323-K327 PolarHBondContact O-N 2.81Å; V324-K327 PolarHBondContact O-N 3.4Å; Q325-K327 PolarHBondContact O-N 2.93Å; K327-F331 VanDerWaalsContact O-CB 3.27Å; K327-F331 WeakPolarHBondContact O-CB 3.41Å; K327-F331 PolarHBondContact O-N 3.21Å
328	M	86.6	Confident	83.1	Confident	109 Å²	109	98.5 Å²	98.5	54%	0.537	54%	0.538	S	S	.	.	H	α-helix	trans	-63.7	-46.1	172.2	-166.5	79.7	74.9	0	0	110.5	V324 Q325 A326 F331 L332	V324-M328 PolarHBondContact O-N 2.88Å; Q325-M328 WeakPolarHBondContact O-CB 3.43Å; Q325-M328 PolarHBondContact O-N 3.3Å; A326-M328 VanDerWaalsContact C-N 3.3Å; A326-M328 PolarHBondContact O-N 3.5Å; M328-F331 PolarHBondContact O-N 3.23Å; M328-L332 HydrophobicContact CG-CD1 4.37Å; M328-L332 VanDerWaalsContact O-CG 3.3Å; M328-L332 WeakPolarHBondContact O-CG 3.3Å; M328-L332 PolarHBondContact O-N 3.06Å
329	Q	85.9	Confident	84.1	Confident	106 Å²	106	98.9 Å²	98.9	50%	0.495	54%	0.536	S	S	.	.	H	α-helix	trans	-60.6	-49.6	176.3	-120.8	69.1	21.5	0	0	111.8	Q325 A326 F331 L332 V333	Q325-Q329 PolarHBondContact O-N 2.91Å; Q325-Q329 PolarHBondContact O-OE1 2.86Å; A326-Q329 WeakPolarHBondContact O-CB 3.48Å; A326-Q329 PolarHBondContact O-N 3.4Å; A326-Q329 VanDerWaalsContact O-N 3.13Å; Q329-F331 VanDerWaalsContact C-N 3.3Å; Q329-F331 PolarHBondContact O-N 3.38Å; Q329-L332 PolarHBondContact O-N 3.42Å; Q329-V333 WeakPolarHBondContact O-CG2 3.48Å; Q329-V333 PolarHBondContact O-N 3.2Å
330	D	88.6	Confident	84.9	Confident	112 Å²	112	99.4 Å²	99.4	60%	0.599	53%	0.532	S	S	*	.	H	α-helix	trans	-58.1	-42.5	177.2	-69.1	-24.4	0	0	0	111.8	A326 V333 A334	A326-D330 PolarHBondContact O-N 3.47Å; D330-V333 PolarHBondContact O-N 2.87Å; D330-A334 VanDerWaalsContact O-CB 3.31Å; D330-A334 WeakPolarHBondContact O-CB 3.22Å; D330-A334 PolarHBondContact O-N 3.33Å
331	F	88.7	Confident	85.8	Confident	136 Å²	136	101.5 Å²	101.5	60%	0.596	54%	0.538	S	S	*	.	H	α-helix	trans	-66.2	-40.5	178.7	-174.5	-96.7	0	0	0	112.3	K327 M328 Q329 A334 L335	K327-F331 VanDerWaalsContact O-CB 3.27Å; K327-F331 WeakPolarHBondContact O-CB 3.41Å; K327-F331 PolarHBondContact O-N 3.21Å; M328-F331 PolarHBondContact O-N 3.23Å; Q329-F331 VanDerWaalsContact C-N 3.3Å; Q329-F331 PolarHBondContact O-N 3.38Å; F331-A334 PolarHBondContact O-N 2.95Å; F331-L335 HydrophobicContact CE1-CD1 4.34Å; F331-L335 HydrophobicContact CZ-CD1 4.44Å; F331-L335 WeakPolarHBondContact O-CB 3.13Å; F331-L335 PolarHBondContact O-N 2.88Å
332	L	87.3	Confident	86.4	Confident	93 Å²	93	103.3 Å²	103.3	49%	0.487	54%	0.541	S	S	.	.	H	α-helix	trans	-64.3	-43.4	176.1	-72.1	169.1	0	0	0	111.8	M328 Q329 L335 Q336	M328-L332 HydrophobicContact CG-CD1 4.37Å; M328-L332 VanDerWaalsContact O-CG 3.3Å; M328-L332 WeakPolarHBondContact O-CG 3.3Å; M328-L332 PolarHBondContact O-N 3.06Å; Q329-L332 PolarHBondContact O-N 3.42Å; L332-L335 WeakPolarHBondContact O-CB 3.41Å; L332-L335 PolarHBondContact O-N 2.76Å; L332-Q336 PolarHBondContact O-N 3.21Å
333	V	91.9	Very high	86.7	Confident	100 Å²	100	105.6 Å²	105.6	61%	0.606	54%	0.544	S	S	*	.	H	α-helix	trans	-63.3	-44	175	173.8	0	0	0	0	111	Q329 D330 L335 Q336 L337	Q329-V333 WeakPolarHBondContact O-CG2 3.48Å; Q329-V333 PolarHBondContact O-N 3.2Å; D330-V333 PolarHBondContact O-N 2.87Å; V333-L335 VanDerWaalsContact C-N 3.31Å; V333-L335 PolarHBondContact O-N 3.28Å; V333-Q336 PolarHBondContact O-N 2.97Å; V333-L337 WeakPolarHBondContact O-CB 3.42Å; V333-L337 PolarHBondContact O-N 2.73Å
334	A	88.6	Confident	87.1	Confident	45 Å²	45	106.7 Å²	106.7	37%	0.372	55%	0.548	S	S	.	.	H	α-helix	trans	-66	-31.2	176.8	0	0	0	0	0	113.3	D330 F331 K338	D330-A334 VanDerWaalsContact O-CB 3.31Å; D330-A334 WeakPolarHBondContact O-CB 3.22Å; D330-A334 PolarHBondContact O-N 3.33Å; F331-A334 PolarHBondContact O-N 2.95Å; A334-K338 WeakPolarHBondContact O-CG 3.49Å; A334-K338 PolarHBondContact O-N 3.15Å
335	L	88.3	Confident	87.4	Confident	93 Å²	93	108 Å²	108	49%	0.487	55%	0.548	S	S	.	.	H	α-helix	trans	-68.9	-47.2	173.7	-164.9	88.6	0	0	0	110.9	F331 L332 V333 K338 Q339	F331-L335 HydrophobicContact CE1-CD1 4.34Å; F331-L335 HydrophobicContact CZ-CD1 4.44Å; F331-L335 WeakPolarHBondContact O-CB 3.13Å; F331-L335 PolarHBondContact O-N 2.88Å; L332-L335 WeakPolarHBondContact O-CB 3.41Å; L332-L335 PolarHBondContact O-N 2.76Å; V333-L335 VanDerWaalsContact C-N 3.31Å; V333-L335 PolarHBondContact O-N 3.28Å; L335-K338 PolarHBondContact O-N 2.98Å; L335-Q339 PolarHBondContact O-N 2.62Å
336	Q	86.2	Confident	87.7	Confident	116 Å²	116	107.1 Å²	107.1	54%	0.542	55%	0.547	S	S	.	.	H	α-helix	trans	-64.4	-43.9	179.6	-174.4	174.9	-28.8	0	0	111.7	L332 V333 K338 Q339 E340	L332-Q336 PolarHBondContact O-N 3.21Å; V333-Q336 PolarHBondContact O-N 2.97Å; Q336-K338 VanDerWaalsContact C-N 3.29Å; Q336-K338 PolarHBondContact O-N 3.3Å; Q336-Q339 WeakPolarHBondContact O-CB 3.32Å; Q336-Q339 PolarHBondContact O-N 3.26Å; Q336-E340 WeakPolarHBondContact CG-OE1 3.4Å; Q336-E340 PolarHBondContact NE2-OE1 3.2Å; Q336-E340 PolarHBondContact O-N 3.19Å
337	L	93.1	Very high	87.5	Confident	113 Å²	113	112.1 Å²	112.1	59%	0.592	56%	0.559	S	S	*	*	H	α-helix	trans	-57.6	-40.9	175	-175	69.6	0	0	0	112	V333 E340 Q341	V333-L337 WeakPolarHBondContact O-CB 3.42Å; V333-L337 PolarHBondContact O-N 2.73Å; L337-E340 PolarHBondContact O-N 3.25Å; L337-Q341 WeakPolarHBondContact O-CB 3.21Å; L337-Q341 PolarHBondContact O-N 3.08Å
338	K	88.6	Confident	87.8	Confident	145 Å²	145	110.6 Å²	110.6	63%	0.63	55%	0.554	S	S	*	*	H	α-helix	trans	-67.2	-37	174.7	-78.8	178.9	177.1	179.3	0	112.8	A334 L335 Q336 L342	A334-K338 WeakPolarHBondContact O-CG 3.49Å; A334-K338 PolarHBondContact O-N 3.15Å; L335-K338 PolarHBondContact O-N 2.98Å; Q336-K338 VanDerWaalsContact C-N 3.29Å; Q336-K338 PolarHBondContact O-N 3.3Å; K338-L342 VanDerWaalsContact O-CB 3.27Å; K338-L342 WeakPolarHBondContact O-CB 3.29Å; K338-L342 PolarHBondContact O-N 2.91Å
339	Q	86.9	Confident	87.7	Confident	133 Å²	133	111.1 Å²	111.1	62%	0.621	55%	0.553	S	S	*	*	H	α-helix	trans	-65.4	-43.3	176	-177.6	174.1	-16.2	0	0	111.3	L335 Q336 L343	L335-Q339 PolarHBondContact O-N 2.62Å; Q336-Q339 WeakPolarHBondContact O-CB 3.32Å; Q336-Q339 PolarHBondContact O-N 3.26Å; Q339-L343 VanDerWaalsContact O-CB 3.32Å; Q339-L343 WeakPolarHBondContact O-CB 3.43Å; Q339-L343 PolarHBondContact O-N 3.05Å
340	E	86.9	Confident	87.4	Confident	103 Å²	103	111.4 Å²	111.4	48%	0.481	56%	0.555	S	S	.	*	H	α-helix	trans	-65.2	-45.5	175.5	-70.5	174.5	-161.8	0	0	111.5	Q336 L337 L342 L343 C344	Q336-E340 WeakPolarHBondContact CG-OE1 3.4Å; Q336-E340 PolarHBondContact NE2-OE1 3.2Å; Q336-E340 PolarHBondContact O-N 3.19Å; L337-E340 PolarHBondContact O-N 3.25Å; E340-L342 PolarHBondContact O-N 3.43Å; E340-L343 PolarHBondContact O-N 2.96Å; E340-C344 PolarHBondContact O-N 3.25Å; E340-C344 PolarHBondContact O-SG 2.98Å
341	Q	90.2	Very high	87.1	Confident	116 Å²	116	111 Å²	111	54%	0.542	55%	0.549	S	S	.	.	H	α-helix	trans	-57.8	-45.3	175.6	-174.8	-179.3	13.2	0	0	112.4	L337 C344 Q345	L337-Q341 WeakPolarHBondContact O-CB 3.21Å; L337-Q341 PolarHBondContact O-N 3.08Å; Q341-C344 PolarHBondContact O-N 3.46Å; Q341-Q345 PolarHBondContact O-N 3.45Å
342	L	87.1	Confident	87.2	Confident	107 Å²	107	109.8 Å²	109.8	56%	0.56	55%	0.548	S	S	*	.	H	α-helix	trans	-70	-34.6	-179.2	-165	151.7	0	0	0	111.6	K338 E340 Q345 L346	K338-L342 VanDerWaalsContact O-CB 3.27Å; K338-L342 WeakPolarHBondContact O-CB 3.29Å; K338-L342 PolarHBondContact O-N 2.91Å; E340-L342 PolarHBondContact O-N 3.43Å; L342-Q345 PolarHBondContact O-N 3.49Å; L342-L346 HydrophobicContact CD2-CD1 3.75Å; L342-L346 HydrophobicContact CD2-CG 4.32Å; L342-L346 WeakPolarHBondContact O-CB 3.47Å; L342-L346 WeakPolarHBondContact O-CG 3.38Å; L342-L346 PolarHBondContact O-N 3.25Å
343	L	85.6	Confident	87	Confident	111 Å²	111	108.7 Å²	108.7	58%	0.581	54%	0.543	S	S	*	.	H	α-helix	trans	-68.1	-38.6	172.9	-173.7	141.7	0	0	0	112.1	Q339 E340 L346 K347	Q339-L343 VanDerWaalsContact O-CB 3.32Å; Q339-L343 WeakPolarHBondContact O-CB 3.43Å; Q339-L343 PolarHBondContact O-N 3.05Å; E340-L343 PolarHBondContact O-N 2.96Å; L343-L346 PolarHBondContact O-N 3.04Å; L343-K347 WeakPolarHBondContact O-CB 3.39Å; L343-K347 PolarHBondContact O-N 3.25Å
344	C	86.3	Confident	86.2	Confident	79 Å²	79	107.9 Å²	107.9	53%	0.534	53%	0.534	S	S	.	.	H	α-helix	trans	-61.6	-47.8	171.4	-76.9	0	0	0	0	112	E340 Q341 L346 K347 E348	E340-C344 PolarHBondContact O-N 3.25Å; E340-C344 PolarHBondContact O-SG 2.98Å; Q341-C344 PolarHBondContact O-N 3.46Å; C344-L346 PolarHBondContact O-N 2.81Å; C344-K347 PolarHBondContact O-N 2.99Å; C344-K347 VanDerWaalsContact O-N 3.17Å; C344-E348 PolarHBondContact O-N 2.79Å
345	Q	87.5	Confident	86	Confident	112 Å²	112	109.4 Å²	109.4	52%	0.523	54%	0.535	S	S	.	.	H	α-helix	trans	-62.5	-39.4	177.5	-74.6	-175.7	-26.8	0	0	112.8	Q341 L342 K349	Q341-Q345 PolarHBondContact O-N 3.45Å; L342-Q345 PolarHBondContact O-N 3.49Å; Q345-K349 WeakPolarHBondContact O-CB 3.48Å; Q345-K349 PolarHBondContact O-N 2.84Å
346	L	86.9	Confident	86	Confident	110 Å²	110	111.7 Å²	111.7	58%	0.576	54%	0.542	S	S	*	.	H	α-helix	trans	-62.5	-41.7	173.2	-83	171	0	0	0	112	L342 L343 C344 H350	L342-L346 HydrophobicContact CD2-CD1 3.75Å; L342-L346 HydrophobicContact CD2-CG 4.32Å; L342-L346 WeakPolarHBondContact O-CB 3.47Å; L342-L346 WeakPolarHBondContact O-CG 3.38Å; L342-L346 PolarHBondContact O-N 3.25Å; L343-L346 PolarHBondContact O-N 3.04Å; C344-L346 PolarHBondContact O-N 2.81Å; L346-H350 VanDerWaalsContact O-CB 3.27Å; L346-H350 WeakPolarHBondContact O-CB 3.39Å; L346-H350 PolarHBondContact O-N 3.49Å
347	K	82.1	Confident	85.4	Confident	156 Å²	156	110.2 Å²	110.2	68%	0.678	54%	0.537	S	S	*	.	H	α-helix	trans	-66.6	-44.6	178.6	-173.5	-179.9	178.2	-175.8	0	112.1	L343 C344 H350 Q351	L343-K347 WeakPolarHBondContact O-CB 3.39Å; L343-K347 PolarHBondContact O-N 3.25Å; C344-K347 PolarHBondContact O-N 2.99Å; C344-K347 VanDerWaalsContact O-N 3.17Å; K347-H350 PolarHBondContact O-N 2.9Å; K347-Q351 WeakPolarHBondContact O-CB 3.48Å; K347-Q351 PolarHBondContact O-N 2.74Å
348	E	90.5	Very high	84.6	Confident	128 Å²	128	110.8 Å²	110.8	60%	0.598	54%	0.535	S	S	*	.	H	α-helix	trans	-61.3	-49.7	176	-178.5	177.8	-159.2	0	0	111.3	C344 H350 Q351 L352	C344-E348 PolarHBondContact O-N 2.79Å; E348-H350 VanDerWaalsContact C-N 3.34Å; E348-H350 PolarHBondContact O-N 2.93Å; E348-Q351 PolarHBondContact O-N 3.46Å; E348-L352 HydrophobicContact CG-CD1 4.4Å; E348-L352 WeakPolarHBondContact O-CG 3.45Å; E348-L352 PolarHBondContact O-N 2.79Å
349	K	84.8	Confident	84.3	Confident	119 Å²	119	106.6 Å²	106.6	52%	0.517	53%	0.527	S	S	.	.	H	α-helix	trans	-58.2	-45.5	175.5	174.8	164.8	173.4	44.1	0	112	Q345 Q351 L352 D353	Q345-K349 WeakPolarHBondContact O-CB 3.48Å; Q345-K349 PolarHBondContact O-N 2.84Å; K349-Q351 VanDerWaalsContact C-N 3.32Å; K349-Q351 PolarHBondContact O-N 3.03Å; K349-L352 PolarHBondContact O-N 2.79Å; K349-D353 WeakPolarHBondContact CE-OD2 3.37Å; K349-D353 WeakPolarHBondContact CG-OD2 3.38Å; K349-D353 VanDerWaalsContact NZ-CG 3.25Å; K349-D353 IonicContact NZ-OD1 2.74Å; K349-D353 PolarHBondContact NZ-OD1 3.46Å; K349-D353 IonicContact NZ-OD2 3.63Å; K349-D353 PolarHBondContact NZ-OD2 2.8Å; K349-D353 WeakPolarHBondContact O-CB 3.34Å; K349-D353 VanDerWaalsContact O-CG 3.28Å; K349-D353 PolarHBondContact O-N 3.28Å
350	H	80.1	Confident	83.8	Confident	113 Å²	113	106.7 Å²	106.7	52%	0.523	53%	0.525	S	S	.	.	H	α-helix	trans	-64.5	-37.7	-179.8	-171.5	60.3	0	0	0	112	L346 K347 E348 D353 M354	L346-H350 VanDerWaalsContact O-CB 3.27Å; L346-H350 WeakPolarHBondContact O-CB 3.39Å; L346-H350 PolarHBondContact O-N 3.49Å; K347-H350 PolarHBondContact O-N 2.9Å; E348-H350 VanDerWaalsContact C-N 3.34Å; E348-H350 PolarHBondContact O-N 2.93Å; H350-D353 PolarHBondContact O-N 2.91Å; H350-M354 WeakPolarHBondContact O-CB 3.43Å; H350-M354 VanDerWaalsContact O-CG 3.25Å; H350-M354 WeakPolarHBondContact O-CG 3.3Å; H350-M354 PolarHBondContact O-N 3.05Å
351	Q	82.3	Confident	83	Confident	103 Å²	103	107 Å²	107	48%	0.481	53%	0.529	S	S	.	.	H	α-helix	trans	-61.8	-48	174.1	-172.7	61.5	49.5	0	0	111.3	K347 E348 K349 D353 M354 D355	K347-Q351 WeakPolarHBondContact O-CB 3.48Å; K347-Q351 PolarHBondContact O-N 2.74Å; E348-Q351 PolarHBondContact O-N 3.46Å; K349-Q351 VanDerWaalsContact C-N 3.32Å; K349-Q351 PolarHBondContact O-N 3.03Å; Q351-D353 PolarHBondContact O-N 2.87Å; Q351-M354 PolarHBondContact O-N 2.85Å; Q351-D355 PolarHBondContact NE2-OD2 3.44Å; Q351-D355 PolarHBondContact O-N 3.41Å
352	L	89.9	Confident	82.3	Confident	111 Å²	111	107 Å²	107	58%	0.581	53%	0.529	S	S	*	.	H	α-helix	trans	-61.1	-43.5	176.5	-68.8	170.5	0	0	0	112.5	E348 K349 M354 D355 F356	E348-L352 HydrophobicContact CG-CD1 4.4Å; E348-L352 WeakPolarHBondContact O-CG 3.45Å; E348-L352 PolarHBondContact O-N 2.79Å; K349-L352 PolarHBondContact O-N 2.79Å; L352-M354 VanDerWaalsContact C-N 3.3Å; L352-M354 PolarHBondContact O-N 3.43Å; L352-D355 PolarHBondContact O-N 3.45Å; L352-F356 VanDerWaalsContact O-CB 3.28Å; L352-F356 WeakPolarHBondContact O-CB 3.39Å; L352-F356 PolarHBondContact O-N 3.05Å
353	D	82.4	Confident	81.8	Confident	69 Å²	69	104.5 Å²	104.5	37%	0.369	52%	0.524	S	S	.	.	H	α-helix	trans	-64.1	-35.2	176.9	-68.6	-28.3	0	0	0	111.4	K349 H350 Q351 L357	K349-D353 WeakPolarHBondContact CE-OD2 3.37Å; K349-D353 WeakPolarHBondContact CG-OD2 3.38Å; K349-D353 VanDerWaalsContact NZ-CG 3.25Å; K349-D353 IonicContact NZ-OD1 2.74Å; K349-D353 PolarHBondContact NZ-OD1 3.46Å; K349-D353 IonicContact NZ-OD2 3.63Å; K349-D353 PolarHBondContact NZ-OD2 2.8Å; K349-D353 WeakPolarHBondContact O-CB 3.34Å; K349-D353 VanDerWaalsContact O-CG 3.28Å; K349-D353 PolarHBondContact O-N 3.28Å; H350-D353 PolarHBondContact O-N 2.91Å; Q351-D353 PolarHBondContact O-N 2.87Å; D353-L357 WeakPolarHBondContact O-CB 3.48Å; D353-L357 PolarHBondContact O-N 2.83Å; D353-L357 VanDerWaalsContact O-N 3.13Å
354	M	77.1	Confident	81.3	Confident	84 Å²	84	104.2 Å²	104.2	41%	0.414	52%	0.523	S	S	.	.	H	α-helix	trans	-73.1	-43.2	175.3	-72.3	-61.4	98.7	0	0	113.1	H350 Q351 L352 L357 K358	H350-M354 WeakPolarHBondContact O-CB 3.43Å; H350-M354 VanDerWaalsContact O-CG 3.25Å; H350-M354 WeakPolarHBondContact O-CG 3.3Å; H350-M354 PolarHBondContact O-N 3.05Å; Q351-M354 PolarHBondContact O-N 2.85Å; L352-M354 VanDerWaalsContact C-N 3.3Å; L352-M354 PolarHBondContact O-N 3.43Å; M354-L357 HydrophobicContact CE-CD2 4.21Å; M354-L357 PolarHBondContact O-N 2.74Å; M354-K358 WeakPolarHBondContact O-CB 3.47Å; M354-K358 PolarHBondContact O-N 3.17Å
355	D	84.3	Confident	81	Confident	76 Å²	76	103.6 Å²	103.6	41%	0.406	52%	0.519	S	S	.	.	H	α-helix	trans	-69.2	-35.6	178.6	-74.3	-42.9	0	0	0	111.8	Q351 L352 K358 A359	Q351-D355 PolarHBondContact NE2-OD2 3.44Å; Q351-D355 PolarHBondContact O-N 3.41Å; L352-D355 PolarHBondContact O-N 3.45Å; D355-K358 PolarHBondContact O-N 2.75Å; D355-A359 WeakPolarHBondContact O-CB 3.42Å; D355-A359 PolarHBondContact O-N 2.61Å
356	F	88.4	Confident	80.7	Confident	142 Å²	142	102 Å²	102	62%	0.623	52%	0.515	S	S	*	.	H	α-helix	trans	-61.1	-45.8	168.7	174.8	-100.6	0	0	0	112	L352 K358 A359 K360	L352-F356 VanDerWaalsContact O-CB 3.28Å; L352-F356 WeakPolarHBondContact O-CB 3.39Å; L352-F356 PolarHBondContact O-N 3.05Å; F356-K358 VanDerWaalsContact C-N 3.34Å; F356-K358 PolarHBondContact O-N 3.47Å; F356-A359 PolarHBondContact O-N 2.82Å; F356-K360 WeakPolarHBondContact O-CB 3.23Å; F356-K360 PolarHBondContact O-N 2.9Å
357	L	72.6	Confident	80.5	Confident	84 Å²	84	101.4 Å²	101.4	44%	0.44	51%	0.511	S	S	.	.	H	α-helix	trans	-64.3	-40.1	178.2	-171.6	66.6	0	0	0	111.5	D353 M354 K360 I361	D353-L357 WeakPolarHBondContact O-CB 3.48Å; D353-L357 PolarHBondContact O-N 2.83Å; D353-L357 VanDerWaalsContact O-N 3.13Å; M354-L357 HydrophobicContact CE-CD2 4.21Å; M354-L357 PolarHBondContact O-N 2.74Å; L357-K360 PolarHBondContact O-N 2.88Å; L357-I361 HydrophobicContact CG-CD1 4.14Å; L357-I361 WeakPolarHBondContact O-CD1 3.1Å; L357-I361 VanDerWaalsContact O-CG1 3.29Å; L357-I361 WeakPolarHBondContact O-CG1 3.44Å; L357-I361 PolarHBondContact O-N 2.97Å
358	K	77.1	Confident	80.2	Confident	126 Å²	126	102.4 Å²	102.4	55%	0.548	51%	0.51	S	S	.	.	H	α-helix	trans	-60.7	-52.6	174.6	-178.9	-169.9	169.9	-164.9	0	111.4	M354 D355 F356 K360 I361 E362	M354-K358 WeakPolarHBondContact O-CB 3.47Å; M354-K358 PolarHBondContact O-N 3.17Å; D355-K358 PolarHBondContact O-N 2.75Å; F356-K358 VanDerWaalsContact C-N 3.34Å; F356-K358 PolarHBondContact O-N 3.47Å; K358-K360 PolarHBondContact O-N 3.42Å; K358-I361 PolarHBondContact O-N 2.77Å; K358-I361 VanDerWaalsContact O-N 3.09Å; K358-E362 WeakPolarHBondContact O-CB 3.32Å; K358-E362 PolarHBondContact O-N 2.82Å
359	A	80.9	Confident	79.8	Confident	56 Å²	56	103.7 Å²	103.7	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-58.6	-36.2	178.2	0	0	0	0	0	112.1	D355 F356 E362 A363	D355-A359 WeakPolarHBondContact O-CB 3.42Å; D355-A359 PolarHBondContact O-N 2.61Å; F356-A359 PolarHBondContact O-N 2.82Å; A359-E362 PolarHBondContact O-N 3.33Å; A359-A363 WeakPolarHBondContact O-CB 3.42Å; A359-A363 PolarHBondContact O-N 3.48Å
360	K	76.1	Confident	79.7	Confident	136 Å²	136	102.8 Å²	102.8	59%	0.591	51%	0.51	S	S	*	.	H	α-helix	trans	-68.3	-38.3	175.5	-169.7	170.6	-176.7	174.5	0	113.2	F356 L357 K358 D364	F356-K360 WeakPolarHBondContact O-CB 3.23Å; F356-K360 PolarHBondContact O-N 2.9Å; L357-K360 PolarHBondContact O-N 2.88Å; K358-K360 PolarHBondContact O-N 3.42Å; K360-D364 WeakPolarHBondContact O-CB 3.38Å; K360-D364 PolarHBondContact O-N 2.93Å; K360-D364 VanDerWaalsContact O-N 3.14Å
361	I	71	Confident	79.7	Confident	110 Å²	110	101.9 Å²	101.9	56%	0.564	51%	0.508	S	S	*	.	H	α-helix	trans	-67.9	-39.2	174.1	-70	163.2	0	0	0	110.9	L357 K358 D364 S365	L357-I361 HydrophobicContact CG-CD1 4.14Å; L357-I361 WeakPolarHBondContact O-CD1 3.1Å; L357-I361 VanDerWaalsContact O-CG1 3.29Å; L357-I361 WeakPolarHBondContact O-CG1 3.44Å; L357-I361 PolarHBondContact O-N 2.97Å; K358-I361 PolarHBondContact O-N 2.77Å; K358-I361 VanDerWaalsContact O-N 3.09Å; I361-D364 PolarHBondContact O-N 2.86Å; I361-S365 PolarHBondContact O-N 2.75Å
362	E	74.8	Confident	79.6	Confident	115 Å²	115	103.1 Å²	103.1	54%	0.537	51%	0.514	S	S	.	.	H	α-helix	trans	-66.1	-45.6	179.5	-163.5	154.1	-158	0	0	110.9	K358 A359 D364 S365 D366	K358-E362 WeakPolarHBondContact O-CB 3.32Å; K358-E362 PolarHBondContact O-N 2.82Å; A359-E362 PolarHBondContact O-N 3.33Å; E362-D364 PolarHBondContact O-N 2.68Å; E362-S365 WeakPolarHBondContact O-CB 3.34Å; E362-S365 PolarHBondContact O-N 3.02Å; E362-S365 VanDerWaalsContact O-N 3.15Å; E362-S365 PolarHBondContact O-OG 3.3Å; E362-D366 PolarHBondContact O-N 3.26Å
363	A	76.4	Confident	79.5	Confident	54 Å²	54	104.2 Å²	104.2	45%	0.446	52%	0.516	S	S	.	.	H	α-helix	trans	-61.2	-42.6	173.4	0	0	0	0	0	113.6	A359 S365 D366 I367	A359-A363 WeakPolarHBondContact O-CB 3.42Å; A359-A363 PolarHBondContact O-N 3.48Å; A363-S365 PolarHBondContact O-N 2.81Å; A363-D366 PolarHBondContact O-N 3.24Å; A363-I367 WeakPolarHBondContact O-CG1 3.39Å; A363-I367 PolarHBondContact O-N 3.13Å
364	D	75.9	Confident	79.5	Confident	106 Å²	106	106.1 Å²	106.1	57%	0.567	52%	0.523	S	S	*	.	H	α-helix	trans	-62.9	-32.6	175.4	-168.1	64.9	0	0	0	111.7	K360 I361 E362 R368	K360-D364 WeakPolarHBondContact O-CB 3.38Å; K360-D364 PolarHBondContact O-N 2.93Å; K360-D364 VanDerWaalsContact O-N 3.14Å; I361-D364 PolarHBondContact O-N 2.86Å; E362-D364 PolarHBondContact O-N 2.68Å; D364-R368 VanDerWaalsContact O-CB 3.25Å; D364-R368 WeakPolarHBondContact O-CB 3.45Å; D364-R368 PolarHBondContact O-N 3.17Å
365	S	80.3	Confident	79.7	Confident	66 Å²	66	106.8 Å²	106.8	46%	0.462	53%	0.532	S	S	.	.	H	α-helix	trans	-67.9	-35.9	175.9	85.6	0	0	0	0	113.3	I361 E362 A363 R369	I361-S365 PolarHBondContact O-N 2.75Å; E362-S365 WeakPolarHBondContact O-CB 3.34Å; E362-S365 PolarHBondContact O-N 3.02Å; E362-S365 VanDerWaalsContact O-N 3.15Å; E362-S365 PolarHBondContact O-OG 3.3Å; A363-S365 PolarHBondContact O-N 2.81Å; S365-R369 PolarHBondContact O-N 2.67Å
366	D	81.8	Confident	79.7	Confident	79 Å²	79	106.5 Å²	106.5	42%	0.422	54%	0.535	S	S	.	.	H	α-helix	trans	-75.7	-39.1	176.1	-103.2	-31.9	0	0	0	112.6	E362 A363 R368 R369 L370	E362-D366 PolarHBondContact O-N 3.26Å; A363-D366 PolarHBondContact O-N 3.24Å; D366-R368 VanDerWaalsContact C-N 3.27Å; D366-R368 PolarHBondContact O-N 3.26Å; D366-R369 WeakPolarHBondContact O-CB 3.47Å; D366-R369 PolarHBondContact O-N 2.95Å; D366-R369 VanDerWaalsContact O-N 3.13Å; D366-R369 IonicContact OD1-CZ 3.3Å; D366-R369 IonicContact OD1-NE 3.65Å; D366-R369 PolarHBondContact OD1-NE 3.2Å; D366-R369 IonicContact OD1-NH2 3.77Å; D366-R369 PolarHBondContact OD1-NH2 2.95Å; D366-L370 PolarHBondContact O-N 3.2Å
367	I	81.2	Confident	79.7	Confident	97 Å²	97	101.3 Å²	101.3	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-57.9	-44.4	170.6	-68	165.9	0	0	0	110	A363 R369 L370 L371	A363-I367 WeakPolarHBondContact O-CG1 3.39Å; A363-I367 PolarHBondContact O-N 3.13Å; I367-R369 VanDerWaalsContact C-N 3.33Å; I367-R369 PolarHBondContact O-N 2.91Å; I367-L370 PolarHBondContact O-N 3.41Å; I367-L371 HydrophobicContact CG2-CD1 4.07Å; I367-L371 WeakPolarHBondContact O-CG 3.27Å; I367-L371 PolarHBondContact O-N 2.89Å
368	R	77.3	Confident	80.3	Confident	176 Å²	176	102.3 Å²	102.3	66%	0.664	53%	0.527	S	S	*	.	H	α-helix	trans	-63.7	-36.2	175.8	-175.8	176.6	178.5	180	0.3	112.8	D364 D366 Q372	D364-R368 VanDerWaalsContact O-CB 3.25Å; D364-R368 WeakPolarHBondContact O-CB 3.45Å; D364-R368 PolarHBondContact O-N 3.17Å; D366-R368 VanDerWaalsContact C-N 3.27Å; D366-R368 PolarHBondContact O-N 3.26Å; R368-Q372 WeakPolarHBondContact O-CB 3.38Å; R368-Q372 PolarHBondContact O-N 3.49Å
369	R	81.8	Confident	80.5	Confident	156 Å²	156	97.8 Å²	97.8	59%	0.589	52%	0.517	S	S	*	.	H	α-helix	trans	-66.1	-42.2	174.7	-175	172.8	65.4	96.7	-5.4	111.6	S365 D366 I367 Q372 Q373	S365-R369 PolarHBondContact O-N 2.67Å; D366-R369 WeakPolarHBondContact O-CB 3.47Å; D366-R369 PolarHBondContact O-N 2.95Å; D366-R369 VanDerWaalsContact O-N 3.13Å; D366-R369 IonicContact OD1-CZ 3.3Å; D366-R369 IonicContact OD1-NE 3.65Å; D366-R369 PolarHBondContact OD1-NE 3.2Å; D366-R369 IonicContact OD1-NH2 3.77Å; D366-R369 PolarHBondContact OD1-NH2 2.95Å; I367-R369 VanDerWaalsContact C-N 3.33Å; I367-R369 PolarHBondContact O-N 2.91Å; R369-Q372 PolarHBondContact O-N 2.72Å; R369-Q373 PolarHBondContact O-N 3.37Å
370	L	82.4	Confident	80.9	Confident	100 Å²	100	101.8 Å²	101.8	52%	0.524	52%	0.524	S	S	.	.	H	α-helix	trans	-62.5	-51.2	175.2	-176.9	65	0	0	0	111.3	D366 I367 Q372 Q373 E374	D366-L370 PolarHBondContact O-N 3.2Å; I367-L370 PolarHBondContact O-N 3.41Å; L370-Q372 VanDerWaalsContact C-N 3.28Å; L370-Q372 PolarHBondContact O-N 3.35Å; L370-Q373 WeakPolarHBondContact O-CA 3.15Å; L370-Q373 WeakPolarHBondContact O-CB 3.42Å; L370-Q373 PolarHBondContact O-N 3Å; L370-E374 PolarHBondContact O-N 3.41Å
371	L	78.9	Confident	81.1	Confident	93 Å²	93	100.9 Å²	100.9	49%	0.487	52%	0.521	S	S	.	.	H	α-helix	trans	-57.7	-39.5	176.2	-73.5	168.7	0	0	0	112.3	I367 Q373 E374 V375	I367-L371 HydrophobicContact CG2-CD1 4.07Å; I367-L371 WeakPolarHBondContact O-CG 3.27Å; I367-L371 PolarHBondContact O-N 2.89Å; L371-Q373 VanDerWaalsContact C-N 3.31Å; L371-Q373 PolarHBondContact O-N 2.93Å; L371-E374 PolarHBondContact O-N 3.09Å; L371-V375 WeakPolarHBondContact O-CB 3.5Å; L371-V375 VanDerWaalsContact O-CG2 3.27Å; L371-V375 WeakPolarHBondContact O-CG2 3.23Å; L371-V375 PolarHBondContact O-N 2.95Å
372	Q	80.4	Confident	81.5	Confident	130 Å²	130	102.1 Å²	102.1	61%	0.607	53%	0.526	S	S	*	.	H	α-helix	trans	-67.7	-31.1	176.5	-172.9	170.5	-23.6	0	0	112.4	R368 R369 L370 S376	R368-Q372 WeakPolarHBondContact O-CB 3.38Å; R368-Q372 PolarHBondContact O-N 3.49Å; R369-Q372 PolarHBondContact O-N 2.72Å; L370-Q372 VanDerWaalsContact C-N 3.28Å; L370-Q372 PolarHBondContact O-N 3.35Å; Q372-S376 WeakPolarHBondContact O-CB 3.27Å; Q372-S376 PolarHBondContact O-N 3.45Å; Q372-S376 VanDerWaalsContact O-N 3.16Å; Q372-S376 PolarHBondContact O-OG 2.93Å
373	Q	88.4	Confident	82	Confident	133 Å²	133	102.7 Å²	102.7	62%	0.621	53%	0.529	S	S	*	.	H	α-helix	trans	-71.2	-43.2	172.1	-178.7	173.4	-27.3	0	0	111.9	R369 L370 L371 S376 G377	R369-Q373 PolarHBondContact O-N 3.37Å; L370-Q373 WeakPolarHBondContact O-CA 3.15Å; L370-Q373 WeakPolarHBondContact O-CB 3.42Å; L370-Q373 PolarHBondContact O-N 3Å; L371-Q373 VanDerWaalsContact C-N 3.31Å; L371-Q373 PolarHBondContact O-N 2.93Å; Q373-S376 WeakPolarHBondContact O-CB 3.4Å; Q373-S376 PolarHBondContact O-N 3.12Å; Q373-G377 PolarHBondContact O-N 3.46Å
374	E	82.8	Confident	82.5	Confident	109 Å²	109	104.4 Å²	104.4	51%	0.509	53%	0.531	S	S	.	.	H	α-helix	trans	-64.3	-46.8	176.2	-69.7	-172.7	145	0	0	112.2	L370 L371 S376 G377 L378	L370-E374 PolarHBondContact O-N 3.41Å; L371-E374 PolarHBondContact O-N 3.09Å; E374-S376 PolarHBondContact O-N 3.24Å; E374-G377 WeakPolarHBondContact O-CA 3.32Å; E374-G377 PolarHBondContact O-N 3.01Å; E374-L378 WeakPolarHBondContact O-CG 3.49Å; E374-L378 PolarHBondContact O-N 3.32Å
375	V	80.6	Confident	82.7	Confident	99 Å²	99	105.5 Å²	105.5	60%	0.6	53%	0.532	S	S	*	.	H	α-helix	trans	-58.7	-34.9	174.1	169.8	0	0	0	0	111.3	L371 G379	L371-V375 WeakPolarHBondContact O-CB 3.5Å; L371-V375 VanDerWaalsContact O-CG2 3.27Å; L371-V375 WeakPolarHBondContact O-CG2 3.23Å; L371-V375 PolarHBondContact O-N 2.95Å; V375-G379 PolarHBondContact O-N 3.37Å
376	S	85.1	Confident	82.9	Confident	69 Å²	69	107.3 Å²	107.3	48%	0.483	53%	0.533	S	S	.	.	H	α-helix	trans	-71.3	-28.9	173.8	-59.3	0	0	0	0	113.3	Q372 Q373 E374 K380	Q372-S376 WeakPolarHBondContact O-CB 3.27Å; Q372-S376 PolarHBondContact O-N 3.45Å; Q372-S376 VanDerWaalsContact O-N 3.16Å; Q372-S376 PolarHBondContact O-OG 2.93Å; Q373-S376 WeakPolarHBondContact O-CB 3.4Å; Q373-S376 PolarHBondContact O-N 3.12Å; E374-S376 PolarHBondContact O-N 3.24Å; S376-K380 WeakPolarHBondContact O-CG 3.41Å
377	G	87.7	Confident	83.2	Confident	33 Å²	33	109.1 Å²	109.1	34%	0.34	54%	0.541	S	S	.	.	H	α-helix	trans	-73.3	-49.7	172.9	0	0	0	0	0	112.4	Q373 E374 G379 K380 Q381	Q373-G377 PolarHBondContact O-N 3.46Å; E374-G377 WeakPolarHBondContact O-CA 3.32Å; E374-G377 PolarHBondContact O-N 3.01Å; G377-G379 VanDerWaalsContact C-N 3.28Å; G377-G379 PolarHBondContact O-N 2.95Å; G377-K380 PolarHBondContact O-N 2.98Å; G377-K380 VanDerWaalsContact O-N 3.11Å; G377-Q381 PolarHBondContact O-N 3.27Å
378	L	84.4	Confident	83.4	Confident	106 Å²	106	108.7 Å²	108.7	56%	0.555	54%	0.54	S	S	*	.	H	α-helix	trans	-57.8	-40	174.9	-72	164.7	0	0	0	111.7	E374 K380 Q381 M382	E374-L378 WeakPolarHBondContact O-CG 3.49Å; E374-L378 PolarHBondContact O-N 3.32Å; L378-K380 VanDerWaalsContact C-N 3.33Å; L378-K380 PolarHBondContact O-N 3.25Å; L378-Q381 PolarHBondContact O-N 2.87Å; L378-M382 WeakPolarHBondContact O-CB 3.28Å; L378-M382 PolarHBondContact O-N 3.31Å
379	G	82.8	Confident	83.6	Confident	31 Å²	31	103.5 Å²	103.5	32%	0.32	53%	0.53	S	S	.	.	H	α-helix	trans	-57.3	-42.8	174.2	0	0	0	0	0	113.2	V375 G377 M382 E383	V375-G379 PolarHBondContact O-N 3.37Å; G377-G379 VanDerWaalsContact C-N 3.28Å; G377-G379 PolarHBondContact O-N 2.95Å; G379-M382 PolarHBondContact O-N 2.88Å; G379-E383 PolarHBondContact O-N 2.99Å
380	K	87.9	Confident	83.8	Confident	140 Å²	140	103.6 Å²	103.6	61%	0.609	53%	0.53	S	S	*	.	H	α-helix	trans	-70	-38.8	176.9	-69	174.3	-179.6	-178.7	0	112.6	S376 G377 L378 M382 E383 N384	S376-K380 WeakPolarHBondContact O-CG 3.41Å; G377-K380 PolarHBondContact O-N 2.98Å; G377-K380 VanDerWaalsContact O-N 3.11Å; L378-K380 VanDerWaalsContact C-N 3.33Å; L378-K380 PolarHBondContact O-N 3.25Å; K380-M382 VanDerWaalsContact C-N 3.35Å; K380-E383 PolarHBondContact O-N 3.42Å; K380-N384 VanDerWaalsContact O-CG 3.31Å; K380-N384 PolarHBondContact O-N 3.29Å
381	Q	81.6	Confident	84.1	Confident	116 Å²	116	102.1 Å²	102.1	54%	0.542	53%	0.529	S	S	.	.	H	α-helix	trans	-62.6	-43	173.9	-72.7	179	-29	0	0	111.4	G377 L378 N384 H385	G377-Q381 PolarHBondContact O-N 3.27Å; L378-Q381 PolarHBondContact O-N 2.87Å; Q381-N384 PolarHBondContact O-N 3.31Å; Q381-H385 PolarHBondContact O-CD2 3.24Å; Q381-H385 VanDerWaalsContact O-CD2 3.27Å; Q381-H385 PolarHBondContact O-N 3.15Å
382	M	79.1	Confident	84.4	Confident	136 Å²	136	101.5 Å²	101.5	67%	0.67	53%	0.528	S	S	*	.	H	α-helix	trans	-64.1	-39.3	175.8	-177.4	174.9	61.5	0	0	112.3	L378 G379 K380 Q386	L378-M382 WeakPolarHBondContact O-CB 3.28Å; L378-M382 PolarHBondContact O-N 3.31Å; G379-M382 PolarHBondContact O-N 2.88Å; K380-M382 VanDerWaalsContact C-N 3.35Å; M382-Q386 VanDerWaalsContact O-CB 3.31Å; M382-Q386 WeakPolarHBondContact O-CB 3.49Å; M382-Q386 PolarHBondContact O-N 3.42Å
383	E	85.6	Confident	84.7	Confident	127 Å²	127	97.9 Å²	97.9	59%	0.593	52%	0.521	S	S	*	.	H	α-helix	trans	-65.1	-44.3	175	-175.1	164.7	-142.8	0	0	112	G379 K380 Q386 M387	G379-E383 PolarHBondContact O-N 2.99Å; K380-E383 PolarHBondContact O-N 3.42Å; E383-Q386 CarbonylContact O-C 3.55Å; E383-Q386 PolarHBondContact O-N 3.28Å; E383-Q386 VanDerWaalsContact O-N 3.15Å; E383-M387 WeakPolarHBondContact O-CG 3.45Å; E383-M387 PolarHBondContact O-N 3.24Å
384	N	85.9	Confident	84.7	Confident	90 Å²	90	94.5 Å²	94.5	48%	0.481	52%	0.516	S	S	.	.	H	α-helix	trans	-59.4	-52.3	174.7	-72	-9.7	0	0	0	111.6	K380 Q381 Q386 M387 D388	K380-N384 VanDerWaalsContact O-CG 3.31Å; K380-N384 PolarHBondContact O-N 3.29Å; Q381-N384 PolarHBondContact O-N 3.31Å; N384-Q386 PolarHBondContact O-N 2.99Å; N384-M387 CarbonylContact O-C 3.58Å; N384-M387 WeakPolarHBondContact O-CA 3.35Å; N384-M387 WeakPolarHBondContact O-CB 3.47Å; N384-M387 PolarHBondContact O-N 3.15Å; N384-D388 PolarHBondContact O-N 3.44Å
385	H	81.3	Confident	85	Confident	129 Å²	129	92.2 Å²	92.2	60%	0.597	51%	0.512	S	S	*	.	H	α-helix	trans	-60.3	-30.6	175.1	-73.4	-48.4	0	0	0	112.9	Q381 S389	Q381-H385 PolarHBondContact O-CD2 3.24Å; Q381-H385 VanDerWaalsContact O-CD2 3.27Å; Q381-H385 PolarHBondContact O-N 3.15Å; H385-S389 WeakPolarHBondContact O-CB 3.38Å; H385-S389 PolarHBondContact O-N 3.18Å; H385-S389 PolarHBondContact O-OG 3.33Å
386	Q	84.5	Confident	85.2	Confident	104 Å²	104	92.5 Å²	92.5	49%	0.486	51%	0.509	S	S	.	.	H	α-helix	trans	-72.5	-28.4	173	-168.2	165.8	53.3	0	0	112.7	M382 E383 N384 S389 R390	M382-Q386 VanDerWaalsContact O-CB 3.31Å; M382-Q386 WeakPolarHBondContact O-CB 3.49Å; M382-Q386 PolarHBondContact O-N 3.42Å; E383-Q386 CarbonylContact O-C 3.55Å; E383-Q386 PolarHBondContact O-N 3.28Å; E383-Q386 VanDerWaalsContact O-N 3.15Å; N384-Q386 PolarHBondContact O-N 2.99Å; Q386-S389 WeakPolarHBondContact CA-OG 3.36Å; Q386-S389 PolarHBondContact O-OG 3.13Å; Q386-R390 WeakPolarHBondContact O-CD 3.5Å; Q386-R390 WeakPolarHBondContact O-CG 3.24Å; Q386-R390 PolarHBondContact O-N 2.86Å
387	M	87.3	Confident	85.4	Confident	117 Å²	117	92.8 Å²	92.8	58%	0.576	51%	0.511	S	S	*	.	H	α-helix	trans	-73.8	-41.5	169.6	-65.2	-141.3	-67.4	0	0	111.9	E383 N384 R390 S391	E383-M387 WeakPolarHBondContact O-CG 3.45Å; E383-M387 PolarHBondContact O-N 3.24Å; N384-M387 CarbonylContact O-C 3.58Å; N384-M387 WeakPolarHBondContact O-CA 3.35Å; N384-M387 WeakPolarHBondContact O-CB 3.47Å; N384-M387 PolarHBondContact O-N 3.15Å; M387-R390 PolarHBondContact O-N 2.87Å; M387-R390 VanDerWaalsContact O-N 3.17Å; M387-S391 PolarHBondContact O-N 3.04Å
388	D	85.9	Confident	85.6	Confident	89 Å²	89	96.5 Å²	96.5	48%	0.476	52%	0.523	S	S	.	.	H	α-helix	trans	-64.2	-42.4	177.2	-64.4	-31.3	0	0	0	112.4	N384 R390 S391 T392	N384-D388 PolarHBondContact O-N 3.44Å; D388-R390 VanDerWaalsContact C-N 3.28Å; D388-R390 PolarHBondContact O-N 2.84Å; D388-S391 PolarHBondContact O-N 2.81Å; D388-S391 PolarHBondContact O-OG 3.06Å; D388-T392 WeakPolarHBondContact O-CB 3.39Å; D388-T392 WeakPolarHBondContact O-CG2 3.4Å; D388-T392 PolarHBondContact O-N 3.23Å; D388-T392 PolarHBondContact O-OG1 3.39Å
389	S	80.5	Confident	85.8	Confident	66 Å²	66	97.7 Å²	97.7	46%	0.462	52%	0.524	S	S	.	.	H	α-helix	trans	-65.5	-29.8	173.9	60.5	0	0	0	0	112.8	H385 Q386 T392 A393	H385-S389 WeakPolarHBondContact O-CB 3.38Å; H385-S389 PolarHBondContact O-N 3.18Å; H385-S389 PolarHBondContact O-OG 3.33Å; Q386-S389 WeakPolarHBondContact CA-OG 3.36Å; Q386-S389 PolarHBondContact O-OG 3.13Å; S389-T392 WeakPolarHBondContact CA-OG1 3.33Å; S389-T392 PolarHBondContact O-OG1 3.43Å; S389-A393 WeakPolarHBondContact O-CB 3.45Å; S389-A393 PolarHBondContact O-N 3.26Å; S389-A393 VanDerWaalsContact O-N 3.09Å
390	R	85.9	Confident	86	Confident	158 Å²	158	100.6 Å²	100.6	60%	0.596	53%	0.531	S	S	*	.	H	α-helix	trans	-75.1	-40.6	172.6	-74	171.3	-173.8	170.8	9.2	112.4	Q386 M387 D388 A393 A394	Q386-R390 WeakPolarHBondContact O-CD 3.5Å; Q386-R390 WeakPolarHBondContact O-CG 3.24Å; Q386-R390 PolarHBondContact O-N 2.86Å; M387-R390 PolarHBondContact O-N 2.87Å; M387-R390 VanDerWaalsContact O-N 3.17Å; D388-R390 VanDerWaalsContact C-N 3.28Å; D388-R390 PolarHBondContact O-N 2.84Å; R390-A393 PolarHBondContact O-N 2.96Å; R390-A394 WeakPolarHBondContact O-CB 3.46Å; R390-A394 PolarHBondContact O-N 3.27Å
391	S	88.4	Confident	86.1	Confident	70 Å²	70	99.6 Å²	99.6	49%	0.49	53%	0.528	S	S	.	.	H	α-helix	trans	-68.4	-41.7	179.6	69.8	0	0	0	0	111.5	M387 D388 A394 S395	M387-S391 PolarHBondContact O-N 3.04Å; D388-S391 PolarHBondContact O-N 2.81Å; D388-S391 PolarHBondContact O-OG 3.06Å; S391-A394 PolarHBondContact O-N 3.39Å; S391-S395 PolarHBondContact O-N 2.89Å
392	T	85.9	Confident	86.5	Confident	79 Å²	79	97.2 Å²	97.2	49%	0.485	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-42.5	172.9	51.1	0	0	0	0	112.1	D388 S389 A394 S395 L396	D388-T392 WeakPolarHBondContact O-CB 3.39Å; D388-T392 WeakPolarHBondContact O-CG2 3.4Å; D388-T392 PolarHBondContact O-N 3.23Å; D388-T392 PolarHBondContact O-OG1 3.39Å; S389-T392 WeakPolarHBondContact CA-OG1 3.33Å; S389-T392 PolarHBondContact O-OG1 3.43Å; T392-A394 PolarHBondContact O-N 2.96Å; T392-S395 WeakPolarHBondContact O-CB 3.47Å; T392-S395 PolarHBondContact O-N 2.04Å; T392-L396 WeakPolarHBondContact O-CG 3.27Å; T392-L396 PolarHBondContact O-N 3.23Å
393	A	86.5	Confident	86.7	Confident	55 Å²	55	95.5 Å²	95.5	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-40.2	173.5	0	0	0	0	0	112.7	S389 R390 L396 S397	S389-A393 WeakPolarHBondContact O-CB 3.45Å; S389-A393 PolarHBondContact O-N 3.26Å; S389-A393 VanDerWaalsContact O-N 3.09Å; R390-A393 PolarHBondContact O-N 2.96Å; A393-L396 PolarHBondContact O-N 2.94Å; A393-S397 WeakPolarHBondContact O-CB 3.22Å; A393-S397 PolarHBondContact O-N 3.09Å
394	A	88.4	Confident	86.9	Confident	62 Å²	62	95.3 Å²	95.3	51%	0.512	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-41.9	174.3	0	0	0	0	0	112.1	R390 S391 T392 S397 L398	R390-A394 WeakPolarHBondContact O-CB 3.46Å; R390-A394 PolarHBondContact O-N 3.27Å; S391-A394 PolarHBondContact O-N 3.39Å; T392-A394 PolarHBondContact O-N 2.96Å; A394-S397 PolarHBondContact O-N 3.17Å; A394-L398 PolarHBondContact O-N 3.15Å
395	S	89.5	Confident	87.1	Confident	61 Å²	61	95.1 Å²	95.1	43%	0.427	52%	0.516	S	S	.	.	H	α-helix	trans	-62.4	-41.3	174.9	-172.1	0	0	0	0	112.5	S391 T392 L398 K399	S391-S395 PolarHBondContact O-N 2.89Å; T392-S395 WeakPolarHBondContact O-CB 3.47Å; T392-S395 PolarHBondContact O-N 2.04Å; S395-L398 PolarHBondContact O-N 3.15Å; S395-K399 WeakPolarHBondContact O-CG 3.33Å; S395-K399 PolarHBondContact O-N 2.89Å; S395-K399 VanDerWaalsContact O-N 3.08Å
396	L	85.9	Confident	87.4	Confident	104 Å²	104	94 Å²	94	55%	0.545	51%	0.511	S	S	.	.	H	α-helix	trans	-65.5	-41.9	174.7	-71.7	169.9	0	0	0	111.9	T392 A393 L398 K399 I400	T392-L396 WeakPolarHBondContact O-CG 3.27Å; T392-L396 PolarHBondContact O-N 3.23Å; A393-L396 PolarHBondContact O-N 2.94Å; L396-L398 VanDerWaalsContact C-N 3.34Å; L396-L398 PolarHBondContact O-N 2.93Å; L396-K399 PolarHBondContact O-N 2.93Å; L396-I400 WeakPolarHBondContact O-CG1 3.48Å; L396-I400 PolarHBondContact O-N 3.3Å
397	S	89.2	Confident	87.5	Confident	75 Å²	75	93.9 Å²	93.9	52%	0.524	51%	0.514	S	S	.	.	H	α-helix	trans	-59.6	-43.4	175.3	-164	0	0	0	0	111.9	A393 A394 K399 I400 Q401	A393-S397 WeakPolarHBondContact O-CB 3.22Å; A393-S397 PolarHBondContact O-N 3.09Å; A394-S397 PolarHBondContact O-N 3.17Å; S397-K399 PolarHBondContact O-N 2.92Å; S397-I400 PolarHBondContact O-N 2.86Å; S397-Q401 PolarHBondContact O-N 2.99Å
398	L	91.8	Very high	87.6	Confident	112 Å²	112	91.2 Å²	91.2	59%	0.586	51%	0.511	S	S	*	.	H	α-helix	trans	-62	-41	175.3	-169.6	74.6	0	0	0	112.1	A394 S395 L396 Q401 T402	A394-L398 PolarHBondContact O-N 3.15Å; S395-L398 PolarHBondContact O-N 3.15Å; L396-L398 VanDerWaalsContact C-N 3.34Å; L396-L398 PolarHBondContact O-N 2.93Å; L398-Q401 PolarHBondContact O-N 2.71Å; L398-T402 WeakPolarHBondContact O-CB 3.16Å; L398-T402 PolarHBondContact O-N 2.95Å; L398-T402 PolarHBondContact O-OG1 2.92Å
399	K	87.6	Confident	87.9	Confident	130 Å²	130	92.8 Å²	92.8	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-63.9	-42.1	174.5	-74.8	-179.8	177.5	-177.4	0	112	S395 L396 S397 T402 L403	S395-K399 WeakPolarHBondContact O-CG 3.33Å; S395-K399 PolarHBondContact O-N 2.89Å; S395-K399 VanDerWaalsContact O-N 3.08Å; L396-K399 PolarHBondContact O-N 2.93Å; S397-K399 PolarHBondContact O-N 2.92Å; K399-T402 WeakPolarHBondContact O-CB 3.16Å; K399-T402 PolarHBondContact O-N 2.82Å; K399-L403 WeakPolarHBondContact O-CG 3.44Å; K399-L403 PolarHBondContact O-N 3.12Å
400	I	87.7	Confident	88.1	Confident	93 Å²	93	94 Å²	94	48%	0.477	51%	0.514	S	S	.	.	H	α-helix	trans	-59.9	-50.9	176.1	-69.3	163.4	0	0	0	110	L396 S397 T402 L403 E404	L396-I400 WeakPolarHBondContact O-CG1 3.48Å; L396-I400 PolarHBondContact O-N 3.3Å; S397-I400 PolarHBondContact O-N 2.86Å; I400-T402 PolarHBondContact O-N 3.38Å; I400-L403 PolarHBondContact O-N 2.94Å; I400-E404 HydrophobicContact CG2-CG 4.27Å; I400-E404 WeakPolarHBondContact O-CG 3.4Å; I400-E404 PolarHBondContact O-N 2.79Å
401	Q	89.4	Confident	87.9	Confident	118 Å²	118	89.7 Å²	89.7	55%	0.551	51%	0.508	S	S	*	.	H	α-helix	trans	-60.1	-34.1	177.6	-168.8	179.8	13.2	0	0	112.9	S397 L398 T405	S397-Q401 PolarHBondContact O-N 2.99Å; L398-Q401 PolarHBondContact O-N 2.71Å; Q401-T405 WeakPolarHBondContact O-CG2 3.29Å; Q401-T405 PolarHBondContact O-N 2.91Å; Q401-T405 PolarHBondContact O-OG1 3.38Å
402	T	91.1	Very high	87.7	Confident	67 Å²	67	93.2 Å²	93.2	41%	0.411	52%	0.517	S	S	.	.	H	α-helix	trans	-67.8	-40.9	174.7	-54.7	0	0	0	0	111.7	L398 K399 I400 T405 Q406	L398-T402 WeakPolarHBondContact O-CB 3.16Å; L398-T402 PolarHBondContact O-N 2.95Å; L398-T402 PolarHBondContact O-OG1 2.92Å; K399-T402 WeakPolarHBondContact O-CB 3.16Å; K399-T402 PolarHBondContact O-N 2.82Å; I400-T402 PolarHBondContact O-N 3.38Å; T402-T405 WeakPolarHBondContact CA-OG1 3.25Å; T402-T405 PolarHBondContact O-OG1 3.37Å; T402-Q406 WeakPolarHBondContact O-CB 3.5Å; T402-Q406 VanDerWaalsContact O-CG 3.3Å; T402-Q406 WeakPolarHBondContact O-CG 3.5Å; T402-Q406 PolarHBondContact O-N 3.43Å
403	L	83.1	Confident	87.5	Confident	100 Å²	100	93.1 Å²	93.1	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-71.6	-36.9	176.5	-68.9	168.3	0	0	0	112.2	K399 I400 Q406 N407	K399-L403 WeakPolarHBondContact O-CG 3.44Å; K399-L403 PolarHBondContact O-N 3.12Å; I400-L403 PolarHBondContact O-N 2.94Å; L403-Q406 PolarHBondContact O-N 2.99Å; L403-N407 WeakPolarHBondContact O-CB 3.49Å; L403-N407 PolarHBondContact O-N 2.63Å; L403-N407 PolarHBondContact O-ND2 3.41Å
404	E	88.4	Confident	87	Confident	122 Å²	122	95.6 Å²	95.6	57%	0.57	52%	0.516	S	S	*	.	H	α-helix	trans	-63.4	-44	174.3	-73.2	174.8	162.6	0	0	111.7	I400 N407 A408	I400-E404 HydrophobicContact CG2-CG 4.27Å; I400-E404 WeakPolarHBondContact O-CG 3.4Å; I400-E404 PolarHBondContact O-N 2.79Å; E404-N407 PolarHBondContact O-N 3.33Å; E404-A408 WeakPolarHBondContact O-CB 3.29Å; E404-A408 PolarHBondContact O-N 3.31Å
405	T	91.7	Very high	86.4	Confident	86 Å²	86	96.2 Å²	96.2	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-68.9	-34.5	176.2	47.1	0	0	0	0	112.7	Q401 T402 A408 K409	Q401-T405 WeakPolarHBondContact O-CG2 3.29Å; Q401-T405 PolarHBondContact O-N 2.91Å; Q401-T405 PolarHBondContact O-OG1 3.38Å; T402-T405 WeakPolarHBondContact CA-OG1 3.25Å; T402-T405 PolarHBondContact O-OG1 3.37Å; T405-A408 PolarHBondContact O-N 3.26Å; T405-K409 PolarHBondContact O-N 3.37Å
406	Q	87.4	Confident	85.8	Confident	106 Å²	106	96.7 Å²	96.7	50%	0.495	52%	0.52	S	S	.	.	H	α-helix	trans	-64.4	-45.3	169.7	-75.9	176.2	-9.1	0	0	112.3	T402 L403 A408 K409 L410	T402-Q406 WeakPolarHBondContact O-CB 3.5Å; T402-Q406 VanDerWaalsContact O-CG 3.3Å; T402-Q406 WeakPolarHBondContact O-CG 3.5Å; T402-Q406 PolarHBondContact O-N 3.43Å; L403-Q406 PolarHBondContact O-N 2.99Å; Q406-A408 VanDerWaalsContact C-N 3.34Å; Q406-A408 PolarHBondContact O-N 2.95Å; Q406-K409 PolarHBondContact O-N 2.97Å; Q406-L410 WeakPolarHBondContact O-CG 3.34Å; Q406-L410 PolarHBondContact O-N 3.28Å
407	N	86.4	Confident	84.7	Confident	101 Å²	101	97.8 Å²	97.8	54%	0.54	52%	0.524	S	S	.	.	H	α-helix	trans	-62.9	-38.3	176	-79.8	-27.4	0	0	0	112.3	L403 E404 L410 S411	L403-N407 WeakPolarHBondContact O-CB 3.49Å; L403-N407 PolarHBondContact O-N 2.63Å; L403-N407 PolarHBondContact O-ND2 3.41Å; E404-N407 PolarHBondContact O-N 3.33Å; N407-L410 PolarHBondContact O-N 2.91Å; N407-S411 WeakPolarHBondContact O-CB 3.44Å; N407-S411 PolarHBondContact O-N 2.9Å; N407-S411 PolarHBondContact O-OG 3.37Å
408	A	90	Very high	83.5	Confident	61 Å²	61	102.6 Å²	102.6	50%	0.504	54%	0.538	S	S	.	.	H	α-helix	trans	-62.5	-44.7	173.8	0	0	0	0	0	111.7	E404 T405 Q406 S411 Q412	E404-A408 WeakPolarHBondContact O-CB 3.29Å; E404-A408 PolarHBondContact O-N 3.31Å; T405-A408 PolarHBondContact O-N 3.26Å; Q406-A408 VanDerWaalsContact C-N 3.34Å; Q406-A408 PolarHBondContact O-N 2.95Å; A408-S411 PolarHBondContact O-N 3.05Å; A408-Q412 PolarHBondContact O-N 2.85Å
409	K	90.5	Very high	82	Confident	123 Å²	123	100.9 Å²	100.9	54%	0.535	54%	0.54	S	S	.	.	H	α-helix	trans	-61.6	-47.2	175.5	-175.5	175.3	-177.4	-77.7	0	112.1	T405 Q406 S411 Q412 E413	T405-K409 PolarHBondContact O-N 3.37Å; Q406-K409 PolarHBondContact O-N 2.97Å; K409-S411 VanDerWaalsContact C-N 3.31Å; K409-S411 PolarHBondContact O-N 3.11Å; K409-Q412 WeakPolarHBondContact O-CB 3.29Å; K409-Q412 PolarHBondContact O-N 3.46Å; K409-Q412 VanDerWaalsContact O-N 3.14Å; K409-E413 WeakPolarHBondContact CE-OE1 3.37Å; K409-E413 IonicContact NZ-OE1 2.75Å; K409-E413 PolarHBondContact NZ-OE1 2.61Å; K409-E413 IonicContact NZ-OE2 3.67Å; K409-E413 WeakPolarHBondContact O-CG 3.49Å; K409-E413 PolarHBondContact O-N 2.97Å
410	L	84.4	Confident	80.4	Confident	91 Å²	91	99.7 Å²	99.7	48%	0.476	54%	0.544	S	S	.	.	H	α-helix	trans	-62.6	-37.3	177.1	-71.3	170.2	0	0	0	112.1	Q406 N407 Q412 E413 L414	Q406-L410 WeakPolarHBondContact O-CG 3.34Å; Q406-L410 PolarHBondContact O-N 3.28Å; N407-L410 PolarHBondContact O-N 2.91Å; L410-Q412 VanDerWaalsContact C-N 3.33Å; L410-E413 PolarHBondContact O-N 3.41Å; L410-L414 WeakPolarHBondContact O-CB 3.26Å; L410-L414 WeakPolarHBondContact O-CG 3.14Å; L410-L414 PolarHBondContact O-N 2.96Å
411	S	82.4	Confident	79	Confident	67 Å²	67	100.5 Å²	100.5	47%	0.469	56%	0.555	S	S	.	*	H	α-helix	trans	-65.5	-36.4	174.6	-56.9	0	0	0	0	112	N407 A408 K409 S415	N407-S411 WeakPolarHBondContact O-CB 3.44Å; N407-S411 PolarHBondContact O-N 2.9Å; N407-S411 PolarHBondContact O-OG 3.37Å; A408-S411 PolarHBondContact O-N 3.05Å; K409-S411 VanDerWaalsContact C-N 3.31Å; K409-S411 PolarHBondContact O-N 3.11Å; S411-S415 WeakPolarHBondContact O-CB 3.28Å; S411-S415 PolarHBondContact O-N 2.99Å; S411-S415 PolarHBondContact O-OG 2.98Å
412	Q	85.3	Confident	77	Confident	145 Å²	145	100 Å²	100	68%	0.678	56%	0.562	S	S	*	*	H	α-helix	trans	-70.3	-39.1	174.7	-171.2	177.2	2.1	0	0	112.1	A408 K409 L410 S415 S416	A408-Q412 PolarHBondContact O-N 2.85Å; K409-Q412 WeakPolarHBondContact O-CB 3.29Å; K409-Q412 PolarHBondContact O-N 3.46Å; K409-Q412 VanDerWaalsContact O-N 3.14Å; L410-Q412 VanDerWaalsContact C-N 3.33Å; Q412-S415 PolarHBondContact O-N 2.91Å; Q412-S416 PolarHBondContact O-N 3.47Å; Q412-S416 PolarHBondContact O-OG 3.05Å
413	E	81.6	Confident	74.9	Confident	76 Å²	76	102.8 Å²	102.8	36%	0.355	58%	0.581	S	S	.	*	H	α-helix	trans	-67.8	-39.4	175.2	-73.1	172.9	172.2	0	0	112.4	K409 L410 S415 S416 M417	K409-E413 WeakPolarHBondContact CE-OE1 3.37Å; K409-E413 IonicContact NZ-OE1 2.75Å; K409-E413 PolarHBondContact NZ-OE1 2.61Å; K409-E413 IonicContact NZ-OE2 3.67Å; K409-E413 WeakPolarHBondContact O-CG 3.49Å; K409-E413 PolarHBondContact O-N 2.97Å; L410-E413 PolarHBondContact O-N 3.41Å; E413-S415 VanDerWaalsContact C-N 3.33Å; E413-S416 PolarHBondContact O-N 3.17Å; E413-S416 PolarHBondContact O-OG 3.09Å; E413-S416 VanDerWaalsContact O-OG 3.05Å; E413-M417 WeakPolarHBondContact O-CG 3.42Å; E413-M417 PolarHBondContact O-N 3.34Å
414	L	75.4	Confident	73	Confident	108 Å²	108	105.4 Å²	105.4	57%	0.565	60%	0.596	S	S	*	*	H	α-helix	trans	-61.1	-43.1	169.7	-74.9	165.9	0	0	0	111.5	L410 S416 M417 Q418	L410-L414 WeakPolarHBondContact O-CB 3.26Å; L410-L414 WeakPolarHBondContact O-CG 3.14Å; L410-L414 PolarHBondContact O-N 2.96Å; L414-S416 PolarHBondContact O-N 3.3Å; L414-M417 HydrophobicContact CD2-CE 4.02Å; L414-M417 PolarHBondContact O-N 2.91Å; L414-Q418 WeakPolarHBondContact O-CB 3.48Å; L414-Q418 PolarHBondContact O-N 3.16Å
415	S	75.9	Confident	71	Confident	75 Å²	75	105 Å²	105	52%	0.524	61%	0.607	S	S	.	*	H	α-helix	trans	-66.5	-34.8	179.1	-58.1	0	0	0	0	112.9	S411 Q412 E413 Q418 A419	S411-S415 WeakPolarHBondContact O-CB 3.28Å; S411-S415 PolarHBondContact O-N 2.99Å; S411-S415 PolarHBondContact O-OG 2.98Å; Q412-S415 PolarHBondContact O-N 2.91Å; E413-S415 VanDerWaalsContact C-N 3.33Å; S415-Q418 PolarHBondContact O-N 3.25Å; S415-A419 PolarHBondContact O-N 3.38Å
416	S	76	Confident	68.7	Low	71 Å²	71	105.3 Å²	105.3	50%	0.497	62%	0.618	S	S	.	*	H	α-helix	trans	-75.9	-37.1	176.8	63.2	0	0	0	0	112.6	Q412 E413 L414 Q418 A419	Q412-S416 PolarHBondContact O-N 3.47Å; Q412-S416 PolarHBondContact O-OG 3.05Å; E413-S416 PolarHBondContact O-N 3.17Å; E413-S416 PolarHBondContact O-OG 3.09Å; E413-S416 VanDerWaalsContact O-OG 3.05Å; L414-S416 PolarHBondContact O-N 3.3Å; S416-Q418 VanDerWaalsContact C-N 3.25Å; S416-Q418 PolarHBondContact O-N 2.98Å; S416-A419 PolarHBondContact O-N 3.44Å; S416-A419 VanDerWaalsContact O-N 3.09Å
417	M	64.3	Low	66.6	Low	127 Å²	127	108.7 Å²	108.7	63%	0.626	63%	0.633	S	S	*	*	H	α-helix	trans	-64	-30.5	170.5	-70.5	-172.4	-65.8	0	0	112.5	E413 L414 A419 T420	E413-M417 WeakPolarHBondContact O-CG 3.42Å; E413-M417 PolarHBondContact O-N 3.34Å; L414-M417 HydrophobicContact CD2-CE 4.02Å; L414-M417 PolarHBondContact O-N 2.91Å; M417-A419 VanDerWaalsContact C-N 3.28Å; M417-T420 PolarHBondContact O-OG1 2.69Å
418	Q	62.1	Low	64.9	Low	175 Å²	175	112 Å²	112	82%	0.818	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-10.2	174.1	-164.8	167.2	7.6	0	0	113.5	L414 S415 S416	L414-Q418 WeakPolarHBondContact O-CB 3.48Å; L414-Q418 PolarHBondContact O-N 3.16Å; S415-Q418 PolarHBondContact O-N 3.25Å; S416-Q418 VanDerWaalsContact C-N 3.25Å; S416-Q418 PolarHBondContact O-N 2.98Å
419	A	61.8	Low	62.9	Low	77 Å²	77	117.5 Å²	117.5	64%	0.636	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-11.1	-179.5	0	0	0	0	0	114.3	S415 S416 M417	S415-A419 PolarHBondContact O-N 3.38Å; S416-A419 PolarHBondContact O-N 3.44Å; S416-A419 VanDerWaalsContact O-N 3.09Å; M417-A419 VanDerWaalsContact C-N 3.28Å
420	T	53.9	Low	61.1	Low	104 Å²	104	116.6 Å²	116.6	64%	0.638	67%	0.667	S	S	*	*	S	Bend	trans	-74.7	124.3	170.5	36.3	0	0	0	0	110.8	M417	M417-T420 PolarHBondContact O-OG1 2.69Å
421	P	57.8	Low	60.2	Low	110 Å²	110	116 Å²	116	71%	0.714	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-67.8	147.4	177.2	29.2	-34.7	0	0	0	110.8
422	P	48.4	Very low	59.5	Low	109 Å²	109	117.6 Å²	117.6	71%	0.708	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-67.5	143.7	174.1	29.9	-34.5	0	0	0	110.4
423	P	45.8	Very low	58.8	Low	125 Å²	125	118.1 Å²	118.1	81%	0.812	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-65.7	139.6	165.1	29.4	-33.3	0	0	0	109.6	S425	P423-S425 PolarHBondContact O-N 3.4Å
424	D	43.3	Very low	58.4	Low	154 Å²	154	119.1 Å²	119.1	82%	0.824	69%	0.685	S	S	*	*	S	Bend	trans	-64.9	124.5	-171.8	-78.2	-57.8	0	0	0	113.3
425	S	47.3	Very low	58.2	Low	114 Å²	114	119.3 Å²	119.3	80%	0.797	68%	0.684	S	S	*	*			trans	48.3	89.5	152.8	61.7	0	0	0	0	119.2	P423	P423-S425 PolarHBondContact O-N 3.4Å
426	A	42.6	Very low	58.4	Low	92 Å²	92	121.3 Å²	121.3	76%	0.76	69%	0.688	S	S	*	*			trans	-156.7	140.5	140.5	0	0	0	0	0	113.7
427	H	42.4	Very low	58.5	Low	178 Å²	178	120.5 Å²	120.5	82%	0.824	69%	0.685	S	S	*	*			trans	47.7	96.7	161.7	-61.5	-40.8	0	0	0	120.3	Q429	H427-Q429 PolarHBondContact O-N 3.09Å
428	N	52.3	Low	59.1	Low	171 Å²	171	119.4 Å²	119.4	91%	0.914	68%	0.68	S	S	*	*			trans	-58.3	93.3	147.9	-78	-31.2	0	0	0	111.1
429	Q	47.9	Very low	59.8	Low	175 Å²	175	117 Å²	117	82%	0.818	67%	0.669	S	S	*	*			trans	-158.8	103.3	154.1	-116.9	167.5	85.8	0	0	108.8	H427 T431	H427-Q429 PolarHBondContact O-N 3.09Å; Q429-T431 PolarHBondContact O-N 3.17Å
430	L	52.4	Low	61	Low	104 Å²	104	119.6 Å²	119.6	55%	0.545	67%	0.666	S	S	.	*			trans	-63.3	123.4	161.5	-88.8	71.1	0	0	0	106.7	Q435	L430-Q435 HydrophobicContact CB-CG 4.14Å; L430-Q435 HydrophobicContact CD2-CG 4Å
431	T	64.9	Low	62.4	Low	80 Å²	80	121.9 Å²	121.9	49%	0.491	66%	0.662	S	S	.	*			trans	-60.2	139.6	172.6	44.2	0	0	0	0	109.4	Q429 E433 L434 Q435	Q429-T431 PolarHBondContact O-N 3.17Å; T431-E433 PolarHBondContact O-N 2.92Å; T431-E433 VanDerWaalsContact O-N 3.15Å; T431-L434 WeakPolarHBondContact O-CB 3.43Å; T431-L434 PolarHBondContact O-N 3Å; T431-Q435 PolarHBondContact O-N 3.13Å
432	P	67.9	Low	63.5	Low	100 Å²	100	121 Å²	121	65%	0.649	65%	0.651	S	S	*	*	H	α-helix	trans	-61.1	-27.6	-177.7	23.7	-33.4	0	0	0	111.9	L434 Q435 L436	P432-L434 PolarHBondContact O-N 2.96Å; P432-Q435 PolarHBondContact O-N 3.05Å; P432-L436 VanDerWaalsContact O-CB 3.28Å; P432-L436 WeakPolarHBondContact O-CB 3.26Å; P432-L436 PolarHBondContact O-N 3.25Å
433	E	69.8	Low	65.1	Low	156 Å²	156	119.5 Å²	119.5	73%	0.729	64%	0.637	S	S	*	*	H	α-helix	trans	-61.1	-39.1	172	-60	-174.1	145	0	0	112.9	T431 L436 A437	T431-E433 PolarHBondContact O-N 2.92Å; T431-E433 VanDerWaalsContact O-N 3.15Å; E433-L436 PolarHBondContact O-N 3.22Å; E433-A437 WeakPolarHBondContact O-CB 3.45Å; E433-A437 PolarHBondContact O-N 3.37Å
434	L	73.3	Confident	66.7	Low	96 Å²	96	116.9 Å²	116.9	50%	0.503	62%	0.616	S	S	.	*	H	α-helix	trans	-71.3	-38.9	178.7	-177.7	62.5	0	0	0	111.5	T431 P432 M438	T431-L434 WeakPolarHBondContact O-CB 3.43Å; T431-L434 PolarHBondContact O-N 3Å; P432-L434 PolarHBondContact O-N 2.96Å; L434-M438 VanDerWaalsContact O-CB 3.3Å; L434-M438 WeakPolarHBondContact O-CB 3.24Å; L434-M438 PolarHBondContact O-N 3.3Å
435	Q	72.9	Confident	68.3	Low	113 Å²	113	116 Å²	116	53%	0.528	60%	0.601	S	S	.	*	H	α-helix	trans	-63.4	-46.5	173	-70.5	-173.3	-38.3	0	0	111.2	L430 T431 P432 M438 E439	L430-Q435 HydrophobicContact CB-CG 4.14Å; L430-Q435 HydrophobicContact CD2-CG 4Å; T431-Q435 PolarHBondContact O-N 3.13Å; P432-Q435 PolarHBondContact O-N 3.05Å; Q435-M438 PolarHBondContact O-N 3.41Å; Q435-E439 WeakPolarHBondContact O-CB 3.46Å; Q435-E439 PolarHBondContact O-N 3.41Å
436	L	79.5	Confident	69.7	Low	117 Å²	117	114.7 Å²	114.7	61%	0.613	58%	0.584	S	S	*	*	H	α-helix	trans	-70.6	-33.7	-178.4	-165.1	147.4	0	0	0	112.3	P432 E433 K440	P432-L436 VanDerWaalsContact O-CB 3.28Å; P432-L436 WeakPolarHBondContact O-CB 3.26Å; P432-L436 PolarHBondContact O-N 3.25Å; E433-L436 PolarHBondContact O-N 3.22Å; L436-K440 WeakPolarHBondContact O-CB 3.43Å; L436-K440 PolarHBondContact O-N 2.99Å
437	A	78.1	Confident	71.3	Confident	54 Å²	54	115.3 Å²	115.3	45%	0.446	57%	0.57	S	S	.	*	H	α-helix	trans	-65.5	-41.9	170.6	0	0	0	0	0	112	E433 W441	E433-A437 WeakPolarHBondContact O-CB 3.45Å; E433-A437 PolarHBondContact O-N 3.37Å; A437-W441 WeakPolarHBondContact O-CB 3.37Å; A437-W441 PolarHBondContact O-N 2.68Å
438	M	75.8	Confident	72.6	Confident	103 Å²	103	112.1 Å²	112.1	51%	0.507	56%	0.555	S	S	.	*	H	α-helix	trans	-69.6	-41.4	177.7	-176.2	155	52.8	0	0	112.1	L434 Q435 W441 L442	L434-M438 VanDerWaalsContact O-CB 3.3Å; L434-M438 WeakPolarHBondContact O-CB 3.24Å; L434-M438 PolarHBondContact O-N 3.3Å; Q435-M438 PolarHBondContact O-N 3.41Å; M438-W441 PolarHBondContact O-N 2.8Å; M438-L442 WeakPolarHBondContact O-CB 3.38Å; M438-L442 PolarHBondContact O-N 3.49Å
439	E	78.1	Confident	72.8	Confident	126 Å²	126	110.9 Å²	110.9	59%	0.589	54%	0.544	S	S	*	.	H	α-helix	trans	-62.7	-45.2	173.8	-175.1	174.3	-155.9	0	0	111.4	Q435 W441 L442 I443	Q435-E439 WeakPolarHBondContact O-CB 3.46Å; Q435-E439 PolarHBondContact O-N 3.41Å; E439-W441 PolarHBondContact O-N 3.45Å; E439-L442 WeakPolarHBondContact O-CB 3.33Å; E439-L442 PolarHBondContact O-N 3Å; E439-I443 HydrophobicContact CG-CD1 4.05Å; E439-I443 WeakPolarHBondContact O-CG1 3.42Å; E439-I443 PolarHBondContact O-N 3.39Å
440	K	87.3	Confident	73.2	Confident	131 Å²	131	108.5 Å²	108.5	57%	0.57	53%	0.533	S	S	*	.	H	α-helix	trans	-58	-48.9	173.7	180	-176.1	174.2	-171.8	0	111.8	L436 L442 I443 D444	L436-K440 WeakPolarHBondContact O-CB 3.43Å; L436-K440 PolarHBondContact O-N 2.99Å; K440-L442 VanDerWaalsContact C-N 3.29Å; K440-L442 PolarHBondContact O-N 2.93Å; K440-I443 PolarHBondContact O-N 3Å; K440-D444 WeakPolarHBondContact CE-OD2 3.29Å; K440-D444 PolarHBondContact O-N 3.47Å
441	W	83	Confident	73.3	Confident	151 Å²	151	107.5 Å²	107.5	57%	0.572	53%	0.531	S	S	*	.	H	α-helix	trans	-60.3	-39.1	178.4	178	90.9	0	0	0	111.9	A437 M438 E439 R445	A437-W441 WeakPolarHBondContact O-CB 3.37Å; A437-W441 PolarHBondContact O-N 2.68Å; M438-W441 PolarHBondContact O-N 2.8Å; E439-W441 PolarHBondContact O-N 3.45Å; W441-R445 VanDerWaalsContact CZ2-NH1 3.27Å; W441-R445 VanDerWaalsContact O-CB 3.23Å; W441-R445 WeakPolarHBondContact O-CB 3.46Å; W441-R445 PolarHBondContact O-N 2.88Å
442	L	81.3	Confident	72.7	Confident	92 Å²	92	107.4 Å²	107.4	48%	0.482	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-45.3	175.4	-128	159.8	0	0	0	111.6	M438 E439 K440 R445 I446	M438-L442 WeakPolarHBondContact O-CB 3.38Å; M438-L442 PolarHBondContact O-N 3.49Å; E439-L442 WeakPolarHBondContact O-CB 3.33Å; E439-L442 PolarHBondContact O-N 3Å; K440-L442 VanDerWaalsContact C-N 3.29Å; K440-L442 PolarHBondContact O-N 2.93Å; L442-R445 PolarHBondContact O-N 2.87Å; L442-I446 HydrophobicContact CD2-CD1 3.75Å; L442-I446 HydrophobicContact CD2-CG1 4.33Å; L442-I446 VanDerWaalsContact O-CG1 3.26Å; L442-I446 WeakPolarHBondContact O-CG1 3.5Å; L442-I446 PolarHBondContact O-N 3.34Å
443	I	80.9	Confident	71.7	Confident	78 Å²	78	110.8 Å²	110.8	40%	0.4	53%	0.532	S	S	.	.	H	α-helix	trans	-62.9	-47.3	177.1	-72	167.1	0	0	0	111.5	E439 K440 R445 I446 K447	E439-I443 HydrophobicContact CG-CD1 4.05Å; E439-I443 WeakPolarHBondContact O-CG1 3.42Å; E439-I443 PolarHBondContact O-N 3.39Å; K440-I443 PolarHBondContact O-N 3Å; I443-R445 VanDerWaalsContact C-N 3.33Å; I443-R445 PolarHBondContact O-N 3.32Å; I443-I446 PolarHBondContact O-N 3.05Å; I443-K447 VanDerWaalsContact CG2-CE 3.49Å; I443-K447 WeakPolarHBondContact O-CG 3.41Å; I443-K447 PolarHBondContact O-N 3.46Å
444	D	80.3	Confident	70.6	Confident	69 Å²	69	110 Å²	110	37%	0.369	53%	0.532	S	S	.	.	H	α-helix	trans	-68.5	-34.2	-178	-69.5	-23.7	0	0	0	111.4	K440 K447 E448	K440-D444 WeakPolarHBondContact CE-OD2 3.29Å; K440-D444 PolarHBondContact O-N 3.47Å; D444-K447 PolarHBondContact O-N 3.37Å; D444-K447 IonicContact OD1-NZ 2.83Å; D444-K447 PolarHBondContact OD1-NZ 3.45Å; D444-E448 PolarHBondContact O-N 3.14Å
445	R	76.5	Confident	69.3	Low	135 Å²	135	113.2 Å²	113.2	51%	0.509	55%	0.545	S	S	.	.	H	α-helix	trans	-74.9	-27.7	175	-155.9	172.7	-167.1	-163.3	-0.3	113.9	W441 L442 I443 Q449	W441-R445 VanDerWaalsContact CZ2-NH1 3.27Å; W441-R445 VanDerWaalsContact O-CB 3.23Å; W441-R445 WeakPolarHBondContact O-CB 3.46Å; W441-R445 PolarHBondContact O-N 2.88Å; L442-R445 PolarHBondContact O-N 2.87Å; I443-R445 VanDerWaalsContact C-N 3.33Å; I443-R445 PolarHBondContact O-N 3.32Å; R445-Q449 PolarHBondContact O-N 3.42Å
446	I	77.3	Confident	67.8	Low	88 Å²	88	113 Å²	113	45%	0.451	55%	0.551	S	S	.	*	H	α-helix	trans	-66.8	-47.4	168.7	-74	165.3	0	0	0	110	L442 I443 E448 Q449 E450	L442-I446 HydrophobicContact CD2-CD1 3.75Å; L442-I446 HydrophobicContact CD2-CG1 4.33Å; L442-I446 VanDerWaalsContact O-CG1 3.26Å; L442-I446 WeakPolarHBondContact O-CG1 3.5Å; L442-I446 PolarHBondContact O-N 3.34Å; I443-I446 PolarHBondContact O-N 3.05Å; I446-E448 VanDerWaalsContact C-N 3.29Å; I446-E448 PolarHBondContact O-N 2.99Å; I446-Q449 PolarHBondContact O-N 3.46Å; I446-E450 PolarHBondContact O-N 3.01Å
447	K	74.4	Confident	65.9	Low	104 Å²	104	115.4 Å²	115.4	45%	0.452	56%	0.556	S	S	.	*	H	α-helix	trans	-58.3	-41.9	175.8	-67	169.8	-164.3	155.2	0	111.9	I443 D444 Q449 E450 T451	I443-K447 VanDerWaalsContact CG2-CE 3.49Å; I443-K447 WeakPolarHBondContact O-CG 3.41Å; I443-K447 PolarHBondContact O-N 3.46Å; D444-K447 PolarHBondContact O-N 3.37Å; D444-K447 IonicContact OD1-NZ 2.83Å; D444-K447 PolarHBondContact OD1-NZ 3.45Å; K447-Q449 VanDerWaalsContact C-N 3.28Å; K447-Q449 PolarHBondContact O-N 3.27Å; K447-E450 PolarHBondContact O-N 3.49Å; K447-T451 PolarHBondContact O-N 3.46Å; K447-T451 PolarHBondContact O-OG1 3Å
448	E	70.2	Confident	64.1	Low	112 Å²	112	120 Å²	120	52%	0.523	57%	0.57	S	S	.	*	H	α-helix	trans	-60.1	-36	175.7	-174.8	178.6	-133.3	0	0	111.9	D444 I446 T451 N452	D444-E448 PolarHBondContact O-N 3.14Å; I446-E448 VanDerWaalsContact C-N 3.29Å; I446-E448 PolarHBondContact O-N 2.99Å; E448-T451 PolarHBondContact O-OG1 3.09Å; E448-T451 VanDerWaalsContact O-OG1 3.11Å; E448-N452 WeakPolarHBondContact O-CB 3.45Å; E448-N452 PolarHBondContact O-N 2.99Å; E448-N452 VanDerWaalsContact O-N 3.13Å; E448-N452 PolarHBondContact O-ND2 3.49Å
449	Q	56.7	Low	62.4	Low	145 Å²	145	120.5 Å²	120.5	68%	0.678	58%	0.575	S	S	*	*	H	α-helix	trans	-72.4	-34	171	-72.3	-159.1	-12.3	0	0	113.1	R445 I446 K447 K453	R445-Q449 PolarHBondContact O-N 3.42Å; I446-Q449 PolarHBondContact O-N 3.46Å; K447-Q449 VanDerWaalsContact C-N 3.28Å; K447-Q449 PolarHBondContact O-N 3.27Å; Q449-K453 WeakPolarHBondContact O-CB 3.38Å; Q449-K453 PolarHBondContact O-N 3.15Å
450	E	56.3	Low	60.6	Low	125 Å²	125	117.7 Å²	117.7	58%	0.584	57%	0.569	S	S	*	*	H	α-helix	trans	-69.8	-38.3	176.6	-68.5	-170.6	140.9	0	0	112.8	I446 K447 K453 L454	I446-E450 PolarHBondContact O-N 3.01Å; K447-E450 PolarHBondContact O-N 3.49Å; E450-K453 PolarHBondContact O-N 3.44Å; E450-L454 PolarHBondContact O-N 3.05Å; E450-L454 VanDerWaalsContact O-N 3.13Å
451	T	54.7	Low	58.5	Low	83 Å²	83	116.4 Å²	116.4	51%	0.509	57%	0.572	S	S	.	*	H	α-helix	trans	-67.9	-45	172.9	54.4	0	0	0	0	111.5	K447 E448 K453 L454 E455	K447-T451 PolarHBondContact O-N 3.46Å; K447-T451 PolarHBondContact O-OG1 3Å; E448-T451 PolarHBondContact O-OG1 3.09Å; E448-T451 VanDerWaalsContact O-OG1 3.11Å; T451-K453 PolarHBondContact O-N 2.91Å; T451-L454 WeakPolarHBondContact O-CA 3.43Å; T451-L454 WeakPolarHBondContact O-CB 3.33Å; T451-L454 PolarHBondContact O-N 3.34Å; T451-E455 PolarHBondContact O-N 2.91Å
452	N	52	Low	56.6	Low	78 Å²	78	113.2 Å²	113.2	42%	0.417	59%	0.586	S	S	.	*	H	α-helix	trans	-61.9	-27.5	173.4	-81.2	-65.2	0	0	0	112.5	E448 V456	E448-N452 WeakPolarHBondContact O-CB 3.45Å; E448-N452 PolarHBondContact O-N 2.99Å; E448-N452 VanDerWaalsContact O-N 3.13Å; E448-N452 PolarHBondContact O-ND2 3.49Å; N452-V456 VanDerWaalsContact O-CB 3.29Å; N452-V456 WeakPolarHBondContact O-CB 3.47Å; N452-V456 VanDerWaalsContact O-CG2 3.31Å; N452-V456 WeakPolarHBondContact O-CG2 3.22Å; N452-V456 PolarHBondContact O-N 2.66Å
453	K	46.5	Very low	55.1	Low	170 Å²	170	113.6 Å²	113.6	74%	0.739	60%	0.595	S	S	*	*	H	α-helix	trans	-78.5	-17.2	174	-168.2	176.8	-177	-177.6	0	113.3	Q449 E450 T451	Q449-K453 WeakPolarHBondContact O-CB 3.38Å; Q449-K453 PolarHBondContact O-N 3.15Å; E450-K453 PolarHBondContact O-N 3.44Å; T451-K453 PolarHBondContact O-N 2.91Å
454	L	48.7	Very low	54	Low	140 Å²	140	120.2 Å²	120.2	73%	0.733	62%	0.615	S	S	*	*	H	α-helix	trans	-79.9	-44.9	166.7	-108.3	71.2	0	0	0	111.5	E450 T451 K457	E450-L454 PolarHBondContact O-N 3.05Å; E450-L454 VanDerWaalsContact O-N 3.13Å; T451-L454 WeakPolarHBondContact O-CA 3.43Å; T451-L454 WeakPolarHBondContact O-CB 3.33Å; T451-L454 PolarHBondContact O-N 3.34Å; L454-K457 VanDerWaalsContact O-CB 3.29Å; L454-K457 WeakPolarHBondContact O-CB 3.39Å; L454-K457 PolarHBondContact O-N 2.89Å
455	E	44.8	Very low	53.4	Low	164 Å²	164	125.8 Å²	125.8	77%	0.766	63%	0.631	S	S	*	*	H	α-helix	trans	-75.3	-38.6	-179	-66.1	-166.9	142.1	0	0	112.6	T451 K457	T451-E455 PolarHBondContact O-N 2.91Å; E455-K457 PolarHBondContact O-N 3.38Å
456	V	42.3	Very low	53.7	Low	109 Å²	109	121.7 Å²	121.7	66%	0.661	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	37.6	169.1	-164	0	0	0	0	110.8	N452 M458	N452-V456 VanDerWaalsContact O-CB 3.29Å; N452-V456 WeakPolarHBondContact O-CB 3.47Å; N452-V456 VanDerWaalsContact O-CG2 3.31Å; N452-V456 WeakPolarHBondContact O-CG2 3.22Å; N452-V456 PolarHBondContact O-N 2.66Å; V456-M458 PolarHBondContact O-N 3.26Å
457	K	39.6	Very low	54.1	Low	166 Å²	166	122.8 Å²	122.8	72%	0.722	63%	0.625	S	S	*	*			trans	-73.5	66	153.3	-169.9	-159.6	170	-160.4	0	108.6	L454 E455 D459	L454-K457 VanDerWaalsContact O-CB 3.29Å; L454-K457 WeakPolarHBondContact O-CB 3.39Å; L454-K457 PolarHBondContact O-N 2.89Å; E455-K457 PolarHBondContact O-N 3.38Å; K457-D459 PolarHBondContact O-N 2.87Å
458	M	39.8	Very low	54.7	Low	151 Å²	151	117.9 Å²	117.9	74%	0.744	60%	0.604	S	S	*	*			trans	-50	122.2	171.8	175.4	174.7	164.8	0	0	108.9	V456 C460	V456-M458 PolarHBondContact O-N 3.26Å; M458-C460 VanDerWaalsContact C-N 3.29Å; M458-C460 PolarHBondContact O-N 2.72Å
459	D	40.5	Very low	55.5	Low	113 Å²	113	116.4 Å²	116.4	60%	0.604	60%	0.6	S	S	*	*			trans	-77.8	77.5	-165.2	-169.1	14.3	0	0	0	112.9	K457 T461	K457-D459 PolarHBondContact O-N 2.87Å; D459-T461 VanDerWaalsContact C-N 3.25Å; D459-T461 VanDerWaalsContact CG-OG1 3.32Å; D459-T461 PolarHBondContact O-N 2.92Å; D459-T461 WeakPolarHBondContact OD1-CB 3.47Å; D459-T461 WeakPolarHBondContact OD1-CG2 3.28Å; D459-T461 PolarHBondContact OD1-N 2.87Å; D459-T461 PolarHBondContact OD1-OG1 3.38Å; D459-T461 PolarHBondContact OD2-OG1 2.93Å
460	C	40.5	Very low	57.1	Low	68 Å²	68	115.6 Å²	115.6	46%	0.459	59%	0.594	S	S	.	*			trans	-90	61.8	159.9	-66.2	0	0	0	0	109.5	M458 G462 C463	M458-C460 VanDerWaalsContact C-N 3.29Å; M458-C460 PolarHBondContact O-N 2.72Å; C460-G462 PolarHBondContact O-N 2.98Å; C460-C463 HydrophobicContact CB-CB 3.8Å; C460-C463 WeakPolarHBondContact O-CB 3.4Å; C460-C463 PolarHBondContact O-N 3.31Å
461	T	41.5	Very low	58.9	Low	104 Å²	104	111.6 Å²	111.6	64%	0.638	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-47.7	-44.2	168.7	4.5	0	0	0	0	110.4	D459 C463 R464	D459-T461 VanDerWaalsContact C-N 3.25Å; D459-T461 VanDerWaalsContact CG-OG1 3.32Å; D459-T461 PolarHBondContact O-N 2.92Å; D459-T461 WeakPolarHBondContact OD1-CB 3.47Å; D459-T461 WeakPolarHBondContact OD1-CG2 3.28Å; D459-T461 PolarHBondContact OD1-N 2.87Å; D459-T461 PolarHBondContact OD1-OG1 3.38Å; D459-T461 PolarHBondContact OD2-OG1 2.93Å; T461-C463 PolarHBondContact O-N 3.36Å; T461-C463 VanDerWaalsContact O-N 3.1Å; T461-R464 PolarHBondContact O-N 2.75Å
462	G	44.5	Very low	60.7	Low	83 Å²	83	111 Å²	111	86%	0.856	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-66.8	-0.4	175	0	0	0	0	0	117.1	C460	C460-G462 PolarHBondContact O-N 2.98Å
463	C	48.5	Very low	62.8	Low	101 Å²	101	107.9 Å²	107.9	68%	0.682	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-102.4	-3.2	174.1	-72.9	0	0	0	0	113.7	C460 T461 R465	C460-C463 HydrophobicContact CB-CB 3.8Å; C460-C463 WeakPolarHBondContact O-CB 3.4Å; C460-C463 PolarHBondContact O-N 3.31Å; T461-C463 PolarHBondContact O-N 3.36Å; T461-C463 VanDerWaalsContact O-N 3.1Å; C463-R465 PolarHBondContact O-N 2.72Å
464	R	57.7	Low	65.2	Low	217 Å²	217	100.3 Å²	100.3	82%	0.819	52%	0.524	S	S	*	.	S	Bend	trans	-81.1	97.7	176.3	-164.7	-179.7	-160.9	-167	3	109.5	T461	T461-R464 PolarHBondContact O-N 2.75Å
465	R	68.9	Low	67.6	Low	185 Å²	185	93.7 Å²	93.7	70%	0.698	49%	0.489	S	S	*	.			trans	-48.3	139.6	174.1	-65.3	-171.5	-172.1	172.9	2.3	110.8	C463 D469 K470	C463-R465 PolarHBondContact O-N 2.72Å; R465-D469 HydrophobicContact CB-CB 4.19Å; R465-K470 VanDerWaalsContact O-CE 3.29Å; R465-K470 WeakPolarHBondContact O-CE 3.19Å; R465-K470 PolarHBondContact O-NZ 3.45Å
466	P	81.6	Confident	70	Confident	49 Å²	49	87.4 Å²	87.4	32%	0.318	46%	0.46	S	S	.	.			trans	-50	160.9	175.3	-30	36	0	0	0	113.6	A468 D469 K470 T600	P466-A468 VanDerWaalsContact C-N 3.33Å; P466-A468 HydrophobicContact CB-CB 4.46Å; P466-D469 PolarHBondContact O-N 3.48Å; P466-K470 WeakPolarHBondContact O-CE 3.29Å; P466-K470 PolarHBondContact O-NZ 3.44Å; P466-K470 VanDerWaalsContact O-NZ 3.07Å; P466-T600 HydrophobicContact CB-CG2 3.67Å; P466-T600 HydrophobicContact CG-CG2 4.09Å
467	E	86.1	Confident	72.6	Confident	112 Å²	112	84.1 Å²	84.1	52%	0.523	44%	0.438	S	S	.	.	S	Bend	trans	-65.3	-39.6	176.6	-164.9	153.7	146	0	0	112.1	D469 K470 M471 T602	E467-D469 PolarHBondContact O-N 2.95Å; E467-K470 WeakPolarHBondContact O-CB 3.39Å; E467-K470 PolarHBondContact O-N 2.95Å; E467-M471 HydrophobicContact CG-CE 4.23Å; E467-T602 HydrophobicContact CB-CG2 4.37Å
468	A	86.9	Confident	75.2	Confident	1 Å²	1	81.8 Å²	81.8	1%	0.008	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-45.7	-42.1	169.3	0	0	0	0	0	114.6	P466 K470 M471 T552 T600 T602	P466-A468 VanDerWaalsContact C-N 3.33Å; P466-A468 HydrophobicContact CB-CB 4.46Å; A468-K470 PolarHBondContact O-N 3.46Å; A468-M471 PolarHBondContact O-N 2.87Å; A468-M471 VanDerWaalsContact O-O 3.09Å; A468-T552 HydrophobicContact CB-CG2 3.63Å; A468-T552 VanDerWaalsContact CB-OG1 3.27Å; A468-T552 WeakPolarHBondContact CB-OG1 3.41Å; A468-T600 HydrophobicContact CB-CG2 4.1Å; A468-T602 PolarHBondContact N-OG1 2.93Å
469	D	88	Confident	77.7	Confident	81 Å²	81	78 Å²	78	43%	0.433	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-75.2	-5	-175.8	-73.5	10.6	0	0	0	113.5	R465 P466 E467 R636	R465-D469 HydrophobicContact CB-CB 4.19Å; P466-D469 PolarHBondContact O-N 3.48Å; E467-D469 PolarHBondContact O-N 2.95Å; D469-R636 IonicContact OD1-CZ 3.21Å; D469-R636 IonicContact OD1-NH1 2.64Å; D469-R636 PolarHBondContact OD1-NH1 3.33Å
470	K	90.4	Very high	80.3	Confident	127 Å²	127	75 Å²	75	55%	0.552	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-99.5	-4.6	176.1	-56.9	164.4	-164.4	122	0	111.8	R465 P466 E467 A468	R465-K470 VanDerWaalsContact O-CE 3.29Å; R465-K470 WeakPolarHBondContact O-CE 3.19Å; R465-K470 PolarHBondContact O-NZ 3.45Å; P466-K470 WeakPolarHBondContact O-CE 3.29Å; P466-K470 PolarHBondContact O-NZ 3.44Å; P466-K470 VanDerWaalsContact O-NZ 3.07Å; E467-K470 WeakPolarHBondContact O-CB 3.39Å; E467-K470 PolarHBondContact O-N 2.95Å; A468-K470 PolarHBondContact O-N 3.46Å
471	M	92.9	Very high	83	Confident	42 Å²	42	72 Å²	72	21%	0.207	39%	0.394	C	S	.	.	S	Bend	trans	-121.1	146.7	-177.1	-66.5	-172.3	-73.9	0	0	110.9	E467 A468 D473 H550 T602 H638	E467-M471 HydrophobicContact CG-CE 4.23Å; A468-M471 PolarHBondContact O-N 2.87Å; A468-M471 VanDerWaalsContact O-O 3.09Å; M471-D473 PolarHBondContact O-N 3.43Å; M471-H550 HydrophobicContact CE-CB 3.91Å; M471-H550 HydrophobicContact SD-CB 4.34Å; M471-T602 HydrophobicContact CE-CG2 3.73Å; M471-H638 HydrophobicContact CB-CB 4.01Å; M471-H638 HydrophobicContact CE-CB 4.11Å; M471-H638 HydrophobicContact SD-CB 3.92Å
472	P	94.1	Very high	85.6	Confident	69 Å²	69	69.7 Å²	69.7	45%	0.448	38%	0.382	S	S	.	.			trans	-62.2	136.3	171.1	26.7	-34.4	0	0	0	110.5	F474 H638	P472-F474 HydrophobicContact CB-CD2 4.43Å; P472-F474 HydrophobicContact CB-CE2 3.88Å; P472-F474 HydrophobicContact CB-CZ 3.97Å; P472-F474 HydrophobicContact CG-CD2 4.38Å; P472-F474 HydrophobicContact CG-CE2 3.52Å; P472-F474 HydrophobicContact CG-CZ 3.78Å; P472-H638 PolarHBondContact O-ND1 2.93Å
473	D	95.9	Very high	88.1	Confident	13 Å²	13	66.6 Å²	66.6	7%	0.07	35%	0.346	C	S	.	.			trans	-96.1	107.6	172.3	-176.9	-1.4	0	0	0	108.9	M471 A475 L476 Q479 R634 R636 V637	M471-D473 PolarHBondContact O-N 3.43Å; D473-A475 PolarHBondContact OD1-N 3.13Å; D473-L476 HydrophobicContact CB-CB 4.29Å; D473-L476 PolarHBondContact OD1-N 2.76Å; D473-Q479 PolarHBondContact O-NE2 3.02Å; D473-Q479 PolarHBondContact O-OE1 2.86Å; D473-R634 IonicContact OD2-CZ 2.68Å; D473-R634 IonicContact OD2-NE 2.72Å; D473-R634 IonicContact OD2-NH2 2.8Å; D473-R634 PolarHBondContact OD2-NH2 2.85Å; D473-R636 HydrophobicContact CB-CB 4.45Å; D473-R636 WeakPolarHBondContact OD1-CA 3.42Å; D473-R636 WeakPolarHBondContact OD2-CG 3.39Å; D473-V637 PolarHBondContact OD1-N 3.41Å
474	F	96.8	Very high	90.2	Very high	12 Å²	12	62.7 Å²	62.7	5%	0.053	32%	0.319	C	S	.	.	S	Bend	trans	-89.1	-5.7	179.8	-64.6	-80.4	0	0	0	113.2	P472 L542 S543 H544 I546 V637 L641	P472-F474 HydrophobicContact CB-CD2 4.43Å; P472-F474 HydrophobicContact CB-CE2 3.88Å; P472-F474 HydrophobicContact CB-CZ 3.97Å; P472-F474 HydrophobicContact CG-CD2 4.38Å; P472-F474 HydrophobicContact CG-CE2 3.52Å; P472-F474 HydrophobicContact CG-CZ 3.78Å; F474-L542 WeakPolarHBondContact O-CA 3.43Å; F474-S543 PolarHBondContact O-N 3.22Å; F474-S543 PolarHBondContact O-OG 3.25Å; F474-H544 HydrophobicContact CD1-CB 4.15Å; F474-H544 HydrophobicContact CE1-CB 4.32Å; F474-I546 HydrophobicContact CB-CD1 4.06Å; F474-I546 HydrophobicContact CD1-CG2 3.84Å; F474-I546 HydrophobicContact CD2-CD1 3.72Å; F474-I546 HydrophobicContact CD2-CG2 4Å; F474-I546 HydrophobicContact CE1-CG2 3.84Å; F474-I546 HydrophobicContact CE2-CD1 4.39Å; F474-I546 HydrophobicContact CE2-CG2 3.95Å; F474-I546 HydrophobicContact CG-CD1 4.04Å; F474-I546 HydrophobicContact CG-CG2 3.92Å; F474-I546 HydrophobicContact CZ-CG2 3.88Å; F474-V637 PolarHBondContact N-O 3.26Å; F474-L641 HydrophobicContact CE1-CD2 3.75Å; F474-L641 HydrophobicContact CE1-CG 4.22Å; F474-L641 HydrophobicContact CZ-CD2 4.25Å; F474-L641 HydrophobicContact CZ-CG 4.26Å
475	A	97.4	Very high	91.6	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-89.3	-6.8	172.5	0	0	0	0	0	112.6	D473 E477 A481 I517 I540 L542 V637	D473-A475 PolarHBondContact OD1-N 3.13Å; A475-E477 PolarHBondContact O-N 2.92Å; A475-A481 WeakPolarHBondContact O-CB 3.25Å; A475-I517 HydrophobicContact CB-CG2 4.41Å; A475-I517 VanDerWaalsContact O-CB 3.25Å; A475-I517 WeakPolarHBondContact O-CB 3.43Å; A475-I517 VanDerWaalsContact O-CG2 3.29Å; A475-I517 WeakPolarHBondContact O-CG2 3.28Å; A475-I540 HydrophobicContact CB-CD1 4.42Å; A475-I540 HydrophobicContact CB-CG2 4.25Å; A475-L542 HydrophobicContact CB-CD2 4.26Å; A475-V637 HydrophobicContact CB-CB 4.09Å; A475-V637 HydrophobicContact CB-CG2 3.92Å
476	L	96.8	Very high	92.4	Very high	33 Å²	33	53.9 Å²	53.9	17%	0.173	31%	0.313	C	S	.	.			trans	-65.3	120.8	-176.2	179.6	61.6	0	0	0	113.4	D473 T478 Q479 A481	D473-L476 HydrophobicContact CB-CB 4.29Å; D473-L476 PolarHBondContact OD1-N 2.76Å; L476-T478 VanDerWaalsContact C-N 3.34Å; L476-T478 WeakPolarHBondContact CG-OG1 3.24Å; L476-T478 PolarHBondContact O-N 3.36Å; L476-Q479 HydrophobicContact CB-CB 4.14Å; L476-Q479 HydrophobicContact CD2-CB 4.37Å; L476-Q479 HydrophobicContact CG-CB 4.3Å; L476-Q479 WeakPolarHBondContact O-CB 3.31Å; L476-Q479 PolarHBondContact O-N 2.96Å; L476-A481 WeakPolarHBondContact O-CB 3.09Å; L476-A481 PolarHBondContact O-N 2.88Å
477	E	96.1	Very high	92.6	Very high	39 Å²	39	54.6 Å²	54.6	18%	0.182	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-58.2	-42	-177.1	-175.2	167.1	-103.6	0	0	112.7	A475 Q479 G480 R514 I517 Q518	A475-E477 PolarHBondContact O-N 2.92Å; E477-Q479 PolarHBondContact O-N 2.83Å; E477-Q479 VanDerWaalsContact O-N 3.15Å; E477-G480 PolarHBondContact O-N 3.33Å; E477-R514 IonicContact OE1-CZ 3.38Å; E477-R514 VanDerWaalsContact OE1-CZ 3.26Å; E477-R514 IonicContact OE1-NE 3.41Å; E477-R514 PolarHBondContact OE1-NE 3.48Å; E477-R514 IonicContact OE1-NH2 2.77Å; E477-R514 PolarHBondContact OE1-NH2 3.23Å; E477-R514 IonicContact OE2-CZ 2.86Å; E477-R514 IonicContact OE2-NE 3.86Å; E477-R514 IonicContact OE2-NH2 2.72Å; E477-R514 PolarHBondContact OE2-NH2 2.94Å; E477-I517 HydrophobicContact CB-CB 4.44Å; E477-I517 HydrophobicContact CB-CD1 3.85Å; E477-I517 HydrophobicContact CB-CG1 3.98Å; E477-I517 WeakPolarHBondContact CB-O 3.01Å; E477-I517 HydrophobicContact CG-CD1 4.29Å; E477-I517 PolarHBondContact N-O 3.11Å; E477-Q518 WeakPolarHBondContact OE2-CG 3.03Å
478	T	93.9	Very high	92.8	Very high	117 Å²	117	50.3 Å²	50.3	72%	0.718	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-69.6	-9.4	179.1	55.7	0	0	0	0	113.8	L476	L476-T478 VanDerWaalsContact C-N 3.34Å; L476-T478 WeakPolarHBondContact CG-OG1 3.24Å; L476-T478 PolarHBondContact O-N 3.36Å
479	Q	93.2	Very high	93.1	Very high	72 Å²	72	52 Å²	52	34%	0.336	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-94.8	0.3	171.3	-154.6	-169.8	98	0	0	112.5	D473 L476 E477 S543	D473-Q479 PolarHBondContact O-NE2 3.02Å; D473-Q479 PolarHBondContact O-OE1 2.86Å; L476-Q479 HydrophobicContact CB-CB 4.14Å; L476-Q479 HydrophobicContact CD2-CB 4.37Å; L476-Q479 HydrophobicContact CG-CB 4.3Å; L476-Q479 WeakPolarHBondContact O-CB 3.31Å; L476-Q479 PolarHBondContact O-N 2.96Å; E477-Q479 PolarHBondContact O-N 2.83Å; E477-Q479 VanDerWaalsContact O-N 3.15Å; Q479-S543 VanDerWaalsContact O-CB 3.27Å; Q479-S543 WeakPolarHBondContact O-CB 3.44Å; Q479-S543 PolarHBondContact OE1-OG 3.3Å
480	G	94.9	Very high	93.3	Very high	51 Å²	51	55 Å²	55	53%	0.526	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.4	14.1	-178.7	0	0	0	0	0	115.2	E477	E477-G480 PolarHBondContact O-N 3.33Å
481	A	96.9	Very high	93.4	Very high	4 Å²	4	50 Å²	50	3%	0.033	30%	0.295	C	S	.	.			trans	-75.4	160.7	164.1	0	0	0	0	0	111.1	A475 L476 S541	A475-A481 WeakPolarHBondContact O-CB 3.25Å; L476-A481 WeakPolarHBondContact O-CB 3.09Å; L476-A481 PolarHBondContact O-N 2.88Å; A481-S541 CarbonylContact C-O 3.52Å; A481-S541 WeakPolarHBondContact CA-O 3.45Å; A481-S541 WeakPolarHBondContact CB-O 3.38Å
482	S	96.4	Very high	93.3	Very high	55 Å²	55	50.4 Å²	50.4	39%	0.385	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	160.7	179.9	64.6	0	0	0	0	112.8	I540 S541	S482-I540 CarbonylContact O-C 3.57Å; S482-I540 WeakPolarHBondContact O-CA 3.41Å; S482-S541 PolarHBondContact N-O 3.25Å; S482-S541 PolarHBondContact O-N 3.43Å
483	I	95.9	Very high	92.9	Very high	18 Å²	18	55.4 Å²	55.4	9%	0.092	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	134.6	175.4	-59.6	-53.2	0	0	0	110.9	S485 C488 P513 R514 I517 L538 I540	I483-S485 PolarHBondContact O-N 3.1Å; I483-C488 WeakPolarHBondContact CG2-SG 3.35Å; I483-P513 HydrophobicContact CG1-CB 4.48Å; I483-P513 HydrophobicContact CG2-CB 4.12Å; I483-R514 HydrophobicContact CB-CG 4.36Å; I483-R514 HydrophobicContact CG1-CB 4.42Å; I483-R514 HydrophobicContact CG1-CG 3.94Å; I483-I517 HydrophobicContact CD1-CD1 3.67Å; I483-I517 HydrophobicContact CD1-CG1 3.89Å; I483-I517 HydrophobicContact CD1-CG2 4.03Å; I483-I517 HydrophobicContact CG1-CD1 3.78Å; I483-I517 HydrophobicContact CG1-CG1 4.12Å; I483-L538 HydrophobicContact CD1-CD1 3.93Å; I483-L538 HydrophobicContact CG2-CD1 4.32Å; I483-I540 HydrophobicContact CD1-CG1 3.88Å
484	V	93.7	Very high	91.7	Very high	20 Å²	20	58.8 Å²	58.8	12%	0.121	32%	0.322	C	S	.	.			trans	-88.8	80.6	169.2	-175	0	0	0	0	108.6	T486 R487 C488 V539 F615	V484-T486 PolarHBondContact O-N 3.05Å; V484-R487 PolarHBondContact O-N 3.35Å; V484-R487 VanDerWaalsContact O-N 3.12Å; V484-C488 PolarHBondContact O-SG 3.46Å; V484-V539 HydrophobicContact CB-CB 4.01Å; V484-V539 HydrophobicContact CB-CG1 3.8Å; V484-V539 HydrophobicContact CG1-CG1 4.44Å; V484-V539 HydrophobicContact CG2-CG1 3.95Å; V484-V539 PolarHBondContact N-O 3.25Å; V484-F615 HydrophobicContact CG2-CD1 3.84Å; V484-F615 HydrophobicContact CG2-CE1 3.91Å
485	S	87.3	Confident	90.2	Very high	87 Å²	87	68.4 Å²	68.4	61%	0.608	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-56.8	-21.7	-169.3	-53.1	0	0	0	0	115.2	I483 R487	I483-S485 PolarHBondContact O-N 3.1Å; S485-R487 VanDerWaalsContact C-N 3.34Å
486	T	85.3	Confident	88.5	Confident	129 Å²	129	73.6 Å²	73.6	79%	0.791	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-73.6	-18.8	-179.8	46.5	0	0	0	0	114.5	V484	V484-T486 PolarHBondContact O-N 3.05Å
487	R	85.7	Confident	87	Confident	64 Å²	64	74.8 Å²	74.8	24%	0.242	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-112.3	12.5	177.3	-70.1	179.1	65.1	151.4	0.6	113.2	V484 S485 S537 V539 D581 E583 E617	V484-R487 PolarHBondContact O-N 3.35Å; V484-R487 VanDerWaalsContact O-N 3.12Å; S485-R487 VanDerWaalsContact C-N 3.34Å; R487-S537 PolarHBondContact O-OG 2.96Å; R487-V539 HydrophobicContact CB-CB 4.08Å; R487-V539 HydrophobicContact CB-CG2 3.48Å; R487-V539 VanDerWaalsContact CB-CG2 3.48Å; R487-D581 VanDerWaalsContact CD-O 3.24Å; R487-D581 WeakPolarHBondContact CD-O 3.5Å; R487-D581 PolarHBondContact NH1-O 3.02Å; R487-E583 PolarHBondContact NH1-O 3.41Å; R487-E583 PolarHBondContact NH2-O 2.99Å; R487-E617 IonicContact CZ-OE2 2.59Å; R487-E617 IonicContact NE-OE2 3.73Å; R487-E617 IonicContact NH2-OE2 2.99Å; R487-E617 PolarHBondContact NH2-OE2 3.41Å
488	C	90.7	Very high	86.1	Confident	23 Å²	23	74.8 Å²	74.8	16%	0.155	41%	0.413	C	S	.	.	S	Bend	trans	-97	148.7	178.4	-59.5	0	0	0	0	111.1	I483 V484 S537	I483-C488 WeakPolarHBondContact CG2-SG 3.35Å; V484-C488 PolarHBondContact O-SG 3.46Å; C488-S537 WeakPolarHBondContact CA-O 3.44Å
489	S	93.2	Very high	85.4	Confident	35 Å²	35	73 Å²	73	25%	0.245	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-65.3	162.3	175.5	-61.6	0	0	0	0	113.6	T491 W529 G536 S537	S489-T491 PolarHBondContact O-N 2.93Å; S489-W529 WeakPolarHBondContact O-CZ2 3.41Å; S489-G536 WeakPolarHBondContact OG-CA 3.36Å; S489-S537 PolarHBondContact N-O 3.34Å; S489-S537 PolarHBondContact OG-N 3.43Å
490	E	92.1	Very high	85.1	Confident	145 Å²	145	73.9 Å²	73.9	68%	0.678	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-72.3	119.7	179.8	-173.5	172.4	-173.8	0	0	112	Y492 H532	E490-Y492 PolarHBondContact O-N 3.39Å; E490-H532 PolarHBondContact O-N 3.03Å; E490-H532 PolarHBondContact O-ND1 3.45Å
491	T	93	Very high	84.6	Confident	23 Å²	23	75.5 Å²	75.5	14%	0.141	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-51.6	128	174.4	-64.5	0	0	0	0	112.1	S489 R493 E511 W529 A530 H532	S489-T491 PolarHBondContact O-N 2.93Å; T491-R493 PolarHBondContact O-N 3.41Å; T491-E511 VanDerWaalsContact CG2-O 3.22Å; T491-E511 WeakPolarHBondContact CG2-O 3.19Å; T491-W529 PolarHBondContact OG1-NE1 2.95Å; T491-A530 CarbonylContact C-O 3.57Å; T491-A530 VanDerWaalsContact CA-O 3.31Å; T491-A530 WeakPolarHBondContact CA-O 3.43Å; T491-H532 PolarHBondContact O-CE1 3.24Å
492	Y	91.1	Very high	84.1	Confident	50 Å²	50	84.4 Å²	84.4	20%	0.196	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-68.1	122.4	172.3	-170.8	-128.8	0	0	0	110.7	E490 I494 A530 H532 E628 Y629	E490-Y492 PolarHBondContact O-N 3.39Å; Y492-I494 HydrophobicContact CD1-CD1 4.14Å; Y492-I494 HydrophobicContact CD1-CG1 3.6Å; Y492-I494 HydrophobicContact CE1-CD1 4.19Å; Y492-I494 HydrophobicContact CE1-CG1 3.55Å; Y492-A530 PolarHBondContact N-O 3.45Å; Y492-H532 AromaticContact CD2-CD2 3.52Å; Y492-H532 AromaticContact CD2-CG 4Å; Y492-H532 AromaticContact CD2-NE2 3.57Å; Y492-E628 PolarHBondContact OH-OE2 2.96Å; Y492-Y629 AromaticContact CD1-CD1 3.44Å; Y492-Y629 HydrophobicContact CD1-CD1 3.44Å; Y492-Y629 VanDerWaalsContact CD1-CD1 3.44Å; Y492-Y629 HydrophobicContact CD1-CE1 4.3Å; Y492-Y629 AromaticContact CD1-CG 3.63Å; Y492-Y629 HydrophobicContact CD1-CG 3.63Å; Y492-Y629 AromaticContact CE1-CD1 3.25Å; Y492-Y629 HydrophobicContact CE1-CD1 3.25Å; Y492-Y629 AromaticContact CE1-CE1 3.96Å; Y492-Y629 HydrophobicContact CE1-CE1 3.96Å; Y492-Y629 AromaticContact CE1-CG 3.94Å; Y492-Y629 HydrophobicContact CE1-CG 3.94Å; Y492-Y629 HydrophobicContact CG-CD1 4.47Å; Y492-Y629 HydrophobicContact CG-CG 4.38Å
493	R	83.8	Confident	83.5	Confident	173 Å²	173	84.9 Å²	84.9	65%	0.653	46%	0.456	S	S	*	.			trans	-107.7	83.9	-175.2	-72.4	-173.6	175.7	169.1	4	112	T491 R495	T491-R493 PolarHBondContact O-N 3.41Å; R493-R495 PolarHBondContact O-N 3.45Å; R493-R495 VanDerWaalsContact O-N 3.17Å
494	I	72.4	Confident	82.8	Confident	84 Å²	84	91.1 Å²	91.1	43%	0.431	48%	0.483	S	S	.	.			trans	-61.1	113.2	174.2	-59.1	173.2	0	0	0	109.8	Y492 S496	Y492-I494 HydrophobicContact CD1-CD1 4.14Å; Y492-I494 HydrophobicContact CD1-CG1 3.6Å; Y492-I494 HydrophobicContact CE1-CD1 4.19Å; Y492-I494 HydrophobicContact CE1-CG1 3.55Å; I494-S496 WeakPolarHBondContact CG2-OG 3.16Å; I494-S496 PolarHBondContact O-N 3.31Å; I494-S496 VanDerWaalsContact O-N 3.09Å
495	R	65.3	Low	82.2	Confident	215 Å²	215	93.9 Å²	93.9	81%	0.811	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	16.5	-177.7	-61.2	-174.9	-178.7	-178.2	1	114.5	R493 Y508	R493-R495 PolarHBondContact O-N 3.45Å; R493-R495 VanDerWaalsContact O-N 3.17Å; R495-Y508 HydrophobicContact CB-CD1 4.49Å; R495-Y508 HydrophobicContact CB-CE1 4.41Å; R495-Y508 WeakPolarHBondContact O-CD1 3.46Å; R495-Y508 WeakPolarHBondContact O-CE1 3.31Å
496	S	61	Low	81.9	Confident	109 Å²	109	93.7 Å²	93.7	76%	0.762	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-31.5	-169.8	-48.9	0	0	0	0	114	I494	I494-S496 WeakPolarHBondContact CG2-OG 3.16Å; I494-S496 PolarHBondContact O-N 3.31Å; I494-S496 VanDerWaalsContact O-N 3.09Å
497	A	64.7	Low	81.6	Confident	57 Å²	57	94.6 Å²	94.6	47%	0.471	48%	0.482	S	S	.	.			trans	-98.5	114	176.1	0	0	0	0	0	109.6	Y508 P509	A497-Y508 WeakPolarHBondContact O-CA 3.43Å; A497-Y508 VanDerWaalsContact O-CD1 3.22Å; A497-Y508 WeakPolarHBondContact O-CD1 3.48Å; A497-P509 WeakPolarHBondContact O-CD 3.22Å
498	C	77.3	Confident	81.3	Confident	40 Å²	40	97.2 Å²	97.2	27%	0.27	49%	0.493	S	S	.	.			trans	-122.8	133.6	176.6	-163.1	0	0	0	0	110.8	V500 P505 W507 Y508	C498-V500 PolarHBondContact O-N 2.9Å; C498-P505 WeakPolarHBondContact SG-CB 3.39Å; C498-W507 PolarHBondContact SG-O 3.03Å; C498-Y508 HydrophobicContact CB-CD1 3.78Å; C498-Y508 HydrophobicContact CB-CE1 3.5Å; C498-Y508 HydrophobicContact CB-CG 4.49Å
499	I	80.3	Confident	80.5	Confident	78 Å²	78	99.3 Å²	99.3	40%	0.4	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	105.8	168.8	-60.9	-168.8	0	0	0	107.7	L506 W507 P509	I499-L506 WeakPolarHBondContact O-CB 3.41Å; I499-L506 PolarHBondContact O-N 3.24Å; I499-W507 HydrophobicContact CD1-CZ2 4.1Å; I499-W507 PolarHBondContact N-O 2.79Å; I499-P509 HydrophobicContact CG1-CG 4.38Å
500	V	86.1	Confident	79.9	Confident	91 Å²	91	100 Å²	100	55%	0.552	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	140	175.2	-67	0	0	0	0	111.3	C498 F504	C498-V500 PolarHBondContact O-N 2.9Å; V500-F504 CarbonylContact C-O 3.49Å; V500-F504 VanDerWaalsContact CA-O 3.27Å; V500-F504 WeakPolarHBondContact CA-O 3.46Å
501	L	84.8	Confident	79.8	Confident	86 Å²	86	95.6 Å²	95.6	45%	0.45	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	124.5	172.4	-178.1	64.3	0	0	0	109	G503 F504 L506	L501-G503 PolarHBondContact O-N 2.91Å; L501-G503 VanDerWaalsContact O-N 3.11Å; L501-F504 PolarHBondContact N-O 3.2Å; L501-F504 PolarHBondContact O-N 2.96Å; L501-L506 HydrophobicContact CB-CD1 3.56Å; L501-L506 HydrophobicContact CB-CD2 4.16Å; L501-L506 HydrophobicContact CB-CG 3.82Å; L501-L506 HydrophobicContact CD2-CD1 3.95Å; L501-L506 HydrophobicContact CG-CD1 4.39Å
502	F	85.9	Confident	79.7	Confident	190 Å²	190	96.7 Å²	96.7	83%	0.833	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	29.8	-171.9	-53.9	-65	0	0	0	114.5	F504	F502-F504 VanDerWaalsContact C-N 3.34Å; F502-F504 HydrophobicContact CB-CD2 4.4Å
503	G	84	Confident	79.9	Confident	65 Å²	65	95.1 Å²	95.1	67%	0.67	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	-9.4	-177.3	0	0	0	0	0	115	L501	L501-G503 PolarHBondContact O-N 2.91Å; L501-G503 VanDerWaalsContact O-N 3.11Å
504	F	80.6	Confident	80.4	Confident	149 Å²	149	92.7 Å²	92.7	65%	0.654	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	131.2	176.5	-61.4	-83.8	0	0	0	111	V500 L501 F502 L506	V500-F504 CarbonylContact C-O 3.49Å; V500-F504 VanDerWaalsContact CA-O 3.27Å; V500-F504 WeakPolarHBondContact CA-O 3.46Å; L501-F504 PolarHBondContact N-O 3.2Å; L501-F504 PolarHBondContact O-N 2.96Å; F502-F504 VanDerWaalsContact C-N 3.34Å; F502-F504 HydrophobicContact CB-CD2 4.4Å; F504-L506 PolarHBondContact O-N 2.96Å
505	P	81.1	Confident	81.4	Confident	79 Å²	79	88.9 Å²	88.9	51%	0.513	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	118.1	173.7	28.5	-33	0	0	0	110.4	C498	C498-P505 WeakPolarHBondContact SG-CB 3.39Å
506	L	82.1	Confident	82.9	Confident	83 Å²	83	78.7 Å²	78.7	44%	0.435	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-54.4	178.5	-62.3	-176.9	0	0	0	111.9	I499 L501 F504	I499-L506 WeakPolarHBondContact O-CB 3.41Å; I499-L506 PolarHBondContact O-N 3.24Å; L501-L506 HydrophobicContact CB-CD1 3.56Å; L501-L506 HydrophobicContact CB-CD2 4.16Å; L501-L506 HydrophobicContact CB-CG 3.82Å; L501-L506 HydrophobicContact CD2-CD1 3.95Å; L501-L506 HydrophobicContact CG-CD1 4.39Å; F504-L506 PolarHBondContact O-N 2.96Å
507	W	78.9	Confident	84.5	Confident	147 Å²	147	73.5 Å²	73.5	56%	0.557	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-160.6	161.7	176.7	62.4	83.6	0	0	0	111.9	C498 I499	C498-W507 PolarHBondContact SG-O 3.03Å; I499-W507 HydrophobicContact CD1-CZ2 4.1Å; I499-W507 PolarHBondContact N-O 2.79Å
508	Y	78.9	Confident	85.8	Confident	120 Å²	120	73 Å²	73	47%	0.471	38%	0.379	S	S	.	.			trans	-102.6	107.9	173.2	-61.5	-96	0	0	0	108.3	R495 A497 C498 S510	R495-Y508 HydrophobicContact CB-CD1 4.49Å; R495-Y508 HydrophobicContact CB-CE1 4.41Å; R495-Y508 WeakPolarHBondContact O-CD1 3.46Å; R495-Y508 WeakPolarHBondContact O-CE1 3.31Å; A497-Y508 WeakPolarHBondContact O-CA 3.43Å; A497-Y508 VanDerWaalsContact O-CD1 3.22Å; A497-Y508 WeakPolarHBondContact O-CD1 3.48Å; C498-Y508 HydrophobicContact CB-CD1 3.78Å; C498-Y508 HydrophobicContact CB-CE1 3.5Å; C498-Y508 HydrophobicContact CB-CG 4.49Å; Y508-S510 PolarHBondContact O-N 2.73Å
509	P	73.6	Confident	85.8	Confident	66 Å²	66	72 Å²	72	43%	0.429	38%	0.376	S	S	.	.			trans	-65.6	123.7	175.3	25.5	-33.9	0	0	0	111	A497 I499	A497-P509 WeakPolarHBondContact O-CD 3.22Å; I499-P509 HydrophobicContact CG1-CG 4.38Å
510	S	82.1	Confident	85.7	Confident	51 Å²	51	74.1 Å²	74.1	36%	0.357	38%	0.38	S	S	.	.			trans	-118.2	135.2	169.6	61.3	0	0	0	0	109.6	Y508	Y508-S510 PolarHBondContact O-N 2.73Å
511	E	89.5	Confident	85	Confident	52 Å²	52	76 Å²	76	24%	0.243	39%	0.394	C	S	.	.			trans	-61.9	141.2	174.5	-64.5	-58.5	139	0	0	111.3	T491 T515 K527 C528	T491-E511 VanDerWaalsContact CG2-O 3.22Å; T491-E511 WeakPolarHBondContact CG2-O 3.19Å; E511-T515 PolarHBondContact OE2-OG1 2.87Å; E511-K527 IonicContact OE1-NZ 2.73Å; E511-K527 PolarHBondContact OE1-NZ 3.14Å; E511-K527 IonicContact OE2-NZ 3.61Å; E511-C528 VanDerWaalsContact CB-O 3.27Å; E511-C528 WeakPolarHBondContact CB-O 3.37Å
512	S	91.2	Very high	84.8	Confident	45 Å²	45	76.3 Å²	76.3	32%	0.315	40%	0.4	S	S	.	.			trans	-97.1	161.6	-178	75.2	0	0	0	0	110.9	R514 T515	S512-R514 PolarHBondContact O-N 3.29Å; S512-R514 WeakPolarHBondContact OG-CB 3.37Å; S512-R514 PolarHBondContact OG-N 3.46Å; S512-T515 VanDerWaalsContact O-CB 3.31Å; S512-T515 WeakPolarHBondContact O-CB 3.31Å; S512-T515 PolarHBondContact O-N 3.44Å; S512-T515 PolarHBondContact O-OG1 3.36Å; S512-T515 VanDerWaalsContact O-OG1 3.12Å
513	P	94.3	Very high	84.9	Confident	18 Å²	18	68.8 Å²	68.8	12%	0.117	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-59.5	-19	176.3	-11.4	20	0	0	0	113.5	I483 T515 V516 W529 L538	I483-P513 HydrophobicContact CG1-CB 4.48Å; I483-P513 HydrophobicContact CG2-CB 4.12Å; P513-T515 PolarHBondContact O-N 2.84Å; P513-V516 WeakPolarHBondContact O-CB 3.27Å; P513-V516 WeakPolarHBondContact O-CG2 3.49Å; P513-V516 PolarHBondContact O-N 2.99Å; P513-W529 VanDerWaalsContact CA-CG 3.5Å; P513-W529 HydrophobicContact CB-CD2 3.79Å; P513-W529 HydrophobicContact CB-CE3 4.2Å; P513-W529 HydrophobicContact CB-CG 4.11Å; P513-W529 HydrophobicContact CB-CZ2 4.18Å; P513-W529 HydrophobicContact CG-CD2 4.14Å; P513-W529 HydrophobicContact CG-CG 4.39Å; P513-W529 HydrophobicContact CG-CZ2 3.97Å; P513-L538 HydrophobicContact CB-CD1 3.67Å
514	R	94.4	Very high	85.1	Confident	121 Å²	121	70.4 Å²	70.4	46%	0.457	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-63	-26.6	172.8	-59.5	175.2	58.5	-161.6	-10.3	113	E477 I483 S512 V516 I517 Q518	E477-R514 IonicContact OE1-CZ 3.38Å; E477-R514 VanDerWaalsContact OE1-CZ 3.26Å; E477-R514 IonicContact OE1-NE 3.41Å; E477-R514 PolarHBondContact OE1-NE 3.48Å; E477-R514 IonicContact OE1-NH2 2.77Å; E477-R514 PolarHBondContact OE1-NH2 3.23Å; E477-R514 IonicContact OE2-CZ 2.86Å; E477-R514 IonicContact OE2-NE 3.86Å; E477-R514 IonicContact OE2-NH2 2.72Å; E477-R514 PolarHBondContact OE2-NH2 2.94Å; I483-R514 HydrophobicContact CB-CG 4.36Å; I483-R514 HydrophobicContact CG1-CB 4.42Å; I483-R514 HydrophobicContact CG1-CG 3.94Å; S512-R514 PolarHBondContact O-N 3.29Å; S512-R514 WeakPolarHBondContact OG-CB 3.37Å; S512-R514 PolarHBondContact OG-N 3.46Å; R514-V516 PolarHBondContact O-N 3.4Å; R514-I517 WeakPolarHBondContact O-CG1 3.41Å; R514-I517 PolarHBondContact O-N 3Å; R514-Q518 WeakPolarHBondContact O-CG 3.31Å; R514-Q518 PolarHBondContact O-N 3.5Å
515	T	93.6	Very high	85.6	Confident	5 Å²	5	66.8 Å²	66.8	3%	0.031	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-57	-32.8	177.8	-55.4	0	0	0	0	111	E511 S512 P513 I517 Q518	E511-T515 PolarHBondContact OE2-OG1 2.87Å; S512-T515 VanDerWaalsContact O-CB 3.31Å; S512-T515 WeakPolarHBondContact O-CB 3.31Å; S512-T515 PolarHBondContact O-N 3.44Å; S512-T515 PolarHBondContact O-OG1 3.36Å; S512-T515 VanDerWaalsContact O-OG1 3.12Å; P513-T515 PolarHBondContact O-N 2.84Å; T515-I517 PolarHBondContact O-N 2.98Å; T515-Q518 PolarHBondContact O-N 3.48Å
516	V	95.8	Very high	85.9	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-62.7	-25.2	176.9	-170.5	0	0	0	0	113.4	P513 R514 W529 L538 L632 R634 F635	P513-V516 WeakPolarHBondContact O-CB 3.27Å; P513-V516 WeakPolarHBondContact O-CG2 3.49Å; P513-V516 PolarHBondContact O-N 2.99Å; R514-V516 PolarHBondContact O-N 3.4Å; V516-W529 HydrophobicContact CG2-CB 3.63Å; V516-W529 HydrophobicContact CG2-CD2 4.49Å; V516-W529 HydrophobicContact CG2-CE3 4.01Å; V516-W529 HydrophobicContact CG2-CG 4.4Å; V516-L538 HydrophobicContact CB-CD2 4.03Å; V516-L538 HydrophobicContact CG1-CD2 3.72Å; V516-L538 HydrophobicContact CG2-CD2 4.12Å; V516-L632 HydrophobicContact CG1-CB 4.37Å; V516-L632 HydrophobicContact CG2-CB 3.91Å; V516-R634 VanDerWaalsContact O-CA 3.28Å; V516-R634 WeakPolarHBondContact O-CA 3.38Å; V516-R634 WeakPolarHBondContact O-CG 3.42Å; V516-F635 HydrophobicContact CG1-CB 3.67Å; V516-F635 PolarHBondContact O-N 3.35Å; V516-F635 VanDerWaalsContact O-N 3.15Å
517	I	96	Very high	86.3	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-113.1	1.5	-176.6	58.9	161	0	0	0	114.4	A475 E477 I483 R514 T515 G519 I540	A475-I517 HydrophobicContact CB-CG2 4.41Å; A475-I517 VanDerWaalsContact O-CB 3.25Å; A475-I517 WeakPolarHBondContact O-CB 3.43Å; A475-I517 VanDerWaalsContact O-CG2 3.29Å; A475-I517 WeakPolarHBondContact O-CG2 3.28Å; E477-I517 HydrophobicContact CB-CB 4.44Å; E477-I517 HydrophobicContact CB-CD1 3.85Å; E477-I517 HydrophobicContact CB-CG1 3.98Å; E477-I517 WeakPolarHBondContact CB-O 3.01Å; E477-I517 HydrophobicContact CG-CD1 4.29Å; E477-I517 PolarHBondContact N-O 3.11Å; I483-I517 HydrophobicContact CD1-CD1 3.67Å; I483-I517 HydrophobicContact CD1-CG1 3.89Å; I483-I517 HydrophobicContact CD1-CG2 4.03Å; I483-I517 HydrophobicContact CG1-CD1 3.78Å; I483-I517 HydrophobicContact CG1-CG1 4.12Å; R514-I517 WeakPolarHBondContact O-CG1 3.41Å; R514-I517 PolarHBondContact O-N 3Å; T515-I517 PolarHBondContact O-N 2.98Å; I517-G519 PolarHBondContact O-N 3.45Å; I517-I540 HydrophobicContact CG2-CD1 3.86Å; I517-I540 HydrophobicContact CG2-CG1 4.43Å; I517-I540 HydrophobicContact CG2-CG2 4.27Å
518	Q	91	Very high	87	Confident	45 Å²	45	59.4 Å²	59.4	21%	0.21	33%	0.328	C	S	.	.	S	Bend	trans	-72.9	-12.4	-176.8	-84.5	164.8	4.3	0	0	114.7	E477 R514 T515 Y520	E477-Q518 WeakPolarHBondContact OE2-CG 3.03Å; R514-Q518 WeakPolarHBondContact O-CG 3.31Å; R514-Q518 PolarHBondContact O-N 3.5Å; T515-Q518 PolarHBondContact O-N 3.48Å; Q518-Y520 HydrophobicContact CB-CD2 4.12Å; Q518-Y520 HydrophobicContact CB-CE2 3.72Å; Q518-Y520 PolarHBondContact O-N 3.48Å
519	G	78.2	Confident	87.8	Confident	20 Å²	20	53.7 Å²	53.7	21%	0.206	31%	0.305	C	S	.	.			trans	72.7	26.1	165.9	0	0	0	0	0	116	I517	I517-G519 PolarHBondContact O-N 3.45Å
520	Y	77.9	Confident	88.8	Confident	123 Å²	123	51 Å²	51	48%	0.482	29%	0.288	S	S	.	.			trans	-54.3	136.2	175.2	-65.9	-68.4	0	0	0	111.4	Q518 V522	Q518-Y520 HydrophobicContact CB-CD2 4.12Å; Q518-Y520 HydrophobicContact CB-CE2 3.72Å; Q518-Y520 PolarHBondContact O-N 3.48Å; Y520-V522 VanDerWaalsContact C-N 3.28Å; Y520-V522 PolarHBondContact O-N 3.17Å
521	P	70.4	Confident	89.5	Confident	129 Å²	129	48.5 Å²	48.5	84%	0.838	27%	0.271	S	S	*	.	S	Bend	trans	-79.9	-7.9	-176.9	32.8	-36.8	0	0	0	113.7
522	V	81.3	Confident	89.7	Confident	94 Å²	94	50.5 Å²	50.5	57%	0.57	28%	0.28	S	S	*	.	S	Bend	trans	-135.2	128.3	176.7	-177.8	0	0	0	0	107.5	Y520 L524	Y520-V522 VanDerWaalsContact C-N 3.28Å; Y520-V522 PolarHBondContact O-N 3.17Å; V522-L524 HydrophobicContact CG1-CD2 4.24Å; V522-L524 PolarHBondContact O-N 2.89Å
523	L	87.9	Confident	89.8	Confident	32 Å²	32	49.4 Å²	49.4	17%	0.168	28%	0.277	C	S	.	.			trans	-76.5	115.1	174.1	-50.5	-178.6	0	0	0	108.6	D554 H555 L556 Y633	L523-D554 HydrophobicContact CD1-CB 4.01Å; L523-D554 HydrophobicContact CD2-CB 4.2Å; L523-H555 VanDerWaalsContact CD1-C 3.49Å; L523-H555 VanDerWaalsContact CD1-O 3.26Å; L523-H555 WeakPolarHBondContact CD1-O 3.47Å; L523-L556 HydrophobicContact CB-CD1 4.34Å; L523-Y633 HydrophobicContact CB-CD1 4.31Å
524	L	88.8	Confident	89.9	Confident	99 Å²	99	51.4 Å²	51.4	52%	0.518	29%	0.288	S	S	.	.			trans	-98.6	129.7	179	-63.4	176.1	0	0	0	109.5	V522 G526 K527 Y633	V522-L524 HydrophobicContact CG1-CD2 4.24Å; V522-L524 PolarHBondContact O-N 2.89Å; L524-G526 PolarHBondContact O-N 3.02Å; L524-K527 HydrophobicContact CB-CB 4.25Å; L524-K527 HydrophobicContact CB-CG 4.06Å; L524-K527 WeakPolarHBondContact O-CB 3.46Å; L524-K527 PolarHBondContact O-N 2.94Å; L524-Y633 WeakPolarHBondContact O-CE1 3.39Å
525	P	90.7	Very high	90	Very high	73 Å²	73	51.8 Å²	51.8	47%	0.474	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	130.3	178.7	-26.7	32.4	0	0	0	112.6	K527 L556	P525-K527 VanDerWaalsContact C-N 3.28Å; P525-K527 PolarHBondContact O-N 3.37Å; P525-L556 HydrophobicContact CB-CD2 4.03Å; P525-L556 HydrophobicContact CG-CD1 3.92Å; P525-L556 HydrophobicContact CG-CD2 3.99Å
526	G	87.4	Confident	90.1	Very high	50 Å²	50	52.1 Å²	52.1	52%	0.515	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	-0.5	-177.2	0	0	0	0	0	115.5	L524 C528 Y633	L524-G526 PolarHBondContact O-N 3.02Å; G526-C528 VanDerWaalsContact C-N 3.27Å; G526-C528 PolarHBondContact O-N 3.06Å; G526-Y633 PolarHBondContact N-OH 3.05Å
527	K	90.8	Very high	90.2	Very high	92 Å²	92	53.4 Å²	53.4	40%	0.4	31%	0.309	S	S	.	.			trans	-92.5	60.3	165.8	-67.1	-59.3	-171.5	176	0	111.3	E511 L524 P525 Y633	E511-K527 IonicContact OE1-NZ 2.73Å; E511-K527 PolarHBondContact OE1-NZ 3.14Å; E511-K527 IonicContact OE2-NZ 3.61Å; L524-K527 HydrophobicContact CB-CB 4.25Å; L524-K527 HydrophobicContact CB-CG 4.06Å; L524-K527 WeakPolarHBondContact O-CB 3.46Å; L524-K527 PolarHBondContact O-N 2.94Å; P525-K527 VanDerWaalsContact C-N 3.28Å; P525-K527 PolarHBondContact O-N 3.37Å; K527-Y633 WeakPolarHBondContact O-CD1 3.22Å
528	C	93.3	Very high	90.2	Very high	11 Å²	11	53.4 Å²	53.4	7%	0.074	31%	0.308	C	S	.	.	S	Bend	trans	-129.3	150.9	171	55.9	0	0	0	0	109.8	E511 G526 C631 L632 Y633	E511-C528 VanDerWaalsContact CB-O 3.27Å; E511-C528 WeakPolarHBondContact CB-O 3.37Å; G526-C528 VanDerWaalsContact C-N 3.27Å; G526-C528 PolarHBondContact O-N 3.06Å; C528-C631 HydrophobicContact CB-CB 3.83Å; C528-C631 WeakPolarHBondContact CB-SG 3.44Å; C528-C631 WeakPolarHBondContact SG-CB 3.46Å; C528-C631 CovalentContact SG-SG 2.04Å; C528-C631 PolarHBondContact SG-SG 3.28Å; C528-L632 CarbonylContact C-O 3.53Å; C528-L632 VanDerWaalsContact CA-O 3.28Å; C528-L632 WeakPolarHBondContact CA-O 3.48Å; C528-L632 VanDerWaalsContact CB-O 3.31Å; C528-L632 WeakPolarHBondContact CB-O 3.42Å; C528-Y633 HydrophobicContact CB-CD1 3.79Å; C528-Y633 HydrophobicContact CB-CD2 3.53Å; C528-Y633 HydrophobicContact CB-CE1 3.82Å; C528-Y633 HydrophobicContact CB-CE2 3.56Å; C528-Y633 HydrophobicContact CB-CG 3.64Å; C528-Y633 VanDerWaalsContact SG-CZ 3.58Å
529	W	95.3	Very high	90.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	119.6	167.4	170.9	55.3	0	0	0	109	S489 T491 P513 V516 F531 S537 L538 C631 L632	S489-W529 WeakPolarHBondContact O-CZ2 3.41Å; T491-W529 PolarHBondContact OG1-NE1 2.95Å; P513-W529 VanDerWaalsContact CA-CG 3.5Å; P513-W529 HydrophobicContact CB-CD2 3.79Å; P513-W529 HydrophobicContact CB-CE3 4.2Å; P513-W529 HydrophobicContact CB-CG 4.11Å; P513-W529 HydrophobicContact CB-CZ2 4.18Å; P513-W529 HydrophobicContact CG-CD2 4.14Å; P513-W529 HydrophobicContact CG-CG 4.39Å; P513-W529 HydrophobicContact CG-CZ2 3.97Å; V516-W529 HydrophobicContact CG2-CB 3.63Å; V516-W529 HydrophobicContact CG2-CD2 4.49Å; V516-W529 HydrophobicContact CG2-CE3 4.01Å; V516-W529 HydrophobicContact CG2-CG 4.4Å; W529-F531 HydrophobicContact CE3-CD1 4.2Å; W529-F531 HydrophobicContact CH2-CB 4.17Å; W529-F531 AromaticContact CH2-CD1 3.83Å; W529-F531 HydrophobicContact CH2-CD1 3.83Å; W529-F531 HydrophobicContact CH2-CG 4.36Å; W529-F531 HydrophobicContact CZ2-CB 3.92Å; W529-F531 HydrophobicContact CZ2-CD1 4.32Å; W529-F531 AromaticContact CZ3-CD1 3.75Å; W529-F531 HydrophobicContact CZ3-CD1 3.75Å; W529-F531 HydrophobicContact CZ3-CE1 4.37Å; W529-S537 WeakPolarHBondContact CH2-O 3.09Å; W529-L538 HydrophobicContact CE3-CD1 4.25Å; W529-L538 HydrophobicContact CH2-CD1 4.35Å; W529-L538 HydrophobicContact CZ3-CB 3.98Å; W529-L538 HydrophobicContact CZ3-CD1 3.89Å; W529-L538 HydrophobicContact CZ3-CD2 4.37Å; W529-L538 HydrophobicContact CZ3-CG 4.31Å; W529-C631 WeakPolarHBondContact O-CA 3.16Å; W529-L632 HydrophobicContact CE3-CB 4.42Å; W529-L632 HydrophobicContact CE3-CD1 3.94Å; W529-L632 HydrophobicContact CZ3-CD1 3.86Å; W529-L632 PolarHBondContact N-O 3.32Å; W529-L632 PolarHBondContact O-N 3.34Å
530	A	95.4	Very high	91.4	Very high	9 Å²	9	50.3 Å²	50.3	7%	0.074	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	139.3	173	0	0	0	0	0	110.9	T491 Y492 Y629 T630	T491-A530 CarbonylContact C-O 3.57Å; T491-A530 VanDerWaalsContact CA-O 3.31Å; T491-A530 WeakPolarHBondContact CA-O 3.43Å; Y492-A530 PolarHBondContact N-O 3.45Å; A530-Y629 HydrophobicContact CB-CD2 4.06Å; A530-Y629 HydrophobicContact CB-CG 4.48Å; A530-T630 VanDerWaalsContact CA-O 3.29Å; A530-T630 WeakPolarHBondContact CA-O 3.49Å
531	F	95.6	Very high	92.3	Very high	0 Å²	0	45 Å²	45	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	156.6	166.8	59.6	-100.4	0	0	0	110.5	W529 Q535 V620 Y629 T630 L632	W529-F531 HydrophobicContact CE3-CD1 4.2Å; W529-F531 HydrophobicContact CH2-CB 4.17Å; W529-F531 AromaticContact CH2-CD1 3.83Å; W529-F531 HydrophobicContact CH2-CD1 3.83Å; W529-F531 HydrophobicContact CH2-CG 4.36Å; W529-F531 HydrophobicContact CZ2-CB 3.92Å; W529-F531 HydrophobicContact CZ2-CD1 4.32Å; W529-F531 AromaticContact CZ3-CD1 3.75Å; W529-F531 HydrophobicContact CZ3-CD1 3.75Å; W529-F531 HydrophobicContact CZ3-CE1 4.37Å; F531-Q535 WeakPolarHBondContact CD2-O 3.44Å; F531-Q535 VanDerWaalsContact CE2-O 3.29Å; F531-Q535 WeakPolarHBondContact CE2-O 3.39Å; F531-V620 HydrophobicContact CE1-CG2 4.22Å; F531-V620 HydrophobicContact CZ-CB 3.84Å; F531-V620 HydrophobicContact CZ-CG1 4.12Å; F531-V620 HydrophobicContact CZ-CG2 4Å; F531-Y629 WeakPolarHBondContact O-CA 3.5Å; F531-Y629 VanDerWaalsContact O-CB 3.25Å; F531-Y629 WeakPolarHBondContact O-CB 3.46Å; F531-T630 HydrophobicContact CE1-CG2 4.32Å; F531-T630 HydrophobicContact CE2-CG2 4.38Å; F531-T630 VanDerWaalsContact CZ-CB 3.49Å; F531-T630 HydrophobicContact CZ-CG2 3.79Å; F531-T630 PolarHBondContact N-O 3.33Å; F531-T630 PolarHBondContact O-N 2.9Å; F531-T630 VanDerWaalsContact O-N 3.13Å; F531-L632 HydrophobicContact CE1-CD1 4.04Å; F531-L632 HydrophobicContact CE1-CG 4.11Å
532	H	94.3	Very high	93.6	Very high	93 Å²	93	38.9 Å²	38.9	43%	0.431	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	134.8	-177.5	-65.8	82.7	0	0	0	112.2	E490 T491 Y492	E490-H532 PolarHBondContact O-N 3.03Å; E490-H532 PolarHBondContact O-ND1 3.45Å; T491-H532 PolarHBondContact O-CE1 3.24Å; Y492-H532 AromaticContact CD2-CD2 3.52Å; Y492-H532 AromaticContact CD2-CG 4Å; Y492-H532 AromaticContact CD2-NE2 3.57Å
533	G	94.1	Very high	94.3	Very high	23 Å²	23	34.9 Å²	34.9	24%	0.237	21%	0.206	C	C	.	.	S	Bend	trans	72.4	-159.5	176.3	0	0	0	0	0	115.2	E628 Y629 T630	G533-E628 PolarHBondContact N-O 3.49Å; G533-Y629 CarbonylContact O-C 3.59Å; G533-Y629 VanDerWaalsContact O-C 3.29Å; G533-Y629 WeakPolarHBondContact O-CA 3.27Å; G533-T630 PolarHBondContact O-N 3.11Å; G533-T630 VanDerWaalsContact O-N 3.17Å; G533-T630 PolarHBondContact O-OG1 3.19Å
534	V	96.1	Very high	94.7	Very high	60 Å²	60	37.2 Å²	37.2	36%	0.364	22%	0.216	S	C	.	.	S	Bend	trans	-99.9	-4.9	-171.7	-49.9	0	0	0	0	114.2	S622 T630	V534-S622 CarbonylContact O-C 3.53Å; V534-S622 WeakPolarHBondContact O-CA 3.32Å; V534-S622 PolarHBondContact O-N 3.43Å; V534-T630 WeakPolarHBondContact CA-OG1 3.36Å
535	Q	96.9	Very high	95	Very high	129 Å²	129	35.1 Å²	35.1	60%	0.603	21%	0.208	S	C	*	.			trans	-129.6	140.5	-176.4	-80.4	176.3	-0.3	0	0	111.2	F531 V620 L621	F531-Q535 WeakPolarHBondContact CD2-O 3.44Å; F531-Q535 VanDerWaalsContact CE2-O 3.29Å; F531-Q535 WeakPolarHBondContact CE2-O 3.39Å; Q535-V620 WeakPolarHBondContact CA-O 3.39Å; Q535-L621 WeakPolarHBondContact CG-O 3.37Å; Q535-L621 PolarHBondContact NE2-O 3.33Å
536	G	96.1	Very high	95.2	Very high	11 Å²	11	31.6 Å²	31.6	11%	0.113	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172	160.5	-179.9	0	0	0	0	0	115	S489 R619 V620	S489-G536 WeakPolarHBondContact OG-CA 3.36Å; G536-R619 CarbonylContact O-C 3.54Å; G536-R619 WeakPolarHBondContact O-CA 3.33Å; G536-V620 PolarHBondContact N-O 3.08Å; G536-V620 VanDerWaalsContact N-O 3.14Å; G536-V620 PolarHBondContact O-N 3.27Å
537	S	96.2	Very high	95.5	Very high	28 Å²	28	34.2 Å²	34.2	20%	0.196	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	144.8	-179.5	62.3	0	0	0	0	111.9	R487 C488 S489 W529 L618	R487-S537 PolarHBondContact O-OG 2.96Å; C488-S537 WeakPolarHBondContact CA-O 3.44Å; S489-S537 PolarHBondContact N-O 3.34Å; S489-S537 PolarHBondContact OG-N 3.43Å; W529-S537 WeakPolarHBondContact CH2-O 3.09Å; S537-L618 CarbonylContact C-O 3.48Å; S537-L618 WeakPolarHBondContact CA-O 3.39Å
538	L	96.3	Very high	95.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	116.6	173.5	-179.1	65.3	0	0	0	109.3	I483 P513 V516 W529 I540 E617 L618 L632	I483-L538 HydrophobicContact CD1-CD1 3.93Å; I483-L538 HydrophobicContact CG2-CD1 4.32Å; P513-L538 HydrophobicContact CB-CD1 3.67Å; V516-L538 HydrophobicContact CB-CD2 4.03Å; V516-L538 HydrophobicContact CG1-CD2 3.72Å; V516-L538 HydrophobicContact CG2-CD2 4.12Å; W529-L538 HydrophobicContact CE3-CD1 4.25Å; W529-L538 HydrophobicContact CH2-CD1 4.35Å; W529-L538 HydrophobicContact CZ3-CB 3.98Å; W529-L538 HydrophobicContact CZ3-CD1 3.89Å; W529-L538 HydrophobicContact CZ3-CD2 4.37Å; W529-L538 HydrophobicContact CZ3-CG 4.31Å; L538-I540 HydrophobicContact CD2-CD1 4.22Å; L538-I540 HydrophobicContact CD2-CG1 4.48Å; L538-I540 HydrophobicContact CG-CD1 4.41Å; L538-I540 HydrophobicContact CG-CG1 4.17Å; L538-E617 WeakPolarHBondContact O-CA 3.42Å; L538-L618 HydrophobicContact CB-CB 4.37Å; L538-L618 HydrophobicContact CD2-CD2 4.46Å; L538-L618 PolarHBondContact N-O 2.97Å; L538-L618 PolarHBondContact O-N 2.91Å; L538-L632 HydrophobicContact CD2-CD1 4.32Å
539	V	96.8	Very high	95.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.4	178.4	-176.4	0	0	0	0	110.6	V484 R487 V616 E617	V484-V539 HydrophobicContact CB-CB 4.01Å; V484-V539 HydrophobicContact CB-CG1 3.8Å; V484-V539 HydrophobicContact CG1-CG1 4.44Å; V484-V539 HydrophobicContact CG2-CG1 3.95Å; V484-V539 PolarHBondContact N-O 3.25Å; R487-V539 HydrophobicContact CB-CB 4.08Å; R487-V539 HydrophobicContact CB-CG2 3.48Å; R487-V539 VanDerWaalsContact CB-CG2 3.48Å; V539-V616 CarbonylContact C-O 3.57Å; V539-V616 WeakPolarHBondContact CA-O 3.22Å; V539-E617 HydrophobicContact CG2-CB 3.9Å; V539-E617 HydrophobicContact CG2-CG 3.74Å
540	I	97.3	Very high	95.8	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	122.5	-173.9	-51	175	0	0	0	108.7	A475 S482 I483 I517 L538 L542 F615 V616 F635	A475-I540 HydrophobicContact CB-CD1 4.42Å; A475-I540 HydrophobicContact CB-CG2 4.25Å; S482-I540 CarbonylContact O-C 3.57Å; S482-I540 WeakPolarHBondContact O-CA 3.41Å; I483-I540 HydrophobicContact CD1-CG1 3.88Å; I517-I540 HydrophobicContact CG2-CD1 3.86Å; I517-I540 HydrophobicContact CG2-CG1 4.43Å; I517-I540 HydrophobicContact CG2-CG2 4.27Å; L538-I540 HydrophobicContact CD2-CD1 4.22Å; L538-I540 HydrophobicContact CD2-CG1 4.48Å; L538-I540 HydrophobicContact CG-CD1 4.41Å; L538-I540 HydrophobicContact CG-CG1 4.17Å; I540-L542 HydrophobicContact CG2-CD2 4.41Å; I540-L542 PolarHBondContact O-N 3.17Å; I540-F615 CarbonylContact O-C 3.27Å; I540-F615 VanDerWaalsContact O-CA 3.23Å; I540-F615 WeakPolarHBondContact O-CA 3.41Å; I540-V616 PolarHBondContact N-O 3.38Å; I540-V616 PolarHBondContact O-N 2.89Å; I540-F635 HydrophobicContact CD1-CD1 3.69Å; I540-F635 HydrophobicContact CD1-CE1 4.26Å
541	S	97.1	Very high	95.9	Very high	11 Å²	11	32.4 Å²	32.4	8%	0.077	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	119.1	159.3	172.8	0	0	0	0	108	A481 S482	A481-S541 CarbonylContact C-O 3.52Å; A481-S541 WeakPolarHBondContact CA-O 3.45Å; A481-S541 WeakPolarHBondContact CB-O 3.38Å; S482-S541 PolarHBondContact N-O 3.25Å; S482-S541 PolarHBondContact O-N 3.43Å
542	L	97.2	Very high	96	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	158	175	-56.7	-177.3	0	0	0	110.9	F474 A475 I540 H544 I546 R614 V616 V637	F474-L542 WeakPolarHBondContact O-CA 3.43Å; A475-L542 HydrophobicContact CB-CD2 4.26Å; I540-L542 HydrophobicContact CG2-CD2 4.41Å; I540-L542 PolarHBondContact O-N 3.17Å; L542-H544 VanDerWaalsContact C-N 3.29Å; L542-H544 WeakPolarHBondContact CB-O 3.39Å; L542-H544 PolarHBondContact O-N 3.08Å; L542-I546 HydrophobicContact CD1-CD1 3.68Å; L542-I546 HydrophobicContact CD1-CG1 3.5Å; L542-I546 VanDerWaalsContact CD1-CG1 3.5Å; L542-R614 WeakPolarHBondContact CB-O 3.38Å; L542-R614 PolarHBondContact N-O 3.38Å; L542-R614 PolarHBondContact O-NE 3.38Å; L542-R614 PolarHBondContact O-NH1 3.14Å; L542-R614 PolarHBondContact O-NH2 3.22Å; L542-V616 HydrophobicContact CD1-CG2 3.89Å; L542-V616 HydrophobicContact CD2-CB 4.48Å; L542-V616 HydrophobicContact CD2-CG2 4.03Å; L542-V616 HydrophobicContact CG-CG2 4.13Å; L542-V637 HydrophobicContact CD1-CG1 4.17Å; L542-V637 HydrophobicContact CD2-CB 3.92Å; L542-V637 HydrophobicContact CD2-CG1 4.11Å; L542-V637 HydrophobicContact CD2-CG2 4.05Å
543	S	96.6	Very high	96.1	Very high	11 Å²	11	28 Å²	28	8%	0.077	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	-40.3	175.3	63.3	0	0	0	0	111.7	F474 Q479 R614	F474-S543 PolarHBondContact O-N 3.22Å; F474-S543 PolarHBondContact O-OG 3.25Å; Q479-S543 VanDerWaalsContact O-CB 3.27Å; Q479-S543 WeakPolarHBondContact O-CB 3.44Å; Q479-S543 PolarHBondContact OE1-OG 3.3Å; S543-R614 VanDerWaalsContact C-NH1 3.28Å; S543-R614 PolarHBondContact O-NH1 3.34Å; S543-R614 PolarHBondContact O-NH2 2.9Å
544	H	95.8	Very high	96.1	Very high	81 Å²	81	26.9 Å²	26.9	38%	0.375	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	152	-176.9	-64.2	77.8	0	0	0	111	F474 L542 I546 L641	F474-H544 HydrophobicContact CD1-CB 4.15Å; F474-H544 HydrophobicContact CE1-CB 4.32Å; L542-H544 VanDerWaalsContact C-N 3.29Å; L542-H544 WeakPolarHBondContact CB-O 3.39Å; L542-H544 PolarHBondContact O-N 3.08Å; H544-I546 HydrophobicContact CB-CG2 4.36Å; H544-I546 PolarHBondContact O-N 2.98Å; H544-L641 HydrophobicContact CB-CD2 3.41Å; H544-L641 VanDerWaalsContact CB-CD2 3.41Å
545	P	95.1	Very high	96.1	Very high	54 Å²	54	24.2 Å²	24.2	35%	0.351	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	124.4	169	31.1	-33.7	0	0	0	110.2	V612 Y613 A642	P545-V612 HydrophobicContact CB-CG1 3.66Å; P545-Y613 WeakPolarHBondContact CA-O 3.25Å; P545-A642 PolarHBondContact O-N 3.12Å
546	I	94.8	Very high	96	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	156.6	-171.9	58.1	158.4	0	0	0	113.5	F474 L542 H544 I548 V612 Y613 V637 K640 L641	F474-I546 HydrophobicContact CB-CD1 4.06Å; F474-I546 HydrophobicContact CD1-CG2 3.84Å; F474-I546 HydrophobicContact CD2-CD1 3.72Å; F474-I546 HydrophobicContact CD2-CG2 4Å; F474-I546 HydrophobicContact CE1-CG2 3.84Å; F474-I546 HydrophobicContact CE2-CD1 4.39Å; F474-I546 HydrophobicContact CE2-CG2 3.95Å; F474-I546 HydrophobicContact CG-CD1 4.04Å; F474-I546 HydrophobicContact CG-CG2 3.92Å; F474-I546 HydrophobicContact CZ-CG2 3.88Å; L542-I546 HydrophobicContact CD1-CD1 3.68Å; L542-I546 HydrophobicContact CD1-CG1 3.5Å; L542-I546 VanDerWaalsContact CD1-CG1 3.5Å; H544-I546 HydrophobicContact CB-CG2 4.36Å; H544-I546 PolarHBondContact O-N 2.98Å; I546-I548 HydrophobicContact CD1-CG1 3.71Å; I546-I548 HydrophobicContact CG1-CG1 3.96Å; I546-V612 WeakPolarHBondContact O-CA 3.44Å; I546-Y613 PolarHBondContact N-O 3.26Å; I546-Y613 PolarHBondContact O-N 3.2Å; I546-V637 HydrophobicContact CD1-CG1 3.92Å; I546-K640 CarbonylContact C-O 3.52Å; I546-K640 VanDerWaalsContact CA-O 3.28Å; I546-K640 WeakPolarHBondContact CA-O 3.37Å; I546-K640 VanDerWaalsContact CB-O 3.32Å; I546-K640 WeakPolarHBondContact CB-O 3.34Å; I546-L641 HydrophobicContact CG2-CD2 4.18Å
547	R	94.6	Very high	95.8	Very high	105 Å²	105	18.6 Å²	18.6	40%	0.396	10%	0.098	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	110	156.9	-69.1	175.7	179.1	160.2	4.1	108	D610 V612 G639 K640	R547-D610 WeakPolarHBondContact CD-OD1 3.48Å; R547-D610 VanDerWaalsContact CZ-O 3.29Å; R547-D610 IonicContact CZ-OD1 3.15Å; R547-D610 PolarHBondContact NE-O 2.98Å; R547-D610 IonicContact NE-OD1 2.77Å; R547-D610 PolarHBondContact NE-OD1 3.02Å; R547-D610 VanDerWaalsContact NE-OD1 3.15Å; R547-D610 IonicContact NH1-OD1 2.97Å; R547-D610 PolarHBondContact NH1-OD1 3.18Å; R547-D610 PolarHBondContact NH2-O 3.28Å; R547-D610 VanDerWaalsContact NH2-O 3.15Å; R547-D610 IonicContact NH2-OD1 2.66Å; R547-V612 HydrophobicContact CG-CG2 4.11Å; R547-G639 CarbonylContact O-C 3.54Å; R547-G639 WeakPolarHBondContact O-CA 3.35Å; R547-K640 PolarHBondContact N-O 3.4Å; R547-K640 PolarHBondContact O-N 2.92Å
548	I	95	Very high	95.5	Very high	6 Å²	6	21 Å²	21	3%	0.031	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	138.5	-178	-57.3	160.8	0	0	0	108.6	I546 L588 L605 Y613 V616 V637	I546-I548 HydrophobicContact CD1-CG1 3.71Å; I546-I548 HydrophobicContact CG1-CG1 3.96Å; I548-L588 HydrophobicContact CB-CD1 4.3Å; I548-L588 HydrophobicContact CD1-CD1 3.54Å; I548-L588 HydrophobicContact CG2-CD1 4.46Å; I548-L605 HydrophobicContact CB-CD2 3.98Å; I548-L605 HydrophobicContact CG2-CD1 4.15Å; I548-L605 HydrophobicContact CG2-CD2 3.66Å; I548-Y613 HydrophobicContact CD1-CD2 4.05Å; I548-Y613 HydrophobicContact CD1-CG 4.31Å; I548-V616 HydrophobicContact CD1-CG2 3.44Å; I548-V616 VanDerWaalsContact CD1-CG2 3.44Å; I548-V637 HydrophobicContact CD1-CG1 4.32Å; I548-V637 HydrophobicContact CG1-CG1 3.97Å; I548-V637 HydrophobicContact CG2-CG1 3.9Å
549	S	94.3	Very high	95.1	Very high	35 Å²	35	30.1 Å²	30.1	25%	0.245	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	-33.7	-179.9	65.8	0	0	0	0	113.2	L605 H638	S549-L605 PolarHBondContact O-N 3.3Å; S549-H638 PolarHBondContact N-O 3.08Å
550	H	96.2	Very high	94.7	Very high	32 Å²	32	33.4 Å²	33.4	15%	0.148	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	154.6	176	-50.5	73	0	0	0	109.8	M471 T602 F603 K604 H638	M471-H550 HydrophobicContact CE-CB 3.91Å; M471-H550 HydrophobicContact SD-CB 4.34Å; H550-T602 HydrophobicContact CB-CG2 4.04Å; H550-F603 CarbonylContact C-O 3.57Å; H550-F603 WeakPolarHBondContact CA-O 3.27Å; H550-F603 WeakPolarHBondContact CB-O 3.34Å; H550-K604 VanDerWaalsContact CD2-CB 3.49Å; H550-K604 WeakPolarHBondContact CD2-CB 3.33Å; H550-H638 HydrophobicContact CB-CB 4.16Å; H550-H638 PolarHBondContact N-O 2.91Å; H550-H638 WeakPolarHBondContact O-CA 3.43Å; H550-H638 WeakPolarHBondContact O-CB 3.32Å; H550-H638 PolarHBondContact O-N 3.03Å; H550-H638 VanDerWaalsContact O-O 3.07Å
551	V	97.1	Very high	94.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	156	163.6	-64.9	0	0	0	0	109	F573 V575 F591 T602 F603 L605 F635 R636 V637	V551-F573 HydrophobicContact CG2-CE2 4.49Å; V551-V575 HydrophobicContact CG1-CG1 4.1Å; V551-V575 HydrophobicContact CG1-CG2 4.29Å; V551-V575 HydrophobicContact CG2-CG2 4.16Å; V551-F591 HydrophobicContact CG2-CD2 4.37Å; V551-F591 HydrophobicContact CG2-CE2 4.14Å; V551-T602 CarbonylContact O-C 3.29Å; V551-T602 WeakPolarHBondContact O-CA 3.43Å; V551-F603 HydrophobicContact CG2-CB 3.97Å; V551-F603 HydrophobicContact CG2-CD2 4.38Å; V551-F603 PolarHBondContact N-O 3.42Å; V551-F603 PolarHBondContact O-N 2.87Å; V551-L605 HydrophobicContact CG1-CD1 4.42Å; V551-F635 HydrophobicContact CB-CE2 3.8Å; V551-F635 HydrophobicContact CB-CZ 3.88Å; V551-F635 HydrophobicContact CG1-CE2 4.23Å; V551-F635 HydrophobicContact CG1-CZ 3.78Å; V551-F635 HydrophobicContact CG2-CE2 4.19Å; V551-F635 HydrophobicContact CG2-CZ 4.49Å; V551-R636 CarbonylContact C-O 3.58Å; V551-R636 WeakPolarHBondContact CA-O 3.37Å; V551-V637 HydrophobicContact CG1-CG2 4.43Å
552	T	97.3	Very high	93.9	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	133.7	170.6	-60	0	0	0	0	109.2	A468 T600 Q601 T602 F635 R636 H638	A468-T552 HydrophobicContact CB-CG2 3.63Å; A468-T552 VanDerWaalsContact CB-OG1 3.27Å; A468-T552 WeakPolarHBondContact CB-OG1 3.41Å; T552-T600 HydrophobicContact CG2-CG2 3.6Å; T552-Q601 CarbonylContact C-O 3.47Å; T552-Q601 VanDerWaalsContact CA-O 3.27Å; T552-Q601 WeakPolarHBondContact CA-O 3.25Å; T552-Q601 WeakPolarHBondContact CG2-O 3.49Å; T552-T602 PolarHBondContact OG1-OG1 3.46Å; T552-F635 CarbonylContact O-C 3.6Å; T552-F635 WeakPolarHBondContact O-CA 3.3Å; T552-F635 WeakPolarHBondContact O-CD2 3.37Å; T552-R636 HydrophobicContact CG2-CG 4.41Å; T552-R636 PolarHBondContact N-O 3.45Å; T552-R636 PolarHBondContact O-N 2.88Å; T552-H638 PolarHBondContact OG1-CD2 3.37Å; T552-H638 PolarHBondContact OG1-NE2 3.42Å
553	L	96.8	Very high	93.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.7	172.2	-170.1	57.4	0	0	0	108.2	P570 F573 Y593 Q601 F603 L632 F635	L553-P570 HydrophobicContact CD2-CB 4.34Å; L553-P570 HydrophobicContact CD2-CG 3.65Å; L553-P570 HydrophobicContact CG-CG 4.31Å; L553-F573 HydrophobicContact CB-CZ 4.43Å; L553-F573 HydrophobicContact CD2-CD1 3.93Å; L553-F573 HydrophobicContact CD2-CE1 3.62Å; L553-F573 HydrophobicContact CD2-CE2 4.43Å; L553-F573 HydrophobicContact CD2-CG 4.46Å; L553-F573 HydrophobicContact CD2-CZ 3.88Å; L553-Y593 HydrophobicContact CB-CD2 4.18Å; L553-Y593 HydrophobicContact CD2-CD2 4.02Å; L553-Y593 HydrophobicContact CD2-CG 4.32Å; L553-Y593 HydrophobicContact CG-CD2 4.06Å; L553-Q601 PolarHBondContact N-O 3.3Å; L553-Q601 PolarHBondContact O-N 3.31Å; L553-F603 HydrophobicContact CB-CE2 4.1Å; L553-L632 HydrophobicContact CD1-CD2 4.2Å; L553-F635 HydrophobicContact CB-CD2 4.49Å; L553-F635 HydrophobicContact CD1-CB 4.36Å; L553-F635 HydrophobicContact CD1-CD2 4.01Å
554	D	95.3	Very high	93	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.6	177	-63.8	-56.4	0	0	0	108.8	L523 S599 T600 Y633 R634 R636	L523-D554 HydrophobicContact CD1-CB 4.01Å; L523-D554 HydrophobicContact CD2-CB 4.2Å; D554-S599 WeakPolarHBondContact CA-O 3.49Å; D554-T600 VanDerWaalsContact OD1-CB 3.28Å; D554-T600 WeakPolarHBondContact OD1-CB 3.47Å; D554-T600 VanDerWaalsContact OD1-CG2 3.23Å; D554-T600 WeakPolarHBondContact OD1-CG2 3.42Å; D554-T600 PolarHBondContact OD1-OG1 3.37Å; D554-Y633 WeakPolarHBondContact O-CB 3.39Å; D554-R634 HydrophobicContact CB-CB 3.95Å; D554-R634 PolarHBondContact N-O 3.26Å; D554-R634 PolarHBondContact O-N 2.95Å; D554-R634 WeakPolarHBondContact OD2-CB 3.35Å; D554-R634 VanDerWaalsContact OD2-CD 3.28Å; D554-R634 WeakPolarHBondContact OD2-CD 3.39Å; D554-R634 VanDerWaalsContact OD2-CG 3.29Å; D554-R634 WeakPolarHBondContact OD2-CG 3.42Å; D554-R634 IonicContact OD2-NE 3.84Å; D554-R636 VanDerWaalsContact CG-NH2 3.31Å; D554-R636 IonicContact OD1-CZ 2.96Å; D554-R636 IonicContact OD1-NE 3.23Å; D554-R636 IonicContact OD1-NH2 2.73Å; D554-R636 PolarHBondContact OD1-NH2 2.91Å; D554-R636 IonicContact OD2-CZ 3.21Å; D554-R636 VanDerWaalsContact OD2-CZ 3.29Å; D554-R636 IonicContact OD2-NE 2.79Å; D554-R636 PolarHBondContact OD2-NE 3.26Å; D554-R636 IonicContact OD2-NH2 2.95Å; D554-R636 PolarHBondContact OD2-NH2 2.89Å
555	H	95.3	Very high	92.8	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.019	25%	0.249	C	C	.	.			trans	-133.3	154.8	167.6	-166.3	-86.2	0	0	0	110.7	L523 Y593 S599 Y633	L523-H555 VanDerWaalsContact CD1-C 3.49Å; L523-H555 VanDerWaalsContact CD1-O 3.26Å; L523-H555 WeakPolarHBondContact CD1-O 3.47Å; H555-Y593 HydrophobicContact CB-CE1 4.05Å; H555-Y593 HydrophobicContact CB-CE2 4.23Å; H555-Y593 WeakPolarHBondContact CB-OH 3.44Å; H555-S599 PolarHBondContact N-O 2.98Å; H555-S599 VanDerWaalsContact O-O 3.13Å; H555-S599 PolarHBondContact O-OG 2.88Å; H555-Y633 AromaticContact CD2-CD2 3.48Å; H555-Y633 VanDerWaalsContact CD2-CD2 3.48Å; H555-Y633 WeakPolarHBondContact CD2-CD2 3.48Å; H555-Y633 AromaticContact CD2-CE2 3.83Å; H555-Y633 AromaticContact CE1-CE2 3.8Å; H555-Y633 AromaticContact CG-CD2 3.96Å; H555-Y633 AromaticContact NE2-CD2 3.61Å; H555-Y633 AromaticContact NE2-CE2 3.42Å; H555-Y633 WeakPolarHBondContact NE2-CE2 3.41Å
556	L	94.1	Very high	92.8	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.021	23%	0.234	C	C	.	.			trans	-56	131.2	173.7	-169.1	77.6	0	0	0	110.4	L523 P525 N560 Y633	L523-L556 HydrophobicContact CB-CD1 4.34Å; P525-L556 HydrophobicContact CB-CD2 4.03Å; P525-L556 HydrophobicContact CG-CD1 3.92Å; P525-L556 HydrophobicContact CG-CD2 3.99Å; L556-N560 HydrophobicContact CD1-CB 3.82Å; L556-N560 HydrophobicContact CD2-CB 4.24Å; L556-N560 HydrophobicContact CG-CB 3.89Å; L556-Y633 HydrophobicContact CB-CD2 4.29Å; L556-Y633 HydrophobicContact CB-CE1 4.08Å; L556-Y633 HydrophobicContact CB-CE2 3.75Å; L556-Y633 HydrophobicContact CD1-CE1 4.41Å
557	P	91.9	Very high	92.9	Very high	18 Å²	18	48.2 Å²	48.2	12%	0.117	25%	0.25	C	S	.	.			trans	-70.9	147.2	176.3	28.1	-32.4	0	0	0	110.9	Y559 N560 S561 S599	P557-Y559 VanDerWaalsContact C-N 3.26Å; P557-Y559 HydrophobicContact CB-CD1 3.91Å; P557-Y559 HydrophobicContact CB-CE1 3.52Å; P557-Y559 HydrophobicContact CG-CD1 4.36Å; P557-Y559 HydrophobicContact CG-CE1 3.79Å; P557-Y559 HydrophobicContact CG-CE2 3.98Å; P557-Y559 PolarHBondContact O-N 3.33Å; P557-Y559 VanDerWaalsContact O-N 3.13Å; P557-N560 HydrophobicContact CG-CB 4.15Å; P557-N560 PolarHBondContact O-N 3.4Å; P557-S561 PolarHBondContact O-N 2.85Å; P557-S599 WeakPolarHBondContact CD-OG 3.46Å
558	R	91.1	Very high	93	Very high	78 Å²	78	44.1 Å²	44.1	29%	0.294	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-48.5	-41.4	-178.6	-79.4	-177.4	-179.9	160.9	-4.7	114.4	N560 S561 G564 I566 E595 D596	R558-N560 PolarHBondContact O-N 3.48Å; R558-S561 VanDerWaalsContact O-CB 3.29Å; R558-S561 WeakPolarHBondContact O-CB 3.27Å; R558-S561 PolarHBondContact O-N 3.02Å; R558-G564 WeakPolarHBondContact CB-O 3.43Å; R558-G564 WeakPolarHBondContact CG-O 3.48Å; R558-I566 HydrophobicContact CG-CD1 4.03Å; R558-I566 HydrophobicContact CG-CG1 3.85Å; R558-I566 HydrophobicContact CG-CG2 4.06Å; R558-E595 IonicContact CZ-OE2 2.71Å; R558-E595 PolarHBondContact NE-O 3.16Å; R558-E595 IonicContact NE-OE2 2.61Å; R558-E595 PolarHBondContact NE-OE2 3.35Å; R558-E595 IonicContact NH2-OE1 3.16Å; R558-E595 IonicContact NH2-OE2 3.72Å; R558-E595 PolarHBondContact NH2-OE2 3.27Å; R558-D596 IonicContact CZ-OD1 2.86Å; R558-D596 IonicContact NH1-OD1 3.26Å; R558-D596 PolarHBondContact NH1-OD1 2.95Å; R558-D596 IonicContact NH2-OD1 3.67Å; R558-D596 PolarHBondContact NH2-OD1 3.33Å; R558-D596 IonicContact NH2-OD2 3.71Å
559	Y	87.9	Confident	93.1	Very high	191 Å²	191	43.8 Å²	43.8	75%	0.749	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-67.7	-15	-180	66	-102.9	0	0	0	114.6	P557	P557-Y559 VanDerWaalsContact C-N 3.26Å; P557-Y559 HydrophobicContact CB-CD1 3.91Å; P557-Y559 HydrophobicContact CB-CE1 3.52Å; P557-Y559 HydrophobicContact CG-CD1 4.36Å; P557-Y559 HydrophobicContact CG-CE1 3.79Å; P557-Y559 HydrophobicContact CG-CE2 3.98Å; P557-Y559 PolarHBondContact O-N 3.33Å; P557-Y559 VanDerWaalsContact O-N 3.13Å
560	N	88.3	Confident	93.3	Very high	70 Å²	70	42.2 Å²	42.2	37%	0.374	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-96	-5.8	171	-76.7	-13.2	0	0	0	112.6	L556 P557 R558	L556-N560 HydrophobicContact CD1-CB 3.82Å; L556-N560 HydrophobicContact CD2-CB 4.24Å; L556-N560 HydrophobicContact CG-CB 3.89Å; P557-N560 HydrophobicContact CG-CB 4.15Å; P557-N560 PolarHBondContact O-N 3.4Å; R558-N560 PolarHBondContact O-N 3.48Å
561	S	90.6	Very high	93.4	Very high	23 Å²	23	43.2 Å²	43.2	16%	0.161	23%	0.229	C	C	.	.	S	Bend	trans	-79.8	131.4	176.1	-173.6	0	0	0	0	110.4	P557 R558 T563 G564 H565	P557-S561 PolarHBondContact O-N 2.85Å; R558-S561 VanDerWaalsContact O-CB 3.29Å; R558-S561 WeakPolarHBondContact O-CB 3.27Å; R558-S561 PolarHBondContact O-N 3.02Å; S561-T563 PolarHBondContact O-N 3.22Å; S561-T563 VanDerWaalsContact O-N 3.09Å; S561-T563 PolarHBondContact OG-OG1 2.9Å; S561-G564 PolarHBondContact O-N 3.27Å; S561-H565 VanDerWaalsContact CB-O 3.24Å; S561-H565 WeakPolarHBondContact CB-O 3.38Å; S561-H565 PolarHBondContact OG-O 3.49Å
562	P	86.7	Confident	93.4	Very high	127 Å²	127	46.2 Å²	46.2	83%	0.825	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.9	177.8	-25.7	35.3	0	0	0	115
563	T	86.8	Confident	93.5	Very high	98 Å²	98	46.2 Å²	46.2	60%	0.601	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-8.5	176	56.2	0	0	0	0	113.2	S561 H565	S561-T563 PolarHBondContact O-N 3.22Å; S561-T563 VanDerWaalsContact O-N 3.09Å; S561-T563 PolarHBondContact OG-OG1 2.9Å; T563-H565 PolarHBondContact O-CD2 3.06Å; T563-H565 PolarHBondContact O-N 3.33Å; T563-H565 PolarHBondContact OG1-N 2.93Å; T563-H565 PolarHBondContact OG1-O 2.92Å
564	G	88.5	Confident	93.5	Very high	36 Å²	36	47.8 Å²	47.8	37%	0.371	25%	0.252	S	S	.	.	S	Bend	trans	73.2	-8	-165.7	0	0	0	0	0	114.8	R558 S561	R558-G564 WeakPolarHBondContact CB-O 3.43Å; R558-G564 WeakPolarHBondContact CG-O 3.48Å; S561-G564 PolarHBondContact O-N 3.27Å
565	H	91.6	Very high	93.6	Very high	111 Å²	111	47.7 Å²	47.7	51%	0.514	25%	0.252	S	S	.	.			trans	-112.4	157.3	-176	-64.7	-78.1	0	0	0	111.7	S561 T563 D567	S561-H565 VanDerWaalsContact CB-O 3.24Å; S561-H565 WeakPolarHBondContact CB-O 3.38Å; S561-H565 PolarHBondContact OG-O 3.49Å; T563-H565 PolarHBondContact O-CD2 3.06Å; T563-H565 PolarHBondContact O-N 3.33Å; T563-H565 PolarHBondContact OG1-N 2.93Å; T563-H565 PolarHBondContact OG1-O 2.92Å; H565-D567 WeakPolarHBondContact CB-OD1 3.42Å
566	I	95.6	Very high	93.6	Very high	8 Å²	8	49 Å²	49	4%	0.041	26%	0.257	C	S	.	.			trans	-132.6	38.2	-178.1	60.6	172.3	0	0	0	112.8	R558 S568 A569 E595	R558-I566 HydrophobicContact CG-CD1 4.03Å; R558-I566 HydrophobicContact CG-CG1 3.85Å; R558-I566 HydrophobicContact CG-CG2 4.06Å; I566-S568 PolarHBondContact O-N 3Å; I566-A569 HydrophobicContact CB-CB 4.4Å; I566-A569 HydrophobicContact CD1-CB 4.38Å; I566-A569 HydrophobicContact CG1-CB 4.42Å; I566-A569 WeakPolarHBondContact O-CB 3.5Å; I566-A569 PolarHBondContact O-N 3.26Å; I566-E595 HydrophobicContact CD1-CB 3.93Å; I566-E595 HydrophobicContact CG1-CB 3.97Å
567	D	96.2	Very high	93.7	Very high	65 Å²	65	48.9 Å²	48.9	35%	0.348	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-23.1	-176.4	-34.8	-32	0	0	0	114.5	H565 W624 G625 H626	H565-D567 WeakPolarHBondContact CB-OD1 3.42Å; D567-W624 CarbonylContact O-C 3.54Å; D567-W624 VanDerWaalsContact O-C 3.27Å; D567-W624 WeakPolarHBondContact O-CA 3.29Å; D567-W624 PolarHBondContact O-N 3.35Å; D567-W624 VanDerWaalsContact O-N 3.15Å; D567-G625 PolarHBondContact O-N 3.21Å; D567-H626 HydrophobicContact CB-CB 4.03Å; D567-H626 WeakPolarHBondContact O-CB 3.31Å; D567-H626 PolarHBondContact O-N 2.99Å
568	S	96.4	Very high	93.8	Very high	19 Å²	19	48.1 Å²	48.1	13%	0.133	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	2.5	177.3	58	0	0	0	0	114.1	I566 T630 C631	I566-S568 PolarHBondContact O-N 3Å; S568-T630 CarbonylContact O-C 3.53Å; S568-T630 WeakPolarHBondContact O-CA 3.44Å; S568-T630 WeakPolarHBondContact O-CG2 3.38Å; S568-C631 PolarHBondContact O-N 3.26Å
569	A	97.5	Very high	93.8	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	-66.4	144.2	168.7	0	0	0	0	0	110.5	I566 N623 W624	I566-A569 HydrophobicContact CB-CB 4.4Å; I566-A569 HydrophobicContact CD1-CB 4.38Å; I566-A569 HydrophobicContact CG1-CB 4.42Å; I566-A569 WeakPolarHBondContact O-CB 3.5Å; I566-A569 PolarHBondContact O-N 3.26Å; A569-N623 WeakPolarHBondContact O-CA 3.49Å; A569-N623 VanDerWaalsContact O-CB 3.26Å; A569-N623 WeakPolarHBondContact O-CB 3.28Å; A569-W624 PolarHBondContact O-N 3.21Å
570	P	97.9	Very high	93.8	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.006	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-59.7	153	168.4	30.8	-37.8	0	0	0	110.2	L553 Y593 V620 W624 T630 L632	L553-P570 HydrophobicContact CD2-CB 4.34Å; L553-P570 HydrophobicContact CD2-CG 3.65Å; L553-P570 HydrophobicContact CG-CG 4.31Å; P570-Y593 WeakPolarHBondContact O-CB 3.4Å; P570-V620 HydrophobicContact CB-CG1 3.87Å; P570-V620 HydrophobicContact CB-CG2 4.12Å; P570-W624 PolarHBondContact O-NE1 3.36Å; P570-T630 HydrophobicContact CB-CG2 4.39Å; P570-L632 HydrophobicContact CB-CD2 3.98Å; P570-L632 HydrophobicContact CG-CD2 3.65Å
571	K	97.9	Very high	93.5	Very high	54 Å²	54	43.7 Å²	43.7	24%	0.235	24%	0.242	C	C	.	.			trans	-124.7	-86.2	-179.4	177.6	174	-174.1	153.3	0	110.7	F592 Y593 S622 N623 W624	K571-F592 HydrophobicContact CD-CE2 4.34Å; K571-F592 HydrophobicContact CG-CD2 4.22Å; K571-F592 HydrophobicContact CG-CE2 3.76Å; K571-F592 HydrophobicContact CG-CZ 4.33Å; K571-F592 CarbonylContact O-C 3.56Å; K571-F592 WeakPolarHBondContact O-CA 3.4Å; K571-Y593 PolarHBondContact O-N 3.21Å; K571-S622 WeakPolarHBondContact CB-OG 3.49Å; K571-S622 PolarHBondContact N-O 3.39Å; K571-N623 WeakPolarHBondContact CD-O 3.45Å; K571-W624 HydrophobicContact CB-CD2 4.29Å; K571-W624 HydrophobicContact CB-CG 4.19Å; K571-W624 HydrophobicContact CD-CD2 3.73Å; K571-W624 HydrophobicContact CD-CE3 3.95Å; K571-W624 HydrophobicContact CD-CG 4.26Å; K571-W624 HydrophobicContact CD-CH2 4.28Å; K571-W624 HydrophobicContact CD-CZ2 4Å; K571-W624 HydrophobicContact CD-CZ3 4.24Å; K571-W624 HydrophobicContact CG-CD2 4.1Å; K571-W624 HydrophobicContact CG-CZ2 3.85Å; K571-W624 VanDerWaalsContact NZ-CE3 3.31Å
572	D	98.3	Very high	93	Very high	62 Å²	62	48.2 Å²	48.2	33%	0.332	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	129.5	173.7	-54.9	-68.1	0	0	0	108.8	F592 L621 S622	D572-F592 WeakPolarHBondContact OD1-CD2 3.47Å; D572-L621 HydrophobicContact CB-CB 4.06Å; D572-L621 WeakPolarHBondContact O-CB 3.45Å; D572-L621 PolarHBondContact O-N 2.93Å; D572-S622 VanDerWaalsContact CB-OG 3.3Å; D572-S622 WeakPolarHBondContact CB-OG 3.34Å; D572-S622 VanDerWaalsContact CG-OG 3.25Å; D572-S622 PolarHBondContact N-OG 3.32Å; D572-S622 PolarHBondContact O-N 3.13Å; D572-S622 WeakPolarHBondContact OD2-CB 3.28Å; D572-S622 PolarHBondContact OD2-OG 3.35Å
573	F	98.3	Very high	92.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	157.8	178.6	73.4	-88.5	0	0	0	113.4	V551 L553 V575 T590 F591 F603 L618 R619	V551-F573 HydrophobicContact CG2-CE2 4.49Å; L553-F573 HydrophobicContact CB-CZ 4.43Å; L553-F573 HydrophobicContact CD2-CD1 3.93Å; L553-F573 HydrophobicContact CD2-CE1 3.62Å; L553-F573 HydrophobicContact CD2-CE2 4.43Å; L553-F573 HydrophobicContact CD2-CG 4.46Å; L553-F573 HydrophobicContact CD2-CZ 3.88Å; F573-V575 HydrophobicContact CD2-CG2 4.16Å; F573-V575 HydrophobicContact CE2-CG2 4.03Å; F573-T590 CarbonylContact O-C 3.57Å; F573-F591 HydrophobicContact CD1-CB 4.2Å; F573-F591 HydrophobicContact CD2-CB 4.24Å; F573-F591 HydrophobicContact CD2-CD2 4.32Å; F573-F591 HydrophobicContact CE1-CB 3.69Å; F573-F591 HydrophobicContact CE2-CB 3.76Å; F573-F591 AromaticContact CE2-CD2 3.74Å; F573-F591 HydrophobicContact CE2-CD2 3.74Å; F573-F591 HydrophobicContact CE2-CG 4.17Å; F573-F591 HydrophobicContact CG-CB 4.46Å; F573-F591 HydrophobicContact CZ-CB 3.46Å; F573-F591 VanDerWaalsContact CZ-CB 3.46Å; F573-F591 HydrophobicContact CZ-CD2 4.19Å; F573-F591 HydrophobicContact CZ-CG 4.17Å; F573-F591 PolarHBondContact N-O 3.37Å; F573-F591 PolarHBondContact O-N 3.5Å; F573-F603 HydrophobicContact CE1-CD2 4.45Å; F573-F603 HydrophobicContact CE1-CE2 4.02Å; F573-F603 HydrophobicContact CE1-CZ 4.11Å; F573-F603 AromaticContact CZ-CD2 3.7Å; F573-F603 HydrophobicContact CZ-CD2 3.7Å; F573-F603 AromaticContact CZ-CE2 3.67Å; F573-F603 HydrophobicContact CZ-CE2 3.67Å; F573-F603 HydrophobicContact CZ-CG 4.21Å; F573-F603 HydrophobicContact CZ-CZ 4.16Å; F573-L618 HydrophobicContact CB-CD1 4.19Å; F573-L618 HydrophobicContact CD2-CD1 3.43Å; F573-L618 VanDerWaalsContact CD2-CD1 3.43Å; F573-L618 HydrophobicContact CE2-CD1 4.12Å; F573-L618 HydrophobicContact CG-CD1 4.13Å; F573-R619 CarbonylContact C-O 3.6Å; F573-R619 WeakPolarHBondContact CA-O 3.35Å; F573-R619 WeakPolarHBondContact CB-O 3.35Å
574	E	97.5	Very high	92.6	Very high	33 Å²	33	50.2 Å²	50.2	15%	0.154	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	150.8	-179.7	-67.2	-178.3	136.9	0	0	111	Y576 L587 T590 R619 L621	E574-Y576 HydrophobicContact CB-CD2 4.3Å; E574-Y576 HydrophobicContact CB-CE2 3.67Å; E574-Y576 PolarHBondContact OE2-OH 3.33Å; E574-L587 HydrophobicContact CB-CD1 4.05Å; E574-L587 HydrophobicContact CG-CD1 4.3Å; E574-T590 HydrophobicContact CG-CG2 3.79Å; E574-T590 PolarHBondContact OE1-OG1 3.33Å; E574-R619 HydrophobicContact CB-CB 4.43Å; E574-R619 PolarHBondContact N-O 3.41Å; E574-R619 PolarHBondContact O-N 3.45Å; E574-L621 HydrophobicContact CG-CD1 3.88Å; E574-L621 HydrophobicContact CG-CG 4.33Å
575	V	97.1	Very high	92.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125.9	176	-176.5	0	0	0	0	109.6	V551 F573 L588 G589 F591 V616 L618 F635	V551-V575 HydrophobicContact CG1-CG1 4.1Å; V551-V575 HydrophobicContact CG1-CG2 4.29Å; V551-V575 HydrophobicContact CG2-CG2 4.16Å; F573-V575 HydrophobicContact CD2-CG2 4.16Å; F573-V575 HydrophobicContact CE2-CG2 4.03Å; V575-L588 HydrophobicContact CG1-CD1 4.33Å; V575-L588 WeakPolarHBondContact O-CB 3.42Å; V575-L588 PolarHBondContact O-N 3.25Å; V575-G589 PolarHBondContact N-O 3.49Å; V575-G589 PolarHBondContact O-N 3.03Å; V575-F591 HydrophobicContact CB-CE2 4.28Å; V575-F591 HydrophobicContact CG2-CD2 4.07Å; V575-F591 HydrophobicContact CG2-CE2 4Å; V575-V616 HydrophobicContact CG1-CG1 3.61Å; V575-L618 HydrophobicContact CG2-CD1 4.32Å; V575-F635 HydrophobicContact CG1-CZ 4.47Å; V575-F635 HydrophobicContact CG2-CE2 4.41Å; V575-F635 HydrophobicContact CG2-CZ 4.03Å
576	Y	95.8	Very high	92.7	Very high	32 Å²	32	46.8 Å²	46.8	13%	0.125	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	139.6	178	-63.3	-101.8	0	0	0	111	E574 G585 T586 L587 V616 E617 R619	E574-Y576 HydrophobicContact CB-CD2 4.3Å; E574-Y576 HydrophobicContact CB-CE2 3.67Å; E574-Y576 PolarHBondContact OE2-OH 3.33Å; Y576-G585 WeakPolarHBondContact CD1-O 3.34Å; Y576-T586 CarbonylContact C-O 3.6Å; Y576-T586 VanDerWaalsContact CA-O 3.25Å; Y576-T586 WeakPolarHBondContact CA-O 3.33Å; Y576-L587 HydrophobicContact CD1-CB 3.95Å; Y576-L587 HydrophobicContact CD1-CD1 4.27Å; Y576-L587 HydrophobicContact CD2-CD1 4.41Å; Y576-L587 HydrophobicContact CE1-CB 3.76Å; Y576-L587 HydrophobicContact CE1-CD1 3.93Å; Y576-L587 HydrophobicContact CE1-CG 4.4Å; Y576-L587 HydrophobicContact CE2-CD1 4.06Å; Y576-V616 WeakPolarHBondContact O-CA 3.32Å; Y576-E617 PolarHBondContact N-O 2.94Å; Y576-E617 PolarHBondContact O-N 3.48Å; Y576-R619 HydrophobicContact CD2-CG 4.17Å; Y576-R619 HydrophobicContact CE2-CB 4.45Å; Y576-R619 HydrophobicContact CE2-CG 3.97Å; Y576-R619 PolarHBondContact OH-NH1 3.03Å; Y576-R619 VanDerWaalsContact OH-NH1 3.11Å
577	G	95	Very high	92.7	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	129.4	172.9	0	0	0	0	0	110.4	G585 T586 Y613	G577-G585 CarbonylContact O-C 3.53Å; G577-G585 WeakPolarHBondContact O-CA 3.4Å; G577-T586 PolarHBondContact N-O 3.5Å; G577-T586 PolarHBondContact O-N 3.44Å; G577-Y613 VanDerWaalsContact C-CE1 3.45Å; G577-Y613 VanDerWaalsContact CA-CD1 3.41Å; G577-Y613 WeakPolarHBondContact O-CE1 3.34Å
578	L	94	Very high	92.6	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.1	179.9	-80.7	79.9	0	0	0	109.9	R614 F615 E617	L578-R614 PolarHBondContact O-N 3.01Å; L578-R614 VanDerWaalsContact O-N 3.15Å; L578-F615 HydrophobicContact CB-CB 3.72Å; L578-F615 PolarHBondContact N-O 3.38Å; L578-F615 PolarHBondContact O-N 3.32Å; L578-E617 HydrophobicContact CD1-CB 3.63Å
579	K	91.4	Very high	92.5	Very high	92 Å²	92	47.2 Å²	47.2	40%	0.4	25%	0.245	S	C	.	.	S	Bend	trans	-85.2	-50.9	176.7	-66.4	161.4	-174.6	157.1	0	109.4	E583 E611 Y613 F615	K579-E583 WeakPolarHBondContact CB-OE2 3.29Å; K579-E611 VanDerWaalsContact CE-OE2 3.25Å; K579-E611 WeakPolarHBondContact CE-OE2 3.49Å; K579-E611 IonicContact NZ-OE2 3.81Å; K579-E611 PolarHBondContact NZ-OE2 3.4Å; K579-Y613 HydrophobicContact CG-CD1 4.24Å; K579-Y613 HydrophobicContact CG-CE1 4.46Å; K579-F615 WeakPolarHBondContact O-CD2 3.38Å
580	N	88.4	Confident	92.5	Very high	83 Å²	83	51.1 Å²	51.1	44%	0.444	27%	0.269	S	S	.	.	S	Bend	trans	-109.7	162.2	168.3	-61.3	-57.6	0	0	0	112.1	T582 E583	N580-T582 VanDerWaalsContact C-N 3.25Å; N580-T582 PolarHBondContact O-N 3.34Å; N580-E583 HydrophobicContact CB-CG 4.11Å; N580-E583 PolarHBondContact N-OE2 2.98Å; N580-E583 PolarHBondContact ND2-OE1 3.28Å
581	D	81.7	Confident	92.5	Very high	72 Å²	72	52.2 Å²	52.2	39%	0.385	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-19	-178.8	65.9	-23.6	0	0	0	114.3	R487 F615	R487-D581 VanDerWaalsContact CD-O 3.24Å; R487-D581 WeakPolarHBondContact CD-O 3.5Å; R487-D581 PolarHBondContact NH1-O 3.02Å; D581-F615 HydrophobicContact CB-CD1 4.47Å; D581-F615 HydrophobicContact CB-CE1 4.03Å; D581-F615 HydrophobicContact CB-CE2 4.32Å; D581-F615 HydrophobicContact CB-CZ 3.95Å
582	T	80.6	Confident	92.5	Very high	117 Å²	117	54 Å²	54	72%	0.718	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-9.6	-171.8	30.2	0	0	0	0	113.5	N580	N580-T582 VanDerWaalsContact C-N 3.25Å; N580-T582 PolarHBondContact O-N 3.34Å
583	E	81.6	Confident	92.5	Very high	78 Å²	78	51.2 Å²	51.2	36%	0.364	27%	0.267	S	S	.	.	S	Bend	trans	-84.6	162.6	-178.2	-72.3	165.1	177.5	0	0	112.7	R487 K579 N580	R487-E583 PolarHBondContact NH1-O 3.41Å; R487-E583 PolarHBondContact NH2-O 2.99Å; K579-E583 WeakPolarHBondContact CB-OE2 3.29Å; N580-E583 HydrophobicContact CB-CG 4.11Å; N580-E583 PolarHBondContact N-OE2 2.98Å; N580-E583 PolarHBondContact ND2-OE1 3.28Å
584	E	84.1	Confident	92.4	Very high	189 Å²	189	54 Å²	54	88%	0.883	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-75.1	136.1	162	-64.8	-166.7	148.9	0	0	109.8
585	G	88.7	Confident	92.3	Very high	17 Å²	17	54 Å²	54	18%	0.175	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-80.7	148.5	-175.6	0	0	0	0	0	113.6	Y576 G577	Y576-G585 WeakPolarHBondContact CD1-O 3.34Å; G577-G585 CarbonylContact O-C 3.53Å; G577-G585 WeakPolarHBondContact O-CA 3.4Å
586	T	93.4	Very high	92.1	Very high	58 Å²	58	59.6 Å²	59.6	36%	0.356	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	124.6	168.7	-51.7	0	0	0	0	109.4	Y576 G577 L588 Y613	Y576-T586 CarbonylContact C-O 3.6Å; Y576-T586 VanDerWaalsContact CA-O 3.25Å; Y576-T586 WeakPolarHBondContact CA-O 3.33Å; G577-T586 PolarHBondContact N-O 3.5Å; G577-T586 PolarHBondContact O-N 3.44Å; T586-L588 PolarHBondContact O-N 3.38Å; T586-Y613 WeakPolarHBondContact CB-OH 3.39Å
587	L	94.9	Very high	91.9	Very high	84 Å²	84	59.9 Å²	59.9	44%	0.44	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	122.2	176.1	179.3	64.3	0	0	0	110	E574 Y576	E574-L587 HydrophobicContact CB-CD1 4.05Å; E574-L587 HydrophobicContact CG-CD1 4.3Å; Y576-L587 HydrophobicContact CD1-CB 3.95Å; Y576-L587 HydrophobicContact CD1-CD1 4.27Å; Y576-L587 HydrophobicContact CD2-CD1 4.41Å; Y576-L587 HydrophobicContact CE1-CB 3.76Å; Y576-L587 HydrophobicContact CE1-CD1 3.93Å; Y576-L587 HydrophobicContact CE1-CG 4.4Å; Y576-L587 HydrophobicContact CE2-CD1 4.06Å
588	L	94.6	Very high	91.7	Very high	13 Å²	13	67.1 Å²	67.1	7%	0.068	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-26.8	179.4	-52.9	-178.3	0	0	0	112.3	I548 V575 T586 L605 P606 Y613	I548-L588 HydrophobicContact CB-CD1 4.3Å; I548-L588 HydrophobicContact CD1-CD1 3.54Å; I548-L588 HydrophobicContact CG2-CD1 4.46Å; V575-L588 HydrophobicContact CG1-CD1 4.33Å; V575-L588 WeakPolarHBondContact O-CB 3.42Å; V575-L588 PolarHBondContact O-N 3.25Å; T586-L588 PolarHBondContact O-N 3.38Å; L588-L605 HydrophobicContact CB-CD2 3.73Å; L588-L605 HydrophobicContact CB-CG 4.1Å; L588-L605 HydrophobicContact CD1-CD2 4.06Å; L588-L605 HydrophobicContact CG-CD2 4.4Å; L588-P606 WeakPolarHBondContact O-CD 3.5Å; L588-Y613 HydrophobicContact CD2-CD2 4.43Å; L588-Y613 HydrophobicContact CD2-CE2 3.69Å
589	G	94.9	Very high	91.7	Very high	5 Å²	5	68.3 Å²	68.3	5%	0.052	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.5	154.3	175.2	0	0	0	0	0	113.1	V575	V575-G589 PolarHBondContact N-O 3.49Å; V575-G589 PolarHBondContact O-N 3.03Å
590	T	97.3	Very high	91.8	Very high	81 Å²	81	65.5 Å²	65.5	50%	0.497	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	136.4	169.4	-48.3	0	0	0	0	107.7	F573 E574	F573-T590 CarbonylContact O-C 3.57Å; E574-T590 HydrophobicContact CG-CG2 3.79Å; E574-T590 PolarHBondContact OE1-OG1 3.33Å
591	F	97.6	Very high	92.2	Very high	25 Å²	25	62.6 Å²	62.6	11%	0.11	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	166.5	-169.6	-56.2	-66.3	0	0	0	111.3	V551 F573 V575 F603 K604 L605	V551-F591 HydrophobicContact CG2-CD2 4.37Å; V551-F591 HydrophobicContact CG2-CE2 4.14Å; F573-F591 HydrophobicContact CD1-CB 4.2Å; F573-F591 HydrophobicContact CD2-CB 4.24Å; F573-F591 HydrophobicContact CD2-CD2 4.32Å; F573-F591 HydrophobicContact CE1-CB 3.69Å; F573-F591 HydrophobicContact CE2-CB 3.76Å; F573-F591 AromaticContact CE2-CD2 3.74Å; F573-F591 HydrophobicContact CE2-CD2 3.74Å; F573-F591 HydrophobicContact CE2-CG 4.17Å; F573-F591 HydrophobicContact CG-CB 4.46Å; F573-F591 HydrophobicContact CZ-CB 3.46Å; F573-F591 VanDerWaalsContact CZ-CB 3.46Å; F573-F591 HydrophobicContact CZ-CD2 4.19Å; F573-F591 HydrophobicContact CZ-CG 4.17Å; F573-F591 PolarHBondContact N-O 3.37Å; F573-F591 PolarHBondContact O-N 3.5Å; V575-F591 HydrophobicContact CB-CE2 4.28Å; V575-F591 HydrophobicContact CG2-CD2 4.07Å; V575-F591 HydrophobicContact CG2-CE2 4Å; F591-F603 HydrophobicContact CB-CD1 4.04Å; F591-F603 HydrophobicContact CB-CG 4.22Å; F591-F603 HydrophobicContact CD1-CB 3.68Å; F591-F603 HydrophobicContact CD1-CD1 4.14Å; F591-F603 HydrophobicContact CD1-CG 4.17Å; F591-F603 HydrophobicContact CD2-CB 4.41Å; F591-F603 HydrophobicContact CE1-CB 3.88Å; F591-F603 HydrophobicContact CG-CB 3.96Å; F591-F603 HydrophobicContact CG-CD1 4.28Å; F591-F603 HydrophobicContact CG-CG 4.17Å; F591-F603 HydrophobicContact CZ-CB 4.33Å; F591-K604 WeakPolarHBondContact CE1-O 3.47Å; F591-L605 HydrophobicContact CZ-CD1 4.08Å; F591-L605 HydrophobicContact CZ-CG 4.4Å
592	F	97.7	Very high	92.9	Very high	91 Å²	91	61 Å²	61	40%	0.399	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	118.7	-176.1	-179.4	-90.1	0	0	0	109.1	K571 D572 D594 F603 W624	K571-F592 HydrophobicContact CD-CE2 4.34Å; K571-F592 HydrophobicContact CG-CD2 4.22Å; K571-F592 HydrophobicContact CG-CE2 3.76Å; K571-F592 HydrophobicContact CG-CZ 4.33Å; K571-F592 CarbonylContact O-C 3.56Å; K571-F592 WeakPolarHBondContact O-CA 3.4Å; D572-F592 WeakPolarHBondContact OD1-CD2 3.47Å; F592-D594 HydrophobicContact CD1-CB 4.5Å; F592-D594 HydrophobicContact CE1-CB 4.32Å; F592-F603 WeakPolarHBondContact O-CE1 3.5Å; F592-F603 WeakPolarHBondContact O-CZ 3.43Å; F592-W624 HydrophobicContact CE1-CH2 4.08Å; F592-W624 AromaticContact CE1-CZ2 3.73Å; F592-W624 HydrophobicContact CE1-CZ2 3.73Å; F592-W624 HydrophobicContact CE2-CH2 4.43Å; F592-W624 HydrophobicContact CE2-CZ2 4.2Å; F592-W624 AromaticContact CZ-CH2 3.51Å; F592-W624 HydrophobicContact CZ-CH2 3.51Å; F592-W624 AromaticContact CZ-CZ2 3.4Å; F592-W624 HydrophobicContact CZ-CZ2 3.4Å; F592-W624 VanDerWaalsContact CZ-CZ2 3.4Å
593	Y	97.9	Very high	93.7	Very high	3 Å²	3	56.9 Å²	56.9	1%	0.012	31%	0.305	C	S	.	.			trans	-87.1	120.6	172.4	-178	-82.2	0	0	0	109.8	L553 H555 P570 K571 E598 Q601 F603 W624	L553-Y593 HydrophobicContact CB-CD2 4.18Å; L553-Y593 HydrophobicContact CD2-CD2 4.02Å; L553-Y593 HydrophobicContact CD2-CG 4.32Å; L553-Y593 HydrophobicContact CG-CD2 4.06Å; H555-Y593 HydrophobicContact CB-CE1 4.05Å; H555-Y593 HydrophobicContact CB-CE2 4.23Å; H555-Y593 WeakPolarHBondContact CB-OH 3.44Å; P570-Y593 WeakPolarHBondContact O-CB 3.4Å; K571-Y593 PolarHBondContact O-N 3.21Å; Y593-E598 PolarHBondContact OH-O 3.06Å; Y593-Q601 HydrophobicContact CD2-CB 4.13Å; Y593-Q601 HydrophobicContact CD2-CG 4.11Å; Y593-Q601 HydrophobicContact CE2-CB 4.04Å; Y593-Q601 VanDerWaalsContact CE2-CD 3.43Å; Y593-Q601 HydrophobicContact CE2-CG 3.67Å; Y593-F603 HydrophobicContact CD2-CZ 4.47Å; Y593-W624 VanDerWaalsContact O-CZ2 3.32Å; Y593-W624 WeakPolarHBondContact O-CZ2 3.34Å; Y593-W624 PolarHBondContact O-NE1 3.37Å
594	D	97.2	Very high	94.4	Very high	60 Å²	60	60.1 Å²	60.1	32%	0.321	32%	0.318	S	S	.	.			trans	-86.5	124.7	-176.7	-176.5	4.3	0	0	0	111.5	F592 D596 G597 Q601	F592-D594 HydrophobicContact CD1-CB 4.5Å; F592-D594 HydrophobicContact CE1-CB 4.32Å; D594-D596 PolarHBondContact OD1-N 3.33Å; D594-G597 PolarHBondContact O-N 2.94Å; D594-Q601 PolarHBondContact O-NE2 3.37Å
595	E	94.6	Very high	94.8	Very high	33 Å²	33	51.3 Å²	51.3	15%	0.154	28%	0.277	C	S	.	.	S	Bend	trans	-79.2	-18.7	177.3	66.7	155.1	145.8	0	0	114.4	R558 I566 G597 W624	R558-E595 IonicContact CZ-OE2 2.71Å; R558-E595 PolarHBondContact NE-O 3.16Å; R558-E595 IonicContact NE-OE2 2.61Å; R558-E595 PolarHBondContact NE-OE2 3.35Å; R558-E595 IonicContact NH2-OE1 3.16Å; R558-E595 IonicContact NH2-OE2 3.72Å; R558-E595 PolarHBondContact NH2-OE2 3.27Å; I566-E595 HydrophobicContact CD1-CB 3.93Å; I566-E595 HydrophobicContact CG1-CB 3.97Å; E595-G597 VanDerWaalsContact C-N 3.35Å; E595-W624 HydrophobicContact CB-CD2 3.87Å; E595-W624 HydrophobicContact CB-CE3 4.4Å; E595-W624 HydrophobicContact CB-CG 4.05Å; E595-W624 HydrophobicContact CB-CZ2 4.28Å; E595-W624 HydrophobicContact CG-CD2 3.58Å; E595-W624 HydrophobicContact CG-CE3 3.59Å; E595-W624 HydrophobicContact CG-CG 4.19Å; E595-W624 HydrophobicContact CG-CH2 3.88Å; E595-W624 HydrophobicContact CG-CZ2 3.93Å; E595-W624 HydrophobicContact CG-CZ3 3.72Å; E595-W624 WeakPolarHBondContact OE1-CZ3 3.42Å
596	D	92.4	Very high	94.5	Very high	117 Å²	117	54.7 Å²	54.7	63%	0.626	30%	0.296	S	S	*	.	S	Bend	trans	-86	-11.7	172.3	-72.3	-59.4	0	0	0	112	R558 D594	R558-D596 IonicContact CZ-OD1 2.86Å; R558-D596 IonicContact NH1-OD1 3.26Å; R558-D596 PolarHBondContact NH1-OD1 2.95Å; R558-D596 IonicContact NH2-OD1 3.67Å; R558-D596 PolarHBondContact NH2-OD1 3.33Å; R558-D596 IonicContact NH2-OD2 3.71Å; D594-D596 PolarHBondContact OD1-N 3.33Å
597	G	91.4	Very high	93.6	Very high	38 Å²	38	58.4 Å²	58.4	39%	0.392	31%	0.314	S	S	.	.	S	Bend	trans	-84.2	-169.5	-175.9	0	0	0	0	0	115.9	D594 E595	D594-G597 PolarHBondContact O-N 2.94Å; E595-G597 VanDerWaalsContact C-N 3.35Å
598	E	92.1	Very high	92.4	Very high	153 Å²	153	58.3 Å²	58.3	72%	0.715	32%	0.318	S	S	*	.			trans	-65.8	152.5	178.1	-75.6	-69.7	177.4	0	0	112.6	Y593 T600 Q601	Y593-E598 PolarHBondContact OH-O 3.06Å; E598-T600 PolarHBondContact O-N 3.44Å; E598-Q601 WeakPolarHBondContact O-CG 3.43Å; E598-Q601 PolarHBondContact O-NE2 2.99Å
599	S	93	Very high	91.3	Very high	25 Å²	25	59.8 Å²	59.8	18%	0.175	33%	0.33	C	S	.	.	S	Bend	trans	-63.3	-22.5	178.6	180	0	0	0	0	114.2	D554 H555 P557	D554-S599 WeakPolarHBondContact CA-O 3.49Å; H555-S599 PolarHBondContact N-O 2.98Å; H555-S599 VanDerWaalsContact O-O 3.13Å; H555-S599 PolarHBondContact O-OG 2.88Å; P557-S599 WeakPolarHBondContact CD-OG 3.46Å
600	T	94.7	Very high	90.6	Very high	33 Å²	33	65 Å²	65	20%	0.202	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	108.5	-178	-72.2	0	0	0	0	107.9	P466 A468 T552 D554 E598	P466-T600 HydrophobicContact CB-CG2 3.67Å; P466-T600 HydrophobicContact CG-CG2 4.09Å; A468-T600 HydrophobicContact CB-CG2 4.1Å; T552-T600 HydrophobicContact CG2-CG2 3.6Å; D554-T600 VanDerWaalsContact OD1-CB 3.28Å; D554-T600 WeakPolarHBondContact OD1-CB 3.47Å; D554-T600 VanDerWaalsContact OD1-CG2 3.23Å; D554-T600 WeakPolarHBondContact OD1-CG2 3.42Å; D554-T600 PolarHBondContact OD1-OG1 3.37Å; E598-T600 PolarHBondContact O-N 3.44Å
601	Q	96.1	Very high	90.2	Very high	22 Å²	22	64.5 Å²	64.5	10%	0.103	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	120.5	-175.4	-58.8	-175.5	13	0	0	110	T552 L553 Y593 D594 E598 F603	T552-Q601 CarbonylContact C-O 3.47Å; T552-Q601 VanDerWaalsContact CA-O 3.27Å; T552-Q601 WeakPolarHBondContact CA-O 3.25Å; T552-Q601 WeakPolarHBondContact CG2-O 3.49Å; L553-Q601 PolarHBondContact N-O 3.3Å; L553-Q601 PolarHBondContact O-N 3.31Å; Y593-Q601 HydrophobicContact CD2-CB 4.13Å; Y593-Q601 HydrophobicContact CD2-CG 4.11Å; Y593-Q601 HydrophobicContact CE2-CB 4.04Å; Y593-Q601 VanDerWaalsContact CE2-CD 3.43Å; Y593-Q601 HydrophobicContact CE2-CG 3.67Å; D594-Q601 PolarHBondContact O-NE2 3.37Å; E598-Q601 WeakPolarHBondContact O-CG 3.43Å; E598-Q601 PolarHBondContact O-NE2 2.99Å; Q601-F603 HydrophobicContact CB-CE1 4.42Å; Q601-F603 HydrophobicContact CB-CE2 3.56Å; Q601-F603 HydrophobicContact CB-CZ 3.47Å; Q601-F603 VanDerWaalsContact CB-CZ 3.47Å; Q601-F603 WeakPolarHBondContact O-CD2 3.5Å; Q601-F603 VanDerWaalsContact O-CE2 3.22Å; Q601-F603 WeakPolarHBondContact O-CE2 3.27Å
602	T	96.9	Very high	90	Very high	38 Å²	38	65.7 Å²	65.7	23%	0.233	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	121.4	-179.3	-61.1	0	0	0	0	109.6	E467 A468 M471 H550 V551 T552	E467-T602 HydrophobicContact CB-CG2 4.37Å; A468-T602 PolarHBondContact N-OG1 2.93Å; M471-T602 HydrophobicContact CE-CG2 3.73Å; H550-T602 HydrophobicContact CB-CG2 4.04Å; V551-T602 CarbonylContact O-C 3.29Å; V551-T602 WeakPolarHBondContact O-CA 3.43Å; T552-T602 PolarHBondContact OG1-OG1 3.46Å
603	F	96.8	Very high	89.9	Confident	31 Å²	31	61.6 Å²	61.6	14%	0.136	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.7	-176	-54.8	-86.4	0	0	0	110	H550 V551 L553 F573 F591 F592 Y593 Q601	H550-F603 CarbonylContact C-O 3.57Å; H550-F603 WeakPolarHBondContact CA-O 3.27Å; H550-F603 WeakPolarHBondContact CB-O 3.34Å; V551-F603 HydrophobicContact CG2-CB 3.97Å; V551-F603 HydrophobicContact CG2-CD2 4.38Å; V551-F603 PolarHBondContact N-O 3.42Å; V551-F603 PolarHBondContact O-N 2.87Å; L553-F603 HydrophobicContact CB-CE2 4.1Å; F573-F603 HydrophobicContact CE1-CD2 4.45Å; F573-F603 HydrophobicContact CE1-CE2 4.02Å; F573-F603 HydrophobicContact CE1-CZ 4.11Å; F573-F603 AromaticContact CZ-CD2 3.7Å; F573-F603 HydrophobicContact CZ-CD2 3.7Å; F573-F603 AromaticContact CZ-CE2 3.67Å; F573-F603 HydrophobicContact CZ-CE2 3.67Å; F573-F603 HydrophobicContact CZ-CG 4.21Å; F573-F603 HydrophobicContact CZ-CZ 4.16Å; F591-F603 HydrophobicContact CB-CD1 4.04Å; F591-F603 HydrophobicContact CB-CG 4.22Å; F591-F603 HydrophobicContact CD1-CB 3.68Å; F591-F603 HydrophobicContact CD1-CD1 4.14Å; F591-F603 HydrophobicContact CD1-CG 4.17Å; F591-F603 HydrophobicContact CD2-CB 4.41Å; F591-F603 HydrophobicContact CE1-CB 3.88Å; F591-F603 HydrophobicContact CG-CB 3.96Å; F591-F603 HydrophobicContact CG-CD1 4.28Å; F591-F603 HydrophobicContact CG-CG 4.17Å; F591-F603 HydrophobicContact CZ-CB 4.33Å; F592-F603 WeakPolarHBondContact O-CE1 3.5Å; F592-F603 WeakPolarHBondContact O-CZ 3.43Å; Y593-F603 HydrophobicContact CD2-CZ 4.47Å; Q601-F603 HydrophobicContact CB-CE1 4.42Å; Q601-F603 HydrophobicContact CB-CE2 3.56Å; Q601-F603 HydrophobicContact CB-CZ 3.47Å; Q601-F603 VanDerWaalsContact CB-CZ 3.47Å; Q601-F603 WeakPolarHBondContact O-CD2 3.5Å; Q601-F603 VanDerWaalsContact O-CE2 3.22Å; Q601-F603 WeakPolarHBondContact O-CE2 3.27Å
604	K	95.7	Very high	89.7	Confident	147 Å²	147	65.3 Å²	65.3	64%	0.639	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	132.9	176.1	-177.9	176.1	174.6	-170.3	0	110.1	H550 F591	H550-K604 VanDerWaalsContact CD2-CB 3.49Å; H550-K604 WeakPolarHBondContact CD2-CB 3.33Å; F591-K604 WeakPolarHBondContact CE1-O 3.47Å
605	L	92.4	Very high	89.7	Confident	4 Å²	4	64 Å²	64	2%	0.021	35%	0.345	C	S	.	.			trans	-65.4	131.9	175.3	-84.4	57.4	0	0	0	110	I548 S549 V551 L588 F591	I548-L605 HydrophobicContact CB-CD2 3.98Å; I548-L605 HydrophobicContact CG2-CD1 4.15Å; I548-L605 HydrophobicContact CG2-CD2 3.66Å; S549-L605 PolarHBondContact O-N 3.3Å; V551-L605 HydrophobicContact CG1-CD1 4.42Å; L588-L605 HydrophobicContact CB-CD2 3.73Å; L588-L605 HydrophobicContact CB-CG 4.1Å; L588-L605 HydrophobicContact CD1-CD2 4.06Å; L588-L605 HydrophobicContact CG-CD2 4.4Å; F591-L605 HydrophobicContact CZ-CD1 4.08Å; F591-L605 HydrophobicContact CZ-CG 4.4Å
606	P	83.1	Confident	89.8	Confident	88 Å²	88	62.4 Å²	62.4	57%	0.571	34%	0.338	S	S	*	.	S	Bend	trans	-65.8	-44.7	-178.4	24.4	-33.4	0	0	0	112	L588 P608	L588-P606 WeakPolarHBondContact O-CD 3.5Å; P606-P608 WeakPolarHBondContact O-CD 3.47Å
607	N	75.3	Confident	90	Very high	135 Å²	135	57.3 Å²	57.3	72%	0.722	31%	0.31	S	S	*	.	S	Bend	trans	-119.7	85.3	178.5	-69.2	-30.6	0	0	0	109.5	S609	N607-S609 PolarHBondContact O-N 3.4Å
608	P	69	Low	90.3	Very high	82 Å²	82	55.6 Å²	55.6	53%	0.532	29%	0.292	S	S	.	.			trans	-70.5	94.9	175.7	29.2	-33.7	0	0	0	110	P606	P606-P608 WeakPolarHBondContact O-CD 3.47Å
609	S	70.3	Confident	90.6	Very high	45 Å²	45	52 Å²	52	32%	0.315	27%	0.272	S	S	.	.			trans	-60.2	146.5	174.2	-176.5	0	0	0	0	111.1	N607 E611	N607-S609 PolarHBondContact O-N 3.4Å; S609-E611 PolarHBondContact O-N 2.94Å; S609-E611 WeakPolarHBondContact OG-CB 3.29Å; S609-E611 WeakPolarHBondContact OG-CG 3.47Å; S609-E611 PolarHBondContact OG-N 3.34Å; S609-E611 PolarHBondContact OG-OE1 2.97Å
610	D	80.8	Confident	90.8	Very high	115 Å²	115	51 Å²	51	62%	0.615	26%	0.264	S	S	*	.	S	Bend	trans	-73.9	2.5	169	-99.4	-44.8	0	0	0	112.6	R547	R547-D610 WeakPolarHBondContact CD-OD1 3.48Å; R547-D610 VanDerWaalsContact CZ-O 3.29Å; R547-D610 IonicContact CZ-OD1 3.15Å; R547-D610 PolarHBondContact NE-O 2.98Å; R547-D610 IonicContact NE-OD1 2.77Å; R547-D610 PolarHBondContact NE-OD1 3.02Å; R547-D610 VanDerWaalsContact NE-OD1 3.15Å; R547-D610 IonicContact NH1-OD1 2.97Å; R547-D610 PolarHBondContact NH1-OD1 3.18Å; R547-D610 PolarHBondContact NH2-O 3.28Å; R547-D610 VanDerWaalsContact NH2-O 3.15Å; R547-D610 IonicContact NH2-OD1 2.66Å
611	E	89.6	Confident	91	Very high	70 Å²	70	52.3 Å²	52.3	33%	0.327	27%	0.27	S	S	.	.			trans	-66.3	144.6	169.7	-73.3	173.1	-82.3	0	0	112.9	K579 S609 Y613	K579-E611 VanDerWaalsContact CE-OE2 3.25Å; K579-E611 WeakPolarHBondContact CE-OE2 3.49Å; K579-E611 IonicContact NZ-OE2 3.81Å; K579-E611 PolarHBondContact NZ-OE2 3.4Å; S609-E611 PolarHBondContact O-N 2.94Å; S609-E611 WeakPolarHBondContact OG-CB 3.29Å; S609-E611 WeakPolarHBondContact OG-CG 3.47Å; S609-E611 PolarHBondContact OG-N 3.34Å; S609-E611 PolarHBondContact OG-OE1 2.97Å; E611-Y613 HydrophobicContact CB-CE2 3.84Å; E611-Y613 PolarHBondContact OE1-OH 2.96Å
612	V	93.3	Very high	91.1	Very high	50 Å²	50	52.4 Å²	52.4	30%	0.303	27%	0.273	S	S	.	.			trans	-105.4	125.9	-177.8	178	0	0	0	0	108.5	P545 I546 R547 A642	P545-V612 HydrophobicContact CB-CG1 3.66Å; I546-V612 WeakPolarHBondContact O-CA 3.44Å; R547-V612 HydrophobicContact CG-CG2 4.11Å; V612-A642 HydrophobicContact CB-CB 4.42Å; V612-A642 HydrophobicContact CG1-CB 3.73Å; V612-A642 HydrophobicContact CG2-CB 3.76Å
613	Y	94.6	Very high	91.1	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	141.6	-179.2	-60.4	-75.5	0	0	0	110.6	P545 I546 I548 G577 K579 T586 L588 E611	P545-Y613 WeakPolarHBondContact CA-O 3.25Å; I546-Y613 PolarHBondContact N-O 3.26Å; I546-Y613 PolarHBondContact O-N 3.2Å; I548-Y613 HydrophobicContact CD1-CD2 4.05Å; I548-Y613 HydrophobicContact CD1-CG 4.31Å; G577-Y613 VanDerWaalsContact C-CE1 3.45Å; G577-Y613 VanDerWaalsContact CA-CD1 3.41Å; G577-Y613 WeakPolarHBondContact O-CE1 3.34Å; K579-Y613 HydrophobicContact CG-CD1 4.24Å; K579-Y613 HydrophobicContact CG-CE1 4.46Å; T586-Y613 WeakPolarHBondContact CB-OH 3.39Å; L588-Y613 HydrophobicContact CD2-CD2 4.43Å; L588-Y613 HydrophobicContact CD2-CE2 3.69Å; E611-Y613 HydrophobicContact CB-CE2 3.84Å; E611-Y613 PolarHBondContact OE1-OH 2.96Å
614	R	94.9	Very high	91.1	Very high	82 Å²	82	52 Å²	52	31%	0.309	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	-27.4	174.7	177.6	59.2	-171.7	-177.5	7.9	111.7	L542 S543 L578	L542-R614 WeakPolarHBondContact CB-O 3.38Å; L542-R614 PolarHBondContact N-O 3.38Å; L542-R614 PolarHBondContact O-NE 3.38Å; L542-R614 PolarHBondContact O-NH1 3.14Å; L542-R614 PolarHBondContact O-NH2 3.22Å; S543-R614 VanDerWaalsContact C-NH1 3.28Å; S543-R614 PolarHBondContact O-NH1 3.34Å; S543-R614 PolarHBondContact O-NH2 2.9Å; L578-R614 PolarHBondContact O-N 3.01Å; L578-R614 VanDerWaalsContact O-N 3.15Å
615	F	96.2	Very high	91.1	Very high	32 Å²	32	47.4 Å²	47.4	14%	0.14	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	153	-179.4	-56.6	-95.3	0	0	0	110.2	V484 I540 L578 K579 D581	V484-F615 HydrophobicContact CG2-CD1 3.84Å; V484-F615 HydrophobicContact CG2-CE1 3.91Å; I540-F615 CarbonylContact O-C 3.27Å; I540-F615 VanDerWaalsContact O-CA 3.23Å; I540-F615 WeakPolarHBondContact O-CA 3.41Å; L578-F615 HydrophobicContact CB-CB 3.72Å; L578-F615 PolarHBondContact N-O 3.38Å; L578-F615 PolarHBondContact O-N 3.32Å; K579-F615 WeakPolarHBondContact O-CD2 3.38Å; D581-F615 HydrophobicContact CB-CD1 4.47Å; D581-F615 HydrophobicContact CB-CE1 4.03Å; D581-F615 HydrophobicContact CB-CE2 4.32Å; D581-F615 HydrophobicContact CB-CZ 3.95Å
616	V	96.6	Very high	91.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	134.2	174.2	173.9	0	0	0	0	109.1	V539 I540 L542 I548 V575 Y576 F635 V637	V539-V616 CarbonylContact C-O 3.57Å; V539-V616 WeakPolarHBondContact CA-O 3.22Å; I540-V616 PolarHBondContact N-O 3.38Å; I540-V616 PolarHBondContact O-N 2.89Å; L542-V616 HydrophobicContact CD1-CG2 3.89Å; L542-V616 HydrophobicContact CD2-CB 4.48Å; L542-V616 HydrophobicContact CD2-CG2 4.03Å; L542-V616 HydrophobicContact CG-CG2 4.13Å; I548-V616 HydrophobicContact CD1-CG2 3.44Å; I548-V616 VanDerWaalsContact CD1-CG2 3.44Å; V575-V616 HydrophobicContact CG1-CG1 3.61Å; Y576-V616 WeakPolarHBondContact O-CA 3.32Å; V616-F635 HydrophobicContact CG1-CE1 4.16Å; V616-V637 HydrophobicContact CB-CG2 4.47Å; V616-V637 HydrophobicContact CG1-CG2 4.3Å; V616-V637 HydrophobicContact CG2-CG1 4.22Å; V616-V637 HydrophobicContact CG2-CG2 4.33Å
617	E	97.2	Very high	91.7	Very high	10 Å²	10	51 Å²	51	5%	0.047	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	114.7	171.4	179.8	172.5	166.6	0	0	109	R487 L538 V539 Y576 L578 R619	R487-E617 IonicContact CZ-OE2 2.59Å; R487-E617 IonicContact NE-OE2 3.73Å; R487-E617 IonicContact NH2-OE2 2.99Å; R487-E617 PolarHBondContact NH2-OE2 3.41Å; L538-E617 WeakPolarHBondContact O-CA 3.42Å; V539-E617 HydrophobicContact CG2-CB 3.9Å; V539-E617 HydrophobicContact CG2-CG 3.74Å; Y576-E617 PolarHBondContact N-O 2.94Å; Y576-E617 PolarHBondContact O-N 3.48Å; L578-E617 HydrophobicContact CD1-CB 3.63Å; E617-R619 VanDerWaalsContact CD-NH2 3.33Å; E617-R619 HydrophobicContact CG-CG 4.11Å; E617-R619 IonicContact OE1-CZ 3.69Å; E617-R619 VanDerWaalsContact OE1-CZ 3.23Å; E617-R619 IonicContact OE1-NE 2.79Å; E617-R619 PolarHBondContact OE1-NE 2.99Å; E617-R619 IonicContact OE1-NH2 2.79Å; E617-R619 PolarHBondContact OE1-NH2 3.42Å; E617-R619 IonicContact OE2-NH2 3.86Å; E617-R619 PolarHBondContact OE2-NH2 2.98Å
618	L	97.7	Very high	92.5	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	126	167.5	168.8	66	0	0	0	107.9	S537 L538 F573 V575 L632 F635	S537-L618 CarbonylContact C-O 3.48Å; S537-L618 WeakPolarHBondContact CA-O 3.39Å; L538-L618 HydrophobicContact CB-CB 4.37Å; L538-L618 HydrophobicContact CD2-CD2 4.46Å; L538-L618 PolarHBondContact N-O 2.97Å; L538-L618 PolarHBondContact O-N 2.91Å; F573-L618 HydrophobicContact CB-CD1 4.19Å; F573-L618 HydrophobicContact CD2-CD1 3.43Å; F573-L618 VanDerWaalsContact CD2-CD1 3.43Å; F573-L618 HydrophobicContact CE2-CD1 4.12Å; F573-L618 HydrophobicContact CG-CD1 4.13Å; V575-L618 HydrophobicContact CG2-CD1 4.32Å; L618-L632 HydrophobicContact CD2-CD1 3.95Å; L618-F635 HydrophobicContact CB-CE1 4.25Å; L618-F635 HydrophobicContact CB-CZ 4.26Å; L618-F635 HydrophobicContact CD1-CE2 4.04Å; L618-F635 HydrophobicContact CD1-CZ 4.29Å; L618-F635 HydrophobicContact CD2-CB 4.37Å; L618-F635 HydrophobicContact CD2-CD1 4.35Å; L618-F635 HydrophobicContact CD2-CD2 3.92Å; L618-F635 HydrophobicContact CD2-CE2 4.19Å; L618-F635 HydrophobicContact CD2-CG 3.98Å
619	R	97.5	Very high	93.8	Very high	76 Å²	76	48.2 Å²	48.2	29%	0.287	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	119.4	171.1	-60.9	-168.8	-178.5	147.1	2.1	109.8	G536 F573 E574 Y576 E617	G536-R619 CarbonylContact O-C 3.54Å; G536-R619 WeakPolarHBondContact O-CA 3.33Å; F573-R619 CarbonylContact C-O 3.6Å; F573-R619 WeakPolarHBondContact CA-O 3.35Å; F573-R619 WeakPolarHBondContact CB-O 3.35Å; E574-R619 HydrophobicContact CB-CB 4.43Å; E574-R619 PolarHBondContact N-O 3.41Å; E574-R619 PolarHBondContact O-N 3.45Å; Y576-R619 HydrophobicContact CD2-CG 4.17Å; Y576-R619 HydrophobicContact CE2-CB 4.45Å; Y576-R619 HydrophobicContact CE2-CG 3.97Å; Y576-R619 PolarHBondContact OH-NH1 3.03Å; Y576-R619 VanDerWaalsContact OH-NH1 3.11Å; E617-R619 VanDerWaalsContact CD-NH2 3.33Å; E617-R619 HydrophobicContact CG-CG 4.11Å; E617-R619 IonicContact OE1-CZ 3.69Å; E617-R619 VanDerWaalsContact OE1-CZ 3.23Å; E617-R619 IonicContact OE1-NE 2.79Å; E617-R619 PolarHBondContact OE1-NE 2.99Å; E617-R619 IonicContact OE1-NH2 2.79Å; E617-R619 PolarHBondContact OE1-NH2 3.42Å; E617-R619 IonicContact OE2-NH2 3.86Å; E617-R619 PolarHBondContact OE2-NH2 2.98Å
620	V	98.3	Very high	95.1	Very high	4 Å²	4	46 Å²	46	2%	0.024	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	125.8	169.4	-177.1	0	0	0	0	107.9	F531 Q535 G536 P570 S622 T630 L632	F531-V620 HydrophobicContact CE1-CG2 4.22Å; F531-V620 HydrophobicContact CZ-CB 3.84Å; F531-V620 HydrophobicContact CZ-CG1 4.12Å; F531-V620 HydrophobicContact CZ-CG2 4Å; Q535-V620 WeakPolarHBondContact CA-O 3.39Å; G536-V620 PolarHBondContact N-O 3.08Å; G536-V620 VanDerWaalsContact N-O 3.14Å; G536-V620 PolarHBondContact O-N 3.27Å; P570-V620 HydrophobicContact CB-CG1 3.87Å; P570-V620 HydrophobicContact CB-CG2 4.12Å; V620-S622 WeakPolarHBondContact CG1-O 3.48Å; V620-T630 HydrophobicContact CG1-CG2 4.36Å; V620-L632 HydrophobicContact CG2-CD1 4.36Å; V620-L632 HydrophobicContact CG2-CD2 4.17Å
621	L	98.1	Very high	95.8	Very high	61 Å²	61	40.9 Å²	40.9	32%	0.319	21%	0.211	S	C	.	.			trans	-97.5	-28.2	-178.7	-55.9	-175.7	0	0	0	112.5	Q535 D572 E574	Q535-L621 WeakPolarHBondContact CG-O 3.37Å; Q535-L621 PolarHBondContact NE2-O 3.33Å; D572-L621 HydrophobicContact CB-CB 4.06Å; D572-L621 WeakPolarHBondContact O-CB 3.45Å; D572-L621 PolarHBondContact O-N 2.93Å; E574-L621 HydrophobicContact CG-CD1 3.88Å; E574-L621 HydrophobicContact CG-CG 4.33Å
622	S	98	Very high	96.1	Very high	24 Å²	24	37.7 Å²	37.7	17%	0.168	20%	0.195	C	C	.	.			trans	-154.5	168.6	179.4	75.5	0	0	0	0	111.9	V534 K571 D572 V620	V534-S622 CarbonylContact O-C 3.53Å; V534-S622 WeakPolarHBondContact O-CA 3.32Å; V534-S622 PolarHBondContact O-N 3.43Å; K571-S622 WeakPolarHBondContact CB-OG 3.49Å; K571-S622 PolarHBondContact N-O 3.39Å; D572-S622 VanDerWaalsContact CB-OG 3.3Å; D572-S622 WeakPolarHBondContact CB-OG 3.34Å; D572-S622 VanDerWaalsContact CG-OG 3.25Å; D572-S622 PolarHBondContact N-OG 3.32Å; D572-S622 PolarHBondContact O-N 3.13Å; D572-S622 WeakPolarHBondContact OD2-CB 3.28Å; D572-S622 PolarHBondContact OD2-OG 3.35Å; V620-S622 WeakPolarHBondContact CG1-O 3.48Å
623	N	97.8	Very high	96.2	Very high	14 Å²	14	36.3 Å²	36.3	8%	0.075	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-127.8	-177.7	170.4	76.5	10.5	0	0	0	110.9	A569 K571 G625 H626 Y629 T630	A569-N623 WeakPolarHBondContact O-CA 3.49Å; A569-N623 VanDerWaalsContact O-CB 3.26Å; A569-N623 WeakPolarHBondContact O-CB 3.28Å; K571-N623 WeakPolarHBondContact CD-O 3.45Å; N623-G625 VanDerWaalsContact C-N 3.28Å; N623-G625 PolarHBondContact O-N 3.5Å; N623-G625 PolarHBondContact OD1-N 2.95Å; N623-H626 PolarHBondContact ND2-O 2.98Å; N623-H626 PolarHBondContact OD1-N 3.23Å; N623-Y629 PolarHBondContact ND2-O 2.9Å; N623-T630 HydrophobicContact CB-CG2 3.78Å; N623-T630 WeakPolarHBondContact CB-OG1 3.39Å; N623-T630 PolarHBondContact ND2-OG1 2.79Å
624	W	97.1	Very high	96.3	Very high	47 Å²	47	37.5 Å²	37.5	18%	0.178	19%	0.19	C	C	.	.	S	Bend	trans	-82.9	7.5	-177.6	-77.9	99.2	0	0	0	115.5	D567 A569 P570 K571 F592 Y593 E595	D567-W624 CarbonylContact O-C 3.54Å; D567-W624 VanDerWaalsContact O-C 3.27Å; D567-W624 WeakPolarHBondContact O-CA 3.29Å; D567-W624 PolarHBondContact O-N 3.35Å; D567-W624 VanDerWaalsContact O-N 3.15Å; A569-W624 PolarHBondContact O-N 3.21Å; P570-W624 PolarHBondContact O-NE1 3.36Å; K571-W624 HydrophobicContact CB-CD2 4.29Å; K571-W624 HydrophobicContact CB-CG 4.19Å; K571-W624 HydrophobicContact CD-CD2 3.73Å; K571-W624 HydrophobicContact CD-CE3 3.95Å; K571-W624 HydrophobicContact CD-CG 4.26Å; K571-W624 HydrophobicContact CD-CH2 4.28Å; K571-W624 HydrophobicContact CD-CZ2 4Å; K571-W624 HydrophobicContact CD-CZ3 4.24Å; K571-W624 HydrophobicContact CG-CD2 4.1Å; K571-W624 HydrophobicContact CG-CZ2 3.85Å; K571-W624 VanDerWaalsContact NZ-CE3 3.31Å; F592-W624 HydrophobicContact CE1-CH2 4.08Å; F592-W624 AromaticContact CE1-CZ2 3.73Å; F592-W624 HydrophobicContact CE1-CZ2 3.73Å; F592-W624 HydrophobicContact CE2-CH2 4.43Å; F592-W624 HydrophobicContact CE2-CZ2 4.2Å; F592-W624 AromaticContact CZ-CH2 3.51Å; F592-W624 HydrophobicContact CZ-CH2 3.51Å; F592-W624 AromaticContact CZ-CZ2 3.4Å; F592-W624 HydrophobicContact CZ-CZ2 3.4Å; F592-W624 VanDerWaalsContact CZ-CZ2 3.4Å; Y593-W624 VanDerWaalsContact O-CZ2 3.32Å; Y593-W624 WeakPolarHBondContact O-CZ2 3.34Å; Y593-W624 PolarHBondContact O-NE1 3.37Å; E595-W624 HydrophobicContact CB-CD2 3.87Å; E595-W624 HydrophobicContact CB-CE3 4.4Å; E595-W624 HydrophobicContact CB-CG 4.05Å; E595-W624 HydrophobicContact CB-CZ2 4.28Å; E595-W624 HydrophobicContact CG-CD2 3.58Å; E595-W624 HydrophobicContact CG-CE3 3.59Å; E595-W624 HydrophobicContact CG-CG 4.19Å; E595-W624 HydrophobicContact CG-CH2 3.88Å; E595-W624 HydrophobicContact CG-CZ2 3.93Å; E595-W624 HydrophobicContact CG-CZ3 3.72Å; E595-W624 WeakPolarHBondContact OE1-CZ3 3.42Å
625	G	94.7	Very high	96.4	Very high	50 Å²	50	33.6 Å²	33.6	52%	0.515	18%	0.175	S	C	.	.	S	Bend	trans	132.6	-5.9	169.6	0	0	0	0	0	115.4	D567 N623 V627	D567-G625 PolarHBondContact O-N 3.21Å; N623-G625 VanDerWaalsContact C-N 3.28Å; N623-G625 PolarHBondContact O-N 3.5Å; N623-G625 PolarHBondContact OD1-N 2.95Å; G625-V627 PolarHBondContact O-N 3.13Å
626	H	95.2	Very high	96.4	Very high	45 Å²	45	33 Å²	33	21%	0.208	17%	0.171	C	C	.	.			trans	-72.6	117.5	-177.2	-166.5	-87.3	0	0	0	112.4	D567 N623 Y629	D567-H626 HydrophobicContact CB-CB 4.03Å; D567-H626 WeakPolarHBondContact O-CB 3.31Å; D567-H626 PolarHBondContact O-N 2.99Å; N623-H626 PolarHBondContact ND2-O 2.98Å; N623-H626 PolarHBondContact OD1-N 3.23Å; H626-Y629 AromaticContact CE1-CD1 3.24Å; H626-Y629 WeakPolarHBondContact CE1-CD1 3.27Å; H626-Y629 AromaticContact CE1-CE1 3.01Å; H626-Y629 WeakPolarHBondContact CE1-CE1 3.34Å; H626-Y629 AromaticContact CE1-CG 3.97Å; H626-Y629 AromaticContact CE1-CZ 3.54Å; H626-Y629 AromaticContact ND1-CD1 3.59Å; H626-Y629 AromaticContact ND1-CE1 3.64Å; H626-Y629 AromaticContact ND1-CG 3.83Å; H626-Y629 AromaticContact ND1-CZ 3.88Å; H626-Y629 PolarHBondContact ND1-O 3.41Å; H626-Y629 AromaticContact NE2-CE1 3.66Å; H626-Y629 AromaticContact NE2-CZ 3.91Å
627	V	92.9	Very high	96.5	Very high	124 Å²	124	33 Å²	33	75%	0.752	17%	0.171	S	C	*	.	S	Bend	trans	-76.2	-28.4	-165	-61.5	0	0	0	0	115.6	G625	G625-V627 PolarHBondContact O-N 3.13Å
628	E	93.8	Very high	96.4	Very high	106 Å²	106	32.5 Å²	32.5	50%	0.495	17%	0.169	S	C	.	.	S	Bend	trans	-90.8	-31.9	-173.2	-57.1	-172.3	157.1	0	0	114.3	Y492 G533	Y492-E628 PolarHBondContact OH-OE2 2.96Å; G533-E628 PolarHBondContact N-O 3.49Å
629	Y	94.9	Very high	96.2	Very high	51 Å²	51	33 Å²	33	20%	0.2	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	160.8	-169.1	71.4	-98	0	0	0	112.1	Y492 A530 F531 G533 N623 H626 C631	Y492-Y629 AromaticContact CD1-CD1 3.44Å; Y492-Y629 HydrophobicContact CD1-CD1 3.44Å; Y492-Y629 VanDerWaalsContact CD1-CD1 3.44Å; Y492-Y629 HydrophobicContact CD1-CE1 4.3Å; Y492-Y629 AromaticContact CD1-CG 3.63Å; Y492-Y629 HydrophobicContact CD1-CG 3.63Å; Y492-Y629 AromaticContact CE1-CD1 3.25Å; Y492-Y629 HydrophobicContact CE1-CD1 3.25Å; Y492-Y629 AromaticContact CE1-CE1 3.96Å; Y492-Y629 HydrophobicContact CE1-CE1 3.96Å; Y492-Y629 AromaticContact CE1-CG 3.94Å; Y492-Y629 HydrophobicContact CE1-CG 3.94Å; Y492-Y629 HydrophobicContact CG-CD1 4.47Å; Y492-Y629 HydrophobicContact CG-CG 4.38Å; A530-Y629 HydrophobicContact CB-CD2 4.06Å; A530-Y629 HydrophobicContact CB-CG 4.48Å; F531-Y629 WeakPolarHBondContact O-CA 3.5Å; F531-Y629 VanDerWaalsContact O-CB 3.25Å; F531-Y629 WeakPolarHBondContact O-CB 3.46Å; G533-Y629 CarbonylContact O-C 3.59Å; G533-Y629 VanDerWaalsContact O-C 3.29Å; G533-Y629 WeakPolarHBondContact O-CA 3.27Å; N623-Y629 PolarHBondContact ND2-O 2.9Å; H626-Y629 AromaticContact CE1-CD1 3.24Å; H626-Y629 WeakPolarHBondContact CE1-CD1 3.27Å; H626-Y629 AromaticContact CE1-CE1 3.01Å; H626-Y629 WeakPolarHBondContact CE1-CE1 3.34Å; H626-Y629 AromaticContact CE1-CG 3.97Å; H626-Y629 AromaticContact CE1-CZ 3.54Å; H626-Y629 AromaticContact ND1-CD1 3.59Å; H626-Y629 AromaticContact ND1-CE1 3.64Å; H626-Y629 AromaticContact ND1-CG 3.83Å; H626-Y629 AromaticContact ND1-CZ 3.88Å; H626-Y629 PolarHBondContact ND1-O 3.41Å; H626-Y629 AromaticContact NE2-CE1 3.66Å; H626-Y629 AromaticContact NE2-CZ 3.91Å; Y629-C631 HydrophobicContact CE2-CB 4.44Å
630	T	97.1	Very high	96.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142.9	170.8	-53.2	0	0	0	0	109	A530 F531 G533 V534 S568 P570 V620 N623	A530-T630 VanDerWaalsContact CA-O 3.29Å; A530-T630 WeakPolarHBondContact CA-O 3.49Å; F531-T630 HydrophobicContact CE1-CG2 4.32Å; F531-T630 HydrophobicContact CE2-CG2 4.38Å; F531-T630 VanDerWaalsContact CZ-CB 3.49Å; F531-T630 HydrophobicContact CZ-CG2 3.79Å; F531-T630 PolarHBondContact N-O 3.33Å; F531-T630 PolarHBondContact O-N 2.9Å; F531-T630 VanDerWaalsContact O-N 3.13Å; G533-T630 PolarHBondContact O-N 3.11Å; G533-T630 VanDerWaalsContact O-N 3.17Å; G533-T630 PolarHBondContact O-OG1 3.19Å; V534-T630 WeakPolarHBondContact CA-OG1 3.36Å; S568-T630 CarbonylContact O-C 3.53Å; S568-T630 WeakPolarHBondContact O-CA 3.44Å; S568-T630 WeakPolarHBondContact O-CG2 3.38Å; P570-T630 HydrophobicContact CB-CG2 4.39Å; V620-T630 HydrophobicContact CG1-CG2 4.36Å; N623-T630 HydrophobicContact CB-CG2 3.78Å; N623-T630 WeakPolarHBondContact CB-OG1 3.39Å; N623-T630 PolarHBondContact ND2-OG1 2.79Å
631	C	95.4	Very high	95.8	Very high	7 Å²	7	41.8 Å²	41.8	5%	0.047	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	125.9	-173.8	-131.7	0	0	0	0	113.1	C528 W529 S568 Y629	C528-C631 HydrophobicContact CB-CB 3.83Å; C528-C631 WeakPolarHBondContact CB-SG 3.44Å; C528-C631 WeakPolarHBondContact SG-CB 3.46Å; C528-C631 CovalentContact SG-SG 2.04Å; C528-C631 PolarHBondContact SG-SG 3.28Å; W529-C631 WeakPolarHBondContact O-CA 3.16Å; S568-C631 PolarHBondContact O-N 3.26Å; Y629-C631 HydrophobicContact CE2-CB 4.44Å
632	L	96.4	Very high	95	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	117.6	175.3	-62.8	-179.7	0	0	0	109.9	V516 C528 W529 F531 L538 L553 P570 L618 V620	V516-L632 HydrophobicContact CG1-CB 4.37Å; V516-L632 HydrophobicContact CG2-CB 3.91Å; C528-L632 CarbonylContact C-O 3.53Å; C528-L632 VanDerWaalsContact CA-O 3.28Å; C528-L632 WeakPolarHBondContact CA-O 3.48Å; C528-L632 VanDerWaalsContact CB-O 3.31Å; C528-L632 WeakPolarHBondContact CB-O 3.42Å; W529-L632 HydrophobicContact CE3-CB 4.42Å; W529-L632 HydrophobicContact CE3-CD1 3.94Å; W529-L632 HydrophobicContact CZ3-CD1 3.86Å; W529-L632 PolarHBondContact N-O 3.32Å; W529-L632 PolarHBondContact O-N 3.34Å; F531-L632 HydrophobicContact CE1-CD1 4.04Å; F531-L632 HydrophobicContact CE1-CG 4.11Å; L538-L632 HydrophobicContact CD2-CD1 4.32Å; L553-L632 HydrophobicContact CD1-CD2 4.2Å; P570-L632 HydrophobicContact CB-CD2 3.98Å; P570-L632 HydrophobicContact CG-CD2 3.65Å; L618-L632 HydrophobicContact CD2-CD1 3.95Å; V620-L632 HydrophobicContact CG2-CD1 4.36Å; V620-L632 HydrophobicContact CG2-CD2 4.17Å
633	Y	95.7	Very high	93.8	Very high	21 Å²	21	43.3 Å²	43.3	8%	0.082	24%	0.242	C	C	.	.			trans	-82.2	-58.5	179.2	-82	-94	0	0	0	111.7	L523 L524 G526 K527 C528 D554 H555 L556	L523-Y633 HydrophobicContact CB-CD1 4.31Å; L524-Y633 WeakPolarHBondContact O-CE1 3.39Å; G526-Y633 PolarHBondContact N-OH 3.05Å; K527-Y633 WeakPolarHBondContact O-CD1 3.22Å; C528-Y633 HydrophobicContact CB-CD1 3.79Å; C528-Y633 HydrophobicContact CB-CD2 3.53Å; C528-Y633 HydrophobicContact CB-CE1 3.82Å; C528-Y633 HydrophobicContact CB-CE2 3.56Å; C528-Y633 HydrophobicContact CB-CG 3.64Å; C528-Y633 VanDerWaalsContact SG-CZ 3.58Å; D554-Y633 WeakPolarHBondContact O-CB 3.39Å; H555-Y633 AromaticContact CD2-CD2 3.48Å; H555-Y633 VanDerWaalsContact CD2-CD2 3.48Å; H555-Y633 WeakPolarHBondContact CD2-CD2 3.48Å; H555-Y633 AromaticContact CD2-CE2 3.83Å; H555-Y633 AromaticContact CE1-CE2 3.8Å; H555-Y633 AromaticContact CG-CD2 3.96Å; H555-Y633 AromaticContact NE2-CD2 3.61Å; H555-Y633 AromaticContact NE2-CE2 3.42Å; H555-Y633 WeakPolarHBondContact NE2-CE2 3.41Å; L556-Y633 HydrophobicContact CB-CD2 4.29Å; L556-Y633 HydrophobicContact CB-CE1 4.08Å; L556-Y633 HydrophobicContact CB-CE2 3.75Å; L556-Y633 HydrophobicContact CD1-CE1 4.41Å
634	R	96.3	Very high	91.5	Very high	30 Å²	30	51.9 Å²	51.9	11%	0.113	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	143.9	173.1	170.3	177.1	-179.3	-167.9	-2.3	111.7	D473 V516 D554 R636	D473-R634 IonicContact OD2-CZ 2.68Å; D473-R634 IonicContact OD2-NE 2.72Å; D473-R634 IonicContact OD2-NH2 2.8Å; D473-R634 PolarHBondContact OD2-NH2 2.85Å; V516-R634 VanDerWaalsContact O-CA 3.28Å; V516-R634 WeakPolarHBondContact O-CA 3.38Å; V516-R634 WeakPolarHBondContact O-CG 3.42Å; D554-R634 HydrophobicContact CB-CB 3.95Å; D554-R634 PolarHBondContact N-O 3.26Å; D554-R634 PolarHBondContact O-N 2.95Å; D554-R634 WeakPolarHBondContact OD2-CB 3.35Å; D554-R634 VanDerWaalsContact OD2-CD 3.28Å; D554-R634 WeakPolarHBondContact OD2-CD 3.39Å; D554-R634 VanDerWaalsContact OD2-CG 3.29Å; D554-R634 WeakPolarHBondContact OD2-CG 3.42Å; D554-R634 IonicContact OD2-NE 3.84Å; R634-R636 HydrophobicContact CG-CG 4.09Å
635	F	97.4	Very high	88.6	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135.1	172.8	-178.4	-108.8	0	0	0	109.1	V516 I540 V551 T552 L553 V575 V616 L618 V637	V516-F635 HydrophobicContact CG1-CB 3.67Å; V516-F635 PolarHBondContact O-N 3.35Å; V516-F635 VanDerWaalsContact O-N 3.15Å; I540-F635 HydrophobicContact CD1-CD1 3.69Å; I540-F635 HydrophobicContact CD1-CE1 4.26Å; V551-F635 HydrophobicContact CB-CE2 3.8Å; V551-F635 HydrophobicContact CB-CZ 3.88Å; V551-F635 HydrophobicContact CG1-CE2 4.23Å; V551-F635 HydrophobicContact CG1-CZ 3.78Å; V551-F635 HydrophobicContact CG2-CE2 4.19Å; V551-F635 HydrophobicContact CG2-CZ 4.49Å; T552-F635 CarbonylContact O-C 3.6Å; T552-F635 WeakPolarHBondContact O-CA 3.3Å; T552-F635 WeakPolarHBondContact O-CD2 3.37Å; L553-F635 HydrophobicContact CB-CD2 4.49Å; L553-F635 HydrophobicContact CD1-CB 4.36Å; L553-F635 HydrophobicContact CD1-CD2 4.01Å; V575-F635 HydrophobicContact CG1-CZ 4.47Å; V575-F635 HydrophobicContact CG2-CE2 4.41Å; V575-F635 HydrophobicContact CG2-CZ 4.03Å; V616-F635 HydrophobicContact CG1-CE1 4.16Å; L618-F635 HydrophobicContact CB-CE1 4.25Å; L618-F635 HydrophobicContact CB-CZ 4.26Å; L618-F635 HydrophobicContact CD1-CE2 4.04Å; L618-F635 HydrophobicContact CD1-CZ 4.29Å; L618-F635 HydrophobicContact CD2-CB 4.37Å; L618-F635 HydrophobicContact CD2-CD1 4.35Å; L618-F635 HydrophobicContact CD2-CD2 3.92Å; L618-F635 HydrophobicContact CD2-CE2 4.19Å; L618-F635 HydrophobicContact CD2-CG 3.98Å; F635-V637 HydrophobicContact CD1-CG2 4.13Å; F635-V637 HydrophobicContact CE1-CG2 3.57Å; F635-V637 HydrophobicContact CZ-CG2 4.26Å
636	R	97.1	Very high	88.2	Confident	18 Å²	18	60.1 Å²	60.1	7%	0.068	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	143.1	-175.5	-38.2	-174.3	-162.5	-178.2	10.3	109.4	D469 D473 V551 T552 D554 R634	D469-R636 IonicContact OD1-CZ 3.21Å; D469-R636 IonicContact OD1-NH1 2.64Å; D469-R636 PolarHBondContact OD1-NH1 3.33Å; D473-R636 HydrophobicContact CB-CB 4.45Å; D473-R636 WeakPolarHBondContact OD1-CA 3.42Å; D473-R636 WeakPolarHBondContact OD2-CG 3.39Å; V551-R636 CarbonylContact C-O 3.58Å; V551-R636 WeakPolarHBondContact CA-O 3.37Å; T552-R636 HydrophobicContact CG2-CG 4.41Å; T552-R636 PolarHBondContact N-O 3.45Å; T552-R636 PolarHBondContact O-N 2.88Å; D554-R636 VanDerWaalsContact CG-NH2 3.31Å; D554-R636 IonicContact OD1-CZ 2.96Å; D554-R636 IonicContact OD1-NE 3.23Å; D554-R636 IonicContact OD1-NH2 2.73Å; D554-R636 PolarHBondContact OD1-NH2 2.91Å; D554-R636 IonicContact OD2-CZ 3.21Å; D554-R636 VanDerWaalsContact OD2-CZ 3.29Å; D554-R636 IonicContact OD2-NE 2.79Å; D554-R636 PolarHBondContact OD2-NE 3.26Å; D554-R636 IonicContact OD2-NH2 2.95Å; D554-R636 PolarHBondContact OD2-NH2 2.89Å; R634-R636 HydrophobicContact CG-CG 4.09Å
637	V	97.3	Very high	87.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	126.4	177.8	-178.9	0	0	0	0	109.4	D473 F474 A475 L542 I546 I548 V551 V616 F635	D473-V637 PolarHBondContact OD1-N 3.41Å; F474-V637 PolarHBondContact N-O 3.26Å; A475-V637 HydrophobicContact CB-CB 4.09Å; A475-V637 HydrophobicContact CB-CG2 3.92Å; L542-V637 HydrophobicContact CD1-CG1 4.17Å; L542-V637 HydrophobicContact CD2-CB 3.92Å; L542-V637 HydrophobicContact CD2-CG1 4.11Å; L542-V637 HydrophobicContact CD2-CG2 4.05Å; I546-V637 HydrophobicContact CD1-CG1 3.92Å; I548-V637 HydrophobicContact CD1-CG1 4.32Å; I548-V637 HydrophobicContact CG1-CG1 3.97Å; I548-V637 HydrophobicContact CG2-CG1 3.9Å; V551-V637 HydrophobicContact CG1-CG2 4.43Å; V616-V637 HydrophobicContact CB-CG2 4.47Å; V616-V637 HydrophobicContact CG1-CG2 4.3Å; V616-V637 HydrophobicContact CG2-CG1 4.22Å; V616-V637 HydrophobicContact CG2-CG2 4.33Å; F635-V637 HydrophobicContact CD1-CG2 4.13Å; F635-V637 HydrophobicContact CE1-CG2 3.57Å; F635-V637 HydrophobicContact CZ-CG2 4.26Å
638	H	96.3	Very high	87.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	145.1	-174.4	-51.8	-65.5	0	0	0	110.7	M471 P472 S549 H550 T552	M471-H638 HydrophobicContact CB-CB 4.01Å; M471-H638 HydrophobicContact CE-CB 4.11Å; M471-H638 HydrophobicContact SD-CB 3.92Å; P472-H638 PolarHBondContact O-ND1 2.93Å; S549-H638 PolarHBondContact N-O 3.08Å; H550-H638 HydrophobicContact CB-CB 4.16Å; H550-H638 PolarHBondContact N-O 2.91Å; H550-H638 WeakPolarHBondContact O-CA 3.43Å; H550-H638 WeakPolarHBondContact O-CB 3.32Å; H550-H638 PolarHBondContact O-N 3.03Å; H550-H638 VanDerWaalsContact O-O 3.07Å; T552-H638 PolarHBondContact OG1-CD2 3.37Å; T552-H638 PolarHBondContact OG1-NE2 3.42Å
639	G	94.1	Very high	87.2	Confident	12 Å²	12	54.5 Å²	54.5	12%	0.124	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	-165.1	-173.4	0	0	0	0	0	113.8	R547	R547-G639 CarbonylContact O-C 3.54Å; R547-G639 WeakPolarHBondContact O-CA 3.35Å
640	K	93.4	Very high	86.8	Confident	164 Å²	164	54.8 Å²	54.8	71%	0.713	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	139.1	168.7	-64.6	179.8	-177.5	175.8	0	109	I546 R547	I546-K640 CarbonylContact C-O 3.52Å; I546-K640 VanDerWaalsContact CA-O 3.28Å; I546-K640 WeakPolarHBondContact CA-O 3.37Å; I546-K640 VanDerWaalsContact CB-O 3.32Å; I546-K640 WeakPolarHBondContact CB-O 3.34Å; R547-K640 PolarHBondContact N-O 3.4Å; R547-K640 PolarHBondContact O-N 2.92Å
641	L	92.4	Very high	86.1	Confident	101 Å²	101	58.4 Å²	58.4	53%	0.529	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	139.8	168.8	-70.6	171.3	0	0	0	110.1	F474 H544 I546 A643	F474-L641 HydrophobicContact CE1-CD2 3.75Å; F474-L641 HydrophobicContact CE1-CG 4.22Å; F474-L641 HydrophobicContact CZ-CD2 4.25Å; F474-L641 HydrophobicContact CZ-CG 4.26Å; H544-L641 HydrophobicContact CB-CD2 3.41Å; H544-L641 VanDerWaalsContact CB-CD2 3.41Å; I546-L641 HydrophobicContact CG2-CD2 4.18Å; L641-A643 PolarHBondContact O-N 3.5Å
642	A	82.1	Confident	85.4	Confident	30 Å²	30	62.1 Å²	62.1	25%	0.248	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-60.9	128.1	157.6	0	0	0	0	0	108.2	P545 V612 H644	P545-A642 PolarHBondContact O-N 3.12Å; V612-A642 HydrophobicContact CB-CB 4.42Å; V612-A642 HydrophobicContact CG1-CB 3.73Å; V612-A642 HydrophobicContact CG2-CB 3.76Å; A642-H644 PolarHBondContact O-N 3.5Å
643	A	71.6	Confident	84.6	Confident	88 Å²	88	66.7 Å²	66.7	73%	0.727	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-64.6	132.9	170.1	0	0	0	0	0	108.5	L641 V645	L641-A643 PolarHBondContact O-N 3.5Å; A643-V645 PolarHBondContact O-N 3.2Å
644	H	50	Low	83.6	Confident	194 Å²	194	70.5 Å²	70.5	90%	0.898	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-63.7	125.4	167.3	-81.2	-82.8	0	0	0	108.9	A642	A642-H644 PolarHBondContact O-N 3.5Å
645	V	35.6	Very low	82.5	Confident	209 Å²	209	74.2 Å²	74.2	100%	1.267	42%	0.416	S	S	*	.			trans	-98.8	0	167.8	-177.5	0	0	0	0	107.8	A643	A643-V645 PolarHBondContact O-N 3.2Å

Retrieved 645 of 645 residues in 295.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).