A0A087XHG8_POEFO Loading...

Leucine-rich repeat protein SHOC-2

AlphaFold DB (A0A3B3VHK1), UniProt , Accession A0A087XHG8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 582 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.2	Very low	32.4	Very low	232 Å²	232	139.3 Å²	139.3	100%	1.143	79%	0.785	S	S	*	*				0	92.7	0	-58.9	-166.8	-153.1	0	0	106.5
2	S	33.3	Very low	32.1	Very low	107 Å²	107	145.3 Å²	145.3	75%	0.748	80%	0.796	S	S	*	*				72	95	105.1	-37.8	0	0	0	0	110
3	S	32.8	Very low	31.8	Very low	103 Å²	103	147.2 Å²	147.2	72%	0.72	80%	0.796	S	S	*	*				79.1	138.1	94.5	69	0	0	0	0	110.7
4	T	33.7	Very low	31.5	Very low	111 Å²	111	150.3 Å²	150.3	68%	0.681	80%	0.798	S	S	*	*			cis	175.9	131.4	29.2	4.5	0	0	0	0	104.1
5	L	35.7	Very low	31.1	Very low	162 Å²	162	150 Å²	150	85%	0.848	80%	0.797	S	S	*	*				66.2	132.2	97.2	-92.6	142.6	0	0	0	117.5
6	G	31.3	Very low	32	Very low	64 Å²	64	146.8 Å²	146.8	66%	0.66	79%	0.788	S	S	*	*			trans	145.7	85.4	151.5	0	0	0	0	0	114.3
7	K	32.1	Very low	31.7	Very low	185 Å²	185	149.6 Å²	149.6	80%	0.804	79%	0.791	S	S	*	*				75.1	112.2	95.8	-74.7	-177.3	177.6	-179.5	0	113.7
8	D	28.8	Very low	31.6	Very low	147 Å²	147	148.1 Å²	148.1	79%	0.786	80%	0.795	S	S	*	*				79.9	131.4	67.8	-92.6	-16.1	0	0	0	116.3
9	K	31.1	Very low	31.4	Very low	174 Å²	174	144.3 Å²	144.3	76%	0.757	79%	0.794	S	S	*	*			trans	88.8	114.9	152.2	-73.1	179.9	179.4	-173.4	0	119.2
10	D	28.6	Very low	31.7	Very low	146 Å²	146	143 Å²	143	78%	0.781	79%	0.792	S	S	*	*				64.6	130.9	83	-78.6	-39.4	0	0	0	111.2
11	S	29.4	Very low	31.5	Very low	101 Å²	101	143.2 Å²	143.2	71%	0.706	80%	0.797	S	S	*	*			cis	176.6	160.1	31.1	40	0	0	0	0	107.3
12	K	29.2	Very low	30.8	Very low	211 Å²	211	135.2 Å²	135.2	92%	0.917	78%	0.775	S	S	*	*			trans	-174.8	117.1	132.4	-105.1	171.5	-176.7	179	0	113.6
13	E	28.4	Very low	30.5	Very low	170 Å²	170	139.9 Å²	139.9	79%	0.794	78%	0.782	S	S	*	*			trans	-50.6	150.5	164	-73	166.4	129.6	0	0	115.5
14	K	27.1	Very low	30.3	Very low	191 Å²	191	144.4 Å²	144.4	83%	0.83	79%	0.791	S	S	*	*				176.8	112.3	101.1	-94.5	-175.1	177.5	179.6	0	112.5
15	D	26.3	Very low	30.2	Very low	146 Å²	146	151 Å²	151	78%	0.781	80%	0.804	S	S	*	*			trans	24.4	166	132.5	-86.3	-38.4	0	0	0	123.5
16	P	44.2	Very low	29.8	Very low	99 Å²	99	152.3 Å²	152.3	64%	0.643	81%	0.805	S	S	*	*			cis	-142.9	172.2	-3.2	25.3	0.4	0	0	0	118.2
17	K	28.2	Very low	29.7	Very low	195 Å²	195	158.9 Å²	158.9	85%	0.848	82%	0.816	S	S	*	*			trans	64.2	116.8	143.6	-76	171.8	-177.9	-178.9	0	121.6
18	S	29.8	Very low	29.5	Very low	122 Å²	122	159.5 Å²	159.5	85%	0.853	82%	0.822	S	S	*	*				164.4	126.2	105	51.9	0	0	0	0	114.5
19	G	28.1	Very low	29.6	Very low	76 Å²	76	157 Å²	157	78%	0.784	82%	0.821	S	S	*	*			trans	78.9	152.9	132.8	0	0	0	0	0	122
20	P	35.9	Very low	29.5	Very low	117 Å²	117	158.2 Å²	158.2	76%	0.76	83%	0.826	S	S	*	*			trans	-132	162.1	-139.5	34.9	-13.9	0	0	0	117.8
21	V	28	Very low	29.4	Very low	148 Å²	148	157.5 Å²	157.5	90%	0.897	83%	0.827	S	S	*	*			trans	57.3	126.9	132.6	179.4	0	0	0	0	121.2
22	G	25.4	Very low	29.3	Very low	65 Å²	65	161.5 Å²	161.5	67%	0.67	84%	0.84	S	S	*	*				126	130.8	122.6	0	0	0	0	0	119.4
23	K	26.5	Very low	29	Very low	205 Å²	205	156.6 Å²	156.6	89%	0.891	83%	0.832	S	S	*	*			trans	77.2	88.9	152.8	-59.7	-177	177.4	-178.5	0	119.7
24	E	28.6	Very low	28.8	Very low	198 Å²	198	153.8 Å²	153.8	93%	0.925	83%	0.831	S	S	*	*			trans	-146.2	75.9	150	-73.4	-165.4	154	0	0	111.5
25	R	30.6	Very low	28.7	Very low	249 Å²	249	152.8 Å²	152.8	94%	0.94	83%	0.834	S	S	*	*			trans	-152.4	72.7	159.8	-87.1	-164	177.3	176.6	-1.6	109
26	E	29.1	Very low	28.6	Very low	189 Å²	189	152.1 Å²	152.1	88%	0.883	84%	0.835	S	S	*	*			trans	-172.8	78.6	165.9	-119	-176.7	173.5	0	0	108.3
27	K	28.1	Very low	27.6	Very low	203 Å²	203	157 Å²	157	88%	0.883	85%	0.846	S	S	*	*			trans	-174.4	66.3	169.4	-108.8	170.7	-168.8	-175.3	0	111.2
28	E	29.1	Very low	27.4	Very low	198 Å²	198	155.6 Å²	155.6	93%	0.925	85%	0.848	S	S	*	*	S	Bend	trans	-159	34.7	160.7	-114.8	167.2	-149.9	0	0	112.1
29	A	29.2	Very low	27	Very low	93 Å²	93	153 Å²	153	77%	0.769	84%	0.84	S	S	*	*	S	Bend	trans	-135.6	67.5	169.7	0	0	0	0	0	108.2
30	K	29	Very low	26.7	Very low	201 Å²	201	153 Å²	153	87%	0.874	84%	0.84	S	S	*	*			trans	-175.6	66	169.5	-107	165.7	-171	-178.8	0	111.5
31	T	27.3	Very low	26.1	Very low	130 Å²	130	157.4 Å²	157.4	80%	0.798	85%	0.847	S	S	*	*			trans	-148.7	85.2	164.5	-15.7	0	0	0	0	108.3
32	L	27.2	Very low	25.8	Very low	185 Å²	185	159.4 Å²	159.4	97%	0.969	85%	0.847	S	S	*	*	S	Bend	trans	167.7	58.6	154.1	-89.3	153.4	0	0	0	108.9
33	S	23.7	Very low	25.7	Very low	108 Å²	108	162.9 Å²	162.9	76%	0.755	86%	0.855	S	S	*	*			trans	-156.3	111.1	163	71.3	0	0	0	0	109.4
34	S	22.6	Very low	25.6	Very low	112 Å²	112	163.1 Å²	163.1	78%	0.783	86%	0.856	S	S	*	*			trans	131.3	146.8	163.1	66.5	0	0	0	0	112.3
35	L	24.8	Very low	25.4	Very low	170 Å²	170	160.6 Å²	160.6	89%	0.89	86%	0.855	S	S	*	*			trans	87.9	106.4	-163.1	-53	167.7	0	0	0	110.2
36	V	25	Very low	25.1	Very low	132 Å²	132	159.1 Å²	159.1	80%	0.8	86%	0.855	S	S	*	*			cis	-155.2	136	21.9	171.5	0	0	0	0	109.3
37	K	23.2	Very low	24.8	Very low	201 Å²	201	153.2 Å²	153.2	87%	0.874	85%	0.845	S	S	*	*			trans	-98.3	130.8	152.1	-80.5	-178.8	175	179.2	0	106.6
38	D	23.6	Very low	24.7	Very low	166 Å²	166	153.4 Å²	153.4	89%	0.888	85%	0.846	S	S	*	*				-176.3	149.1	113.4	-140.4	-11.5	0	0	0	113.5
39	G	22.2	Very low	24.5	Very low	66 Å²	66	151.9 Å²	151.9	68%	0.68	84%	0.844	S	S	*	*			trans	86.7	76.6	136.1	0	0	0	0	0	123
40	G	21.3	Very low	24.3	Very low	76 Å²	76	152.1 Å²	152.1	78%	0.784	85%	0.846	S	S	*	*			trans	30.4	130.4	136.1	0	0	0	0	0	124.6
41	K	22.8	Very low	24.1	Very low	211 Å²	211	152.5 Å²	152.5	92%	0.917	85%	0.848	S	S	*	*				-179.5	141.9	109.1	-102.2	178.9	-179.5	177.2	0	112.1
42	E	21.6	Very low	23.9	Very low	189 Å²	189	155.7 Å²	155.7	88%	0.883	85%	0.854	S	S	*	*			trans	-58	138.6	176.4	-61.9	176.1	132.3	0	0	113.1
43	T	23.7	Very low	23.8	Very low	139 Å²	139	150.3 Å²	150.3	85%	0.853	84%	0.843	S	S	*	*			trans	-150.5	132	137.9	34	0	0	0	0	109.6
44	K	24.3	Very low	23.9	Very low	209 Å²	209	155.3 Å²	155.3	91%	0.909	85%	0.851	S	S	*	*			trans	-75.9	132.9	176.7	-75.3	171.8	173.7	168.8	0	110.2
45	T	25.2	Very low	24	Very low	145 Å²	145	159.2 Å²	159.2	89%	0.89	85%	0.854	S	S	*	*			trans	-151.6	136	151.2	10.4	0	0	0	0	111.3
46	K	23.5	Very low	23.9	Very low	218 Å²	218	158.9 Å²	158.9	95%	0.948	85%	0.853	S	S	*	*			trans	-80.3	142.9	-179.9	-74.7	172.9	170.4	175.8	0	111.2
47	G	24.4	Very low	23.8	Very low	66 Å²	66	159 Å²	159	68%	0.68	86%	0.855	S	S	*	*			trans	175.1	97.5	160.4	0	0	0	0	0	107.8
48	K	25.3	Very low	23.9	Very low	207 Å²	207	155.1 Å²	155.1	90%	0.9	85%	0.853	S	S	*	*				42.2	95.1	96.4	-82.6	-167.4	177.4	-176.6	0	112.8
49	D	23.8	Very low	24	Very low	166 Å²	166	153 Å²	153	89%	0.888	85%	0.85	S	S	*	*			trans	-137	133.5	152.7	-89.7	-44.6	0	0	0	111.2
50	A	25.1	Very low	24	Very low	98 Å²	98	154.8 Å²	154.8	81%	0.81	85%	0.853	S	S	*	*			trans	-73.4	146.8	175.9	0	0	0	0	0	109.8
51	K	25	Very low	24.2	Very low	209 Å²	209	157.6 Å²	157.6	91%	0.909	86%	0.855	S	S	*	*			trans	-120.7	105.6	172.9	-143	176.4	-174	179.4	0	108.2
52	E	24.2	Very low	24.7	Very low	196 Å²	196	153.6 Å²	153.6	92%	0.916	85%	0.851	S	S	*	*			trans	-64.3	132.4	168.6	-72.3	176.4	142.9	0	0	110.1
53	G	25.4	Very low	24.8	Very low	73 Å²	73	147.9 Å²	147.9	75%	0.753	84%	0.843	S	S	*	*			trans	-104.3	120.5	171	0	0	0	0	0	109.7
54	K	24.6	Very low	24.7	Very low	213 Å²	213	148.3 Å²	148.3	93%	0.926	85%	0.845	S	S	*	*			trans	-56.7	138.2	168.1	-82.5	179	170.8	-178.8	0	110.6
55	K	24.7	Very low	24.7	Very low	193 Å²	193	142.7 Å²	142.7	84%	0.839	84%	0.837	S	S	*	*			trans	-113.5	107.1	-176.5	-150.8	-178.2	-171.1	-175.3	0	107.5
56	D	23.1	Very low	24.7	Very low	164 Å²	164	145.9 Å²	145.9	88%	0.877	84%	0.839	S	S	*	*			trans	-76.9	126.9	171.7	-70.9	-40	0	0	0	109.5
57	T	23.4	Very low	24.8	Very low	135 Å²	135	140.5 Å²	140.5	83%	0.828	83%	0.829	S	S	*	*			trans	-106.6	116.2	176.4	47.9	0	0	0	0	109.5
58	S	25.2	Very low	25	Very low	119 Å²	119	144.1 Å²	144.1	83%	0.832	84%	0.837	S	S	*	*			trans	-127.1	132.7	159.9	60.7	0	0	0	0	110.2
59	S	24.4	Very low	25	Very low	120 Å²	120	140.9 Å²	140.9	84%	0.839	83%	0.83	S	S	*	*			trans	-79.2	140.8	-169.9	42.9	0	0	0	0	111.8
60	S	23.2	Very low	25.1	Very low	104 Å²	104	140.3 Å²	140.3	73%	0.727	83%	0.827	S	S	*	*			trans	-133.3	144	173.2	56.2	0	0	0	0	109.4
61	T	25.5	Very low	25.1	Very low	136 Å²	136	141.5 Å²	141.5	83%	0.834	82%	0.824	S	S	*	*			trans	155.3	164.3	141.1	40.8	0	0	0	0	111.5
62	P	33.2	Very low	25.4	Very low	127 Å²	127	139.5 Å²	139.5	83%	0.825	82%	0.822	S	S	*	*			cis	-127.8	171.6	-25.3	29.6	-10.1	0	0	0	110.7
63	G	23.2	Very low	25.8	Very low	69 Å²	69	139.7 Å²	139.7	71%	0.711	82%	0.82	S	S	*	*			cis	160.3	145.2	4	0	0	0	0	0	108.9
64	V	22.9	Very low	25.9	Very low	148 Å²	148	147.5 Å²	147.5	90%	0.897	83%	0.826	S	S	*	*			trans	-136.9	116.7	144.4	-178.3	0	0	0	0	105.9
65	A	24.4	Very low	26	Very low	91 Å²	91	142.8 Å²	142.8	75%	0.752	82%	0.818	S	S	*	*			trans	-89.2	142.7	-168.9	0	0	0	0	0	112.1
66	F	25	Very low	26.2	Very low	211 Å²	211	141.2 Å²	141.2	93%	0.925	82%	0.818	S	S	*	*			trans	-117.1	116.9	151.5	-92.3	-84.2	0	0	0	108.1
67	S	24	Very low	26.5	Very low	106 Å²	106	139.2 Å²	139.2	74%	0.741	81%	0.814	S	S	*	*			trans	-76.1	129	-178.3	54	0	0	0	0	111.5
68	V	28.9	Very low	26.8	Very low	141 Å²	141	136.7 Å²	136.7	86%	0.855	81%	0.807	S	S	*	*			trans	-117	106	151.8	-177.2	0	0	0	0	106.4
69	D	25.8	Very low	27.1	Very low	139 Å²	139	137.7 Å²	137.7	74%	0.743	81%	0.811	S	S	*	*			trans	-65.3	128.5	-178.1	-123.5	-29.9	0	0	0	110.8
70	N	25.9	Very low	27.4	Very low	155 Å²	155	135.1 Å²	135.1	83%	0.829	80%	0.803	S	S	*	*			trans	-135.2	77.9	177.3	-123.8	-4.5	0	0	0	108
71	T	25.5	Very low	27.9	Very low	122 Å²	122	136.2 Å²	136.2	75%	0.748	81%	0.805	S	S	*	*			trans	-141.6	85.8	167.2	51	0	0	0	0	112.5
72	I	30.6	Very low	28.6	Very low	167 Å²	167	141.4 Å²	141.4	86%	0.856	81%	0.81	S	S	*	*			trans	-133.7	105.6	141.7	-59.1	-176.7	0	0	0	107.5
73	K	32.3	Very low	29.1	Very low	201 Å²	201	143 Å²	143	87%	0.874	80%	0.804	S	S	*	*			trans	-68.8	126	166.9	-81.1	-179.3	174.7	175.8	0	109.4
74	R	28.4	Very low	30.2	Very low	236 Å²	236	149.2 Å²	149.2	89%	0.891	81%	0.811	S	S	*	*			trans	-170.2	161.3	150.6	-104.2	167.1	-161	-148	6.8	110.9
75	P	27.3	Very low	31.9	Very low	115 Å²	115	143.2 Å²	143.2	75%	0.747	78%	0.776	S	S	*	*				-83.6	160.8	-120.7	33.6	-36.2	0	0	0	114.8
76	N	28.7	Very low	33.9	Very low	160 Å²	160	141.4 Å²	141.4	86%	0.856	76%	0.758	S	S	*	*			trans	-42.7	124.5	169.7	-87.6	-12.2	0	0	0	111.9
77	P	28.5	Very low	36.3	Very low	121 Å²	121	135.5 Å²	135.5	79%	0.786	74%	0.736	S	S	*	*			trans	-76.7	128.9	158.7	24.4	-15.8	0	0	0	108.6
78	A	30.2	Very low	38.9	Very low	83 Å²	83	133.7 Å²	133.7	69%	0.686	73%	0.727	S	S	*	*			trans	-48.9	159.1	163.9	0	0	0	0	0	111.1	G80	A78-G80 VanDerWaalsContact C-N 3.34Å; A78-G80 PolarHBondContact O-N 3.46Å
79	P	30.7	Very low	41.6	Very low	140 Å²	140	131 Å²	131	91%	0.909	71%	0.706	S	S	*	*			trans	-62.6	92.8	-175.4	25.5	-33.1	0	0	0	110.9
80	G	31.3	Very low	44.5	Very low	65 Å²	65	124.5 Å²	124.5	67%	0.67	67%	0.671	S	S	*	*			trans	-79.2	125	177.8	0	0	0	0	0	110.1	A78 R82	A78-G80 VanDerWaalsContact C-N 3.34Å; A78-G80 PolarHBondContact O-N 3.46Å; G80-R82 PolarHBondContact O-N 2.91Å
81	T	33.5	Very low	47.4	Very low	127 Å²	127	120.4 Å²	120.4	78%	0.779	65%	0.648	S	S	*	*			trans	-33.5	121.1	167.9	48.4	0	0	0	0	112.6	K83	T81-K83 PolarHBondContact O-N 3.24Å
82	R	40	Very low	50.4	Low	245 Å²	245	121.8 Å²	121.8	93%	0.925	64%	0.644	S	S	*	*			trans	-56	97.2	167.8	-75	177.1	175.4	171.3	-2.5	108.9	G80 K84	G80-R82 PolarHBondContact O-N 2.91Å; R82-K84 PolarHBondContact O-N 2.9Å
83	K	44.3	Very low	53.2	Low	162 Å²	162	116.3 Å²	116.3	70%	0.704	62%	0.615	S	S	*	*			trans	-62.7	119.8	169	-86.4	-175.4	173.9	-176.4	0	107.6	T81 S85	T81-K83 PolarHBondContact O-N 3.24Å; K83-S85 PolarHBondContact O-N 2.95Å
84	K	46.3	Very low	56	Low	198 Å²	198	106.9 Å²	106.9	86%	0.861	57%	0.574	S	S	*	*			trans	-60.9	113.9	161.5	-75	177.7	176.5	177.4	0	106	R82 S86	R82-K84 PolarHBondContact O-N 2.9Å; K84-S86 PolarHBondContact O-N 3.44Å; K84-S86 VanDerWaalsContact O-N 3.11Å
85	S	58.2	Low	58.9	Low	22 Å²	22	98.1 Å²	98.1	15%	0.154	54%	0.544	C	S	.	.			trans	-59.4	119	169.3	173.1	0	0	0	0	107.5	K83 E89 R110	K83-S85 PolarHBondContact O-N 2.95Å; S85-E89 WeakPolarHBondContact CA-OE2 3.44Å; S85-R110 WeakPolarHBondContact CB-O 3.41Å
86	S	67.3	Low	61.9	Low	53 Å²	53	97.3 Å²	97.3	37%	0.371	53%	0.529	S	S	.	.			trans	-76.6	147.4	171.7	68.6	0	0	0	0	108.6	K84 A88 E89 V90	K84-S86 PolarHBondContact O-N 3.44Å; K84-S86 VanDerWaalsContact O-N 3.11Å; S86-A88 PolarHBondContact O-N 3.45Å; S86-A88 VanDerWaalsContact O-N 3.08Å; S86-E89 PolarHBondContact N-OE2 3.4Å; S86-E89 PolarHBondContact O-N 2.98Å; S86-E89 PolarHBondContact OG-N 3.47Å; S86-V90 PolarHBondContact O-N 3.43Å
87	N	74	Confident	64.9	Low	88 Å²	88	90 Å²	90	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-55.1	-27.1	173.2	-81.4	-8.7	0	0	0	111.9	V90 I91	N87-V90 PolarHBondContact O-N 3.47Å; N87-I91 WeakPolarHBondContact O-CG1 2.82Å; N87-I91 PolarHBondContact O-N 3.38Å
88	A	79.8	Confident	67.9	Low	68 Å²	68	89 Å²	89	56%	0.562	47%	0.471	S	S	*	.	H	α-helix	trans	-64.5	-36.9	175.8	0	0	0	0	0	113	S86 I91 K92	S86-A88 PolarHBondContact O-N 3.45Å; S86-A88 VanDerWaalsContact O-N 3.08Å; A88-I91 PolarHBondContact O-N 2.63Å; A88-K92 WeakPolarHBondContact O-CB 3.47Å; A88-K92 PolarHBondContact O-N 3.08Å
89	E	84.3	Confident	70.7	Confident	85 Å²	85	92.2 Å²	92.2	40%	0.397	47%	0.472	S	S	.	.	H	α-helix	trans	-67.8	-38.5	176	-73.3	170.9	159.7	0	0	111.4	S85 S86 K92 E93	S85-E89 WeakPolarHBondContact CA-OE2 3.44Å; S86-E89 PolarHBondContact N-OE2 3.4Å; S86-E89 PolarHBondContact O-N 2.98Å; S86-E89 PolarHBondContact OG-N 3.47Å; E89-K92 PolarHBondContact O-N 3.16Å; E89-E93 VanDerWaalsContact O-CG 3.26Å; E89-E93 WeakPolarHBondContact O-CG 3.39Å; E89-E93 PolarHBondContact O-N 3.33Å
90	V	87.3	Confident	73.6	Confident	1 Å²	1	91.4 Å²	91.4	1%	0.006	46%	0.456	C	S	.	.	H	α-helix	trans	-63.9	-47.2	175.4	-176.4	0	0	0	0	110.3	S86 N87 K92 E93 L94 L107 I112 P116	S86-V90 PolarHBondContact O-N 3.43Å; N87-V90 PolarHBondContact O-N 3.47Å; V90-K92 VanDerWaalsContact C-N 3.32Å; V90-K92 PolarHBondContact O-N 3.12Å; V90-E93 PolarHBondContact O-N 2.97Å; V90-E93 VanDerWaalsContact O-N 3.16Å; V90-L94 HydrophobicContact CG1-CD1 4.47Å; V90-L94 WeakPolarHBondContact O-CG 3.4Å; V90-L94 PolarHBondContact O-N 2.92Å; V90-L107 HydrophobicContact CG1-CD1 4.1Å; V90-I112 HydrophobicContact CG1-CD1 4.49Å; V90-I112 HydrophobicContact CG2-CD1 3.84Å; V90-I112 HydrophobicContact CG2-CG1 3.87Å; V90-I112 HydrophobicContact CG2-CG2 4.4Å; V90-P116 HydrophobicContact CB-CG 4.31Å; V90-P116 HydrophobicContact CG1-CG 3.81Å
91	I	87	Confident	76.4	Confident	69 Å²	69	93.6 Å²	93.6	35%	0.354	45%	0.452	S	S	.	.	H	α-helix	trans	-61.2	-40.5	178.5	-67.7	166.7	0	0	0	111.5	N87 A88 E93 L94 N95 P116	N87-I91 WeakPolarHBondContact O-CG1 2.82Å; N87-I91 PolarHBondContact O-N 3.38Å; A88-I91 PolarHBondContact O-N 2.63Å; I91-E93 PolarHBondContact O-N 3.19Å; I91-L94 PolarHBondContact O-N 2.9Å; I91-N95 PolarHBondContact O-N 2.88Å; I91-P116 HydrophobicContact CG1-CB 4.14Å; I91-P116 HydrophobicContact CG1-CG 3.9Å
92	K	88.6	Confident	79.2	Confident	151 Å²	151	89.5 Å²	89.5	66%	0.657	43%	0.428	S	S	*	.	H	α-helix	trans	-58.1	-40.6	176.7	-173.1	-178.9	178.5	-178.2	0	111.7	A88 E89 V90 N95 K96	A88-K92 WeakPolarHBondContact O-CB 3.47Å; A88-K92 PolarHBondContact O-N 3.08Å; E89-K92 PolarHBondContact O-N 3.16Å; V90-K92 VanDerWaalsContact C-N 3.32Å; V90-K92 PolarHBondContact O-N 3.12Å; K92-N95 PolarHBondContact O-N 3.2Å; K92-K96 WeakPolarHBondContact O-CB 3.39Å; K92-K96 PolarHBondContact O-N 3.23Å
93	E	89.9	Confident	81.8	Confident	53 Å²	53	81.4 Å²	81.4	25%	0.248	41%	0.407	C	S	.	.	H	α-helix	trans	-76.4	-33.3	-178	-65.4	-90.1	122.8	0	0	112	E89 V90 I91 K96 C97 L107 R110	E89-E93 VanDerWaalsContact O-CG 3.26Å; E89-E93 WeakPolarHBondContact O-CG 3.39Å; E89-E93 PolarHBondContact O-N 3.33Å; V90-E93 PolarHBondContact O-N 2.97Å; V90-E93 VanDerWaalsContact O-N 3.16Å; I91-E93 PolarHBondContact O-N 3.19Å; E93-K96 PolarHBondContact O-N 3.16Å; E93-C97 WeakPolarHBondContact O-CB 3.48Å; E93-C97 PolarHBondContact O-N 3.33Å; E93-L107 HydrophobicContact CB-CD2 4.1Å; E93-R110 VanDerWaalsContact CG-NH1 3.27Å; E93-R110 IonicContact OE2-CZ 2.79Å; E93-R110 IonicContact OE2-NH1 3.34Å; E93-R110 PolarHBondContact OE2-NH1 3.26Å; E93-R110 IonicContact OE2-NH2 2.74Å; E93-R110 PolarHBondContact OE2-NH2 3.48Å
94	L	90.8	Very high	84.3	Confident	3 Å²	3	79.5 Å²	79.5	2%	0.016	40%	0.395	C	S	.	.	H	α-helix	trans	-60.7	-47.5	168.7	-64.4	177	0	0	0	111	V90 I91 K96 C97 R98 L105 L107 P116 A118 I119 L122	V90-L94 HydrophobicContact CG1-CD1 4.47Å; V90-L94 WeakPolarHBondContact O-CG 3.4Å; V90-L94 PolarHBondContact O-N 2.92Å; I91-L94 PolarHBondContact O-N 2.9Å; L94-K96 PolarHBondContact O-N 3.23Å; L94-C97 WeakPolarHBondContact O-CB 3.41Å; L94-C97 PolarHBondContact O-N 2.96Å; L94-R98 PolarHBondContact O-N 3Å; L94-L105 HydrophobicContact CD2-CD2 3.6Å; L94-L107 HydrophobicContact CD2-CD1 4.37Å; L94-P116 HydrophobicContact CD1-CB 4.08Å; L94-P116 HydrophobicContact CD1-CG 3.9Å; L94-A118 HydrophobicContact CD1-CB 4.18Å; L94-I119 HydrophobicContact CD2-CD1 3.6Å; L94-L122 HydrophobicContact CB-CD1 4.36Å; L94-L122 HydrophobicContact CD2-CD1 3.6Å
95	N	89.3	Confident	86.6	Confident	51 Å²	51	70.5 Å²	70.5	27%	0.273	36%	0.356	S	S	.	.	H	α-helix	trans	-62.6	-42.5	178	-71.8	-23.2	0	0	0	111.8	I91 K92 C97 R98 E99	I91-N95 PolarHBondContact O-N 2.88Å; K92-N95 PolarHBondContact O-N 3.2Å; N95-C97 PolarHBondContact O-N 3.29Å; N95-R98 WeakPolarHBondContact O-CB 3.47Å; N95-R98 PolarHBondContact O-N 3.04Å; N95-E99 WeakPolarHBondContact O-CG 3.34Å; N95-E99 PolarHBondContact O-N 3.05Å
96	K	90.6	Very high	88.4	Confident	98 Å²	98	72.3 Å²	72.3	43%	0.426	36%	0.364	S	S	.	.	H	α-helix	trans	-59.2	-46.8	175	-176.4	-177.3	174.1	-172.2	0	111.4	K92 E93 L94 R98 E99 E100	K92-K96 WeakPolarHBondContact O-CB 3.39Å; K92-K96 PolarHBondContact O-N 3.23Å; E93-K96 PolarHBondContact O-N 3.16Å; L94-K96 PolarHBondContact O-N 3.23Å; K96-R98 PolarHBondContact O-N 3.21Å; K96-E99 PolarHBondContact O-N 3.35Å; K96-E100 VanDerWaalsContact CE-CD 3.42Å; K96-E100 WeakPolarHBondContact CE-OE1 3.38Å; K96-E100 WeakPolarHBondContact CE-OE2 3.43Å; K96-E100 HydrophobicContact CG-CG 4.38Å; K96-E100 IonicContact NZ-OE1 2.79Å; K96-E100 WeakPolarHBondContact O-CB 3.37Å; K96-E100 WeakPolarHBondContact O-CG 3.26Å; K96-E100 PolarHBondContact O-N 3.13Å
97	C	91.3	Very high	89.7	Confident	6 Å²	6	69.8 Å²	69.8	4%	0.041	35%	0.346	C	S	.	.	H	α-helix	trans	-60.6	-35.7	177.1	-170.5	0	0	0	0	112.5	E93 L94 N95 N101 S102 L105 L122	E93-C97 WeakPolarHBondContact O-CB 3.48Å; E93-C97 PolarHBondContact O-N 3.33Å; L94-C97 WeakPolarHBondContact O-CB 3.41Å; L94-C97 PolarHBondContact O-N 2.96Å; N95-C97 PolarHBondContact O-N 3.29Å; C97-N101 PolarHBondContact O-N 3.2Å; C97-S102 PolarHBondContact O-N 3.25Å; C97-S102 VanDerWaalsContact O-N 3.12Å; C97-L105 HydrophobicContact CB-CD1 4.17Å; C97-L122 HydrophobicContact CB-CD1 4.29Å; C97-L122 HydrophobicContact CB-CD2 4.4Å
98	R	90.8	Very high	90.6	Very high	101 Å²	101	66.2 Å²	66.2	38%	0.381	33%	0.328	S	S	.	.	H	α-helix	trans	-67.8	-47.3	174.9	-169.4	-177.4	64.3	-168.9	-4	111.7	L94 N95 K96 N101 E121 L122	L94-R98 PolarHBondContact O-N 3Å; N95-R98 WeakPolarHBondContact O-CB 3.47Å; N95-R98 PolarHBondContact O-N 3.04Å; K96-R98 PolarHBondContact O-N 3.21Å; R98-N101 PolarHBondContact O-N 3.11Å; R98-E121 IonicContact CZ-OE2 4Å; R98-E121 IonicContact NH1-OE2 3.68Å; R98-E121 PolarHBondContact NH1-OE2 3.07Å; R98-L122 HydrophobicContact CB-CD2 3.58Å; R98-L122 HydrophobicContact CG-CD2 4.2Å
99	E	90.2	Very high	91.2	Very high	151 Å²	151	70 Å²	70	71%	0.706	33%	0.332	S	S	*	.	H	α-helix	trans	-65.8	-37.8	-179.7	-73.3	169.9	-166	0	0	112.3	N95 K96 N101	N95-E99 WeakPolarHBondContact O-CG 3.34Å; N95-E99 PolarHBondContact O-N 3.05Å; K96-E99 PolarHBondContact O-N 3.35Å; E99-N101 VanDerWaalsContact C-N 3.26Å; E99-N101 PolarHBondContact O-N 3.48Å
100	E	91.4	Very high	91.5	Very high	123 Å²	123	70 Å²	70	58%	0.575	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-5.5	177.7	-67.2	175.6	169.7	0	0	113	K96 S102	K96-E100 VanDerWaalsContact CE-CD 3.42Å; K96-E100 WeakPolarHBondContact CE-OE1 3.38Å; K96-E100 WeakPolarHBondContact CE-OE2 3.43Å; K96-E100 HydrophobicContact CG-CG 4.38Å; K96-E100 IonicContact NZ-OE1 2.79Å; K96-E100 WeakPolarHBondContact O-CB 3.37Å; K96-E100 WeakPolarHBondContact O-CG 3.26Å; K96-E100 PolarHBondContact O-N 3.13Å; E100-S102 PolarHBondContact O-N 3.26Å; E100-S102 VanDerWaalsContact O-N 3.16Å
101	N	90	Very high	91.7	Very high	111 Å²	111	71.9 Å²	71.9	59%	0.594	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	37.5	-174.3	-163.9	39.2	0	0	0	112.9	C97 R98 E99 Q124	C97-N101 PolarHBondContact O-N 3.2Å; R98-N101 PolarHBondContact O-N 3.11Å; E99-N101 VanDerWaalsContact C-N 3.26Å; E99-N101 PolarHBondContact O-N 3.48Å; N101-Q124 WeakPolarHBondContact OD1-CG 3.39Å
102	S	92.5	Very high	91.9	Very high	40 Å²	40	68.7 Å²	68.7	28%	0.28	33%	0.326	S	S	.	.			trans	-70.8	138.5	-178	-179.9	0	0	0	0	110.6	C97 E100 R104 Q124	C97-S102 PolarHBondContact O-N 3.25Å; C97-S102 VanDerWaalsContact O-N 3.12Å; E100-S102 PolarHBondContact O-N 3.26Å; E100-S102 VanDerWaalsContact O-N 3.16Å; S102-R104 VanDerWaalsContact C-N 3.33Å; S102-R104 PolarHBondContact OG-N 3Å; S102-R104 PolarHBondContact OG-O 3.23Å; S102-Q124 WeakPolarHBondContact O-CG 3.33Å; S102-Q124 PolarHBondContact O-NE2 3.18Å
103	T	94.7	Very high	92	Very high	76 Å²	76	66.5 Å²	66.5	47%	0.466	32%	0.317	S	S	.	.	S	Bend	trans	-86.8	-6.3	175.1	59.5	0	0	0	0	112.8	T126 E127	T103-T126 PolarHBondContact O-N 2.8Å; T103-T126 PolarHBondContact O-OG1 2.89Å; T103-E127 PolarHBondContact O-N 2.92Å
104	R	96.4	Very high	92	Very high	121 Å²	121	69.4 Å²	69.4	46%	0.457	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	133	-179.8	178.2	-179	176.7	134.8	-8.8	110.8	S102 E127 Y129	S102-R104 VanDerWaalsContact C-N 3.33Å; S102-R104 PolarHBondContact OG-N 3Å; S102-R104 PolarHBondContact OG-O 3.23Å; R104-E127 WeakPolarHBondContact CA-O 3.47Å; R104-E127 HydrophobicContact CB-CB 4.18Å; R104-E127 VanDerWaalsContact CD-OE2 3.27Å; R104-E127 WeakPolarHBondContact CD-OE2 3.15Å; R104-E127 HydrophobicContact CG-CB 3.98Å; R104-E127 IonicContact CZ-OE2 3.5Å; R104-E127 IonicContact NE-OE2 3.54Å; R104-E127 IonicContact NH1-OE2 3.09Å; R104-E127 PolarHBondContact NH1-OE2 2.94Å; R104-Y129 HydrophobicContact CG-CD2 4.43Å; R104-Y129 HydrophobicContact CG-CE2 4.18Å; R104-Y129 VanDerWaalsContact CZ-CE2 3.44Å
105	L	95.5	Very high	92.1	Very high	10 Å²	10	69.7 Å²	69.7	5%	0.052	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	124.4	175.5	177.7	60.8	0	0	0	110.8	L94 C97 L107 I119 L122 L125 E127 L128 Y129	L94-L105 HydrophobicContact CD2-CD2 3.6Å; C97-L105 HydrophobicContact CB-CD1 4.17Å; L105-L107 HydrophobicContact CD1-CD2 4.17Å; L105-L107 HydrophobicContact CD1-CG 4.05Å; L105-L107 HydrophobicContact CD2-CD1 4.01Å; L105-L107 HydrophobicContact CD2-CG 4.32Å; L105-L107 HydrophobicContact CG-CD1 4.26Å; L105-L107 HydrophobicContact CG-CG 4.02Å; L105-I119 HydrophobicContact CD2-CD1 4.24Å; L105-L122 HydrophobicContact CD2-CD1 3.86Å; L105-L125 HydrophobicContact CB-CD1 4.04Å; L105-L125 HydrophobicContact CB-CD2 3.73Å; L105-L125 HydrophobicContact CD2-CD1 4.05Å; L105-E127 PolarHBondContact N-O 3.4Å; L105-L128 HydrophobicContact CB-CD1 4Å; L105-L128 HydrophobicContact CD2-CD1 3.83Å; L105-L128 HydrophobicContact CG-CD1 3.95Å; L105-Y129 PolarHBondContact O-N 2.88Å
106	D	95.1	Very high	92.2	Very high	59 Å²	59	68.2 Å²	68.2	32%	0.316	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	110.9	175.9	-168.7	-9.4	0	0	0	111.6	S108 Y129	D106-S108 WeakPolarHBondContact OD1-CB 3.43Å; D106-S108 PolarHBondContact OD1-N 3.04Å; D106-S108 PolarHBondContact OD1-OG 3.45Å; D106-Y129 HydrophobicContact CB-CD2 4.5Å
107	L	94.1	Very high	92.2	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.33	C	S	.	.			trans	-114.9	24.4	178.4	-66.7	178.8	0	0	0	111.7	V90 E93 L94 L105 I112 L115 Y129 L130 N133	V90-L107 HydrophobicContact CG1-CD1 4.1Å; E93-L107 HydrophobicContact CB-CD2 4.1Å; L94-L107 HydrophobicContact CD2-CD1 4.37Å; L105-L107 HydrophobicContact CD1-CD2 4.17Å; L105-L107 HydrophobicContact CD1-CG 4.05Å; L105-L107 HydrophobicContact CD2-CD1 4.01Å; L105-L107 HydrophobicContact CD2-CG 4.32Å; L105-L107 HydrophobicContact CG-CD1 4.26Å; L105-L107 HydrophobicContact CG-CG 4.02Å; L107-I112 HydrophobicContact CB-CD1 3.82Å; L107-I112 HydrophobicContact CD1-CD1 4.48Å; L107-L115 HydrophobicContact CD1-CD1 4.14Å; L107-Y129 PolarHBondContact N-O 2.99Å; L107-L130 HydrophobicContact CB-CD2 3.78Å; L107-L130 HydrophobicContact CD1-CD2 4.11Å; L107-N133 PolarHBondContact O-ND2 3.23Å
108	S	93.5	Very high	92.1	Very high	13 Å²	13	68.4 Å²	68.4	9%	0.091	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	152.9	-172.9	-50.3	0	0	0	0	113.2	D106 R110 Y129 Y131	D106-S108 WeakPolarHBondContact OD1-CB 3.43Å; D106-S108 PolarHBondContact OD1-N 3.04Å; D106-S108 PolarHBondContact OD1-OG 3.45Å; S108-R110 WeakPolarHBondContact O-CG 3.36Å; S108-R110 PolarHBondContact O-N 3.11Å; S108-Y129 PolarHBondContact OG-O 3.42Å; S108-Y131 CarbonylContact C-O 3.57Å; S108-Y131 WeakPolarHBondContact CA-O 3.48Å; S108-Y131 VanDerWaalsContact CB-CE1 3.41Å; S108-Y131 VanDerWaalsContact CB-CE2 3.45Å; S108-Y131 VanDerWaalsContact CB-O 3.25Å; S108-Y131 WeakPolarHBondContact CB-O 3.42Å; S108-Y131 WeakPolarHBondContact OG-CD1 3.16Å; S108-Y131 WeakPolarHBondContact OG-CE1 3.45Å; S108-Y131 PolarHBondContact OG-N 3.04Å
109	K	91.9	Very high	92.2	Very high	148 Å²	148	63.6 Å²	63.6	64%	0.643	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	23.9	178.6	-62.7	170.7	173.9	164.8	0	114.7	Y131 S132	K109-Y131 HydrophobicContact CD-CE2 4.35Å; K109-Y131 HydrophobicContact CG-CE2 4.29Å; K109-Y131 PolarHBondContact N-O 3.25Å; K109-S132 WeakPolarHBondContact CA-O 3.45Å
110	R	91.4	Very high	92.3	Very high	84 Å²	84	61.4 Å²	61.4	32%	0.317	31%	0.309	S	S	.	.	S	Bend	trans	-98.4	3.8	-177.9	-65.4	-173.2	-175.1	-162	4.5	113.7	S85 E93 S108 I112 N133	S85-R110 WeakPolarHBondContact CB-O 3.41Å; E93-R110 VanDerWaalsContact CG-NH1 3.27Å; E93-R110 IonicContact OE2-CZ 2.79Å; E93-R110 IonicContact OE2-NH1 3.34Å; E93-R110 PolarHBondContact OE2-NH1 3.26Å; E93-R110 IonicContact OE2-NH2 2.74Å; E93-R110 PolarHBondContact OE2-NH2 3.48Å; S108-R110 WeakPolarHBondContact O-CG 3.36Å; S108-R110 PolarHBondContact O-N 3.11Å; R110-I112 HydrophobicContact CB-CD1 3.97Å; R110-I112 HydrophobicContact CB-CG1 3.8Å; R110-I112 PolarHBondContact O-N 3.2Å; R110-N133 PolarHBondContact N-OD1 2.72Å; R110-N133 VanDerWaalsContact N-OD1 3.11Å
111	S	90.9	Very high	92.3	Very high	41 Å²	41	59.8 Å²	59.8	29%	0.287	30%	0.302	S	S	.	.			trans	56.3	34.2	-176.6	-62.1	0	0	0	0	113.7	H113 N133	S111-H113 PolarHBondContact O-CD2 3.03Å; S111-N133 PolarHBondContact N-OD1 3.08Å
112	I	91.2	Very high	92.4	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.015	27%	0.274	C	S	.	.			trans	-69.4	132.8	-179.5	-59.5	170.9	0	0	0	109.9	V90 L107 R110 M114 N133 K134 L135	V90-I112 HydrophobicContact CG1-CD1 4.49Å; V90-I112 HydrophobicContact CG2-CD1 3.84Å; V90-I112 HydrophobicContact CG2-CG1 3.87Å; V90-I112 HydrophobicContact CG2-CG2 4.4Å; L107-I112 HydrophobicContact CB-CD1 3.82Å; L107-I112 HydrophobicContact CD1-CD1 4.48Å; R110-I112 HydrophobicContact CB-CD1 3.97Å; R110-I112 HydrophobicContact CB-CG1 3.8Å; R110-I112 PolarHBondContact O-N 3.2Å; I112-M114 VanDerWaalsContact CG2-O 3.24Å; I112-M114 WeakPolarHBondContact CG2-O 3.24Å; I112-N133 HydrophobicContact CB-CB 4.36Å; I112-N133 PolarHBondContact N-OD1 3.23Å; I112-K134 CarbonylContact O-C 3.29Å; I112-K134 VanDerWaalsContact O-CA 3.29Å; I112-K134 WeakPolarHBondContact O-CA 2.9Å; I112-K134 PolarHBondContact O-N 3.05Å; I112-L135 HydrophobicContact CB-CD2 4.47Å; I112-L135 HydrophobicContact CG2-CD2 3.86Å; I112-L135 PolarHBondContact O-N 2.96Å
113	H	90.8	Very high	92.4	Very high	104 Å²	104	56.1 Å²	56.1	48%	0.481	28%	0.281	S	S	.	.	S	Bend	trans	-95.3	-35	179.7	-75.6	-83.5	0	0	0	113.4	S111 K134	S111-H113 PolarHBondContact O-CD2 3.03Å; H113-K134 VanDerWaalsContact CE1-CD 3.46Å; H113-K134 WeakPolarHBondContact CE1-CD 3.4Å
114	M	90.5	Very high	92.3	Very high	114 Å²	114	54.3 Å²	54.3	56%	0.562	27%	0.268	S	S	*	.	S	Bend	trans	-144.8	144.2	176.5	-62.4	-165.5	-54.5	0	0	109.5	I112	I112-M114 VanDerWaalsContact CG2-O 3.24Å; I112-M114 WeakPolarHBondContact CG2-O 3.24Å
115	L	92	Very high	92.3	Very high	9 Å²	9	48.5 Å²	48.5	5%	0.047	25%	0.246	C	C	.	.			trans	-85.7	132.3	173.2	-169.1	71	0	0	0	109.4	L107 I119 L130 P139 L142	L107-L115 HydrophobicContact CD1-CD1 4.14Å; L115-I119 HydrophobicContact CD2-CB 4.22Å; L115-I119 HydrophobicContact CD2-CD1 4.26Å; L115-I119 HydrophobicContact CD2-CG1 3.98Å; L115-I119 HydrophobicContact CD2-CG2 4.25Å; L115-I119 HydrophobicContact CG-CB 4.48Å; L115-L130 HydrophobicContact CD1-CD2 4.02Å; L115-L130 HydrophobicContact CD2-CD1 4.32Å; L115-P139 HydrophobicContact CB-CG 4.01Å; L115-P139 HydrophobicContact CD2-CG 4.11Å; L115-P139 HydrophobicContact CG-CG 4.32Å; L115-L142 HydrophobicContact CD2-CD1 4.03Å
116	P	91.1	Very high	92.4	Very high	20 Å²	20	50 Å²	50	13%	0.13	26%	0.255	C	S	.	.			trans	-65.5	149.4	178.6	-16.9	28.8	0	0	0	112.5	V90 I91 L94 A118 I119	V90-P116 HydrophobicContact CB-CG 4.31Å; V90-P116 HydrophobicContact CG1-CG 3.81Å; I91-P116 HydrophobicContact CG1-CB 4.14Å; I91-P116 HydrophobicContact CG1-CG 3.9Å; L94-P116 HydrophobicContact CD1-CB 4.08Å; L94-P116 HydrophobicContact CD1-CG 3.9Å; P116-A118 HydrophobicContact CB-CB 4.42Å; P116-A118 PolarHBondContact O-N 3.23Å; P116-I119 WeakPolarHBondContact O-CG2 3.37Å; P116-I119 PolarHBondContact O-N 2.84Å
117	T	90.2	Very high	92.5	Very high	81 Å²	81	49.8 Å²	49.8	50%	0.497	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-65.1	-18.5	175	56.2	0	0	0	0	113.3	I119 K120 E141	T117-I119 PolarHBondContact O-N 3.46Å; T117-K120 WeakPolarHBondContact O-CG 3.41Å; T117-K120 PolarHBondContact O-N 3.31Å; T117-E141 HydrophobicContact CG2-CG 4.4Å
118	A	90.4	Very high	92.7	Very high	27 Å²	27	49.8 Å²	49.8	22%	0.223	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-58	-15	173.1	0	0	0	0	0	113.6	L94 P116 K120 E121	L94-A118 HydrophobicContact CD1-CB 4.18Å; P116-A118 HydrophobicContact CB-CB 4.42Å; P116-A118 PolarHBondContact O-N 3.23Å; A118-K120 PolarHBondContact O-N 3.28Å; A118-K120 VanDerWaalsContact O-N 3.13Å; A118-E121 PolarHBondContact O-N 2.91Å
119	I	92.7	Very high	92.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-55.2	-27.7	173.4	-164.3	72.9	0	0	0	112.8	L94 L105 L115 P116 T117 E121 L122 P139 E141 L142 L145	L94-I119 HydrophobicContact CD2-CD1 3.6Å; L105-I119 HydrophobicContact CD2-CD1 4.24Å; L115-I119 HydrophobicContact CD2-CB 4.22Å; L115-I119 HydrophobicContact CD2-CD1 4.26Å; L115-I119 HydrophobicContact CD2-CG1 3.98Å; L115-I119 HydrophobicContact CD2-CG2 4.25Å; L115-I119 HydrophobicContact CG-CB 4.48Å; P116-I119 WeakPolarHBondContact O-CG2 3.37Å; P116-I119 PolarHBondContact O-N 2.84Å; T117-I119 PolarHBondContact O-N 3.46Å; I119-E121 PolarHBondContact O-N 2.93Å; I119-L122 HydrophobicContact CD1-CD1 4.06Å; I119-L122 PolarHBondContact O-N 2.78Å; I119-L122 VanDerWaalsContact O-N 3.11Å; I119-P139 HydrophobicContact CG2-CG 4.19Å; I119-E141 HydrophobicContact CG2-CB 3.96Å; I119-L142 HydrophobicContact CG1-CD1 4.07Å; I119-L145 HydrophobicContact CG1-CD1 4.13Å; I119-L145 WeakPolarHBondContact O-CD2 3.48Å
120	K	92	Very high	93	Very high	105 Å²	105	44.2 Å²	44.2	46%	0.457	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-57.2	-22.8	179.2	68.7	-175.6	-177.1	177.1	0	114.4	T117 A118 L122 E141 C144	T117-K120 WeakPolarHBondContact O-CG 3.41Å; T117-K120 PolarHBondContact O-N 3.31Å; A118-K120 PolarHBondContact O-N 3.28Å; A118-K120 VanDerWaalsContact O-N 3.13Å; K120-L122 VanDerWaalsContact C-N 3.32Å; K120-E141 HydrophobicContact CB-CB 3.92Å; K120-E141 HydrophobicContact CB-CG 4.09Å; K120-E141 HydrophobicContact CD-CG 4.16Å; K120-C144 HydrophobicContact CB-CB 4.17Å
121	E	90.9	Very high	93.2	Very high	90 Å²	90	43.4 Å²	43.4	42%	0.421	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-82	-12.2	-176.4	-60.5	-179.5	-171.8	0	0	112.9	R98 A118 I119 T123	R98-E121 IonicContact CZ-OE2 4Å; R98-E121 IonicContact NH1-OE2 3.68Å; R98-E121 PolarHBondContact NH1-OE2 3.07Å; A118-E121 PolarHBondContact O-N 2.91Å; I119-E121 PolarHBondContact O-N 2.93Å; E121-T123 VanDerWaalsContact C-N 3.31Å; E121-T123 PolarHBondContact O-N 3.2Å
122	L	92.8	Very high	93.4	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	22%	0.218	C	C	.	.			trans	-92.4	46.4	-175.5	-60.3	-175.6	0	0	0	112.8	L94 C97 R98 L105 I119 K120 Q124 L125 L145	L94-L122 HydrophobicContact CB-CD1 4.36Å; L94-L122 HydrophobicContact CD2-CD1 3.6Å; C97-L122 HydrophobicContact CB-CD1 4.29Å; C97-L122 HydrophobicContact CB-CD2 4.4Å; R98-L122 HydrophobicContact CB-CD2 3.58Å; R98-L122 HydrophobicContact CG-CD2 4.2Å; L105-L122 HydrophobicContact CD2-CD1 3.86Å; I119-L122 HydrophobicContact CD1-CD1 4.06Å; I119-L122 PolarHBondContact O-N 2.78Å; I119-L122 VanDerWaalsContact O-N 3.11Å; K120-L122 VanDerWaalsContact C-N 3.32Å; L122-Q124 VanDerWaalsContact CA-OE1 3.26Å; L122-Q124 PolarHBondContact O-N 3.06Å; L122-L125 HydrophobicContact CB-CD1 3.57Å; L122-L125 HydrophobicContact CB-CG 3.89Å; L122-L125 HydrophobicContact CD1-CD1 3.74Å; L122-L125 HydrophobicContact CG-CD1 4.3Å; L122-L125 WeakPolarHBondContact O-CB 3.31Å; L122-L125 WeakPolarHBondContact O-CG 3.07Å; L122-L125 PolarHBondContact O-N 3.25Å; L122-L145 HydrophobicContact CB-CD2 4.22Å; L122-L145 WeakPolarHBondContact O-CD2 2.96Å
123	T	91.7	Very high	93.6	Very high	71 Å²	71	43.2 Å²	43.2	44%	0.436	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-17.6	-173.1	57.3	0	0	0	0	114.4	E121 L125	E121-T123 VanDerWaalsContact C-N 3.31Å; E121-T123 PolarHBondContact O-N 3.2Å; T123-L125 VanDerWaalsContact C-N 3.28Å; T123-L125 PolarHBondContact O-N 3.46Å
124	Q	92.9	Very high	93.8	Very high	38 Å²	38	43 Å²	43	18%	0.178	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-9.2	175.6	79.4	-76.5	6	0	0	114.5	N101 S102 L122 T126	N101-Q124 WeakPolarHBondContact OD1-CG 3.39Å; S102-Q124 WeakPolarHBondContact O-CG 3.33Å; S102-Q124 PolarHBondContact O-NE2 3.18Å; L122-Q124 VanDerWaalsContact CA-OE1 3.26Å; L122-Q124 PolarHBondContact O-N 3.06Å; Q124-T126 PolarHBondContact O-N 2.58Å
125	L	96.1	Very high	94	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.			trans	-68.6	129.4	-175	-77.7	176.7	0	0	0	112.2	L105 L122 T123 L145 E147 L148	L105-L125 HydrophobicContact CB-CD1 4.04Å; L105-L125 HydrophobicContact CB-CD2 3.73Å; L105-L125 HydrophobicContact CD2-CD1 4.05Å; L122-L125 HydrophobicContact CB-CD1 3.57Å; L122-L125 HydrophobicContact CB-CG 3.89Å; L122-L125 HydrophobicContact CD1-CD1 3.74Å; L122-L125 HydrophobicContact CG-CD1 4.3Å; L122-L125 WeakPolarHBondContact O-CB 3.31Å; L122-L125 WeakPolarHBondContact O-CG 3.07Å; L122-L125 PolarHBondContact O-N 3.25Å; T123-L125 VanDerWaalsContact C-N 3.28Å; T123-L125 PolarHBondContact O-N 3.46Å; L125-L145 HydrophobicContact CD1-CD1 4.49Å; L125-E147 CarbonylContact O-C 3.25Å; L125-E147 VanDerWaalsContact O-C 3.29Å; L125-L148 HydrophobicContact CB-CD1 4.25Å; L125-L148 VanDerWaalsContact O-CA 3.31Å; L125-L148 WeakPolarHBondContact O-CA 2.99Å; L125-L148 PolarHBondContact O-N 2.92Å
126	T	97.2	Very high	94.1	Very high	40 Å²	40	43.2 Å²	43.2	25%	0.245	22%	0.218	C	C	.	.	S	Bend	trans	-105.3	-28.9	173.6	64.1	0	0	0	0	112	T103 Q124 V149 T150	T103-T126 PolarHBondContact O-N 2.8Å; T103-T126 PolarHBondContact O-OG1 2.89Å; Q124-T126 PolarHBondContact O-N 2.58Å; T126-V149 WeakPolarHBondContact O-CA 3.25Å; T126-V149 PolarHBondContact O-N 2.84Å; T126-T150 PolarHBondContact O-N 2.95Å
127	E	97.9	Very high	94.2	Very high	56 Å²	56	45 Å²	45	26%	0.262	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	124.8	-178.7	-65.2	179.5	-174.8	0	0	111.1	T103 R104 L105 Y129	T103-E127 PolarHBondContact O-N 2.92Å; R104-E127 WeakPolarHBondContact CA-O 3.47Å; R104-E127 HydrophobicContact CB-CB 4.18Å; R104-E127 VanDerWaalsContact CD-OE2 3.27Å; R104-E127 WeakPolarHBondContact CD-OE2 3.15Å; R104-E127 HydrophobicContact CG-CB 3.98Å; R104-E127 IonicContact CZ-OE2 3.5Å; R104-E127 IonicContact NE-OE2 3.54Å; R104-E127 IonicContact NH1-OE2 3.09Å; R104-E127 PolarHBondContact NH1-OE2 2.94Å; L105-E127 PolarHBondContact N-O 3.4Å; E127-Y129 HydrophobicContact CB-CE2 3.89Å; E127-Y129 PolarHBondContact OE2-OH 3.41Å
128	L	97.5	Very high	94.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	116.6	176.7	179.9	58.8	0	0	0	111.1	L105 L130 L142 L145 L148 T150 L151 A152	L105-L128 HydrophobicContact CB-CD1 4Å; L105-L128 HydrophobicContact CD2-CD1 3.83Å; L105-L128 HydrophobicContact CG-CD1 3.95Å; L128-L130 HydrophobicContact CD1-CD1 4.39Å; L128-L130 HydrophobicContact CD1-CG 4.23Å; L128-L130 HydrophobicContact CD2-CD1 3.92Å; L128-L130 HydrophobicContact CG-CD1 3.98Å; L128-L130 HydrophobicContact CG-CG 4.17Å; L128-L142 HydrophobicContact CD2-CD1 3.66Å; L128-L145 HydrophobicContact CD2-CD1 4.14Å; L128-L148 HydrophobicContact CB-CD1 3.81Å; L128-L148 HydrophobicContact CB-CD2 4.42Å; L128-T150 PolarHBondContact N-O 3.33Å; L128-L151 HydrophobicContact CB-CD1 4.14Å; L128-L151 HydrophobicContact CD2-CD1 3.91Å; L128-L151 HydrophobicContact CG-CD1 4.09Å; L128-A152 PolarHBondContact O-N 2.98Å
129	Y	97.3	Very high	94.6	Very high	43 Å²	43	41.5 Å²	41.5	17%	0.169	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.6	177.9	-59.4	-86.2	0	0	0	111.2	R104 L105 D106 L107 S108 E127 Y131 T150 A152	R104-Y129 HydrophobicContact CG-CD2 4.43Å; R104-Y129 HydrophobicContact CG-CE2 4.18Å; R104-Y129 VanDerWaalsContact CZ-CE2 3.44Å; L105-Y129 PolarHBondContact O-N 2.88Å; D106-Y129 HydrophobicContact CB-CD2 4.5Å; L107-Y129 PolarHBondContact N-O 2.99Å; S108-Y129 PolarHBondContact OG-O 3.42Å; E127-Y129 HydrophobicContact CB-CE2 3.89Å; E127-Y129 PolarHBondContact OE2-OH 3.41Å; Y129-Y131 HydrophobicContact CD1-CD1 4.27Å; Y129-Y131 HydrophobicContact CD1-CE1 4.23Å; Y129-Y131 HydrophobicContact CG-CE1 4.49Å; Y129-T150 HydrophobicContact CE1-CG2 4.45Å; Y129-A152 HydrophobicContact CD1-CB 3.61Å; Y129-A152 HydrophobicContact CE1-CB 4.17Å; Y129-A152 HydrophobicContact CG-CB 4.47Å
130	L	95.8	Very high	94.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.228	C	C	.	.			trans	-132.1	22.6	-177.6	-72.6	164.8	0	0	0	111.4	L107 L115 L128 N133 L135 A152 L153 N156	L107-L130 HydrophobicContact CB-CD2 3.78Å; L107-L130 HydrophobicContact CD1-CD2 4.11Å; L115-L130 HydrophobicContact CD1-CD2 4.02Å; L115-L130 HydrophobicContact CD2-CD1 4.32Å; L128-L130 HydrophobicContact CD1-CD1 4.39Å; L128-L130 HydrophobicContact CD1-CG 4.23Å; L128-L130 HydrophobicContact CD2-CD1 3.92Å; L128-L130 HydrophobicContact CG-CD1 3.98Å; L128-L130 HydrophobicContact CG-CG 4.17Å; L130-N133 PolarHBondContact O-ND2 3.07Å; L130-L135 HydrophobicContact CB-CD1 4.12Å; L130-L135 HydrophobicContact CD1-CD1 4.29Å; L130-L135 HydrophobicContact CD2-CD1 4.33Å; L130-A152 WeakPolarHBondContact CA-O 3.2Å; L130-A152 WeakPolarHBondContact CB-O 3.31Å; L130-A152 PolarHBondContact N-O 3.2Å; L130-L153 HydrophobicContact CB-CD2 3.94Å; L130-L153 HydrophobicContact CD1-CD2 3.66Å; L130-L153 HydrophobicContact CG-CD2 4.45Å; L130-N156 PolarHBondContact O-ND2 3.11Å
131	Y	94.9	Very high	94.9	Very high	68 Å²	68	42 Å²	42	27%	0.267	22%	0.22	S	C	.	.			trans	-72.9	155.2	-172.4	64.5	-96.4	0	0	0	113	S108 K109 Y129 N133 S154	S108-Y131 CarbonylContact C-O 3.57Å; S108-Y131 WeakPolarHBondContact CA-O 3.48Å; S108-Y131 VanDerWaalsContact CB-CE1 3.41Å; S108-Y131 VanDerWaalsContact CB-CE2 3.45Å; S108-Y131 VanDerWaalsContact CB-O 3.25Å; S108-Y131 WeakPolarHBondContact CB-O 3.42Å; S108-Y131 WeakPolarHBondContact OG-CD1 3.16Å; S108-Y131 WeakPolarHBondContact OG-CE1 3.45Å; S108-Y131 PolarHBondContact OG-N 3.04Å; K109-Y131 HydrophobicContact CD-CE2 4.35Å; K109-Y131 HydrophobicContact CG-CE2 4.29Å; K109-Y131 PolarHBondContact N-O 3.25Å; Y129-Y131 HydrophobicContact CD1-CD1 4.27Å; Y129-Y131 HydrophobicContact CD1-CE1 4.23Å; Y129-Y131 HydrophobicContact CG-CE1 4.49Å; Y131-N133 PolarHBondContact O-N 2.89Å; Y131-S154 CarbonylContact C-O 3.21Å; Y131-S154 WeakPolarHBondContact CA-O 3.48Å; Y131-S154 WeakPolarHBondContact CB-O 3.13Å; Y131-S154 WeakPolarHBondContact CB-OG 3.34Å
132	S	95.2	Very high	95.1	Very high	27 Å²	27	37.7 Å²	37.7	19%	0.189	20%	0.2	C	C	.	.	S	Bend	trans	55.7	49.6	-178.7	-50.1	0	0	0	0	113.3	K109 S154 E155	K109-S132 WeakPolarHBondContact CA-O 3.45Å; S132-S154 PolarHBondContact N-O 3.21Å; S132-E155 CarbonylContact C-O 3.26Å; S132-E155 VanDerWaalsContact CA-O 3.31Å; S132-E155 WeakPolarHBondContact CA-O 3.17Å; S132-E155 WeakPolarHBondContact CB-OE2 3.31Å; S132-E155 PolarHBondContact N-O 2.79Å; S132-E155 PolarHBondContact OG-OE2 2.78Å
133	N	95.3	Very high	95	Very high	12 Å²	12	37.9 Å²	37.9	6%	0.064	20%	0.203	C	C	.	.	S	Bend	trans	-118	-166.4	176.3	-81.8	-54.8	0	0	0	110.7	L107 R110 S111 I112 L130 Y131 L135 E155 N156	L107-N133 PolarHBondContact O-ND2 3.23Å; R110-N133 PolarHBondContact N-OD1 2.72Å; R110-N133 VanDerWaalsContact N-OD1 3.11Å; S111-N133 PolarHBondContact N-OD1 3.08Å; I112-N133 HydrophobicContact CB-CB 4.36Å; I112-N133 PolarHBondContact N-OD1 3.23Å; L130-N133 PolarHBondContact O-ND2 3.07Å; Y131-N133 PolarHBondContact O-N 2.89Å; N133-L135 HydrophobicContact CB-CG 4.28Å; N133-E155 PolarHBondContact N-O 3.04Å; N133-E155 VanDerWaalsContact N-O 3.12Å; N133-N156 VanDerWaalsContact CA-OD1 3.32Å; N133-N156 WeakPolarHBondContact CA-OD1 3.48Å; N133-N156 WeakPolarHBondContact CB-OD1 3.43Å; N133-N156 PolarHBondContact O-OD1 3.23Å
134	K	94.7	Very high	95.1	Very high	101 Å²	101	37.4 Å²	37.4	44%	0.439	20%	0.202	S	C	.	.			trans	-122.2	27.6	-179.8	-62.1	-178.1	-177.9	176.4	0	111.7	I112 H113 Q136 N156	I112-K134 CarbonylContact O-C 3.29Å; I112-K134 VanDerWaalsContact O-CA 3.29Å; I112-K134 WeakPolarHBondContact O-CA 2.9Å; I112-K134 PolarHBondContact O-N 3.05Å; H113-K134 VanDerWaalsContact CE1-CD 3.46Å; H113-K134 WeakPolarHBondContact CE1-CD 3.4Å; K134-Q136 PolarHBondContact O-N 2.84Å; K134-N156 PolarHBondContact N-OD1 3.33Å
135	L	94.9	Very high	95.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.193	C	C	.	.			trans	-64.3	128.6	-178.4	-62.4	170.4	0	0	0	109.9	I112 L130 N133 L138 L153 N156 S157 L158	I112-L135 HydrophobicContact CB-CD2 4.47Å; I112-L135 HydrophobicContact CG2-CD2 3.86Å; I112-L135 PolarHBondContact O-N 2.96Å; L130-L135 HydrophobicContact CB-CD1 4.12Å; L130-L135 HydrophobicContact CD1-CD1 4.29Å; L130-L135 HydrophobicContact CD2-CD1 4.33Å; N133-L135 HydrophobicContact CB-CG 4.28Å; L135-L138 HydrophobicContact CD1-CD2 4.1Å; L135-L153 HydrophobicContact CD1-CD2 4.36Å; L135-N156 HydrophobicContact CB-CB 4.28Å; L135-N156 VanDerWaalsContact CB-OD1 3.3Å; L135-N156 WeakPolarHBondContact CB-OD1 3.25Å; L135-N156 WeakPolarHBondContact CG-OD1 3.07Å; L135-N156 PolarHBondContact N-OD1 2.94Å; L135-S157 CarbonylContact O-C 3.45Å; L135-S157 VanDerWaalsContact O-CA 3.25Å; L135-S157 WeakPolarHBondContact O-CA 3.36Å; L135-S157 PolarHBondContact O-N 3.17Å; L135-L158 HydrophobicContact CB-CD2 4.06Å; L135-L158 PolarHBondContact O-N 3.04Å
136	Q	94.1	Very high	95	Very high	127 Å²	127	38.3 Å²	38.3	59%	0.593	21%	0.212	S	C	*	.	S	Bend	trans	-98.9	-29.8	174.1	-64	-178.1	17.5	0	0	112	K134 L158	K134-Q136 PolarHBondContact O-N 2.84Å; Q136-L158 WeakPolarHBondContact O-CA 3.42Å
137	S	94.1	Very high	94.9	Very high	58 Å²	58	40.7 Å²	40.7	41%	0.406	22%	0.22	S	C	.	.			trans	-147.3	168.6	176.5	59.7	0	0	0	0	110.1
138	L	95.1	Very high	94.9	Very high	12 Å²	12	38 Å²	38	6%	0.063	21%	0.208	C	C	.	.			trans	-114.8	145.5	172.3	-61.9	171.6	0	0	0	110	L135 L142 L153 L158 L161 P162	L135-L138 HydrophobicContact CD1-CD2 4.1Å; L138-L142 HydrophobicContact CB-CD2 4.32Å; L138-L142 HydrophobicContact CD1-CD2 3.77Å; L138-L142 HydrophobicContact CG-CD2 4.44Å; L138-L153 HydrophobicContact CD1-CD1 3.56Å; L138-L153 HydrophobicContact CD1-CD2 3.9Å; L138-L153 HydrophobicContact CD1-CG 4.4Å; L138-L153 HydrophobicContact CD2-CD2 3.79Å; L138-L153 HydrophobicContact CG-CD2 4.41Å; L138-L158 HydrophobicContact CG-CD2 4.15Å; L138-L161 HydrophobicContact CD1-CD2 3.58Å; L138-P162 HydrophobicContact CB-CG 4.06Å
139	P	94.4	Very high	94.9	Very high	21 Å²	21	40.2 Å²	40.2	14%	0.136	22%	0.221	C	C	.	.			trans	-68	149.4	175	30.2	-35.9	0	0	0	111.1	L115 I119 E141 L142	L115-P139 HydrophobicContact CB-CG 4.01Å; L115-P139 HydrophobicContact CD2-CG 4.11Å; L115-P139 HydrophobicContact CG-CG 4.32Å; I119-P139 HydrophobicContact CG2-CG 4.19Å; P139-E141 HydrophobicContact CB-CB 4.49Å; P139-E141 WeakPolarHBondContact CB-OE2 3.32Å; P139-E141 PolarHBondContact O-N 3.27Å; P139-L142 WeakPolarHBondContact O-CB 3.42Å; P139-L142 PolarHBondContact O-N 2.98Å
140	A	93.9	Very high	95	Very high	56 Å²	56	39 Å²	39	46%	0.463	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-64.5	-27.4	179.1	0	0	0	0	0	112	L142 G143 S164	A140-L142 PolarHBondContact O-N 3.28Å; A140-G143 PolarHBondContact O-N 3.41Å; A140-S164 VanDerWaalsContact C-OG 3.28Å; A140-S164 VanDerWaalsContact CA-OG 3.24Å; A140-S164 WeakPolarHBondContact CA-OG 3.27Å; A140-S164 VanDerWaalsContact O-CB 3.31Å; A140-S164 WeakPolarHBondContact O-CB 3.34Å; A140-S164 PolarHBondContact O-OG 3.12Å
141	E	95.4	Very high	95.1	Very high	59 Å²	59	39 Å²	39	28%	0.276	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-56.5	-19.6	175.5	-74.3	82.8	179	0	0	114.2	T117 I119 K120 P139 G143 C144	T117-E141 HydrophobicContact CG2-CG 4.4Å; I119-E141 HydrophobicContact CG2-CB 3.96Å; K120-E141 HydrophobicContact CB-CB 3.92Å; K120-E141 HydrophobicContact CB-CG 4.09Å; K120-E141 HydrophobicContact CD-CG 4.16Å; P139-E141 HydrophobicContact CB-CB 4.49Å; P139-E141 WeakPolarHBondContact CB-OE2 3.32Å; P139-E141 PolarHBondContact O-N 3.27Å; E141-G143 PolarHBondContact O-N 2.84Å; E141-C144 WeakPolarHBondContact O-CB 3.24Å; E141-C144 PolarHBondContact O-N 3.41Å; E141-C144 VanDerWaalsContact O-N 3.08Å
142	L	94.8	Very high	95.2	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-61.2	-26.1	174.5	-164.2	71	0	0	0	112.4	L115 I119 L128 L138 P139 A140 C144 L145 L151 L165	L115-L142 HydrophobicContact CD2-CD1 4.03Å; I119-L142 HydrophobicContact CG1-CD1 4.07Å; L128-L142 HydrophobicContact CD2-CD1 3.66Å; L138-L142 HydrophobicContact CB-CD2 4.32Å; L138-L142 HydrophobicContact CD1-CD2 3.77Å; L138-L142 HydrophobicContact CG-CD2 4.44Å; P139-L142 WeakPolarHBondContact O-CB 3.42Å; P139-L142 PolarHBondContact O-N 2.98Å; A140-L142 PolarHBondContact O-N 3.28Å; L142-C144 PolarHBondContact O-N 2.59Å; L142-L145 HydrophobicContact CD1-CD1 3.62Å; L142-L145 HydrophobicContact CG-CD1 4.4Å; L142-L145 WeakPolarHBondContact O-CG 3.27Å; L142-L145 PolarHBondContact O-N 2.99Å; L142-L151 HydrophobicContact CD2-CD2 4.06Å; L142-L165 HydrophobicContact CD2-CD2 4.03Å
143	G	92.1	Very high	95.3	Very high	7 Å²	7	34.7 Å²	34.7	7%	0.072	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-64.5	-15.8	174.7	0	0	0	0	0	114.5	A140 E141 L145 S164 S167	A140-G143 PolarHBondContact O-N 3.41Å; E141-G143 PolarHBondContact O-N 2.84Å; G143-L145 VanDerWaalsContact C-N 3.26Å; G143-L145 PolarHBondContact O-N 2.78Å; G143-S164 VanDerWaalsContact CA-O 3.25Å; G143-S164 WeakPolarHBondContact CA-O 3.3Å; G143-S167 VanDerWaalsContact O-CB 3.31Å; G143-S167 WeakPolarHBondContact O-CB 3.29Å
144	C	94.1	Very high	95.4	Very high	61 Å²	61	34.7 Å²	34.7	41%	0.412	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-75.4	-11.9	178.1	-62.2	0	0	0	0	113.6	K120 E141 L142 S146	K120-C144 HydrophobicContact CB-CB 4.17Å; E141-C144 WeakPolarHBondContact O-CB 3.24Å; E141-C144 PolarHBondContact O-N 3.41Å; E141-C144 VanDerWaalsContact O-N 3.08Å; L142-C144 PolarHBondContact O-N 2.59Å; C144-S146 PolarHBondContact O-N 3.23Å
145	L	94.8	Very high	95.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.201	C	C	.	.			trans	-80.1	61.8	-176.5	-55.6	-176.4	0	0	0	112.1	I119 L122 L125 L128 L142 G143 E147 L148 L168	I119-L145 HydrophobicContact CG1-CD1 4.13Å; I119-L145 WeakPolarHBondContact O-CD2 3.48Å; L122-L145 HydrophobicContact CB-CD2 4.22Å; L122-L145 WeakPolarHBondContact O-CD2 2.96Å; L125-L145 HydrophobicContact CD1-CD1 4.49Å; L128-L145 HydrophobicContact CD2-CD1 4.14Å; L142-L145 HydrophobicContact CD1-CD1 3.62Å; L142-L145 HydrophobicContact CG-CD1 4.4Å; L142-L145 WeakPolarHBondContact O-CG 3.27Å; L142-L145 PolarHBondContact O-N 2.99Å; G143-L145 VanDerWaalsContact C-N 3.26Å; G143-L145 PolarHBondContact O-N 2.78Å; L145-E147 PolarHBondContact O-N 3.11Å; L145-L148 HydrophobicContact CB-CB 4.09Å; L145-L148 HydrophobicContact CD1-CD2 4.35Å; L145-L148 WeakPolarHBondContact O-CB 3.31Å; L145-L148 PolarHBondContact O-N 2.95Å; L145-L168 HydrophobicContact CB-CD2 4.16Å; L145-L168 WeakPolarHBondContact O-CD2 3.46Å
146	S	91.9	Very high	95.6	Very high	56 Å²	56	35.2 Å²	35.2	39%	0.392	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-28	-168.7	57.1	0	0	0	0	115.5	C144 L148	C144-S146 PolarHBondContact O-N 3.23Å; S146-L148 VanDerWaalsContact C-N 3.31Å
147	E	95.4	Very high	95.7	Very high	91 Å²	91	30.7 Å²	30.7	43%	0.425	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	1.2	179.2	-60	-53.9	129.3	0	0	113.8	L125 L145 V149	L125-E147 CarbonylContact O-C 3.25Å; L125-E147 VanDerWaalsContact O-C 3.29Å; L145-E147 PolarHBondContact O-N 3.11Å; E147-V149 PolarHBondContact O-N 2.91Å
148	L	97.4	Very high	95.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.166	C	C	.	.			trans	-67.8	121.1	-174.7	-162.4	73.6	0	0	0	111.2	L125 L128 L145 S146 L151 L168 M170 L171	L125-L148 HydrophobicContact CB-CD1 4.25Å; L125-L148 VanDerWaalsContact O-CA 3.31Å; L125-L148 WeakPolarHBondContact O-CA 2.99Å; L125-L148 PolarHBondContact O-N 2.92Å; L128-L148 HydrophobicContact CB-CD1 3.81Å; L128-L148 HydrophobicContact CB-CD2 4.42Å; L145-L148 HydrophobicContact CB-CB 4.09Å; L145-L148 HydrophobicContact CD1-CD2 4.35Å; L145-L148 WeakPolarHBondContact O-CB 3.31Å; L145-L148 PolarHBondContact O-N 2.95Å; S146-L148 VanDerWaalsContact C-N 3.31Å; L148-L151 HydrophobicContact CD2-CB 3.93Å; L148-L151 HydrophobicContact CD2-CD1 4.24Å; L148-L151 HydrophobicContact CD2-CD2 4.38Å; L148-L151 HydrophobicContact CD2-CG 4.41Å; L148-L168 HydrophobicContact CB-CD1 4.48Å; L148-L168 HydrophobicContact CD2-CD1 3.92Å; L148-M170 CarbonylContact O-C 3.5Å; L148-M170 VanDerWaalsContact O-C 3.26Å; L148-L171 HydrophobicContact CB-CD1 4.48Å; L148-L171 HydrophobicContact CD2-CD1 4.1Å; L148-L171 HydrophobicContact CG-CD1 4.09Å; L148-L171 WeakPolarHBondContact O-CA 3.18Å; L148-L171 PolarHBondContact O-N 3.25Å; L148-L171 VanDerWaalsContact O-N 3.11Å
149	V	98.1	Very high	95.8	Very high	45 Å²	45	31.5 Å²	31.5	27%	0.273	19%	0.189	S	C	.	.			trans	-100.9	-38	179	180	0	0	0	0	111.1	T126 E147 R172 M173	T126-V149 WeakPolarHBondContact O-CA 3.25Å; T126-V149 PolarHBondContact O-N 2.84Å; E147-V149 PolarHBondContact O-N 2.91Å; V149-R172 HydrophobicContact CG1-CB 3.96Å; V149-R172 HydrophobicContact CG1-CG 3.95Å; V149-R172 PolarHBondContact O-N 3.28Å; V149-M173 PolarHBondContact O-N 2.95Å
150	T	98.3	Very high	95.9	Very high	19 Å²	19	33.5 Å²	33.5	12%	0.117	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.5	-176.5	-58.9	0	0	0	0	111.1	T126 L128 Y129 M173	T126-T150 PolarHBondContact O-N 2.95Å; L128-T150 PolarHBondContact N-O 3.33Å; Y129-T150 HydrophobicContact CE1-CG2 4.45Å; T150-M173 HydrophobicContact CG2-CB 4.3Å; T150-M173 HydrophobicContact CG2-CE 4.31Å; T150-M173 HydrophobicContact CG2-CG 4.35Å; T150-M173 HydrophobicContact CG2-SD 4.06Å
151	L	98.1	Very high	96	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	111.7	174	179.6	55.4	0	0	0	110.2	L128 L142 L148 L153 L165 L171 M173 L174 D175	L128-L151 HydrophobicContact CB-CD1 4.14Å; L128-L151 HydrophobicContact CD2-CD1 3.91Å; L128-L151 HydrophobicContact CG-CD1 4.09Å; L142-L151 HydrophobicContact CD2-CD2 4.06Å; L148-L151 HydrophobicContact CD2-CB 3.93Å; L148-L151 HydrophobicContact CD2-CD1 4.24Å; L148-L151 HydrophobicContact CD2-CD2 4.38Å; L148-L151 HydrophobicContact CD2-CG 4.41Å; L151-L153 HydrophobicContact CD1-CD1 4.15Å; L151-L153 HydrophobicContact CD1-CD2 4.33Å; L151-L153 HydrophobicContact CD1-CG 4.01Å; L151-L153 HydrophobicContact CD2-CD1 3.85Å; L151-L153 HydrophobicContact CG-CD1 3.76Å; L151-L153 HydrophobicContact CG-CG 4.01Å; L151-L165 HydrophobicContact CD2-CD2 3.9Å; L151-L171 HydrophobicContact CB-CD1 3.79Å; L151-L171 HydrophobicContact CB-CD2 4.49Å; L151-M173 PolarHBondContact N-O 2.9Å; L151-L174 HydrophobicContact CB-CD1 4.11Å; L151-L174 HydrophobicContact CD2-CD1 3.94Å; L151-L174 HydrophobicContact CG-CD1 4.02Å; L151-D175 PolarHBondContact O-N 3.12Å
152	A	97.8	Very high	96	Very high	3 Å²	3	29.8 Å²	29.8	3%	0.025	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	113.4	-180	0	0	0	0	0	111.9	L128 Y129 L130 D175	L128-A152 PolarHBondContact O-N 2.98Å; Y129-A152 HydrophobicContact CD1-CB 3.61Å; Y129-A152 HydrophobicContact CE1-CB 4.17Å; Y129-A152 HydrophobicContact CG-CB 4.47Å; L130-A152 WeakPolarHBondContact CA-O 3.2Å; L130-A152 WeakPolarHBondContact CB-O 3.31Å; L130-A152 PolarHBondContact N-O 3.2Å; A152-D175 HydrophobicContact CB-CB 4.4Å
153	L	97.1	Very high	96	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.205	C	C	.	.			trans	-123.8	19	-174	-68.2	161.7	0	0	0	112.1	L130 L135 L138 L151 N156 L158 L161 L174 D175 L176 N179	L130-L153 HydrophobicContact CB-CD2 3.94Å; L130-L153 HydrophobicContact CD1-CD2 3.66Å; L130-L153 HydrophobicContact CG-CD2 4.45Å; L135-L153 HydrophobicContact CD1-CD2 4.36Å; L138-L153 HydrophobicContact CD1-CD1 3.56Å; L138-L153 HydrophobicContact CD1-CD2 3.9Å; L138-L153 HydrophobicContact CD1-CG 4.4Å; L138-L153 HydrophobicContact CD2-CD2 3.79Å; L138-L153 HydrophobicContact CG-CD2 4.41Å; L151-L153 HydrophobicContact CD1-CD1 4.15Å; L151-L153 HydrophobicContact CD1-CD2 4.33Å; L151-L153 HydrophobicContact CD1-CG 4.01Å; L151-L153 HydrophobicContact CD2-CD1 3.85Å; L151-L153 HydrophobicContact CG-CD1 3.76Å; L151-L153 HydrophobicContact CG-CG 4.01Å; L153-N156 PolarHBondContact O-ND2 2.63Å; L153-L158 HydrophobicContact CB-CD1 3.92Å; L153-L158 HydrophobicContact CD1-CD1 4.16Å; L153-L158 HydrophobicContact CD2-CD1 4.29Å; L153-L158 HydrophobicContact CG-CD1 4.37Å; L153-L161 HydrophobicContact CD1-CD2 4.33Å; L153-L174 HydrophobicContact CD1-CD1 4.3Å; L153-D175 CarbonylContact C-O 3.52Å; L153-D175 WeakPolarHBondContact CA-O 3.36Å; L153-D175 WeakPolarHBondContact CB-O 3.34Å; L153-D175 PolarHBondContact N-O 3.46Å; L153-L176 HydrophobicContact CB-CD2 4.07Å; L153-L176 HydrophobicContact CD1-CD2 3.75Å; L153-N179 PolarHBondContact O-ND2 2.93Å
154	S	97	Very high	96.1	Very high	12 Å²	12	36 Å²	36	8%	0.084	21%	0.212	C	C	.	.			trans	-63.8	153.4	-176.3	37.5	0	0	0	0	113.4	Y131 S132 N156 D175 R177	Y131-S154 CarbonylContact C-O 3.21Å; Y131-S154 WeakPolarHBondContact CA-O 3.48Å; Y131-S154 WeakPolarHBondContact CB-O 3.13Å; Y131-S154 WeakPolarHBondContact CB-OG 3.34Å; S132-S154 PolarHBondContact N-O 3.21Å; S154-N156 PolarHBondContact O-ND2 3.48Å; S154-D175 VanDerWaalsContact CB-OD2 3.3Å; S154-D175 WeakPolarHBondContact CB-OD2 3.19Å; S154-D175 PolarHBondContact N-O 2.72Å; S154-D175 PolarHBondContact OG-OD2 3.46Å; S154-R177 CarbonylContact C-O 3.03Å; S154-R177 WeakPolarHBondContact CA-O 3.46Å
155	E	96.7	Very high	96.2	Very high	102 Å²	102	33.2 Å²	33.2	48%	0.477	19%	0.193	S	C	.	.	S	Bend	trans	55.3	56.7	179.4	-62.2	176.9	-153.9	0	0	112.9	S132 N133 R177 H178	S132-E155 CarbonylContact C-O 3.26Å; S132-E155 VanDerWaalsContact CA-O 3.31Å; S132-E155 WeakPolarHBondContact CA-O 3.17Å; S132-E155 WeakPolarHBondContact CB-OE2 3.31Å; S132-E155 PolarHBondContact N-O 2.79Å; S132-E155 PolarHBondContact OG-OE2 2.78Å; N133-E155 PolarHBondContact N-O 3.04Å; N133-E155 VanDerWaalsContact N-O 3.12Å; E155-R177 PolarHBondContact N-O 3.49Å; E155-H178 VanDerWaalsContact CA-O 3.32Å; E155-H178 WeakPolarHBondContact CA-O 3.14Å; E155-H178 HydrophobicContact CB-CB 4.38Å; E155-H178 HydrophobicContact CG-CB 3.88Å; E155-H178 PolarHBondContact N-O 3Å
156	N	96.6	Very high	96.2	Very high	11 Å²	11	35.3 Å²	35.3	6%	0.059	21%	0.205	C	C	.	.	S	Bend	trans	-125.6	-165.2	174.4	-84.8	-76.3	0	0	0	110.2	L130 N133 K134 L135 L153 S154 L158 H178 N179	L130-N156 PolarHBondContact O-ND2 3.11Å; N133-N156 VanDerWaalsContact CA-OD1 3.32Å; N133-N156 WeakPolarHBondContact CA-OD1 3.48Å; N133-N156 WeakPolarHBondContact CB-OD1 3.43Å; N133-N156 PolarHBondContact O-OD1 3.23Å; K134-N156 PolarHBondContact N-OD1 3.33Å; L135-N156 HydrophobicContact CB-CB 4.28Å; L135-N156 VanDerWaalsContact CB-OD1 3.3Å; L135-N156 WeakPolarHBondContact CB-OD1 3.25Å; L135-N156 WeakPolarHBondContact CG-OD1 3.07Å; L135-N156 PolarHBondContact N-OD1 2.94Å; L153-N156 PolarHBondContact O-ND2 2.63Å; S154-N156 PolarHBondContact O-ND2 3.48Å; N156-L158 HydrophobicContact CB-CG 4.16Å; N156-H178 PolarHBondContact N-O 2.95Å; N156-N179 WeakPolarHBondContact CA-OD1 3.36Å; N156-N179 WeakPolarHBondContact CB-OD1 3.35Å; N156-N179 PolarHBondContact O-OD1 3.47Å
157	S	96.4	Very high	96.3	Very high	31 Å²	31	35.6 Å²	35.6	22%	0.217	21%	0.207	C	C	.	.			trans	-119.9	29.7	175.6	-77.4	0	0	0	0	112	L135 N179 K180	L135-S157 CarbonylContact O-C 3.45Å; L135-S157 VanDerWaalsContact O-CA 3.25Å; L135-S157 WeakPolarHBondContact O-CA 3.36Å; L135-S157 PolarHBondContact O-N 3.17Å; S157-N179 PolarHBondContact N-OD1 3.37Å; S157-K180 PolarHBondContact OG-NZ 3.21Å
158	L	96.6	Very high	96.3	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.186	C	C	.	.			trans	-64.2	134.3	-177.1	-61.8	172	0	0	0	111.1	L135 Q136 L138 L153 N156 L161 L176 N179 K180 L181	L135-L158 HydrophobicContact CB-CD2 4.06Å; L135-L158 PolarHBondContact O-N 3.04Å; Q136-L158 WeakPolarHBondContact O-CA 3.42Å; L138-L158 HydrophobicContact CG-CD2 4.15Å; L153-L158 HydrophobicContact CB-CD1 3.92Å; L153-L158 HydrophobicContact CD1-CD1 4.16Å; L153-L158 HydrophobicContact CD2-CD1 4.29Å; L153-L158 HydrophobicContact CG-CD1 4.37Å; N156-L158 HydrophobicContact CB-CG 4.16Å; L158-L161 HydrophobicContact CD1-CD2 4.38Å; L158-L176 HydrophobicContact CD1-CD2 4.12Å; L158-N179 HydrophobicContact CB-CB 4.26Å; L158-N179 VanDerWaalsContact CB-OD1 3.28Å; L158-N179 WeakPolarHBondContact CB-OD1 3.14Å; L158-N179 WeakPolarHBondContact CG-OD1 3.35Å; L158-N179 PolarHBondContact N-OD1 3.37Å; L158-K180 CarbonylContact O-C 3.49Å; L158-K180 WeakPolarHBondContact O-CA 3.27Å; L158-K180 PolarHBondContact O-N 2.96Å; L158-L181 PolarHBondContact O-N 3.13Å
159	T	95.4	Very high	96.1	Very high	88 Å²	88	37.2 Å²	37.2	54%	0.54	21%	0.212	S	C	.	.			trans	-111.7	-20	173.4	53.2	0	0	0	0	113	K180	T159-K180 HydrophobicContact CG2-CB 4.06Å
160	S	95.5	Very high	96.1	Very high	62 Å²	62	39.8 Å²	39.8	43%	0.434	22%	0.222	S	C	.	.			trans	-153.9	173.6	178	60.6	0	0	0	0	110.4
161	L	96.5	Very high	96.1	Very high	15 Å²	15	38.9 Å²	38.9	8%	0.079	22%	0.217	C	C	.	.			trans	-126.7	144.3	174	-70.1	177.5	0	0	0	109.2	L138 L153 L158 L165 L176 P185 V187 V188	L138-L161 HydrophobicContact CD1-CD2 3.58Å; L153-L161 HydrophobicContact CD1-CD2 4.33Å; L158-L161 HydrophobicContact CD1-CD2 4.38Å; L161-L165 HydrophobicContact CB-CD1 3.68Å; L161-L165 HydrophobicContact CD1-CD1 4.32Å; L161-L165 HydrophobicContact CD2-CD1 4.03Å; L161-L165 HydrophobicContact CG-CD1 4.22Å; L161-L176 HydrophobicContact CD1-CD1 3.84Å; L161-L176 HydrophobicContact CD1-CD2 4.08Å; L161-L176 HydrophobicContact CD2-CD2 4.07Å; L161-P185 HydrophobicContact CB-CB 4.03Å; L161-P185 HydrophobicContact CB-CG 4.23Å; L161-P185 HydrophobicContact CD1-CB 4.32Å; L161-P185 HydrophobicContact CD1-CG 4.05Å; L161-P185 HydrophobicContact CG-CB 4.32Å; L161-P185 HydrophobicContact CG-CG 4Å; L161-V187 HydrophobicContact CB-CG1 3.67Å; L161-V187 HydrophobicContact CD1-CG1 4.43Å; L161-V188 HydrophobicContact CD1-CG2 3.77Å
162	P	95.5	Very high	96.1	Very high	22 Å²	22	45.9 Å²	45.9	14%	0.143	24%	0.243	C	C	.	.			trans	-67	143.9	178.7	26.7	-35.6	0	0	0	112.1	L138 S164 L165	L138-P162 HydrophobicContact CB-CG 4.06Å; P162-S164 PolarHBondContact O-N 3.37Å; P162-L165 HydrophobicContact CG-CD1 3.68Å; P162-L165 HydrophobicContact CG-CG 4.15Å; P162-L165 WeakPolarHBondContact O-CB 3.25Å; P162-L165 PolarHBondContact O-N 3.41Å
163	D	94.7	Very high	96.1	Very high	105 Å²	105	48.1 Å²	48.1	56%	0.561	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-62.5	-28.7	-177.9	-78.1	-47.2	0	0	0	113.9	L165 D166 V187 R190	D163-L165 PolarHBondContact O-N 3.23Å; D163-L165 VanDerWaalsContact O-N 3.13Å; D163-D166 PolarHBondContact O-N 3.22Å; D163-V187 VanDerWaalsContact O-CG2 3.27Å; D163-V187 WeakPolarHBondContact O-CG2 3.1Å; D163-R190 IonicContact OD1-CZ 3.81Å; D163-R190 IonicContact OD1-NH1 2.75Å; D163-R190 IonicContact OD1-NH2 3.02Å; D163-R190 PolarHBondContact OD1-NH2 3.19Å
164	S	95	Very high	96.2	Very high	32 Å²	32	48.2 Å²	48.2	22%	0.224	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-63.4	-14.1	178.2	56.8	0	0	0	0	114.4	A140 G143 P162 D166 S167	A140-S164 VanDerWaalsContact C-OG 3.28Å; A140-S164 VanDerWaalsContact CA-OG 3.24Å; A140-S164 WeakPolarHBondContact CA-OG 3.27Å; A140-S164 VanDerWaalsContact O-CB 3.31Å; A140-S164 WeakPolarHBondContact O-CB 3.34Å; A140-S164 PolarHBondContact O-OG 3.12Å; G143-S164 VanDerWaalsContact CA-O 3.25Å; G143-S164 WeakPolarHBondContact CA-O 3.3Å; P162-S164 PolarHBondContact O-N 3.37Å; S164-D166 PolarHBondContact O-N 2.83Å; S164-S167 WeakPolarHBondContact O-CB 3.41Å; S164-S167 PolarHBondContact O-N 3.14Å; S164-S167 VanDerWaalsContact O-N 3.14Å; S164-S167 PolarHBondContact O-OG 3.18Å
165	L	95.8	Very high	96.2	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.016	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-58.6	-24	172.9	-88.9	153.1	0	0	0	112.1	L142 L151 L161 P162 D163 S167 L168 V187 L191	L142-L165 HydrophobicContact CD2-CD2 4.03Å; L151-L165 HydrophobicContact CD2-CD2 3.9Å; L161-L165 HydrophobicContact CB-CD1 3.68Å; L161-L165 HydrophobicContact CD1-CD1 4.32Å; L161-L165 HydrophobicContact CD2-CD1 4.03Å; L161-L165 HydrophobicContact CG-CD1 4.22Å; P162-L165 HydrophobicContact CG-CD1 3.68Å; P162-L165 HydrophobicContact CG-CG 4.15Å; P162-L165 WeakPolarHBondContact O-CB 3.25Å; P162-L165 PolarHBondContact O-N 3.41Å; D163-L165 PolarHBondContact O-N 3.23Å; D163-L165 VanDerWaalsContact O-N 3.13Å; L165-S167 PolarHBondContact O-N 3.04Å; L165-L168 HydrophobicContact CD2-CD1 3.52Å; L165-L168 HydrophobicContact CD2-CG 4.28Å; L165-L168 WeakPolarHBondContact O-CB 3.49Å; L165-L168 WeakPolarHBondContact O-CG 3.46Å; L165-L168 PolarHBondContact O-N 3.2Å; L165-V187 HydrophobicContact CB-CG1 4.44Å; L165-V187 HydrophobicContact CB-CG2 3.67Å; L165-L191 WeakPolarHBondContact O-CD2 3.48Å
166	D	93.9	Very high	96.3	Very high	45 Å²	45	43 Å²	43	24%	0.241	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-60.4	-15	176.2	64.6	9.7	0	0	0	114.4	D163 S164 L168 K169 V187 R190	D163-D166 PolarHBondContact O-N 3.22Å; S164-D166 PolarHBondContact O-N 2.83Å; D166-L168 PolarHBondContact O-N 2.82Å; D166-K169 WeakPolarHBondContact O-CE 3.47Å; D166-K169 PolarHBondContact O-NZ 2.67Å; D166-V187 HydrophobicContact CB-CG2 4Å; D166-R190 HydrophobicContact CB-CB 3.9Å; D166-R190 IonicContact OD2-CZ 3.68Å; D166-R190 IonicContact OD2-NE 3.97Å; D166-R190 PolarHBondContact OD2-NE 3.04Å; D166-R190 VanDerWaalsContact OD2-NE 3.14Å; D166-R190 IonicContact OD2-NH2 3.39Å
167	S	94.3	Very high	96.4	Very high	61 Å²	61	46.5 Å²	46.5	43%	0.427	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-73.3	-15.2	174.2	-62.3	0	0	0	0	113.1	G143 S164 L165 K169	G143-S167 VanDerWaalsContact O-CB 3.31Å; G143-S167 WeakPolarHBondContact O-CB 3.29Å; S164-S167 WeakPolarHBondContact O-CB 3.41Å; S164-S167 PolarHBondContact O-N 3.14Å; S164-S167 VanDerWaalsContact O-N 3.14Å; S164-S167 PolarHBondContact O-OG 3.18Å; L165-S167 PolarHBondContact O-N 3.04Å; S167-K169 VanDerWaalsContact C-N 3.29Å; S167-K169 PolarHBondContact O-N 3.24Å
168	L	95.6	Very high	96.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.247	C	C	.	.			trans	-77.9	71.1	179.7	-56.5	-167.3	0	0	0	112.3	L145 L148 L165 D166 M170 L171 L191	L145-L168 HydrophobicContact CB-CD2 4.16Å; L145-L168 WeakPolarHBondContact O-CD2 3.46Å; L148-L168 HydrophobicContact CB-CD1 4.48Å; L148-L168 HydrophobicContact CD2-CD1 3.92Å; L165-L168 HydrophobicContact CD2-CD1 3.52Å; L165-L168 HydrophobicContact CD2-CG 4.28Å; L165-L168 WeakPolarHBondContact O-CB 3.49Å; L165-L168 WeakPolarHBondContact O-CG 3.46Å; L165-L168 PolarHBondContact O-N 3.2Å; D166-L168 PolarHBondContact O-N 2.82Å; L168-M170 PolarHBondContact O-N 3.3Å; L168-L171 HydrophobicContact CB-CB 4.05Å; L168-L171 HydrophobicContact CD1-CD2 4.37Å; L168-L171 WeakPolarHBondContact O-CB 3.31Å; L168-L171 PolarHBondContact O-N 3.23Å; L168-L191 HydrophobicContact CB-CD2 4.38Å
169	K	94.2	Very high	96.4	Very high	125 Å²	125	49.1 Å²	49.1	54%	0.543	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-9.4	-175.6	-57.5	-51.4	-172.9	-167.6	0	115	D166 S167 S193	D166-K169 WeakPolarHBondContact O-CE 3.47Å; D166-K169 PolarHBondContact O-NZ 2.67Å; S167-K169 VanDerWaalsContact C-N 3.29Å; S167-K169 PolarHBondContact O-N 3.24Å; K169-S193 WeakPolarHBondContact O-CB 3.48Å; K169-S193 PolarHBondContact O-OG 3.5Å
170	M	96.6	Very high	96.5	Very high	99 Å²	99	49 Å²	49	49%	0.488	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-3.9	176.3	-65.9	-59	-153.6	0	0	113.4	L148 L168 R172	L148-M170 CarbonylContact O-C 3.5Å; L148-M170 VanDerWaalsContact O-C 3.26Å; L168-M170 PolarHBondContact O-N 3.3Å; M170-R172 PolarHBondContact O-N 2.82Å
171	L	97.9	Very high	96.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.222	C	C	.	.			trans	-68.3	118.8	-173	-165.9	74.8	0	0	0	110.7	L148 L151 L168 L174 L191 S193 L194	L148-L171 HydrophobicContact CB-CD1 4.48Å; L148-L171 HydrophobicContact CD2-CD1 4.1Å; L148-L171 HydrophobicContact CG-CD1 4.09Å; L148-L171 WeakPolarHBondContact O-CA 3.18Å; L148-L171 PolarHBondContact O-N 3.25Å; L148-L171 VanDerWaalsContact O-N 3.11Å; L151-L171 HydrophobicContact CB-CD1 3.79Å; L151-L171 HydrophobicContact CB-CD2 4.49Å; L168-L171 HydrophobicContact CB-CB 4.05Å; L168-L171 HydrophobicContact CD1-CD2 4.37Å; L168-L171 WeakPolarHBondContact O-CB 3.31Å; L168-L171 PolarHBondContact O-N 3.23Å; L171-L174 HydrophobicContact CD2-CB 4.21Å; L171-L174 HydrophobicContact CD2-CD1 4.49Å; L171-L191 HydrophobicContact CD2-CD1 4.06Å; L171-S193 PolarHBondContact N-OG 2.79Å; L171-S193 CarbonylContact O-C 3.49Å; L171-S193 VanDerWaalsContact O-CB 3.31Å; L171-S193 WeakPolarHBondContact O-CB 3.09Å; L171-S193 PolarHBondContact O-OG 3.29Å; L171-L194 HydrophobicContact CD2-CD2 4.06Å; L171-L194 HydrophobicContact CG-CD2 4.08Å; L171-L194 WeakPolarHBondContact O-CA 3.3Å; L171-L194 PolarHBondContact O-N 2.7Å
172	R	98.2	Very high	96.5	Very high	147 Å²	147	54.3 Å²	54.3	56%	0.555	25%	0.252	S	S	*	.			trans	-103.4	-38.3	-179.9	-65.9	-174.9	-174.9	-142.5	1.6	111.9	V149 M170 T195 T196	V149-R172 HydrophobicContact CG1-CB 3.96Å; V149-R172 HydrophobicContact CG1-CG 3.95Å; V149-R172 PolarHBondContact O-N 3.28Å; M170-R172 PolarHBondContact O-N 2.82Å; R172-T195 HydrophobicContact CB-CG2 4.45Å; R172-T195 PolarHBondContact O-N 3.24Å; R172-T195 PolarHBondContact O-OG1 3.34Å; R172-T195 VanDerWaalsContact O-OG1 3.13Å; R172-T196 PolarHBondContact O-N 2.88Å
173	M	98.5	Very high	96.6	Very high	51 Å²	51	57.9 Å²	57.9	25%	0.251	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.2	-178	178.5	179.1	150.6	0	0	111.1	V149 T150 L151 D175 T196 Y198	V149-M173 PolarHBondContact O-N 2.95Å; T150-M173 HydrophobicContact CG2-CB 4.3Å; T150-M173 HydrophobicContact CG2-CE 4.31Å; T150-M173 HydrophobicContact CG2-CG 4.35Å; T150-M173 HydrophobicContact CG2-SD 4.06Å; L151-M173 PolarHBondContact N-O 2.9Å; M173-D175 HydrophobicContact CE-CB 4.1Å; M173-T196 WeakPolarHBondContact CA-O 3.49Å; M173-T196 HydrophobicContact CG-CG2 4.32Å; M173-Y198 HydrophobicContact CE-CD2 4.4Å; M173-Y198 HydrophobicContact CE-CE2 4.2Å
174	L	98.4	Very high	96.7	Very high	2 Å²	2	53 Å²	53	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	116.1	172.1	179.3	57.7	0	0	0	110	L151 L153 L171 L176 V188 L191 L194 T196 L197 Y198	L151-L174 HydrophobicContact CB-CD1 4.11Å; L151-L174 HydrophobicContact CD2-CD1 3.94Å; L151-L174 HydrophobicContact CG-CD1 4.02Å; L153-L174 HydrophobicContact CD1-CD1 4.3Å; L171-L174 HydrophobicContact CD2-CB 4.21Å; L171-L174 HydrophobicContact CD2-CD1 4.49Å; L174-L176 HydrophobicContact CD1-CD1 4.34Å; L174-L176 HydrophobicContact CD1-CD2 4.34Å; L174-L176 HydrophobicContact CD1-CG 4.08Å; L174-L176 HydrophobicContact CD2-CD1 3.84Å; L174-L176 HydrophobicContact CD2-CG 4.45Å; L174-L176 HydrophobicContact CG-CD1 3.89Å; L174-L176 HydrophobicContact CG-CG 3.99Å; L174-V188 HydrophobicContact CD2-CG1 4.38Å; L174-V188 HydrophobicContact CD2-CG2 4.12Å; L174-L191 HydrophobicContact CD2-CD1 3.96Å; L174-L194 HydrophobicContact CB-CD1 4.47Å; L174-L194 HydrophobicContact CB-CD2 3.77Å; L174-L194 HydrophobicContact CD2-CD1 4.47Å; L174-T196 PolarHBondContact N-O 3.03Å; L174-L197 HydrophobicContact CB-CD1 4.09Å; L174-L197 HydrophobicContact CD2-CD1 4.07Å; L174-L197 HydrophobicContact CG-CD1 4.12Å; L174-Y198 PolarHBondContact O-N 3.26Å
175	D	98.3	Very high	96.7	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	111.7	177.1	174.8	19	0	0	0	111.3	L151 A152 L153 S154 M173 R177 Y198	L151-D175 PolarHBondContact O-N 3.12Å; A152-D175 HydrophobicContact CB-CB 4.4Å; L153-D175 CarbonylContact C-O 3.52Å; L153-D175 WeakPolarHBondContact CA-O 3.36Å; L153-D175 WeakPolarHBondContact CB-O 3.34Å; L153-D175 PolarHBondContact N-O 3.46Å; S154-D175 VanDerWaalsContact CB-OD2 3.3Å; S154-D175 WeakPolarHBondContact CB-OD2 3.19Å; S154-D175 PolarHBondContact N-O 2.72Å; S154-D175 PolarHBondContact OG-OD2 3.46Å; M173-D175 HydrophobicContact CE-CB 4.1Å; D175-R177 VanDerWaalsContact CG-NE 3.31Å; D175-R177 WeakPolarHBondContact OD1-CB 3.18Å; D175-R177 WeakPolarHBondContact OD1-CG 3.38Å; D175-R177 IonicContact OD1-CZ 2.63Å; D175-R177 PolarHBondContact OD1-N 3.49Å; D175-R177 IonicContact OD1-NE 3.38Å; D175-R177 PolarHBondContact OD1-NE 3.03Å; D175-R177 IonicContact OD1-NH2 3.82Å; D175-R177 IonicContact OD2-CZ 3.94Å; D175-R177 IonicContact OD2-NE 2.79Å; D175-R177 PolarHBondContact OD2-NE 2.9Å; D175-R177 IonicContact OD2-NH2 3.72Å; D175-R177 PolarHBondContact OD2-NH2 3.38Å; D175-Y198 HydrophobicContact CB-CD2 4.23Å
176	L	97.9	Very high	96.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.249	C	C	.	.			trans	-119	19.9	-179.8	-67.1	164.1	0	0	0	112	L153 L158 L161 L174 N179 L181 V188 Y198 L199 N202	L153-L176 HydrophobicContact CB-CD2 4.07Å; L153-L176 HydrophobicContact CD1-CD2 3.75Å; L158-L176 HydrophobicContact CD1-CD2 4.12Å; L161-L176 HydrophobicContact CD1-CD1 3.84Å; L161-L176 HydrophobicContact CD1-CD2 4.08Å; L161-L176 HydrophobicContact CD2-CD2 4.07Å; L174-L176 HydrophobicContact CD1-CD1 4.34Å; L174-L176 HydrophobicContact CD1-CD2 4.34Å; L174-L176 HydrophobicContact CD1-CG 4.08Å; L174-L176 HydrophobicContact CD2-CD1 3.84Å; L174-L176 HydrophobicContact CD2-CG 4.45Å; L174-L176 HydrophobicContact CG-CD1 3.89Å; L174-L176 HydrophobicContact CG-CG 3.99Å; L176-N179 PolarHBondContact O-ND2 3.22Å; L176-L181 HydrophobicContact CB-CD1 4.08Å; L176-L181 HydrophobicContact CD1-CD1 4.16Å; L176-V188 HydrophobicContact CD1-CG2 4.47Å; L176-Y198 CarbonylContact C-O 3.26Å; L176-Y198 WeakPolarHBondContact CA-O 3.44Å; L176-Y198 PolarHBondContact N-O 3.05Å; L176-L199 HydrophobicContact CB-CD2 3.87Å; L176-L199 HydrophobicContact CD1-CD2 3.75Å; L176-L199 HydrophobicContact CG-CD2 4.48Å; L176-N202 PolarHBondContact O-ND2 2.81Å
177	R	98.2	Very high	96.9	Very high	85 Å²	85	52.3 Å²	52.3	32%	0.321	24%	0.238	S	C	.	.			trans	-59.4	151.6	-177.5	-64.3	173.3	-73	179.9	0.8	112.2	S154 E155 D175 N179 R200	S154-R177 CarbonylContact C-O 3.03Å; S154-R177 WeakPolarHBondContact CA-O 3.46Å; E155-R177 PolarHBondContact N-O 3.49Å; D175-R177 VanDerWaalsContact CG-NE 3.31Å; D175-R177 WeakPolarHBondContact OD1-CB 3.18Å; D175-R177 WeakPolarHBondContact OD1-CG 3.38Å; D175-R177 IonicContact OD1-CZ 2.63Å; D175-R177 PolarHBondContact OD1-N 3.49Å; D175-R177 IonicContact OD1-NE 3.38Å; D175-R177 PolarHBondContact OD1-NE 3.03Å; D175-R177 IonicContact OD1-NH2 3.82Å; D175-R177 IonicContact OD2-CZ 3.94Å; D175-R177 IonicContact OD2-NE 2.79Å; D175-R177 PolarHBondContact OD2-NE 2.9Å; D175-R177 IonicContact OD2-NH2 3.72Å; D175-R177 PolarHBondContact OD2-NH2 3.38Å; R177-N179 PolarHBondContact O-N 2.93Å; R177-N179 PolarHBondContact O-ND2 3.07Å; R177-R200 CarbonylContact C-O 3.31Å; R177-R200 WeakPolarHBondContact CA-O 3.16Å; R177-R200 HydrophobicContact CB-CB 4.47Å; R177-R200 HydrophobicContact CG-CB 3.86Å
178	H	97.3	Very high	97	Very high	75 Å²	75	49.4 Å²	49.4	35%	0.347	22%	0.218	S	C	.	.	S	Bend	trans	53.4	55.4	176	-65.6	-85.7	0	0	0	113	E155 N156 R200 F201	E155-H178 VanDerWaalsContact CA-O 3.32Å; E155-H178 WeakPolarHBondContact CA-O 3.14Å; E155-H178 HydrophobicContact CB-CB 4.38Å; E155-H178 HydrophobicContact CG-CB 3.88Å; E155-H178 PolarHBondContact N-O 3Å; N156-H178 PolarHBondContact N-O 2.95Å; H178-R200 PolarHBondContact N-O 3.14Å; H178-F201 VanDerWaalsContact CA-O 3.24Å; H178-F201 WeakPolarHBondContact CA-O 3.41Å; H178-F201 AromaticContact CE1-CD1 4Å; H178-F201 AromaticContact CE1-CD2 3.02Å; H178-F201 WeakPolarHBondContact CE1-CD2 3.22Å; H178-F201 AromaticContact CE1-CE2 3.4Å; H178-F201 VanDerWaalsContact CE1-CE2 3.4Å; H178-F201 WeakPolarHBondContact CE1-CE2 3.48Å; H178-F201 AromaticContact CE1-CG 3.34Å; H178-F201 WeakPolarHBondContact CE1-CG 3.07Å; H178-F201 PolarHBondContact N-O 3.01Å; H178-F201 WeakPolarHBondContact ND1-CB 3.47Å; H178-F201 AromaticContact ND1-CD2 3.76Å; H178-F201 AromaticContact ND1-CG 3.62Å; H178-F201 AromaticContact NE2-CD2 3.22Å; H178-F201 WeakPolarHBondContact NE2-CD2 3.32Å; H178-F201 AromaticContact NE2-CE2 3.7Å; H178-F201 AromaticContact NE2-CG 3.9Å
179	N	97.6	Very high	97.1	Very high	11 Å²	11	49.6 Å²	49.6	6%	0.059	22%	0.218	C	C	.	.	S	Bend	trans	-122.4	-166.5	173.4	-84.9	-73.3	0	0	0	110.2	L153 N156 S157 L158 L176 R177 L181 F201 N202	L153-N179 PolarHBondContact O-ND2 2.93Å; N156-N179 WeakPolarHBondContact CA-OD1 3.36Å; N156-N179 WeakPolarHBondContact CB-OD1 3.35Å; N156-N179 PolarHBondContact O-OD1 3.47Å; S157-N179 PolarHBondContact N-OD1 3.37Å; L158-N179 HydrophobicContact CB-CB 4.26Å; L158-N179 VanDerWaalsContact CB-OD1 3.28Å; L158-N179 WeakPolarHBondContact CB-OD1 3.14Å; L158-N179 WeakPolarHBondContact CG-OD1 3.35Å; L158-N179 PolarHBondContact N-OD1 3.37Å; L176-N179 PolarHBondContact O-ND2 3.22Å; R177-N179 PolarHBondContact O-N 2.93Å; R177-N179 PolarHBondContact O-ND2 3.07Å; N179-L181 HydrophobicContact CB-CG 4.28Å; N179-F201 PolarHBondContact N-O 3.4Å; N179-N202 VanDerWaalsContact CA-OD1 3.27Å; N179-N202 WeakPolarHBondContact CA-OD1 3.24Å; N179-N202 WeakPolarHBondContact CB-OD1 3.28Å; N179-N202 PolarHBondContact N-OD1 3.44Å; N179-N202 PolarHBondContact O-OD1 2.85Å
180	K	96.7	Very high	97.2	Very high	87 Å²	87	47.8 Å²	47.8	38%	0.378	21%	0.208	S	C	.	.			trans	-116.1	25.5	-178.4	-65.4	175	179.7	160.9	0	111.9	S157 L158 T159 R182 N202	S157-K180 PolarHBondContact OG-NZ 3.21Å; L158-K180 CarbonylContact O-C 3.49Å; L158-K180 WeakPolarHBondContact O-CA 3.27Å; L158-K180 PolarHBondContact O-N 2.96Å; T159-K180 HydrophobicContact CG2-CB 4.06Å; K180-R182 PolarHBondContact O-N 3.02Å; K180-N202 PolarHBondContact N-OD1 3.02Å
181	L	96.7	Very high	97.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	19%	0.186	C	C	.	.			trans	-64.8	127	-179.1	-59.9	174.5	0	0	0	110.2	L158 L176 N179 P185 L199 N202 R203 I204	L158-L181 PolarHBondContact O-N 3.13Å; L176-L181 HydrophobicContact CB-CD1 4.08Å; L176-L181 HydrophobicContact CD1-CD1 4.16Å; N179-L181 HydrophobicContact CB-CG 4.28Å; L181-P185 HydrophobicContact CD2-CG 3.96Å; L181-L199 HydrophobicContact CD1-CD2 3.89Å; L181-N202 HydrophobicContact CB-CB 4.21Å; L181-N202 WeakPolarHBondContact CB-OD1 3.26Å; L181-N202 WeakPolarHBondContact CG-OD1 3.32Å; L181-N202 PolarHBondContact N-OD1 2.83Å; L181-N202 VanDerWaalsContact N-OD1 3.13Å; L181-R203 CarbonylContact O-C 3.12Å; L181-R203 VanDerWaalsContact O-CA 3.26Å; L181-R203 WeakPolarHBondContact O-CA 3.37Å; L181-R203 WeakPolarHBondContact O-CB 3.37Å; L181-R203 PolarHBondContact O-N 2.82Å; L181-I204 HydrophobicContact CB-CG1 4.39Å; L181-I204 PolarHBondContact O-N 2.79Å
182	R	95.9	Very high	97.1	Very high	188 Å²	188	46.3 Å²	46.3	71%	0.709	21%	0.205	S	C	*	.	S	Bend	trans	-90.9	-19.4	175.7	-67	-176.1	-178.1	179.7	0.2	113.1	K180 I204 T205	K180-R182 PolarHBondContact O-N 3.02Å; R182-I204 VanDerWaalsContact O-CA 3.28Å; R182-I204 WeakPolarHBondContact O-CA 3.43Å; R182-T205 PolarHBondContact O-N 2.93Å; R182-T205 VanDerWaalsContact O-N 3.15Å; R182-T205 PolarHBondContact O-OG1 2.91Å
183	E	96.3	Very high	97.1	Very high	97 Å²	97	39.9 Å²	39.9	45%	0.453	18%	0.182	S	C	.	.	S	Bend	trans	-147.2	165.5	177.1	64.5	-167.6	-173.9	0	0	107.9	P185	E183-P185 WeakPolarHBondContact O-CD 3.49Å
184	I	96.8	Very high	97	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	17%	0.17	C	C	.	.			trans	-73.6	119.9	168.1	-58.9	178	0	0	0	106.9	V188 Y189 L199 I204 V207	I184-V188 HydrophobicContact CG2-CB 3.81Å; I184-V188 HydrophobicContact CG2-CG1 3.94Å; I184-V188 HydrophobicContact CG2-CG2 4.25Å; I184-Y189 HydrophobicContact CB-CE1 4.45Å; I184-Y189 HydrophobicContact CB-CE2 4.38Å; I184-Y189 WeakPolarHBondContact CB-OH 3.44Å; I184-Y189 HydrophobicContact CG2-CE1 4.07Å; I184-Y189 HydrophobicContact CG2-CE2 4.28Å; I184-L199 HydrophobicContact CD1-CD1 3.76Å; I184-L199 HydrophobicContact CG1-CD1 3.81Å; I184-L199 HydrophobicContact CG2-CD1 4.46Å; I184-I204 HydrophobicContact CG1-CD1 3.99Å; I184-I204 HydrophobicContact CG1-CG2 4.16Å; I184-V207 HydrophobicContact CD1-CG1 4.21Å; I184-V207 HydrophobicContact CD1-CG2 4.12Å
185	P	96	Very high	97	Very high	6 Å²	6	39.2 Å²	39.2	4%	0.039	18%	0.181	C	C	.	.			trans	-57.3	136.2	-177.4	-26.6	35.9	0	0	0	111.7	L161 L181 E183 V187 V188	L161-P185 HydrophobicContact CB-CB 4.03Å; L161-P185 HydrophobicContact CB-CG 4.23Å; L161-P185 HydrophobicContact CD1-CB 4.32Å; L161-P185 HydrophobicContact CD1-CG 4.05Å; L161-P185 HydrophobicContact CG-CB 4.32Å; L161-P185 HydrophobicContact CG-CG 4Å; L181-P185 HydrophobicContact CD2-CG 3.96Å; E183-P185 WeakPolarHBondContact O-CD 3.49Å; P185-V187 HydrophobicContact CB-CG1 4.18Å; P185-V187 PolarHBondContact O-N 3.37Å; P185-V188 HydrophobicContact CB-CG2 4.26Å; P185-V188 HydrophobicContact CG-CG2 4.46Å; P185-V188 VanDerWaalsContact O-CB 3.31Å; P185-V188 WeakPolarHBondContact O-CB 3.42Å; P185-V188 WeakPolarHBondContact O-CG2 3.45Å; P185-V188 PolarHBondContact O-N 2.81Å
186	P	96	Very high	97.1	Very high	60 Å²	60	40.1 Å²	40.1	39%	0.39	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-54.9	-31.2	-174.3	-30.5	35.8	0	0	0	114.8	V188 Y189	P186-V188 PolarHBondContact O-N 3.39Å; P186-Y189 PolarHBondContact O-N 3.26Å
187	V	96.7	Very high	97.1	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.006	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-59.9	-30.9	175.9	68.8	0	0	0	0	113	L161 D163 L165 D166 P185 Y189 R190	L161-V187 HydrophobicContact CB-CG1 3.67Å; L161-V187 HydrophobicContact CD1-CG1 4.43Å; D163-V187 VanDerWaalsContact O-CG2 3.27Å; D163-V187 WeakPolarHBondContact O-CG2 3.1Å; L165-V187 HydrophobicContact CB-CG1 4.44Å; L165-V187 HydrophobicContact CB-CG2 3.67Å; D166-V187 HydrophobicContact CB-CG2 4Å; P185-V187 HydrophobicContact CB-CG1 4.18Å; P185-V187 PolarHBondContact O-N 3.37Å; V187-Y189 VanDerWaalsContact C-N 3.3Å; V187-Y189 PolarHBondContact O-N 2.94Å; V187-R190 WeakPolarHBondContact O-CB 3.45Å; V187-R190 PolarHBondContact O-N 3.13Å
188	V	97.5	Very high	97.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-61.7	-40.2	179	178.1	0	0	0	0	110.6	L161 L174 L176 I184 P185 P186 R190 L191 L194 L197 L214	L161-V188 HydrophobicContact CD1-CG2 3.77Å; L174-V188 HydrophobicContact CD2-CG1 4.38Å; L174-V188 HydrophobicContact CD2-CG2 4.12Å; L176-V188 HydrophobicContact CD1-CG2 4.47Å; I184-V188 HydrophobicContact CG2-CB 3.81Å; I184-V188 HydrophobicContact CG2-CG1 3.94Å; I184-V188 HydrophobicContact CG2-CG2 4.25Å; P185-V188 HydrophobicContact CB-CG2 4.26Å; P185-V188 HydrophobicContact CG-CG2 4.46Å; P185-V188 VanDerWaalsContact O-CB 3.31Å; P185-V188 WeakPolarHBondContact O-CB 3.42Å; P185-V188 WeakPolarHBondContact O-CG2 3.45Å; P185-V188 PolarHBondContact O-N 2.81Å; P186-V188 PolarHBondContact O-N 3.39Å; V188-R190 PolarHBondContact O-N 3.02Å; V188-L191 WeakPolarHBondContact O-CB 3.22Å; V188-L191 PolarHBondContact O-N 2.99Å; V188-L191 VanDerWaalsContact O-N 3.1Å; V188-L194 HydrophobicContact CG1-CD1 4.26Å; V188-L197 HydrophobicContact CG1-CD1 4.11Å; V188-L197 HydrophobicContact CG1-CD2 3.79Å; V188-L214 WeakPolarHBondContact O-CD2 2.81Å
189	Y	97	Very high	97.1	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.016	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-65.9	-16.9	177.5	-56	-61.3	0	0	0	113.6	I184 P186 V187 E208 D210 I211 N213	I184-Y189 HydrophobicContact CB-CE1 4.45Å; I184-Y189 HydrophobicContact CB-CE2 4.38Å; I184-Y189 WeakPolarHBondContact CB-OH 3.44Å; I184-Y189 HydrophobicContact CG2-CE1 4.07Å; I184-Y189 HydrophobicContact CG2-CE2 4.28Å; P186-Y189 PolarHBondContact O-N 3.26Å; V187-Y189 VanDerWaalsContact C-N 3.3Å; V187-Y189 PolarHBondContact O-N 2.94Å; Y189-E208 HydrophobicContact CE2-CB 3.86Å; Y189-E208 HydrophobicContact CE2-CG 4.07Å; Y189-E208 WeakPolarHBondContact CE2-OE2 3.3Å; Y189-E208 WeakPolarHBondContact OH-CB 3.47Å; Y189-E208 PolarHBondContact OH-N 3.09Å; Y189-D210 HydrophobicContact CD1-CB 4.34Å; Y189-D210 HydrophobicContact CD2-CB 4.14Å; Y189-D210 HydrophobicContact CG-CB 3.88Å; Y189-I211 HydrophobicContact CD1-CB 4.36Å; Y189-I211 HydrophobicContact CD1-CD1 4.25Å; Y189-I211 HydrophobicContact CE1-CB 4.06Å; Y189-I211 HydrophobicContact CE1-CD1 3.92Å; Y189-N213 WeakPolarHBondContact O-CB 3.33Å
190	R	96.9	Very high	97.1	Very high	86 Å²	86	38.7 Å²	38.7	33%	0.325	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-87.7	-7.1	176.4	-58.7	-166.2	-68.6	-87.2	3.9	113.2	D163 D166 V187 V188 T192	D163-R190 IonicContact OD1-CZ 3.81Å; D163-R190 IonicContact OD1-NH1 2.75Å; D163-R190 IonicContact OD1-NH2 3.02Å; D163-R190 PolarHBondContact OD1-NH2 3.19Å; D166-R190 HydrophobicContact CB-CB 3.9Å; D166-R190 IonicContact OD2-CZ 3.68Å; D166-R190 IonicContact OD2-NE 3.97Å; D166-R190 PolarHBondContact OD2-NE 3.04Å; D166-R190 VanDerWaalsContact OD2-NE 3.14Å; D166-R190 IonicContact OD2-NH2 3.39Å; V187-R190 WeakPolarHBondContact O-CB 3.45Å; V187-R190 PolarHBondContact O-N 3.13Å; V188-R190 PolarHBondContact O-N 3.02Å; R190-T192 VanDerWaalsContact C-N 3.34Å; R190-T192 PolarHBondContact O-N 2.79Å; R190-T192 VanDerWaalsContact O-N 3.12Å
191	L	96.5	Very high	97.1	Very high	3 Å²	3	38 Å²	38	2%	0.016	18%	0.175	C	C	.	.			trans	-86.1	67.4	-180	-59.6	172.2	0	0	0	111.6	L165 L168 L171 L174 V188 S193 L194 L214	L165-L191 WeakPolarHBondContact O-CD2 3.48Å; L168-L191 HydrophobicContact CB-CD2 4.38Å; L171-L191 HydrophobicContact CD2-CD1 4.06Å; L174-L191 HydrophobicContact CD2-CD1 3.96Å; V188-L191 WeakPolarHBondContact O-CB 3.22Å; V188-L191 PolarHBondContact O-N 2.99Å; V188-L191 VanDerWaalsContact O-N 3.1Å; L191-S193 PolarHBondContact O-N 2.96Å; L191-L194 HydrophobicContact CB-CD1 3.63Å; L191-L194 HydrophobicContact CB-CG 3.79Å; L191-L194 HydrophobicContact CD1-CD1 3.99Å; L191-L194 HydrophobicContact CG-CD1 4.46Å; L191-L194 WeakPolarHBondContact O-CB 3.31Å; L191-L194 WeakPolarHBondContact O-CG 3.02Å; L191-L194 PolarHBondContact O-N 3.1Å; L191-L194 VanDerWaalsContact O-N 3.09Å; L191-L214 WeakPolarHBondContact O-CD2 2.75Å
192	T	95.8	Very high	97.2	Very high	66 Å²	66	38.6 Å²	38.6	41%	0.405	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-9.6	-173.2	62	0	0	0	0	115.1	R190 N213	R190-T192 VanDerWaalsContact C-N 3.34Å; R190-T192 PolarHBondContact O-N 2.79Å; R190-T192 VanDerWaalsContact O-N 3.12Å; T192-N213 WeakPolarHBondContact CG2-O 3.17Å
193	S	97.2	Very high	97.2	Very high	12 Å²	12	35.9 Å²	35.9	8%	0.084	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-12.1	175	53.9	0	0	0	0	114.3	K169 L171 L191 T195	K169-S193 WeakPolarHBondContact O-CB 3.48Å; K169-S193 PolarHBondContact O-OG 3.5Å; L171-S193 PolarHBondContact N-OG 2.79Å; L171-S193 CarbonylContact O-C 3.49Å; L171-S193 VanDerWaalsContact O-CB 3.31Å; L171-S193 WeakPolarHBondContact O-CB 3.09Å; L171-S193 PolarHBondContact O-OG 3.29Å; L191-S193 PolarHBondContact O-N 2.96Å; S193-T195 PolarHBondContact O-N 3.29Å
194	L	98.2	Very high	97.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.147	C	C	.	.			trans	-62.1	129.5	-174.8	-76.7	175.5	0	0	0	111.9	L171 L174 V188 L191 L214 K216 L217	L171-L194 HydrophobicContact CD2-CD2 4.06Å; L171-L194 HydrophobicContact CG-CD2 4.08Å; L171-L194 WeakPolarHBondContact O-CA 3.3Å; L171-L194 PolarHBondContact O-N 2.7Å; L174-L194 HydrophobicContact CB-CD1 4.47Å; L174-L194 HydrophobicContact CB-CD2 3.77Å; L174-L194 HydrophobicContact CD2-CD1 4.47Å; V188-L194 HydrophobicContact CG1-CD1 4.26Å; L191-L194 HydrophobicContact CB-CD1 3.63Å; L191-L194 HydrophobicContact CB-CG 3.79Å; L191-L194 HydrophobicContact CD1-CD1 3.99Å; L191-L194 HydrophobicContact CG-CD1 4.46Å; L191-L194 WeakPolarHBondContact O-CB 3.31Å; L191-L194 WeakPolarHBondContact O-CG 3.02Å; L191-L194 PolarHBondContact O-N 3.1Å; L191-L194 VanDerWaalsContact O-N 3.09Å; L194-L214 HydrophobicContact CD1-CD2 4.4Å; L194-K216 CarbonylContact O-C 3.59Å; L194-K216 VanDerWaalsContact O-C 3.27Å; L194-L217 HydrophobicContact CB-CD1 4.22Å; L194-L217 WeakPolarHBondContact O-CA 3.2Å; L194-L217 PolarHBondContact O-N 3.18Å
195	T	98.3	Very high	97.2	Very high	38 Å²	38	34.5 Å²	34.5	23%	0.233	17%	0.166	C	C	.	.	S	Bend	trans	-104.7	-25.3	170.5	61.1	0	0	0	0	111.4	R172 S193 T218 M219	R172-T195 HydrophobicContact CB-CG2 4.45Å; R172-T195 PolarHBondContact O-N 3.24Å; R172-T195 PolarHBondContact O-OG1 3.34Å; R172-T195 VanDerWaalsContact O-OG1 3.13Å; S193-T195 PolarHBondContact O-N 3.29Å; T195-T218 PolarHBondContact O-N 2.86Å; T195-T218 PolarHBondContact O-OG1 2.92Å; T195-M219 PolarHBondContact O-N 3.1Å; T195-M219 VanDerWaalsContact O-N 3.1Å
196	T	98.6	Very high	97.2	Very high	22 Å²	22	37.6 Å²	37.6	14%	0.135	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	122.9	-173.8	-53.9	0	0	0	0	111.1	R172 M173 L174 Y198 M219	R172-T196 PolarHBondContact O-N 2.88Å; M173-T196 WeakPolarHBondContact CA-O 3.49Å; M173-T196 HydrophobicContact CG-CG2 4.32Å; L174-T196 PolarHBondContact N-O 3.03Å; T196-Y198 HydrophobicContact CG2-CD2 3.88Å; T196-Y198 HydrophobicContact CG2-CE1 4.35Å; T196-Y198 HydrophobicContact CG2-CE2 3.26Å; T196-M219 WeakPolarHBondContact CA-O 3.34Å; T196-M219 HydrophobicContact CG2-CB 4.04Å; T196-M219 HydrophobicContact CG2-CG 3.98Å
197	L	98.5	Very high	97.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	116	178.9	-180	58.3	0	0	0	110.7	L174 V188 L199 L214 L217 M219 L220 S221	L174-L197 HydrophobicContact CB-CD1 4.09Å; L174-L197 HydrophobicContact CD2-CD1 4.07Å; L174-L197 HydrophobicContact CG-CD1 4.12Å; V188-L197 HydrophobicContact CG1-CD1 4.11Å; V188-L197 HydrophobicContact CG1-CD2 3.79Å; L197-L199 HydrophobicContact CD1-CD1 4.18Å; L197-L199 HydrophobicContact CD1-CG 4.12Å; L197-L199 HydrophobicContact CD2-CD1 3.77Å; L197-L199 HydrophobicContact CG-CD1 3.8Å; L197-L199 HydrophobicContact CG-CG 4.11Å; L197-L214 HydrophobicContact CD2-CD1 4.13Å; L197-L217 HydrophobicContact CB-CD1 3.93Å; L197-M219 PolarHBondContact N-O 3.13Å; L197-L220 HydrophobicContact CB-CD1 4.13Å; L197-L220 HydrophobicContact CD2-CD1 3.91Å; L197-L220 HydrophobicContact CG-CD1 4.13Å; L197-S221 PolarHBondContact O-N 3.26Å
198	Y	98.5	Very high	97.2	Very high	56 Å²	56	38.6 Å²	38.6	22%	0.22	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120.7	175.6	-60.5	-72.5	0	0	0	111.5	M173 L174 D175 L176 T196 M219	M173-Y198 HydrophobicContact CE-CD2 4.4Å; M173-Y198 HydrophobicContact CE-CE2 4.2Å; L174-Y198 PolarHBondContact O-N 3.26Å; D175-Y198 HydrophobicContact CB-CD2 4.23Å; L176-Y198 CarbonylContact C-O 3.26Å; L176-Y198 WeakPolarHBondContact CA-O 3.44Å; L176-Y198 PolarHBondContact N-O 3.05Å; T196-Y198 HydrophobicContact CG2-CD2 3.88Å; T196-Y198 HydrophobicContact CG2-CE1 4.35Å; T196-Y198 HydrophobicContact CG2-CE2 3.26Å; Y198-M219 HydrophobicContact CE1-CE 3.73Å; Y198-M219 HydrophobicContact CE1-CG 4.11Å
199	L	97.9	Very high	97.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.209	C	C	.	.			trans	-130	15.8	-178.2	-73.9	161.7	0	0	0	112.1	L176 L181 I184 L197 N202 I204 S221 I222 N225	L176-L199 HydrophobicContact CB-CD2 3.87Å; L176-L199 HydrophobicContact CD1-CD2 3.75Å; L176-L199 HydrophobicContact CG-CD2 4.48Å; L181-L199 HydrophobicContact CD1-CD2 3.89Å; I184-L199 HydrophobicContact CD1-CD1 3.76Å; I184-L199 HydrophobicContact CG1-CD1 3.81Å; I184-L199 HydrophobicContact CG2-CD1 4.46Å; L197-L199 HydrophobicContact CD1-CD1 4.18Å; L197-L199 HydrophobicContact CD1-CG 4.12Å; L197-L199 HydrophobicContact CD2-CD1 3.77Å; L197-L199 HydrophobicContact CG-CD1 3.8Å; L197-L199 HydrophobicContact CG-CG 4.11Å; L199-N202 PolarHBondContact O-ND2 3.32Å; L199-I204 HydrophobicContact CB-CD1 3.94Å; L199-I204 HydrophobicContact CD1-CD1 4.25Å; L199-I204 HydrophobicContact CD2-CD1 3.97Å; L199-I204 HydrophobicContact CG-CD1 4.29Å; L199-S221 WeakPolarHBondContact CA-O 3.47Å; L199-S221 PolarHBondContact N-O 3.44Å; L199-I222 HydrophobicContact CB-CG2 3.97Å; L199-I222 HydrophobicContact CD1-CG2 3.78Å; L199-N225 PolarHBondContact O-ND2 3.5Å
200	R	97.3	Very high	97.2	Very high	85 Å²	85	46.3 Å²	46.3	32%	0.321	22%	0.222	S	C	.	.			trans	-55.5	145	-178.1	-171.6	-173.5	171.1	-178.7	-2.8	112.1	R177 H178 N202 S221 R223 E224	R177-R200 CarbonylContact C-O 3.31Å; R177-R200 WeakPolarHBondContact CA-O 3.16Å; R177-R200 HydrophobicContact CB-CB 4.47Å; R177-R200 HydrophobicContact CG-CB 3.86Å; H178-R200 PolarHBondContact N-O 3.14Å; R200-N202 PolarHBondContact O-ND2 3.1Å; R200-S221 PolarHBondContact N-O 2.97Å; R200-R223 CarbonylContact C-O 3.44Å; R200-R223 WeakPolarHBondContact CA-O 3.28Å; R200-R223 HydrophobicContact CG-CB 3.98Å; R200-R223 HydrophobicContact CG-CG 4.05Å; R200-R223 WeakPolarHBondContact CG-O 3.4Å; R200-E224 HydrophobicContact CG-CB 4.42Å; R200-E224 IonicContact CZ-OE1 2.76Å; R200-E224 IonicContact NE-OE1 3.7Å; R200-E224 PolarHBondContact NE-OE1 3.08Å; R200-E224 VanDerWaalsContact NE-OE1 3.09Å; R200-E224 IonicContact NH2-OE1 2.9Å; R200-E224 PolarHBondContact NH2-OE1 3.32Å
201	F	96.7	Very high	97.2	Very high	72 Å²	72	42.2 Å²	42.2	32%	0.316	21%	0.206	S	C	.	.	S	Bend	trans	57.4	58.8	176.8	-78.8	-77.9	0	0	0	112.1	H178 N179 R223 E224	H178-F201 VanDerWaalsContact CA-O 3.24Å; H178-F201 WeakPolarHBondContact CA-O 3.41Å; H178-F201 AromaticContact CE1-CD1 4Å; H178-F201 AromaticContact CE1-CD2 3.02Å; H178-F201 WeakPolarHBondContact CE1-CD2 3.22Å; H178-F201 AromaticContact CE1-CE2 3.4Å; H178-F201 VanDerWaalsContact CE1-CE2 3.4Å; H178-F201 WeakPolarHBondContact CE1-CE2 3.48Å; H178-F201 AromaticContact CE1-CG 3.34Å; H178-F201 WeakPolarHBondContact CE1-CG 3.07Å; H178-F201 PolarHBondContact N-O 3.01Å; H178-F201 WeakPolarHBondContact ND1-CB 3.47Å; H178-F201 AromaticContact ND1-CD2 3.76Å; H178-F201 AromaticContact ND1-CG 3.62Å; H178-F201 AromaticContact NE2-CD2 3.22Å; H178-F201 WeakPolarHBondContact NE2-CD2 3.32Å; H178-F201 AromaticContact NE2-CE2 3.7Å; H178-F201 AromaticContact NE2-CG 3.9Å; N179-F201 PolarHBondContact N-O 3.4Å; F201-R223 PolarHBondContact N-O 3.39Å; F201-R223 VanDerWaalsContact N-O 3.1Å; F201-E224 VanDerWaalsContact CA-O 3.28Å; F201-E224 WeakPolarHBondContact CA-O 3.38Å; F201-E224 HydrophobicContact CD1-CB 4.05Å; F201-E224 HydrophobicContact CD2-CB 4.46Å; F201-E224 HydrophobicContact CE1-CB 4.37Å; F201-E224 VanDerWaalsContact CE1-CD 3.46Å; F201-E224 HydrophobicContact CE1-CG 4.48Å; F201-E224 WeakPolarHBondContact CE1-OE2 3.28Å; F201-E224 WeakPolarHBondContact CE2-OE1 3.46Å; F201-E224 HydrophobicContact CG-CB 4.12Å; F201-E224 WeakPolarHBondContact CZ-OE1 3.34Å; F201-E224 WeakPolarHBondContact CZ-OE2 3.44Å; F201-E224 PolarHBondContact N-O 2.96Å
202	N	97.6	Very high	97.2	Very high	14 Å²	14	46.5 Å²	46.5	8%	0.075	22%	0.222	C	C	.	.	S	Bend	trans	-121.4	-158.6	168.4	-84.4	-78.1	0	0	0	108.7	L176 N179 K180 L181 L199 R200 I204 E224 N225	L176-N202 PolarHBondContact O-ND2 2.81Å; N179-N202 VanDerWaalsContact CA-OD1 3.27Å; N179-N202 WeakPolarHBondContact CA-OD1 3.24Å; N179-N202 WeakPolarHBondContact CB-OD1 3.28Å; N179-N202 PolarHBondContact N-OD1 3.44Å; N179-N202 PolarHBondContact O-OD1 2.85Å; K180-N202 PolarHBondContact N-OD1 3.02Å; L181-N202 HydrophobicContact CB-CB 4.21Å; L181-N202 WeakPolarHBondContact CB-OD1 3.26Å; L181-N202 WeakPolarHBondContact CG-OD1 3.32Å; L181-N202 PolarHBondContact N-OD1 2.83Å; L181-N202 VanDerWaalsContact N-OD1 3.13Å; L199-N202 PolarHBondContact O-ND2 3.32Å; R200-N202 PolarHBondContact O-ND2 3.1Å; N202-I204 HydrophobicContact CB-CD1 4.05Å; N202-I204 HydrophobicContact CB-CG1 4Å; N202-E224 PolarHBondContact N-O 2.81Å; N202-N225 WeakPolarHBondContact CA-OD1 3.35Å; N202-N225 WeakPolarHBondContact CB-OD1 3.44Å; N202-N225 PolarHBondContact N-OD1 3.41Å; N202-N225 PolarHBondContact O-OD1 3.5Å
203	R	96.8	Very high	97.3	Very high	131 Å²	131	46.4 Å²	46.4	49%	0.494	22%	0.219	S	C	.	.			trans	-125.2	29.1	177.4	-58.1	175.1	-178.2	179.4	-2.5	110.5	L181 T205 N225	L181-R203 CarbonylContact O-C 3.12Å; L181-R203 VanDerWaalsContact O-CA 3.26Å; L181-R203 WeakPolarHBondContact O-CA 3.37Å; L181-R203 WeakPolarHBondContact O-CB 3.37Å; L181-R203 PolarHBondContact O-N 2.82Å; R203-T205 PolarHBondContact O-N 3.04Å; R203-N225 PolarHBondContact N-OD1 3.22Å
204	I	97.5	Very high	97.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.215	C	C	.	.			trans	-65.4	126.4	-174.5	-62	164.9	0	0	0	109.2	L181 R182 I184 L199 N202 T206 N225 K226 I227	L181-I204 HydrophobicContact CB-CG1 4.39Å; L181-I204 PolarHBondContact O-N 2.79Å; R182-I204 VanDerWaalsContact O-CA 3.28Å; R182-I204 WeakPolarHBondContact O-CA 3.43Å; I184-I204 HydrophobicContact CG1-CD1 3.99Å; I184-I204 HydrophobicContact CG1-CG2 4.16Å; L199-I204 HydrophobicContact CB-CD1 3.94Å; L199-I204 HydrophobicContact CD1-CD1 4.25Å; L199-I204 HydrophobicContact CD2-CD1 3.97Å; L199-I204 HydrophobicContact CG-CD1 4.29Å; N202-I204 HydrophobicContact CB-CD1 4.05Å; N202-I204 HydrophobicContact CB-CG1 4Å; I204-T206 VanDerWaalsContact CG2-O 3.3Å; I204-T206 WeakPolarHBondContact CG2-O 3.12Å; I204-N225 HydrophobicContact CB-CB 4.15Å; I204-N225 WeakPolarHBondContact CB-OD1 3.37Å; I204-N225 WeakPolarHBondContact CG1-OD1 3.25Å; I204-N225 PolarHBondContact N-OD1 3.01Å; I204-K226 CarbonylContact O-C 3.48Å; I204-K226 WeakPolarHBondContact O-CA 3.46Å; I204-K226 PolarHBondContact O-N 3.37Å; I204-I227 HydrophobicContact CB-CG1 4.44Å; I204-I227 HydrophobicContact CG2-CD1 4.19Å; I204-I227 HydrophobicContact CG2-CG1 4.03Å; I204-I227 WeakPolarHBondContact O-CG1 3.28Å; I204-I227 PolarHBondContact O-N 3.32Å
205	T	96.1	Very high	97.1	Very high	68 Å²	68	48.7 Å²	48.7	42%	0.417	24%	0.235	S	C	.	.			trans	-100.6	-26.6	179.3	50.6	0	0	0	0	113.7	R182 R203 K226 I227	R182-T205 PolarHBondContact O-N 2.93Å; R182-T205 VanDerWaalsContact O-N 3.15Å; R182-T205 PolarHBondContact O-OG1 2.91Å; R203-T205 PolarHBondContact O-N 3.04Å; T205-K226 WeakPolarHBondContact CA-O 3.41Å; T205-K226 HydrophobicContact CG2-CB 4.2Å; T205-I227 WeakPolarHBondContact O-CA 3.24Å
206	T	94.9	Very high	97.1	Very high	71 Å²	71	52.6 Å²	52.6	44%	0.436	25%	0.249	S	C	.	.			trans	-142.5	147	-172.6	46.8	0	0	0	0	110.5	I204	I204-T206 VanDerWaalsContact CG2-O 3.3Å; I204-T206 WeakPolarHBondContact CG2-O 3.12Å
207	V	96.7	Very high	97.1	Very high	12 Å²	12	51.5 Å²	51.5	7%	0.073	24%	0.242	C	C	.	.			trans	-111.2	127	166.8	-179.8	0	0	0	0	106.4	I184 I211 I222 I227 L230 P231	I184-V207 HydrophobicContact CD1-CG1 4.21Å; I184-V207 HydrophobicContact CD1-CG2 4.12Å; V207-I211 HydrophobicContact CG1-CB 4.11Å; V207-I211 HydrophobicContact CG1-CD1 4.34Å; V207-I211 HydrophobicContact CG1-CG1 4.24Å; V207-I211 HydrophobicContact CG1-CG2 4.38Å; V207-I222 HydrophobicContact CG2-CD1 4.01Å; V207-I227 HydrophobicContact CG2-CD1 3.93Å; V207-I227 HydrophobicContact CG2-CG2 4.45Å; V207-L230 HydrophobicContact CG2-CD2 4.12Å; V207-P231 HydrophobicContact CB-CG 4.28Å; V207-P231 HydrophobicContact CG1-CG 4.02Å; V207-P231 WeakPolarHBondContact O-CD 3.34Å
208	E	96.3	Very high	97	Very high	70 Å²	70	53.7 Å²	53.7	33%	0.327	26%	0.256	S	S	.	.			trans	-84.6	157.3	-176.5	-57.8	-171.3	157.5	0	0	111.5	Y189 D210 I211	Y189-E208 HydrophobicContact CE2-CB 3.86Å; Y189-E208 HydrophobicContact CE2-CG 4.07Å; Y189-E208 WeakPolarHBondContact CE2-OE2 3.3Å; Y189-E208 WeakPolarHBondContact OH-CB 3.47Å; Y189-E208 PolarHBondContact OH-N 3.09Å; E208-D210 PolarHBondContact O-N 3.02Å; E208-D210 VanDerWaalsContact O-N 3.08Å; E208-I211 WeakPolarHBondContact O-CB 3.45Å; E208-I211 WeakPolarHBondContact O-CG2 3.18Å; E208-I211 PolarHBondContact O-N 3.02Å; E208-I211 VanDerWaalsContact O-N 3.1Å
209	K	96.9	Very high	97	Very high	116 Å²	116	53 Å²	53	50%	0.504	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-56	-24.9	177.8	62.6	179	-176.8	-177.7	0	114	I211 R212 E233	K209-I211 PolarHBondContact O-N 3.26Å; K209-I211 VanDerWaalsContact O-N 3.08Å; K209-R212 WeakPolarHBondContact O-CG 3.22Å; K209-R212 PolarHBondContact O-N 3.06Å; K209-E233 HydrophobicContact CB-CB 4.41Å; K209-E233 HydrophobicContact CB-CG 3.87Å; K209-E233 WeakPolarHBondContact CB-OE1 3.46Å; K209-E233 VanDerWaalsContact O-CB 3.31Å; K209-E233 WeakPolarHBondContact O-CB 3.48Å
210	D	97.3	Very high	97.1	Very high	51 Å²	51	53.1 Å²	53.1	27%	0.273	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-70.2	-2.6	-179.6	-65.7	-38.5	0	0	0	113.1	Y189 E208 R212 N213	Y189-D210 HydrophobicContact CD1-CB 4.34Å; Y189-D210 HydrophobicContact CD2-CB 4.14Å; Y189-D210 HydrophobicContact CG-CB 3.88Å; E208-D210 PolarHBondContact O-N 3.02Å; E208-D210 VanDerWaalsContact O-N 3.08Å; D210-R212 PolarHBondContact O-N 3.03Å; D210-R212 VanDerWaalsContact O-N 3.15Å; D210-N213 WeakPolarHBondContact O-CB 3.21Å; D210-N213 PolarHBondContact O-N 3.04Å; D210-N213 PolarHBondContact O-ND2 3.01Å
211	I	97.4	Very high	97.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-52.8	-31	167.6	-163.1	71.2	0	0	0	112.6	Y189 V207 E208 K209 N213 L214 L220 P231 E233 I234 L237	Y189-I211 HydrophobicContact CD1-CB 4.36Å; Y189-I211 HydrophobicContact CD1-CD1 4.25Å; Y189-I211 HydrophobicContact CE1-CB 4.06Å; Y189-I211 HydrophobicContact CE1-CD1 3.92Å; V207-I211 HydrophobicContact CG1-CB 4.11Å; V207-I211 HydrophobicContact CG1-CD1 4.34Å; V207-I211 HydrophobicContact CG1-CG1 4.24Å; V207-I211 HydrophobicContact CG1-CG2 4.38Å; E208-I211 WeakPolarHBondContact O-CB 3.45Å; E208-I211 WeakPolarHBondContact O-CG2 3.18Å; E208-I211 PolarHBondContact O-N 3.02Å; E208-I211 VanDerWaalsContact O-N 3.1Å; K209-I211 PolarHBondContact O-N 3.26Å; K209-I211 VanDerWaalsContact O-N 3.08Å; I211-N213 PolarHBondContact O-N 2.74Å; I211-L214 HydrophobicContact CD1-CD1 3.77Å; I211-L214 WeakPolarHBondContact O-CB 3.17Å; I211-L214 PolarHBondContact O-N 3.09Å; I211-L220 HydrophobicContact CD1-CD2 4.45Å; I211-P231 HydrophobicContact CG2-CG 3.99Å; I211-E233 HydrophobicContact CG2-CB 4.36Å; I211-I234 HydrophobicContact CG1-CD1 4.1Å; I211-I234 HydrophobicContact CG2-CD1 4.38Å; I211-L237 HydrophobicContact CG1-CD1 4.13Å; I211-L237 WeakPolarHBondContact O-CD2 3.44Å
212	R	96.9	Very high	97.1	Very high	92 Å²	92	46 Å²	46	35%	0.347	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-54	-26.5	175	63.9	-173	171	174.7	-1	114.6	K209 D210 L214 E233 E236	K209-R212 WeakPolarHBondContact O-CG 3.22Å; K209-R212 PolarHBondContact O-N 3.06Å; D210-R212 PolarHBondContact O-N 3.03Å; D210-R212 VanDerWaalsContact O-N 3.15Å; R212-L214 PolarHBondContact O-N 3.28Å; R212-E233 HydrophobicContact CB-CB 4.17Å; R212-E236 HydrophobicContact CB-CB 4.01Å; R212-E236 HydrophobicContact CB-CG 4.42Å; R212-E236 WeakPolarHBondContact CB-OE2 3.45Å
213	N	97.1	Very high	97.1	Very high	64 Å²	64	47.1 Å²	47.1	34%	0.342	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-68.1	-20	-179	-65.5	-23	0	0	0	111.9	Y189 T192 D210 I211 S215	Y189-N213 WeakPolarHBondContact O-CB 3.33Å; T192-N213 WeakPolarHBondContact CG2-O 3.17Å; D210-N213 WeakPolarHBondContact O-CB 3.21Å; D210-N213 PolarHBondContact O-N 3.04Å; D210-N213 PolarHBondContact O-ND2 3.01Å; I211-N213 PolarHBondContact O-N 2.74Å; N213-S215 PolarHBondContact O-N 2.84Å
214	L	97	Very high	97.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.218	C	C	.	.			trans	-82.4	49	178.4	-53.8	-173.9	0	0	0	111.8	V188 L191 L194 L197 I211 R212 K216 L217 L237	V188-L214 WeakPolarHBondContact O-CD2 2.81Å; L191-L214 WeakPolarHBondContact O-CD2 2.75Å; L194-L214 HydrophobicContact CD1-CD2 4.4Å; L197-L214 HydrophobicContact CD2-CD1 4.13Å; I211-L214 HydrophobicContact CD1-CD1 3.77Å; I211-L214 WeakPolarHBondContact O-CB 3.17Å; I211-L214 PolarHBondContact O-N 3.09Å; R212-L214 PolarHBondContact O-N 3.28Å; L214-K216 PolarHBondContact O-N 3.08Å; L214-L217 HydrophobicContact CB-CB 4.16Å; L214-L217 HydrophobicContact CB-CD2 4.42Å; L214-L217 HydrophobicContact CD1-CD2 4.36Å; L214-L217 WeakPolarHBondContact O-CB 3.25Å; L214-L217 PolarHBondContact O-N 3.1Å; L214-L237 HydrophobicContact CB-CD2 4.34Å; L214-L237 VanDerWaalsContact O-CD2 3.3Å; L214-L237 WeakPolarHBondContact O-CD2 3.33Å
215	S	95.1	Very high	97.2	Very high	61 Å²	61	43.8 Å²	43.8	43%	0.427	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.8	-170.9	60.5	0	0	0	0	115.3	N213 N239	N213-S215 PolarHBondContact O-N 2.84Å; S215-N239 PolarHBondContact O-ND2 3.38Å
216	K	97.5	Very high	97.2	Very high	119 Å²	119	45.9 Å²	45.9	52%	0.517	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-0.3	175.2	-64.5	-175	-177	176.4	0	113.8	L194 L214 T218	L194-K216 CarbonylContact O-C 3.59Å; L194-K216 VanDerWaalsContact O-C 3.27Å; L214-K216 PolarHBondContact O-N 3.08Å; K216-T218 PolarHBondContact O-N 3.44Å
217	L	98.2	Very high	97.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.204	C	C	.	.			trans	-68.4	127	-174.3	-160.3	72.2	0	0	0	110.8	L194 L197 L214 L220 L237 N239 L240	L194-L217 HydrophobicContact CB-CD1 4.22Å; L194-L217 WeakPolarHBondContact O-CA 3.2Å; L194-L217 PolarHBondContact O-N 3.18Å; L197-L217 HydrophobicContact CB-CD1 3.93Å; L214-L217 HydrophobicContact CB-CB 4.16Å; L214-L217 HydrophobicContact CB-CD2 4.42Å; L214-L217 HydrophobicContact CD1-CD2 4.36Å; L214-L217 WeakPolarHBondContact O-CB 3.25Å; L214-L217 PolarHBondContact O-N 3.1Å; L217-L220 HydrophobicContact CD2-CB 3.75Å; L217-L220 HydrophobicContact CD2-CD1 4.12Å; L217-L220 HydrophobicContact CD2-CD2 4.26Å; L217-L220 HydrophobicContact CD2-CG 4.26Å; L217-L237 HydrophobicContact CD2-CD1 4.17Å; L217-N239 CarbonylContact O-C 3.14Å; L217-N239 VanDerWaalsContact O-C 3.29Å; L217-L240 HydrophobicContact CD2-CD1 4.39Å; L217-L240 HydrophobicContact CG-CD1 4.34Å; L217-L240 WeakPolarHBondContact O-CA 3.47Å; L217-L240 PolarHBondContact O-N 3.15Å
218	T	98.4	Very high	97.3	Very high	46 Å²	46	47.6 Å²	47.6	28%	0.282	23%	0.225	S	C	.	.			trans	-110.4	-27.8	178.5	62.7	0	0	0	0	111.9	T195 K216 N239 I241 T242	T195-T218 PolarHBondContact O-N 2.86Å; T195-T218 PolarHBondContact O-OG1 2.92Å; K216-T218 PolarHBondContact O-N 3.44Å; T218-N239 WeakPolarHBondContact CA-O 3.35Å; T218-I241 HydrophobicContact CG2-CD1 4.45Å; T218-I241 PolarHBondContact O-N 3.3Å; T218-T242 PolarHBondContact O-N 3.36Å
219	M	98.4	Very high	97.3	Very high	42 Å²	42	50.3 Å²	50.3	21%	0.207	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	115.2	-178.2	176.2	69.8	176.1	0	0	109.7	T195 T196 L197 Y198 T242	T195-M219 PolarHBondContact O-N 3.1Å; T195-M219 VanDerWaalsContact O-N 3.1Å; T196-M219 WeakPolarHBondContact CA-O 3.34Å; T196-M219 HydrophobicContact CG2-CB 4.04Å; T196-M219 HydrophobicContact CG2-CG 3.98Å; L197-M219 PolarHBondContact N-O 3.13Å; Y198-M219 HydrophobicContact CE1-CE 3.73Å; Y198-M219 HydrophobicContact CE1-CG 4.11Å; M219-T242 HydrophobicContact CE-CG2 3.9Å; M219-T242 WeakPolarHBondContact SD-CB 3.11Å; M219-T242 HydrophobicContact SD-CG2 3.32Å; M219-T242 WeakPolarHBondContact SD-CG2 3.28Å
220	L	98.3	Very high	97.3	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	117.9	171.5	-179.5	56.3	0	0	0	109.7	L197 I211 L217 I222 I234 L240 T242 L243 D244	L197-L220 HydrophobicContact CB-CD1 4.13Å; L197-L220 HydrophobicContact CD2-CD1 3.91Å; L197-L220 HydrophobicContact CG-CD1 4.13Å; I211-L220 HydrophobicContact CD1-CD2 4.45Å; L217-L220 HydrophobicContact CD2-CB 3.75Å; L217-L220 HydrophobicContact CD2-CD1 4.12Å; L217-L220 HydrophobicContact CD2-CD2 4.26Å; L217-L220 HydrophobicContact CD2-CG 4.26Å; L220-I222 HydrophobicContact CD1-CG2 3.84Å; L220-I222 HydrophobicContact CG-CG2 4.27Å; L220-I234 HydrophobicContact CD2-CD1 3.92Å; L220-L240 HydrophobicContact CB-CD1 3.98Å; L220-T242 PolarHBondContact N-O 3.41Å; L220-L243 HydrophobicContact CB-CD1 4.01Å; L220-L243 HydrophobicContact CD2-CD1 3.9Å; L220-L243 HydrophobicContact CG-CD1 4.03Å; L220-D244 PolarHBondContact O-N 2.92Å
221	S	97.9	Very high	97.3	Very high	6 Å²	6	44 Å²	44	4%	0.042	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	105.4	176.4	157.4	0	0	0	0	110.4	L197 L199 R200	L197-S221 PolarHBondContact O-N 3.26Å; L199-S221 WeakPolarHBondContact CA-O 3.47Å; L199-S221 PolarHBondContact N-O 3.44Å; R200-S221 PolarHBondContact N-O 2.97Å
222	I	97.1	Very high	97.3	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	23%	0.225	C	C	.	.			trans	-116.2	22.4	176.2	58.5	-173.8	0	0	0	111.7	L199 V207 L220 N225 I227 L230 D244 V245 N248	L199-I222 HydrophobicContact CB-CG2 3.97Å; L199-I222 HydrophobicContact CD1-CG2 3.78Å; V207-I222 HydrophobicContact CG2-CD1 4.01Å; L220-I222 HydrophobicContact CD1-CG2 3.84Å; L220-I222 HydrophobicContact CG-CG2 4.27Å; I222-N225 PolarHBondContact O-ND2 3.31Å; I222-I227 HydrophobicContact CB-CD1 3.88Å; I222-I227 HydrophobicContact CD1-CD1 3.55Å; I222-I227 HydrophobicContact CG1-CD1 3.85Å; I222-L230 HydrophobicContact CD1-CD2 3.96Å; I222-D244 PolarHBondContact N-O 2.95Å; I222-V245 HydrophobicContact CD1-CB 4.47Å; I222-V245 HydrophobicContact CD1-CG1 3.62Å; I222-V245 HydrophobicContact CG1-CB 4.18Å; I222-V245 HydrophobicContact CG1-CG1 3.58Å; I222-N248 PolarHBondContact O-ND2 3.25Å
223	R	97.8	Very high	97.4	Very high	39 Å²	39	43.8 Å²	43.8	15%	0.147	22%	0.22	C	C	.	.			trans	-51.8	148.9	175.2	172.3	172.3	-172.8	129.1	4.1	114.2	R200 F201 N225 D244 A246 H247 D267	R200-R223 CarbonylContact C-O 3.44Å; R200-R223 WeakPolarHBondContact CA-O 3.28Å; R200-R223 HydrophobicContact CG-CB 3.98Å; R200-R223 HydrophobicContact CG-CG 4.05Å; R200-R223 WeakPolarHBondContact CG-O 3.4Å; F201-R223 PolarHBondContact N-O 3.39Å; F201-R223 VanDerWaalsContact N-O 3.1Å; R223-N225 PolarHBondContact O-ND2 2.83Å; R223-D244 WeakPolarHBondContact CD-OD2 3.41Å; R223-D244 PolarHBondContact N-O 2.89Å; R223-A246 CarbonylContact C-O 3.57Å; R223-A246 WeakPolarHBondContact CA-O 3.3Å; R223-A246 HydrophobicContact CG-CB 4.11Å; R223-A246 WeakPolarHBondContact CG-O 3.45Å; R223-H247 VanDerWaalsContact CZ-CD2 3.5Å; R223-H247 PolarHBondContact NH2-CD2 3.39Å; R223-H247 PolarHBondContact NH2-NE2 3.07Å; R223-D267 IonicContact NH1-OD2 3.13Å; R223-D267 PolarHBondContact NH1-OD2 3.05Å
224	E	97.9	Very high	97.3	Very high	47 Å²	47	40.8 Å²	40.8	22%	0.22	20%	0.204	C	C	.	.	S	Bend	trans	55.6	58.3	175.8	-70.8	-176.2	-104.6	0	0	111.9	R200 F201 N202 A246 H247	R200-E224 HydrophobicContact CG-CB 4.42Å; R200-E224 IonicContact CZ-OE1 2.76Å; R200-E224 IonicContact NE-OE1 3.7Å; R200-E224 PolarHBondContact NE-OE1 3.08Å; R200-E224 VanDerWaalsContact NE-OE1 3.09Å; R200-E224 IonicContact NH2-OE1 2.9Å; R200-E224 PolarHBondContact NH2-OE1 3.32Å; F201-E224 VanDerWaalsContact CA-O 3.28Å; F201-E224 WeakPolarHBondContact CA-O 3.38Å; F201-E224 HydrophobicContact CD1-CB 4.05Å; F201-E224 HydrophobicContact CD2-CB 4.46Å; F201-E224 HydrophobicContact CE1-CB 4.37Å; F201-E224 VanDerWaalsContact CE1-CD 3.46Å; F201-E224 HydrophobicContact CE1-CG 4.48Å; F201-E224 WeakPolarHBondContact CE1-OE2 3.28Å; F201-E224 WeakPolarHBondContact CE2-OE1 3.46Å; F201-E224 HydrophobicContact CG-CB 4.12Å; F201-E224 WeakPolarHBondContact CZ-OE1 3.34Å; F201-E224 WeakPolarHBondContact CZ-OE2 3.44Å; F201-E224 PolarHBondContact N-O 2.96Å; N202-E224 PolarHBondContact N-O 2.81Å; E224-A246 PolarHBondContact N-O 3.33Å; E224-H247 VanDerWaalsContact CA-O 3.25Å; E224-H247 WeakPolarHBondContact CA-O 3.46Å; E224-H247 HydrophobicContact CB-CB 4.38Å; E224-H247 HydrophobicContact CG-CB 3.5Å; E224-H247 VanDerWaalsContact CG-CB 3.5Å; E224-H247 PolarHBondContact N-O 3.06Å
225	N	97.9	Very high	97.3	Very high	13 Å²	13	40.9 Å²	40.9	7%	0.07	21%	0.205	C	C	.	.	S	Bend	trans	-128.9	-161.2	173.6	-83.6	-74.7	0	0	0	109.1	L199 N202 R203 I204 I222 R223 I227 H247 N248	L199-N225 PolarHBondContact O-ND2 3.5Å; N202-N225 WeakPolarHBondContact CA-OD1 3.35Å; N202-N225 WeakPolarHBondContact CB-OD1 3.44Å; N202-N225 PolarHBondContact N-OD1 3.41Å; N202-N225 PolarHBondContact O-OD1 3.5Å; R203-N225 PolarHBondContact N-OD1 3.22Å; I204-N225 HydrophobicContact CB-CB 4.15Å; I204-N225 WeakPolarHBondContact CB-OD1 3.37Å; I204-N225 WeakPolarHBondContact CG1-OD1 3.25Å; I204-N225 PolarHBondContact N-OD1 3.01Å; I222-N225 PolarHBondContact O-ND2 3.31Å; R223-N225 PolarHBondContact O-ND2 2.83Å; N225-I227 HydrophobicContact CB-CD1 4.18Å; N225-I227 HydrophobicContact CB-CG1 4.1Å; N225-H247 PolarHBondContact N-O 3.41Å; N225-N248 VanDerWaalsContact CA-OD1 3.28Å; N225-N248 WeakPolarHBondContact CA-OD1 3.27Å; N225-N248 WeakPolarHBondContact CB-OD1 3.23Å; N225-N248 PolarHBondContact N-OD1 3.15Å; N225-N248 PolarHBondContact O-OD1 2.95Å
226	K	97.2	Very high	97.3	Very high	113 Å²	113	42.9 Å²	42.9	49%	0.491	21%	0.208	S	C	.	.			trans	-123.9	34	-179.6	-60.4	-172.5	176.9	-169.9	0	111.2	I204 T205 K228 N248	I204-K226 CarbonylContact O-C 3.48Å; I204-K226 WeakPolarHBondContact O-CA 3.46Å; I204-K226 PolarHBondContact O-N 3.37Å; T205-K226 WeakPolarHBondContact CA-O 3.41Å; T205-K226 HydrophobicContact CG2-CB 4.2Å; K226-K228 PolarHBondContact O-N 3.26Å; K226-N248 PolarHBondContact N-OD1 3.35Å
227	I	97.3	Very high	97.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.183	C	C	.	.			trans	-75.1	126.7	-173.6	-59.4	167.8	0	0	0	109.1	I204 T205 V207 I222 N225 Q229 L230 N248 Q249 L250	I204-I227 HydrophobicContact CB-CG1 4.44Å; I204-I227 HydrophobicContact CG2-CD1 4.19Å; I204-I227 HydrophobicContact CG2-CG1 4.03Å; I204-I227 WeakPolarHBondContact O-CG1 3.28Å; I204-I227 PolarHBondContact O-N 3.32Å; T205-I227 WeakPolarHBondContact O-CA 3.24Å; V207-I227 HydrophobicContact CG2-CD1 3.93Å; V207-I227 HydrophobicContact CG2-CG2 4.45Å; I222-I227 HydrophobicContact CB-CD1 3.88Å; I222-I227 HydrophobicContact CD1-CD1 3.55Å; I222-I227 HydrophobicContact CG1-CD1 3.85Å; N225-I227 HydrophobicContact CB-CD1 4.18Å; N225-I227 HydrophobicContact CB-CG1 4.1Å; I227-Q229 VanDerWaalsContact CG2-O 3.26Å; I227-Q229 WeakPolarHBondContact CG2-O 3.45Å; I227-L230 HydrophobicContact CG2-CD2 4.25Å; I227-N248 HydrophobicContact CB-CB 4.29Å; I227-N248 WeakPolarHBondContact CB-OD1 3.44Å; I227-N248 WeakPolarHBondContact CG1-OD1 3.49Å; I227-N248 PolarHBondContact N-OD1 3.11Å; I227-Q249 CarbonylContact O-C 3.37Å; I227-Q249 WeakPolarHBondContact O-CA 3.46Å; I227-Q249 PolarHBondContact O-N 3.18Å; I227-L250 HydrophobicContact CG2-CD2 3.86Å; I227-L250 PolarHBondContact O-N 3.31Å
228	K	96.1	Very high	97.1	Very high	119 Å²	119	40.2 Å²	40.2	52%	0.517	20%	0.203	S	C	.	.			trans	-93.5	-32	178.9	-66.4	-170.4	174.5	-165.8	0	114.1	K226 Q249 L250 E251	K226-K228 PolarHBondContact O-N 3.26Å; K228-Q249 WeakPolarHBondContact CA-O 3.41Å; K228-Q249 HydrophobicContact CG-CB 4.31Å; K228-L250 WeakPolarHBondContact O-CA 3.46Å; K228-E251 PolarHBondContact O-N 2.84Å
229	Q	96	Very high	97	Very high	126 Å²	126	41.2 Å²	41.2	59%	0.589	21%	0.207	S	C	*	.			trans	-149.1	151.9	-177.9	-64	-176.9	1.7	0	0	110	I227	I227-Q229 VanDerWaalsContact CG2-O 3.26Å; I227-Q229 WeakPolarHBondContact CG2-O 3.45Å
230	L	97.2	Very high	97	Very high	14 Å²	14	39.2 Å²	39.2	7%	0.073	20%	0.197	C	C	.	.			trans	-102.2	141.9	169	-63.7	175.6	0	0	0	109.7	V207 I222 I227 V245 L250 L253 P254	V207-L230 HydrophobicContact CG2-CD2 4.12Å; I222-L230 HydrophobicContact CD1-CD2 3.96Å; I227-L230 HydrophobicContact CG2-CD2 4.25Å; L230-V245 HydrophobicContact CD1-CG1 4.24Å; L230-L250 HydrophobicContact CD1-CD1 4.32Å; L230-L250 HydrophobicContact CG-CD1 4.41Å; L230-L250 HydrophobicContact CG-CD2 4.05Å; L230-L253 HydrophobicContact CD1-CD1 3.98Å; L230-P254 HydrophobicContact CB-CG 4.05Å
231	P	97.1	Very high	97	Very high	20 Å²	20	42.4 Å²	42.4	13%	0.13	21%	0.213	C	C	.	.			trans	-68.8	152.5	175.1	30.4	-35.6	0	0	0	110.9	V207 I211 E233 I234	V207-P231 HydrophobicContact CB-CG 4.28Å; V207-P231 HydrophobicContact CG1-CG 4.02Å; V207-P231 WeakPolarHBondContact O-CD 3.34Å; I211-P231 HydrophobicContact CG2-CG 3.99Å; P231-E233 WeakPolarHBondContact CB-OE2 3.48Å; P231-E233 PolarHBondContact O-N 3.08Å; P231-I234 WeakPolarHBondContact O-CB 3.46Å; P231-I234 WeakPolarHBondContact O-CG2 3.38Å; P231-I234 PolarHBondContact O-N 3.25Å
232	A	97.1	Very high	97	Very high	39 Å²	39	43.3 Å²	43.3	32%	0.322	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-60.5	-32.1	177.1	0	0	0	0	0	112	I234 G235 E256	A232-I234 PolarHBondContact O-N 3.3Å; A232-G235 PolarHBondContact O-N 3.08Å; A232-E256 HydrophobicContact CB-CG 3.97Å; A232-E256 WeakPolarHBondContact O-CB 3.39Å
233	E	97.9	Very high	97	Very high	50 Å²	50	43.3 Å²	43.3	23%	0.234	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-60.3	-13.3	178.4	-68.5	86.2	168.6	0	0	113.8	K209 I211 R212 P231 G235 E236	K209-E233 HydrophobicContact CB-CB 4.41Å; K209-E233 HydrophobicContact CB-CG 3.87Å; K209-E233 WeakPolarHBondContact CB-OE1 3.46Å; K209-E233 VanDerWaalsContact O-CB 3.31Å; K209-E233 WeakPolarHBondContact O-CB 3.48Å; I211-E233 HydrophobicContact CG2-CB 4.36Å; R212-E233 HydrophobicContact CB-CB 4.17Å; P231-E233 WeakPolarHBondContact CB-OE2 3.48Å; P231-E233 PolarHBondContact O-N 3.08Å; E233-G235 PolarHBondContact O-N 3.37Å; E233-E236 WeakPolarHBondContact O-CB 3.2Å; E233-E236 PolarHBondContact O-N 3.11Å; E233-E236 VanDerWaalsContact O-N 3.08Å
234	I	96.8	Very high	97.1	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-57.9	-30.2	169.4	-161.3	70.8	0	0	0	111.8	I211 L220 P231 A232 E236 L237 P254 I257 C260	I211-I234 HydrophobicContact CG1-CD1 4.1Å; I211-I234 HydrophobicContact CG2-CD1 4.38Å; L220-I234 HydrophobicContact CD2-CD1 3.92Å; P231-I234 WeakPolarHBondContact O-CB 3.46Å; P231-I234 WeakPolarHBondContact O-CG2 3.38Å; P231-I234 PolarHBondContact O-N 3.25Å; A232-I234 PolarHBondContact O-N 3.3Å; I234-E236 PolarHBondContact O-N 3.11Å; I234-L237 HydrophobicContact CD1-CD1 3.58Å; I234-L237 HydrophobicContact CD1-CG 4.49Å; I234-L237 HydrophobicContact CG1-CD1 4.39Å; I234-L237 WeakPolarHBondContact O-CB 3.31Å; I234-L237 WeakPolarHBondContact O-CG 3.45Å; I234-L237 PolarHBondContact O-N 2.96Å; I234-P254 HydrophobicContact CG2-CG 3.78Å; I234-I257 HydrophobicContact CG2-CD1 4.29Å; I234-C260 PolarHBondContact O-SG 2.78Å; I234-C260 VanDerWaalsContact O-SG 3.34Å
235	G	95.4	Very high	97	Very high	2 Å²	2	40.3 Å²	40.3	2%	0.021	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-67.9	-11.4	177.2	0	0	0	0	0	114.7	A232 E233 L237 E256 N259	A232-G235 PolarHBondContact O-N 3.08Å; E233-G235 PolarHBondContact O-N 3.37Å; G235-L237 VanDerWaalsContact C-N 3.28Å; G235-E256 WeakPolarHBondContact CA-O 3.17Å; G235-N259 VanDerWaalsContact O-CB 3.25Å; G235-N259 WeakPolarHBondContact O-CB 3.23Å
236	E	96.4	Very high	97.1	Very high	103 Å²	103	39.7 Å²	39.7	48%	0.481	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-82.3	-8	174.6	-62.3	-177	-148.1	0	0	112.3	R212 E233 I234 C238	R212-E236 HydrophobicContact CB-CB 4.01Å; R212-E236 HydrophobicContact CB-CG 4.42Å; R212-E236 WeakPolarHBondContact CB-OE2 3.45Å; E233-E236 WeakPolarHBondContact O-CB 3.2Å; E233-E236 PolarHBondContact O-N 3.11Å; E233-E236 VanDerWaalsContact O-N 3.08Å; I234-E236 PolarHBondContact O-N 3.11Å; E236-C238 PolarHBondContact O-N 3.33Å
237	L	96.6	Very high	97.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.193	C	C	.	.			trans	-80.1	66.1	175.5	-57.5	-175.1	0	0	0	111.4	I211 L214 L217 I234 G235 N239 L240 C260	I211-L237 HydrophobicContact CG1-CD1 4.13Å; I211-L237 WeakPolarHBondContact O-CD2 3.44Å; L214-L237 HydrophobicContact CB-CD2 4.34Å; L214-L237 VanDerWaalsContact O-CD2 3.3Å; L214-L237 WeakPolarHBondContact O-CD2 3.33Å; L217-L237 HydrophobicContact CD2-CD1 4.17Å; I234-L237 HydrophobicContact CD1-CD1 3.58Å; I234-L237 HydrophobicContact CD1-CG 4.49Å; I234-L237 HydrophobicContact CG1-CD1 4.39Å; I234-L237 WeakPolarHBondContact O-CB 3.31Å; I234-L237 WeakPolarHBondContact O-CG 3.45Å; I234-L237 PolarHBondContact O-N 2.96Å; G235-L237 VanDerWaalsContact C-N 3.28Å; L237-N239 PolarHBondContact O-N 3.01Å; L237-N239 VanDerWaalsContact O-N 3.11Å; L237-L240 HydrophobicContact CB-CB 4.16Å; L237-L240 HydrophobicContact CB-CD2 4.49Å; L237-L240 HydrophobicContact CD1-CD2 4.39Å; L237-L240 VanDerWaalsContact O-CB 3.24Å; L237-L240 WeakPolarHBondContact O-CB 3.38Å; L237-L240 PolarHBondContact O-N 3.05Å; L237-L240 VanDerWaalsContact O-N 3.08Å; L237-C260 PolarHBondContact O-SG 3.38Å; L237-C260 VanDerWaalsContact O-SG 3.37Å
238	C	94.3	Very high	97.1	Very high	63 Å²	63	37.6 Å²	37.6	43%	0.426	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15	-172.8	-58.8	0	0	0	0	114.8	E236 Q262	E236-C238 PolarHBondContact O-N 3.33Å; C238-Q262 PolarHBondContact O-NE2 2.78Å
239	N	96.7	Very high	97.2	Very high	67 Å²	67	35.4 Å²	35.4	36%	0.358	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	3.4	177.7	-65.1	-47.6	0	0	0	113.2	S215 L217 T218 L237 I241 Q262	S215-N239 PolarHBondContact O-ND2 3.38Å; L217-N239 CarbonylContact O-C 3.14Å; L217-N239 VanDerWaalsContact O-C 3.29Å; T218-N239 WeakPolarHBondContact CA-O 3.35Å; L237-N239 PolarHBondContact O-N 3.01Å; L237-N239 VanDerWaalsContact O-N 3.11Å; N239-I241 PolarHBondContact O-N 3.22Å; N239-Q262 PolarHBondContact OD1-NE2 3.21Å
240	L	97.8	Very high	97.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.16	C	C	.	.			trans	-69.9	121.7	-176.7	-161.8	67	0	0	0	110	L217 L220 L237 L243 Q262 I263	L217-L240 HydrophobicContact CD2-CD1 4.39Å; L217-L240 HydrophobicContact CG-CD1 4.34Å; L217-L240 WeakPolarHBondContact O-CA 3.47Å; L217-L240 PolarHBondContact O-N 3.15Å; L220-L240 HydrophobicContact CB-CD1 3.98Å; L237-L240 HydrophobicContact CB-CB 4.16Å; L237-L240 HydrophobicContact CB-CD2 4.49Å; L237-L240 HydrophobicContact CD1-CD2 4.39Å; L237-L240 VanDerWaalsContact O-CB 3.24Å; L237-L240 WeakPolarHBondContact O-CB 3.38Å; L237-L240 PolarHBondContact O-N 3.05Å; L237-L240 VanDerWaalsContact O-N 3.08Å; L240-L243 HydrophobicContact CD2-CB 3.82Å; L240-L243 HydrophobicContact CD2-CD1 4.24Å; L240-L243 HydrophobicContact CD2-CD2 4.18Å; L240-L243 HydrophobicContact CD2-CG 4.29Å; L240-L243 HydrophobicContact CG-CB 4.48Å; L240-Q262 CarbonylContact O-C 3.22Å; L240-Q262 VanDerWaalsContact O-C 3.22Å; L240-I263 HydrophobicContact CB-CG1 4.32Å; L240-I263 HydrophobicContact CD2-CD1 4.27Å; L240-I263 HydrophobicContact CG-CG1 4.47Å; L240-I263 WeakPolarHBondContact O-CA 3.46Å; L240-I263 VanDerWaalsContact O-CG1 3.25Å; L240-I263 WeakPolarHBondContact O-CG1 3.16Å; L240-I263 PolarHBondContact O-N 2.91Å; L240-I263 VanDerWaalsContact O-N 3.11Å
241	I	98	Very high	97.3	Very high	68 Å²	68	32.5 Å²	32.5	35%	0.349	17%	0.173	S	C	.	.			trans	-100.8	-38.3	179.1	-60.9	174.5	0	0	0	109.7	T218 N239 T264 N265	T218-I241 HydrophobicContact CG2-CD1 4.45Å; T218-I241 PolarHBondContact O-N 3.3Å; N239-I241 PolarHBondContact O-N 3.22Å; I241-T264 HydrophobicContact CG2-CG2 4.26Å; I241-T264 VanDerWaalsContact CG2-OG1 3.27Å; I241-T264 WeakPolarHBondContact CG2-OG1 3.49Å; I241-T264 PolarHBondContact O-N 3.03Å; I241-T264 PolarHBondContact O-OG1 3.18Å; I241-N265 PolarHBondContact O-N 2.65Å
242	T	98.3	Very high	97.3	Very high	25 Å²	25	35.3 Å²	35.3	15%	0.153	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	127	-179.6	-61.9	0	0	0	0	111.1	T218 M219 L220 N265	T218-T242 PolarHBondContact O-N 3.36Å; M219-T242 HydrophobicContact CE-CG2 3.9Å; M219-T242 WeakPolarHBondContact SD-CB 3.11Å; M219-T242 HydrophobicContact SD-CG2 3.32Å; M219-T242 WeakPolarHBondContact SD-CG2 3.28Å; L220-T242 PolarHBondContact N-O 3.41Å; T242-N265 WeakPolarHBondContact CA-O 3.47Å; T242-N265 HydrophobicContact CG2-CB 4.14Å
243	L	98.3	Very high	97.3	Very high	1 Å²	1	34 Å²	34	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	110	173.7	178.7	56.1	0	0	0	109.1	L220 L240 V245 I257 N265 L266 D267	L220-L243 HydrophobicContact CB-CD1 4.01Å; L220-L243 HydrophobicContact CD2-CD1 3.9Å; L220-L243 HydrophobicContact CG-CD1 4.03Å; L240-L243 HydrophobicContact CD2-CB 3.82Å; L240-L243 HydrophobicContact CD2-CD1 4.24Å; L240-L243 HydrophobicContact CD2-CD2 4.18Å; L240-L243 HydrophobicContact CD2-CG 4.29Å; L240-L243 HydrophobicContact CG-CB 4.48Å; L243-V245 HydrophobicContact CD1-CG1 3.59Å; L243-V245 HydrophobicContact CD2-CG1 4.43Å; L243-V245 HydrophobicContact CG-CG1 3.86Å; L243-I257 HydrophobicContact CD2-CD1 3.68Å; L243-N265 PolarHBondContact N-O 3.38Å; L243-L266 HydrophobicContact CB-CD1 3.86Å; L243-L266 HydrophobicContact CD2-CD1 3.76Å; L243-L266 HydrophobicContact CG-CD1 3.89Å; L243-D267 PolarHBondContact O-N 3.5Å
244	D	98.3	Very high	97.2	Very high	23 Å²	23	32.6 Å²	32.6	12%	0.123	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	106.1	175.3	-177	1.6	0	0	0	110.1	L220 I222 R223 A246 D267	L220-D244 PolarHBondContact O-N 2.92Å; I222-D244 PolarHBondContact N-O 2.95Å; R223-D244 WeakPolarHBondContact CD-OD2 3.41Å; R223-D244 PolarHBondContact N-O 2.89Å; D244-A246 VanDerWaalsContact OD1-CB 3.23Å; D244-A246 WeakPolarHBondContact OD1-CB 3.21Å; D244-A246 PolarHBondContact OD1-N 3.24Å; D244-A246 VanDerWaalsContact OD1-N 3.07Å; D244-D267 HydrophobicContact CB-CB 4.44Å
245	V	97.6	Very high	97.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.195	C	C	.	.			trans	-119.3	20.4	176.8	-54.6	0	0	0	0	111.6	I222 L230 L243 N248 L250 D267 L268 N271	I222-V245 HydrophobicContact CD1-CB 4.47Å; I222-V245 HydrophobicContact CD1-CG1 3.62Å; I222-V245 HydrophobicContact CG1-CB 4.18Å; I222-V245 HydrophobicContact CG1-CG1 3.58Å; L230-V245 HydrophobicContact CD1-CG1 4.24Å; L243-V245 HydrophobicContact CD1-CG1 3.59Å; L243-V245 HydrophobicContact CD2-CG1 4.43Å; L243-V245 HydrophobicContact CG-CG1 3.86Å; V245-N248 PolarHBondContact O-ND2 3.17Å; V245-L250 HydrophobicContact CB-CD1 4.03Å; V245-L250 HydrophobicContact CG2-CD1 3.63Å; V245-D267 CarbonylContact C-O 3.56Å; V245-D267 WeakPolarHBondContact CG2-O 3.36Å; V245-D267 PolarHBondContact N-O 2.93Å; V245-L268 HydrophobicContact CG2-CD2 3.27Å; V245-L268 HydrophobicContact CG2-CG 4.09Å; V245-N271 PolarHBondContact O-ND2 3.48Å; V245-N271 VanDerWaalsContact O-ND2 3.1Å
246	A	98.1	Very high	97.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.206	C	C	.	.			trans	-60.5	155	-178.9	0	0	0	0	0	112.9	R223 E224 D244 N248 D267 Q269	R223-A246 CarbonylContact C-O 3.57Å; R223-A246 WeakPolarHBondContact CA-O 3.3Å; R223-A246 HydrophobicContact CG-CB 4.11Å; R223-A246 WeakPolarHBondContact CG-O 3.45Å; E224-A246 PolarHBondContact N-O 3.33Å; D244-A246 VanDerWaalsContact OD1-CB 3.23Å; D244-A246 WeakPolarHBondContact OD1-CB 3.21Å; D244-A246 PolarHBondContact OD1-N 3.24Å; D244-A246 VanDerWaalsContact OD1-N 3.07Å; A246-N248 PolarHBondContact O-N 2.9Å; A246-N248 PolarHBondContact O-ND2 3.38Å; A246-D267 PolarHBondContact N-O 3.25Å; A246-Q269 CarbonylContact C-O 3.29Å; A246-Q269 WeakPolarHBondContact CA-O 3.08Å; A246-Q269 HydrophobicContact CB-CG 3.48Å; A246-Q269 VanDerWaalsContact CB-CG 3.48Å
247	H	98.2	Very high	97.4	Very high	59 Å²	59	36.5 Å²	36.5	27%	0.273	18%	0.183	S	C	.	.	S	Bend	trans	53.6	54.1	179.2	-60.5	-92.4	0	0	0	112.6	R223 E224 N225 Q269 H270	R223-H247 VanDerWaalsContact CZ-CD2 3.5Å; R223-H247 PolarHBondContact NH2-CD2 3.39Å; R223-H247 PolarHBondContact NH2-NE2 3.07Å; E224-H247 VanDerWaalsContact CA-O 3.25Å; E224-H247 WeakPolarHBondContact CA-O 3.46Å; E224-H247 HydrophobicContact CB-CB 4.38Å; E224-H247 HydrophobicContact CG-CB 3.5Å; E224-H247 VanDerWaalsContact CG-CB 3.5Å; E224-H247 PolarHBondContact N-O 3.06Å; N225-H247 PolarHBondContact N-O 3.41Å; H247-Q269 PolarHBondContact N-O 3.45Å; H247-H270 WeakPolarHBondContact CA-O 3.26Å; H247-H270 HydrophobicContact CB-CB 4.43Å; H247-H270 AromaticContact CE1-CD2 3.18Å; H247-H270 PolarHBondContact CE1-CD2 2.85Å; H247-H270 AromaticContact CE1-CG 3.38Å; H247-H270 AromaticContact CE1-NE2 3.73Å; H247-H270 PolarHBondContact N-O 3.16Å; H247-H270 WeakPolarHBondContact ND1-CB 3.46Å; H247-H270 AromaticContact ND1-CD2 3.88Å; H247-H270 AromaticContact ND1-CG 3.64Å; H247-H270 AromaticContact NE2-CD2 3.38Å; H247-H270 PolarHBondContact NE2-CD2 3.24Å; H247-H270 AromaticContact NE2-CG 3.92Å
248	N	98.3	Very high	97.3	Very high	9 Å²	9	36.5 Å²	36.5	5%	0.048	18%	0.183	C	C	.	.	S	Bend	trans	-123.7	-162.5	171.3	-84	-74.9	0	0	0	108.7	I222 N225 K226 I227 V245 A246 L250 H270 N271	I222-N248 PolarHBondContact O-ND2 3.25Å; N225-N248 VanDerWaalsContact CA-OD1 3.28Å; N225-N248 WeakPolarHBondContact CA-OD1 3.27Å; N225-N248 WeakPolarHBondContact CB-OD1 3.23Å; N225-N248 PolarHBondContact N-OD1 3.15Å; N225-N248 PolarHBondContact O-OD1 2.95Å; K226-N248 PolarHBondContact N-OD1 3.35Å; I227-N248 HydrophobicContact CB-CB 4.29Å; I227-N248 WeakPolarHBondContact CB-OD1 3.44Å; I227-N248 WeakPolarHBondContact CG1-OD1 3.49Å; I227-N248 PolarHBondContact N-OD1 3.11Å; V245-N248 PolarHBondContact O-ND2 3.17Å; A246-N248 PolarHBondContact O-N 2.9Å; A246-N248 PolarHBondContact O-ND2 3.38Å; N248-L250 HydrophobicContact CB-CG 4.34Å; N248-H270 PolarHBondContact N-O 3.1Å; N248-N271 WeakPolarHBondContact CA-OD1 3.44Å; N248-N271 WeakPolarHBondContact CB-OD1 3.4Å; N248-N271 PolarHBondContact N-OD1 2.97Å; N248-N271 PolarHBondContact O-OD1 2.95Å
249	Q	97.7	Very high	97.4	Very high	74 Å²	74	37.8 Å²	37.8	35%	0.346	19%	0.186	S	C	.	.			trans	-121	34	-179.4	-62.1	179.9	-21.1	0	0	110.2	I227 K228 E251 N271	I227-Q249 CarbonylContact O-C 3.37Å; I227-Q249 WeakPolarHBondContact O-CA 3.46Å; I227-Q249 PolarHBondContact O-N 3.18Å; K228-Q249 WeakPolarHBondContact CA-O 3.41Å; K228-Q249 HydrophobicContact CG-CB 4.31Å; Q249-E251 PolarHBondContact O-N 3.39Å; Q249-N271 PolarHBondContact N-OD1 2.89Å
250	L	97.8	Very high	97.4	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	17%	0.169	C	C	.	.			trans	-67.6	123	-177.3	-64.5	175.1	0	0	0	110.4	I227 K228 L230 V245 N248 L268 N271 E272 L273	I227-L250 HydrophobicContact CG2-CD2 3.86Å; I227-L250 PolarHBondContact O-N 3.31Å; K228-L250 WeakPolarHBondContact O-CA 3.46Å; L230-L250 HydrophobicContact CD1-CD1 4.32Å; L230-L250 HydrophobicContact CG-CD1 4.41Å; L230-L250 HydrophobicContact CG-CD2 4.05Å; V245-L250 HydrophobicContact CB-CD1 4.03Å; V245-L250 HydrophobicContact CG2-CD1 3.63Å; N248-L250 HydrophobicContact CB-CG 4.34Å; L250-L268 HydrophobicContact CD1-CD2 4.18Å; L250-N271 HydrophobicContact CB-CB 4.09Å; L250-N271 WeakPolarHBondContact CB-OD1 3Å; L250-N271 WeakPolarHBondContact CG-OD1 3.21Å; L250-N271 PolarHBondContact N-OD1 3.12Å; L250-E272 CarbonylContact O-C 3.59Å; L250-E272 VanDerWaalsContact O-CA 3.31Å; L250-E272 WeakPolarHBondContact O-CA 3.32Å; L250-E272 PolarHBondContact O-N 2.97Å; L250-L273 HydrophobicContact CB-CD2 3.91Å; L250-L273 HydrophobicContact CB-CG 4.47Å; L250-L273 PolarHBondContact O-N 3.01Å
251	E	96.6	Very high	97.3	Very high	77 Å²	77	38.2 Å²	38.2	36%	0.36	19%	0.191	S	C	.	.	S	Bend	trans	-91.3	-33.1	174.1	-68.3	175.9	-158.4	0	0	112.1	K228 Q249 E272 L273 L274	K228-E251 PolarHBondContact O-N 2.84Å; Q249-E251 PolarHBondContact O-N 3.39Å; E251-E272 HydrophobicContact CG-CB 4.48Å; E251-L273 WeakPolarHBondContact O-CA 3.45Å; E251-L274 PolarHBondContact O-N 3.3Å
252	H	96.8	Very high	97.2	Very high	80 Å²	80	39.1 Å²	39.1	37%	0.37	19%	0.194	S	C	.	.			trans	-141.5	157.3	-179.5	-60.1	-71.2	0	0	0	111	D275	H252-D275 IonicContact CE1-OD1 2.89Å; H252-D275 PolarHBondContact CE1-OD1 2.96Å; H252-D275 IonicContact CG-OD1 3.41Å; H252-D275 IonicContact ND1-OD1 3.86Å; H252-D275 PolarHBondContact ND1-OD1 3.11Å
253	L	96.9	Very high	97.1	Very high	12 Å²	12	38 Å²	38	6%	0.063	19%	0.187	C	C	.	.			trans	-108.8	133.7	172	-169.1	71	0	0	0	109.4	L230 I257 L268 P277 I280	L230-L253 HydrophobicContact CD1-CD1 3.98Å; L253-I257 HydrophobicContact CD1-CG1 4.48Å; L253-I257 HydrophobicContact CD2-CB 4.25Å; L253-I257 HydrophobicContact CD2-CG1 4.17Å; L253-I257 HydrophobicContact CD2-CG2 3.63Å; L253-I257 HydrophobicContact CG-CB 4.23Å; L253-I257 HydrophobicContact CG-CG1 4.43Å; L253-I257 HydrophobicContact CG-CG2 3.92Å; L253-L268 HydrophobicContact CD1-CD2 3.91Å; L253-L268 HydrophobicContact CD2-CD1 4.05Å; L253-P277 HydrophobicContact CB-CG 4.41Å; L253-P277 HydrophobicContact CD2-CG 4.39Å; L253-I280 HydrophobicContact CD2-CD1 4.18Å
254	P	97	Very high	97.1	Very high	20 Å²	20	40.1 Å²	40.1	13%	0.13	20%	0.2	C	C	.	.			trans	-63.5	140.9	177.1	26.6	-34.1	0	0	0	110.4	L230 I234 E256 I257	L230-P254 HydrophobicContact CB-CG 4.05Å; I234-P254 HydrophobicContact CG2-CG 3.78Å; P254-E256 PolarHBondContact O-N 3.49Å; P254-I257 WeakPolarHBondContact O-CB 3.29Å; P254-I257 WeakPolarHBondContact O-CG2 3.2Å; P254-I257 PolarHBondContact O-N 3.32Å; P254-I257 VanDerWaalsContact O-N 3.15Å
255	K	97	Very high	97	Very high	132 Å²	132	41.1 Å²	41.1	57%	0.574	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-61.7	-26.9	179.8	64.7	180	-178.7	-179.1	0	112.2	I257 G258 P277 T279	K255-I257 PolarHBondContact O-N 3.37Å; K255-I257 VanDerWaalsContact O-N 3.15Å; K255-G258 PolarHBondContact O-N 3.29Å; K255-P277 HydrophobicContact CB-CB 4.14Å; K255-T279 WeakPolarHBondContact CA-OG1 3.25Å; K255-T279 HydrophobicContact CB-CG2 4.2Å; K255-T279 WeakPolarHBondContact O-CB 3.48Å; K255-T279 WeakPolarHBondContact O-CG2 3.15Å; K255-T279 PolarHBondContact O-OG1 3.01Å
256	E	97.8	Very high	97	Very high	55 Å²	55	41.1 Å²	41.1	26%	0.257	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-64.6	-16	179.8	-67.3	73.3	-160.3	0	0	112.7	A232 G235 P254 G258 N259	A232-E256 HydrophobicContact CB-CG 3.97Å; A232-E256 WeakPolarHBondContact O-CB 3.39Å; G235-E256 WeakPolarHBondContact CA-O 3.17Å; P254-E256 PolarHBondContact O-N 3.49Å; E256-G258 PolarHBondContact O-N 3.31Å; E256-G258 VanDerWaalsContact O-N 3.09Å; E256-N259 VanDerWaalsContact O-CB 3.26Å; E256-N259 WeakPolarHBondContact O-CB 3.31Å; E256-N259 PolarHBondContact O-N 3.48Å
257	I	96.8	Very high	97	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-54.5	-30.3	173.9	-165.2	59.2	0	0	0	112.7	I234 L243 L253 P254 K255 N259 C260 I263 P277 I280	I234-I257 HydrophobicContact CG2-CD1 4.29Å; L243-I257 HydrophobicContact CD2-CD1 3.68Å; L253-I257 HydrophobicContact CD1-CG1 4.48Å; L253-I257 HydrophobicContact CD2-CB 4.25Å; L253-I257 HydrophobicContact CD2-CG1 4.17Å; L253-I257 HydrophobicContact CD2-CG2 3.63Å; L253-I257 HydrophobicContact CG-CB 4.23Å; L253-I257 HydrophobicContact CG-CG1 4.43Å; L253-I257 HydrophobicContact CG-CG2 3.92Å; P254-I257 WeakPolarHBondContact O-CB 3.29Å; P254-I257 WeakPolarHBondContact O-CG2 3.2Å; P254-I257 PolarHBondContact O-N 3.32Å; P254-I257 VanDerWaalsContact O-N 3.15Å; K255-I257 PolarHBondContact O-N 3.37Å; K255-I257 VanDerWaalsContact O-N 3.15Å; I257-N259 PolarHBondContact O-N 3.22Å; I257-N259 VanDerWaalsContact O-N 3.14Å; I257-C260 WeakPolarHBondContact O-CB 3.44Å; I257-C260 PolarHBondContact O-N 2.73Å; I257-C260 VanDerWaalsContact O-N 3.11Å; I257-I263 HydrophobicContact CD1-CD1 4.1Å; I257-P277 HydrophobicContact CG2-CG 4.19Å; I257-I280 HydrophobicContact CG2-CD1 4.44Å
258	G	95.6	Very high	97	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.01	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-67.5	-8.1	177.6	0	0	0	0	0	114.4	K255 E256 T279 N282	K255-G258 PolarHBondContact O-N 3.29Å; E256-G258 PolarHBondContact O-N 3.31Å; E256-G258 VanDerWaalsContact O-N 3.09Å; G258-T279 WeakPolarHBondContact CA-O 3.49Å; G258-N282 VanDerWaalsContact O-CB 3.26Å; G258-N282 WeakPolarHBondContact O-CB 3.49Å
259	N	96.7	Very high	97	Very high	90 Å²	90	38.9 Å²	38.9	48%	0.481	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-80	-21.1	173.2	-64.6	-13.6	0	0	0	112.2	G235 E256 I257 T261	G235-N259 VanDerWaalsContact O-CB 3.25Å; G235-N259 WeakPolarHBondContact O-CB 3.23Å; E256-N259 VanDerWaalsContact O-CB 3.26Å; E256-N259 WeakPolarHBondContact O-CB 3.31Å; E256-N259 PolarHBondContact O-N 3.48Å; I257-N259 PolarHBondContact O-N 3.22Å; I257-N259 VanDerWaalsContact O-N 3.14Å; N259-T261 PolarHBondContact O-N 2.82Å
260	C	96.2	Very high	97	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.			trans	-77.8	60.9	178.1	-63	0	0	0	0	111.6	I234 L237 I257 Q262 I263 L283	I234-C260 PolarHBondContact O-SG 2.78Å; I234-C260 VanDerWaalsContact O-SG 3.34Å; L237-C260 PolarHBondContact O-SG 3.38Å; L237-C260 VanDerWaalsContact O-SG 3.37Å; I257-C260 WeakPolarHBondContact O-CB 3.44Å; I257-C260 PolarHBondContact O-N 2.73Å; I257-C260 VanDerWaalsContact O-N 3.11Å; C260-Q262 PolarHBondContact O-N 3.42Å; C260-I263 HydrophobicContact CB-CD1 3.37Å; C260-I263 HydrophobicContact CB-CG1 3.76Å; C260-I263 WeakPolarHBondContact O-CB 3.46Å; C260-I263 VanDerWaalsContact O-CG1 3.31Å; C260-I263 WeakPolarHBondContact O-CG1 3.29Å; C260-I263 PolarHBondContact O-N 3.13Å; C260-L283 WeakPolarHBondContact O-CD2 3.19Å
261	T	95.3	Very high	97	Very high	76 Å²	76	38.6 Å²	38.6	47%	0.466	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.2	-170.4	53.3	0	0	0	0	115.3	N259 I263	N259-T261 PolarHBondContact O-N 2.82Å; T261-I263 VanDerWaalsContact C-N 3.32Å
262	Q	96.3	Very high	97.1	Very high	87 Å²	87	37.6 Å²	37.6	41%	0.407	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-3.3	176	-64.8	-172.1	51.3	0	0	113.9	C238 N239 L240 C260 T264	C238-Q262 PolarHBondContact O-NE2 2.78Å; N239-Q262 PolarHBondContact OD1-NE2 3.21Å; L240-Q262 CarbonylContact O-C 3.22Å; L240-Q262 VanDerWaalsContact O-C 3.22Å; C260-Q262 PolarHBondContact O-N 3.42Å; Q262-T264 PolarHBondContact O-N 3.28Å
263	I	97.1	Very high	97.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.172	C	C	.	.			trans	-64.1	122.1	179.7	-70.8	175.5	0	0	0	109.7	L240 I257 C260 T261 L266 L283 S285 I286	L240-I263 HydrophobicContact CB-CG1 4.32Å; L240-I263 HydrophobicContact CD2-CD1 4.27Å; L240-I263 HydrophobicContact CG-CG1 4.47Å; L240-I263 WeakPolarHBondContact O-CA 3.46Å; L240-I263 VanDerWaalsContact O-CG1 3.25Å; L240-I263 WeakPolarHBondContact O-CG1 3.16Å; L240-I263 PolarHBondContact O-N 2.91Å; L240-I263 VanDerWaalsContact O-N 3.11Å; I257-I263 HydrophobicContact CD1-CD1 4.1Å; C260-I263 HydrophobicContact CB-CD1 3.37Å; C260-I263 HydrophobicContact CB-CG1 3.76Å; C260-I263 WeakPolarHBondContact O-CB 3.46Å; C260-I263 VanDerWaalsContact O-CG1 3.31Å; C260-I263 WeakPolarHBondContact O-CG1 3.29Å; C260-I263 PolarHBondContact O-N 3.13Å; T261-I263 VanDerWaalsContact C-N 3.32Å; I263-L266 HydrophobicContact CG2-CB 3.93Å; I263-L283 HydrophobicContact CB-CD2 4.45Å; I263-L283 HydrophobicContact CG2-CD1 4.49Å; I263-S285 CarbonylContact O-C 3.59Å; I263-I286 PolarHBondContact O-N 3.13Å
264	T	96.9	Very high	97.2	Very high	46 Å²	46	36.7 Å²	36.7	28%	0.282	19%	0.187	S	C	.	.	S	Bend	trans	-104.7	-27.6	173.5	58	0	0	0	0	111.9	I241 Q262 S285 N287 R288	I241-T264 HydrophobicContact CG2-CG2 4.26Å; I241-T264 VanDerWaalsContact CG2-OG1 3.27Å; I241-T264 WeakPolarHBondContact CG2-OG1 3.49Å; I241-T264 PolarHBondContact O-N 3.03Å; I241-T264 PolarHBondContact O-OG1 3.18Å; Q262-T264 PolarHBondContact O-N 3.28Å; T264-S285 WeakPolarHBondContact CA-O 3.18Å; T264-N287 PolarHBondContact O-N 3.17Å; T264-R288 PolarHBondContact O-N 3.11Å; T264-R288 VanDerWaalsContact O-N 3.12Å
265	N	97.3	Very high	97.1	Very high	44 Å²	44	39.2 Å²	39.2	24%	0.235	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	111.5	-179.1	-175.2	17.7	0	0	0	110.6	I241 T242 L243 R288	I241-N265 PolarHBondContact O-N 2.65Å; T242-N265 WeakPolarHBondContact CA-O 3.47Å; T242-N265 HydrophobicContact CG2-CB 4.14Å; L243-N265 PolarHBondContact N-O 3.38Å; N265-R288 WeakPolarHBondContact CA-O 3.4Å; N265-R288 WeakPolarHBondContact OD1-CD 3.45Å
266	L	97.6	Very high	97.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	111	175.4	179.9	57.2	0	0	0	109.3	L243 I263 L268 I280 L283 I286 R288 L289 G290	L243-L266 HydrophobicContact CB-CD1 3.86Å; L243-L266 HydrophobicContact CD2-CD1 3.76Å; L243-L266 HydrophobicContact CG-CD1 3.89Å; I263-L266 HydrophobicContact CG2-CB 3.93Å; L266-L268 HydrophobicContact CD1-CD1 4.28Å; L266-L268 HydrophobicContact CD1-CG 4.16Å; L266-L268 HydrophobicContact CD2-CD1 3.8Å; L266-L268 HydrophobicContact CG-CD1 3.8Å; L266-L268 HydrophobicContact CG-CG 4.04Å; L266-I280 HydrophobicContact CD2-CD1 3.76Å; L266-L283 HydrophobicContact CD2-CD1 4.04Å; L266-I286 HydrophobicContact CB-CD1 3.79Å; L266-R288 PolarHBondContact N-O 2.87Å; L266-L289 HydrophobicContact CB-CD1 4.12Å; L266-L289 HydrophobicContact CD2-CD1 3.94Å; L266-L289 HydrophobicContact CG-CD1 4.11Å; L266-L289 WeakPolarHBondContact O-CA 3.07Å; L266-G290 PolarHBondContact O-N 3.2Å
267	D	97.8	Very high	97.1	Very high	12 Å²	12	31.7 Å²	31.7	6%	0.064	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	106.6	-178.4	-162.9	2.4	0	0	0	111.1	R223 L243 D244 V245 A246 Q269	R223-D267 IonicContact NH1-OD2 3.13Å; R223-D267 PolarHBondContact NH1-OD2 3.05Å; L243-D267 PolarHBondContact O-N 3.5Å; D244-D267 HydrophobicContact CB-CB 4.44Å; V245-D267 CarbonylContact C-O 3.56Å; V245-D267 WeakPolarHBondContact CG2-O 3.36Å; V245-D267 PolarHBondContact N-O 2.93Å; A246-D267 PolarHBondContact N-O 3.25Å; D267-Q269 VanDerWaalsContact CG-NE2 3.27Å; D267-Q269 WeakPolarHBondContact OD1-CG 3.43Å; D267-Q269 PolarHBondContact OD1-N 2.89Å; D267-Q269 PolarHBondContact OD1-NE2 3.46Å; D267-Q269 VanDerWaalsContact OD1-NE2 3.11Å; D267-Q269 PolarHBondContact OD2-NE2 2.95Å
268	L	97.6	Very high	97.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.191	C	C	.	.			trans	-114.7	10.5	-178.3	-69	159.1	0	0	0	112	V245 L250 L253 L266 N271 L273 L276 L289 G290 L291 N294	V245-L268 HydrophobicContact CG2-CD2 3.27Å; V245-L268 HydrophobicContact CG2-CG 4.09Å; L250-L268 HydrophobicContact CD1-CD2 4.18Å; L253-L268 HydrophobicContact CD1-CD2 3.91Å; L253-L268 HydrophobicContact CD2-CD1 4.05Å; L266-L268 HydrophobicContact CD1-CD1 4.28Å; L266-L268 HydrophobicContact CD1-CG 4.16Å; L266-L268 HydrophobicContact CD2-CD1 3.8Å; L266-L268 HydrophobicContact CG-CD1 3.8Å; L266-L268 HydrophobicContact CG-CG 4.04Å; L268-N271 PolarHBondContact O-ND2 2.8Å; L268-L273 HydrophobicContact CB-CD1 3.84Å; L268-L273 HydrophobicContact CD1-CD1 4.27Å; L268-L273 HydrophobicContact CD2-CD1 4.1Å; L268-L273 HydrophobicContact CG-CD1 4.31Å; L268-L276 HydrophobicContact CD1-CD2 4.38Å; L268-L289 HydrophobicContact CD1-CD1 4.43Å; L268-G290 CarbonylContact C-O 3.48Å; L268-G290 VanDerWaalsContact C-O 3.25Å; L268-G290 VanDerWaalsContact CA-O 3.25Å; L268-G290 WeakPolarHBondContact CA-O 3.4Å; L268-G290 VanDerWaalsContact CB-O 3.27Å; L268-G290 WeakPolarHBondContact CB-O 3.4Å; L268-G290 PolarHBondContact N-O 3.34Å; L268-L291 HydrophobicContact CB-CD2 4.21Å; L268-L291 HydrophobicContact CD1-CD2 4.01Å; L268-N294 PolarHBondContact O-ND2 2.93Å
269	Q	97.8	Very high	97.1	Very high	10 Å²	10	38.5 Å²	38.5	5%	0.047	20%	0.202	C	C	.	.			trans	-62.8	153	-175.6	66.5	-170.3	-33	0	0	113.1	A246 H247 D267 N271 G290 R292	A246-Q269 CarbonylContact C-O 3.29Å; A246-Q269 WeakPolarHBondContact CA-O 3.08Å; A246-Q269 HydrophobicContact CB-CG 3.48Å; A246-Q269 VanDerWaalsContact CB-CG 3.48Å; H247-Q269 PolarHBondContact N-O 3.45Å; D267-Q269 VanDerWaalsContact CG-NE2 3.27Å; D267-Q269 WeakPolarHBondContact OD1-CG 3.43Å; D267-Q269 PolarHBondContact OD1-N 2.89Å; D267-Q269 PolarHBondContact OD1-NE2 3.46Å; D267-Q269 VanDerWaalsContact OD1-NE2 3.11Å; D267-Q269 PolarHBondContact OD2-NE2 2.95Å; Q269-N271 PolarHBondContact O-ND2 3.1Å; Q269-G290 PolarHBondContact N-O 3.23Å; Q269-G290 VanDerWaalsContact N-O 3.14Å; Q269-R292 CarbonylContact C-O 3.14Å; Q269-R292 VanDerWaalsContact CA-O 3.25Å; Q269-R292 WeakPolarHBondContact CA-O 3.38Å; Q269-R292 HydrophobicContact CB-CG 3.71Å
270	H	98.1	Very high	97.1	Very high	58 Å²	58	34.2 Å²	34.2	27%	0.269	18%	0.179	S	C	.	.	S	Bend	trans	54.4	53.9	-179.7	-64.1	-82.3	0	0	0	112.5	H247 N248 R292 Y293	H247-H270 WeakPolarHBondContact CA-O 3.26Å; H247-H270 HydrophobicContact CB-CB 4.43Å; H247-H270 AromaticContact CE1-CD2 3.18Å; H247-H270 PolarHBondContact CE1-CD2 2.85Å; H247-H270 AromaticContact CE1-CG 3.38Å; H247-H270 AromaticContact CE1-NE2 3.73Å; H247-H270 PolarHBondContact N-O 3.16Å; H247-H270 WeakPolarHBondContact ND1-CB 3.46Å; H247-H270 AromaticContact ND1-CD2 3.88Å; H247-H270 AromaticContact ND1-CG 3.64Å; H247-H270 AromaticContact NE2-CD2 3.38Å; H247-H270 PolarHBondContact NE2-CD2 3.24Å; H247-H270 AromaticContact NE2-CG 3.92Å; N248-H270 PolarHBondContact N-O 3.1Å; H270-R292 PolarHBondContact N-O 3.3Å; H270-Y293 WeakPolarHBondContact CA-O 3.42Å; H270-Y293 AromaticContact CE1-CD1 3.69Å; H270-Y293 AromaticContact CE1-CD2 3.26Å; H270-Y293 WeakPolarHBondContact CE1-CD2 3.44Å; H270-Y293 AromaticContact CE1-CE2 3.79Å; H270-Y293 AromaticContact CE1-CG 3.24Å; H270-Y293 PolarHBondContact N-O 3.28Å; H270-Y293 VanDerWaalsContact ND1-CB 3.34Å; H270-Y293 WeakPolarHBondContact ND1-CB 3.02Å; H270-Y293 AromaticContact ND1-CD2 3.91Å; H270-Y293 AromaticContact ND1-CG 3.5Å; H270-Y293 AromaticContact NE2-CD2 3.45Å; H270-Y293 WeakPolarHBondContact NE2-CD2 3.25Å; H270-Y293 AromaticContact NE2-CE2 3.94Å; H270-Y293 AromaticContact NE2-CG 3.88Å
271	N	98.4	Very high	97	Very high	10 Å²	10	34.3 Å²	34.3	5%	0.053	18%	0.18	C	C	.	.	S	Bend	trans	-122.1	-168.5	170.2	-83.6	-73.9	0	0	0	109	V245 N248 Q249 L250 L268 Q269 L273 Y293 N294	V245-N271 PolarHBondContact O-ND2 3.48Å; V245-N271 VanDerWaalsContact O-ND2 3.1Å; N248-N271 WeakPolarHBondContact CA-OD1 3.44Å; N248-N271 WeakPolarHBondContact CB-OD1 3.4Å; N248-N271 PolarHBondContact N-OD1 2.97Å; N248-N271 PolarHBondContact O-OD1 2.95Å; Q249-N271 PolarHBondContact N-OD1 2.89Å; L250-N271 HydrophobicContact CB-CB 4.09Å; L250-N271 WeakPolarHBondContact CB-OD1 3Å; L250-N271 WeakPolarHBondContact CG-OD1 3.21Å; L250-N271 PolarHBondContact N-OD1 3.12Å; L268-N271 PolarHBondContact O-ND2 2.8Å; Q269-N271 PolarHBondContact O-ND2 3.1Å; N271-L273 HydrophobicContact CB-CG 4.13Å; N271-Y293 PolarHBondContact N-O 2.99Å; N271-N294 VanDerWaalsContact CA-OD1 3.27Å; N271-N294 WeakPolarHBondContact CA-OD1 3.18Å; N271-N294 WeakPolarHBondContact CB-OD1 3.37Å; N271-N294 PolarHBondContact N-OD1 2.83Å; N271-N294 PolarHBondContact O-OD1 3.18Å
272	E	97.9	Very high	97.1	Very high	57 Å²	57	34 Å²	34	27%	0.266	18%	0.176	S	C	.	.			trans	-113.1	28.1	177.6	-57	-167.5	-164.5	0	0	111.1	L250 E251 L274 R295	L250-E272 CarbonylContact O-C 3.59Å; L250-E272 VanDerWaalsContact O-CA 3.31Å; L250-E272 WeakPolarHBondContact O-CA 3.32Å; L250-E272 PolarHBondContact O-N 2.97Å; E251-E272 HydrophobicContact CG-CB 4.48Å; E272-L274 PolarHBondContact O-N 3.03Å; E272-R295 VanDerWaalsContact CD-NH2 3.26Å; E272-R295 IonicContact OE1-NH2 2.58Å; E272-R295 IonicContact OE2-CZ 2.7Å; E272-R295 IonicContact OE2-NH1 3.4Å; E272-R295 PolarHBondContact OE2-NH1 3.45Å; E272-R295 IonicContact OE2-NH2 3.28Å; E272-R295 PolarHBondContact OE2-NH2 3.01Å
273	L	98.1	Very high	97.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.156	C	C	.	.			trans	-61.5	126.1	-170.9	-68.3	172	0	0	0	111	L250 E251 L268 N271 L276 N294 R295 L296	L250-L273 HydrophobicContact CB-CD2 3.91Å; L250-L273 HydrophobicContact CB-CG 4.47Å; L250-L273 PolarHBondContact O-N 3.01Å; E251-L273 WeakPolarHBondContact O-CA 3.45Å; L268-L273 HydrophobicContact CB-CD1 3.84Å; L268-L273 HydrophobicContact CD1-CD1 4.27Å; L268-L273 HydrophobicContact CD2-CD1 4.1Å; L268-L273 HydrophobicContact CG-CD1 4.31Å; N271-L273 HydrophobicContact CB-CG 4.13Å; L273-L276 HydrophobicContact CD1-CD2 4.28Å; L273-N294 HydrophobicContact CB-CB 4.16Å; L273-N294 VanDerWaalsContact CB-OD1 3.32Å; L273-N294 WeakPolarHBondContact CB-OD1 3.35Å; L273-N294 WeakPolarHBondContact CG-OD1 3.22Å; L273-N294 PolarHBondContact N-OD1 2.97Å; L273-R295 CarbonylContact O-C 3.6Å; L273-R295 VanDerWaalsContact O-CA 3.26Å; L273-R295 WeakPolarHBondContact O-CA 3.38Å; L273-R295 PolarHBondContact O-N 3.3Å; L273-L296 HydrophobicContact CB-CD2 3.91Å; L273-L296 HydrophobicContact CB-CG 4.49Å; L273-L296 PolarHBondContact O-N 2.97Å
274	L	97.2	Very high	96.8	Very high	73 Å²	73	32.4 Å²	32.4	38%	0.382	18%	0.178	S	C	.	.			trans	-89.4	-32.9	179.2	-61.3	175.4	0	0	0	112.2	E251 E272 R295 S297	E251-L274 PolarHBondContact O-N 3.3Å; E272-L274 PolarHBondContact O-N 3.03Å; L274-R295 HydrophobicContact CD2-CB 3.98Å; L274-S297 PolarHBondContact O-N 2.86Å
275	D	96.3	Very high	96.7	Very high	72 Å²	72	33.1 Å²	33.1	39%	0.385	18%	0.184	S	C	.	.			trans	-151.1	172.9	-178.1	69.2	-34.1	0	0	0	111.9	H252	H252-D275 IonicContact CE1-OD1 2.89Å; H252-D275 PolarHBondContact CE1-OD1 2.96Å; H252-D275 IonicContact CG-OD1 3.41Å; H252-D275 IonicContact ND1-OD1 3.86Å; H252-D275 PolarHBondContact ND1-OD1 3.11Å
276	L	97.2	Very high	96.6	Very high	10 Å²	10	31 Å²	31	5%	0.052	17%	0.173	C	C	.	.			trans	-126.8	140.5	171.1	-65.3	171.4	0	0	0	109.2	L268 L273 L291 L296 I299 P300	L268-L276 HydrophobicContact CD1-CD2 4.38Å; L273-L276 HydrophobicContact CD1-CD2 4.28Å; L276-L291 HydrophobicContact CD1-CD1 3.64Å; L276-L291 HydrophobicContact CD1-CD2 3.76Å; L276-L291 HydrophobicContact CD1-CG 4.37Å; L276-L291 HydrophobicContact CD2-CD2 3.9Å; L276-L291 HydrophobicContact CG-CD2 4.37Å; L276-L296 HydrophobicContact CD1-CD1 4.32Å; L276-L296 HydrophobicContact CG-CD2 3.98Å; L276-I299 HydrophobicContact CD1-CD1 4.14Å; L276-P300 HydrophobicContact CB-CG 3.91Å
277	P	96.9	Very high	96.4	Very high	20 Å²	20	34.2 Å²	34.2	13%	0.13	19%	0.19	C	C	.	.			trans	-69.5	147.8	179.1	29.7	-35.8	0	0	0	111.7	L253 K255 I257 T279 I280	L253-P277 HydrophobicContact CB-CG 4.41Å; L253-P277 HydrophobicContact CD2-CG 4.39Å; K255-P277 HydrophobicContact CB-CB 4.14Å; I257-P277 HydrophobicContact CG2-CG 4.19Å; P277-T279 PolarHBondContact O-N 3.11Å; P277-I280 WeakPolarHBondContact O-CB 3.35Å; P277-I280 WeakPolarHBondContact O-CG2 3.22Å; P277-I280 PolarHBondContact O-N 3.43Å
278	E	96.4	Very high	96.3	Very high	105 Å²	105	40.6 Å²	40.6	49%	0.491	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-63.3	-12.4	175.9	-75.7	-68.5	168.6	0	0	113.8	I280 P300 K301 S302	E278-I280 PolarHBondContact O-N 3.44Å; E278-P300 HydrophobicContact CG-CB 4.17Å; E278-P300 WeakPolarHBondContact OE1-CA 3.39Å; E278-P300 WeakPolarHBondContact OE1-CB 3.24Å; E278-P300 WeakPolarHBondContact OE2-CB 3.12Å; E278-K301 PolarHBondContact OE1-N 3.19Å; E278-K301 VanDerWaalsContact OE1-N 3.12Å; E278-K301 PolarHBondContact OE2-N 3.27Å; E278-S302 WeakPolarHBondContact CA-OG 3.45Å; E278-S302 WeakPolarHBondContact O-CB 3.33Å; E278-S302 PolarHBondContact O-OG 2.96Å; E278-S302 WeakPolarHBondContact OE2-CB 3.5Å; E278-S302 PolarHBondContact OE2-N 3.02Å; E278-S302 PolarHBondContact OE2-OG 3.04Å
279	T	96.9	Very high	96.2	Very high	38 Å²	38	40.9 Å²	40.9	23%	0.233	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-75.5	-11.9	174	53.2	0	0	0	0	112.7	K255 G258 P277 G281 N282	K255-T279 WeakPolarHBondContact CA-OG1 3.25Å; K255-T279 HydrophobicContact CB-CG2 4.2Å; K255-T279 WeakPolarHBondContact O-CB 3.48Å; K255-T279 WeakPolarHBondContact O-CG2 3.15Å; K255-T279 PolarHBondContact O-OG1 3.01Å; G258-T279 WeakPolarHBondContact CA-O 3.49Å; P277-T279 PolarHBondContact O-N 3.11Å; T279-G281 PolarHBondContact O-N 2.86Å; T279-N282 VanDerWaalsContact O-CB 3.3Å; T279-N282 WeakPolarHBondContact O-CB 3.13Å; T279-N282 PolarHBondContact O-N 3.13Å
280	I	96.2	Very high	96.1	Very high	1 Å²	1	41 Å²	41	1%	0.005	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-58.5	-31.4	176.3	-158.8	71.5	0	0	0	111.8	L253 I257 L266 P277 E278 N282 L283 P300 L303	L253-I280 HydrophobicContact CD2-CD1 4.18Å; I257-I280 HydrophobicContact CG2-CD1 4.44Å; L266-I280 HydrophobicContact CD2-CD1 3.76Å; P277-I280 WeakPolarHBondContact O-CB 3.35Å; P277-I280 WeakPolarHBondContact O-CG2 3.22Å; P277-I280 PolarHBondContact O-N 3.43Å; E278-I280 PolarHBondContact O-N 3.44Å; I280-N282 PolarHBondContact O-N 2.86Å; I280-N282 VanDerWaalsContact O-N 3.13Å; I280-L283 HydrophobicContact CD1-CD1 3.65Å; I280-L283 HydrophobicContact CG1-CD1 4.39Å; I280-L283 WeakPolarHBondContact O-CB 3.36Å; I280-L283 WeakPolarHBondContact O-CG 3.27Å; I280-L283 PolarHBondContact O-N 3.49Å; I280-L283 VanDerWaalsContact O-N 3.11Å; I280-P300 HydrophobicContact CG2-CG 3.55Å; I280-L303 HydrophobicContact CG2-CD1 4.25Å
281	G	94.9	Very high	96.1	Very high	2 Å²	2	38.2 Å²	38.2	2%	0.021	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-67	-7.9	175.9	0	0	0	0	0	115.1	T279 L283 S302 K305	T279-G281 PolarHBondContact O-N 2.86Å; G281-L283 VanDerWaalsContact C-N 3.29Å; G281-S302 WeakPolarHBondContact CA-O 3.45Å; G281-K305 WeakPolarHBondContact O-CB 3.47Å
282	N	96.4	Very high	96.1	Very high	68 Å²	68	41.7 Å²	41.7	36%	0.364	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-79.6	-14.3	173	-65.8	-10.8	0	0	0	112.4	G258 T279 I280 A284	G258-N282 VanDerWaalsContact O-CB 3.26Å; G258-N282 WeakPolarHBondContact O-CB 3.49Å; T279-N282 VanDerWaalsContact O-CB 3.3Å; T279-N282 WeakPolarHBondContact O-CB 3.13Å; T279-N282 PolarHBondContact O-N 3.13Å; I280-N282 PolarHBondContact O-N 2.86Å; I280-N282 VanDerWaalsContact O-N 3.13Å; N282-A284 PolarHBondContact O-N 2.95Å
283	L	95.6	Very high	96.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.22	C	C	.	.			trans	-77.2	62	177.1	-55.1	-174.4	0	0	0	110.7	C260 I263 L266 I280 G281 S285 I286	C260-L283 WeakPolarHBondContact O-CD2 3.19Å; I263-L283 HydrophobicContact CB-CD2 4.45Å; I263-L283 HydrophobicContact CG2-CD1 4.49Å; L266-L283 HydrophobicContact CD2-CD1 4.04Å; I280-L283 HydrophobicContact CD1-CD1 3.65Å; I280-L283 HydrophobicContact CG1-CD1 4.39Å; I280-L283 WeakPolarHBondContact O-CB 3.36Å; I280-L283 WeakPolarHBondContact O-CG 3.27Å; I280-L283 PolarHBondContact O-N 3.49Å; I280-L283 VanDerWaalsContact O-N 3.11Å; G281-L283 VanDerWaalsContact C-N 3.29Å; L283-S285 PolarHBondContact O-N 2.9Å; L283-S285 VanDerWaalsContact O-N 3.13Å; L283-I286 HydrophobicContact CB-CB 4.24Å; L283-I286 HydrophobicContact CB-CG2 4.42Å; L283-I286 HydrophobicContact CD1-CD1 4.38Å; L283-I286 WeakPolarHBondContact O-CB 3.47Å; L283-I286 WeakPolarHBondContact O-CG2 3.34Å; L283-I286 PolarHBondContact O-N 2.79Å; L283-I286 VanDerWaalsContact O-N 3.08Å
284	A	91.9	Very high	96.1	Very high	55 Å²	55	43 Å²	43	46%	0.455	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.4	-171.4	0	0	0	0	0	114	N282	N282-A284 PolarHBondContact O-N 2.95Å
285	S	94.2	Very high	96.1	Very high	60 Å²	60	45.3 Å²	45.3	42%	0.42	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	8.9	178.6	-58.9	0	0	0	0	114.1	I263 T264 L283 N287	I263-S285 CarbonylContact O-C 3.59Å; T264-S285 WeakPolarHBondContact CA-O 3.18Å; L283-S285 PolarHBondContact O-N 2.9Å; L283-S285 VanDerWaalsContact O-N 3.13Å; S285-N287 PolarHBondContact O-N 3.01Å; S285-N287 PolarHBondContact O-OD1 3.4Å
286	I	95.4	Very high	96.2	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.207	C	C	.	.			trans	-73.6	122	-178.5	-161.7	168.6	0	0	0	111.3	I263 L266 L283 L289 C306 E308 L309	I263-I286 PolarHBondContact O-N 3.13Å; L266-I286 HydrophobicContact CB-CD1 3.79Å; L283-I286 HydrophobicContact CB-CB 4.24Å; L283-I286 HydrophobicContact CB-CG2 4.42Å; L283-I286 HydrophobicContact CD1-CD1 4.38Å; L283-I286 WeakPolarHBondContact O-CB 3.47Å; L283-I286 WeakPolarHBondContact O-CG2 3.34Å; L283-I286 PolarHBondContact O-N 2.79Å; L283-I286 VanDerWaalsContact O-N 3.08Å; I286-L289 HydrophobicContact CD1-CB 3.79Å; I286-L289 HydrophobicContact CD1-CD1 3.87Å; I286-L289 HydrophobicContact CD1-CG 4.24Å; I286-L289 HydrophobicContact CG1-CB 4.42Å; I286-C306 HydrophobicContact CG2-CB 3.6Å; I286-E308 CarbonylContact O-C 3.55Å; I286-L309 PolarHBondContact O-N 3.25Å
287	N	93.8	Very high	96.2	Very high	67 Å²	67	44.8 Å²	44.8	36%	0.358	23%	0.229	S	C	.	.	S	Bend	trans	-101.8	-32.6	176.9	-62.5	1.3	0	0	0	110.8	T264 S285 E308	T264-N287 PolarHBondContact O-N 3.17Å; S285-N287 PolarHBondContact O-N 3.01Å; S285-N287 PolarHBondContact O-OD1 3.4Å; N287-E308 WeakPolarHBondContact OD1-CB 3.46Å
288	R	94.3	Very high	96.1	Very high	145 Å²	145	46.4 Å²	46.4	55%	0.547	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	117.7	-178	-174.3	173.5	-179.2	157	4.9	111	T264 N265 L266	T264-R288 PolarHBondContact O-N 3.11Å; T264-R288 VanDerWaalsContact O-N 3.12Å; N265-R288 WeakPolarHBondContact CA-O 3.4Å; N265-R288 WeakPolarHBondContact OD1-CD 3.45Å; L266-R288 PolarHBondContact N-O 2.87Å
289	L	96.4	Very high	96.1	Very high	6 Å²	6	41.8 Å²	41.8	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	102.8	176.1	179.7	56.2	0	0	0	109.6	L266 L268 I286 L291 L303 L309	L266-L289 HydrophobicContact CB-CD1 4.12Å; L266-L289 HydrophobicContact CD2-CD1 3.94Å; L266-L289 HydrophobicContact CG-CD1 4.11Å; L266-L289 WeakPolarHBondContact O-CA 3.07Å; L268-L289 HydrophobicContact CD1-CD1 4.43Å; I286-L289 HydrophobicContact CD1-CB 3.79Å; I286-L289 HydrophobicContact CD1-CD1 3.87Å; I286-L289 HydrophobicContact CD1-CG 4.24Å; I286-L289 HydrophobicContact CG1-CB 4.42Å; L289-L291 HydrophobicContact CD1-CD1 4.38Å; L289-L291 HydrophobicContact CD1-CD2 4.27Å; L289-L291 HydrophobicContact CD1-CG 4.15Å; L289-L291 HydrophobicContact CD2-CD1 3.75Å; L289-L291 HydrophobicContact CD2-CG 4.38Å; L289-L291 HydrophobicContact CG-CD1 3.76Å; L289-L291 HydrophobicContact CG-CD2 4.49Å; L289-L291 HydrophobicContact CG-CG 3.86Å; L289-L291 PolarHBondContact O-N 3.08Å; L289-L303 HydrophobicContact CD2-CD1 3.64Å; L289-L303 HydrophobicContact CD2-CD2 4.48Å; L289-L309 HydrophobicContact CB-CD1 3.97Å
290	G	96.3	Very high	96	Very high	12 Å²	12	40.3 Å²	40.3	12%	0.124	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	107.7	-179.4	0	0	0	0	0	111.8	L266 L268 Q269	L266-G290 PolarHBondContact O-N 3.2Å; L268-G290 CarbonylContact C-O 3.48Å; L268-G290 VanDerWaalsContact C-O 3.25Å; L268-G290 VanDerWaalsContact CA-O 3.25Å; L268-G290 WeakPolarHBondContact CA-O 3.4Å; L268-G290 VanDerWaalsContact CB-O 3.27Å; L268-G290 WeakPolarHBondContact CB-O 3.4Å; L268-G290 PolarHBondContact N-O 3.34Å; Q269-G290 PolarHBondContact N-O 3.23Å; Q269-G290 VanDerWaalsContact N-O 3.14Å
291	L	97.5	Very high	96	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.244	C	C	.	.			trans	-123.8	-0.6	-177.9	-68.8	170.7	0	0	0	114.4	L268 L276 L289 N294 L296 I299 L314 N317	L268-L291 HydrophobicContact CB-CD2 4.21Å; L268-L291 HydrophobicContact CD1-CD2 4.01Å; L276-L291 HydrophobicContact CD1-CD1 3.64Å; L276-L291 HydrophobicContact CD1-CD2 3.76Å; L276-L291 HydrophobicContact CD1-CG 4.37Å; L276-L291 HydrophobicContact CD2-CD2 3.9Å; L276-L291 HydrophobicContact CG-CD2 4.37Å; L289-L291 HydrophobicContact CD1-CD1 4.38Å; L289-L291 HydrophobicContact CD1-CD2 4.27Å; L289-L291 HydrophobicContact CD1-CG 4.15Å; L289-L291 HydrophobicContact CD2-CD1 3.75Å; L289-L291 HydrophobicContact CD2-CG 4.38Å; L289-L291 HydrophobicContact CG-CD1 3.76Å; L289-L291 HydrophobicContact CG-CD2 4.49Å; L289-L291 HydrophobicContact CG-CG 3.86Å; L289-L291 PolarHBondContact O-N 3.08Å; L291-N294 PolarHBondContact O-ND2 3.24Å; L291-L296 HydrophobicContact CB-CD1 4.17Å; L291-L296 HydrophobicContact CD1-CD1 4.43Å; L291-L296 HydrophobicContact CD2-CD1 4.18Å; L291-L296 HydrophobicContact CG-CD1 4.49Å; L291-I299 HydrophobicContact CD1-CD1 4.43Å; L291-L314 HydrophobicContact CB-CD2 3.82Å; L291-L314 HydrophobicContact CD1-CD2 3.59Å; L291-L314 HydrophobicContact CG-CD2 4.38Å; L291-N317 PolarHBondContact O-ND2 3Å
292	R	97.6	Very high	96.1	Very high	83 Å²	83	48 Å²	48	31%	0.313	25%	0.247	S	C	.	.			trans	-60.9	152.4	-179.4	63	171	-170.1	174.1	0.2	113	Q269 H270 N294 E315	Q269-R292 CarbonylContact C-O 3.14Å; Q269-R292 VanDerWaalsContact CA-O 3.25Å; Q269-R292 WeakPolarHBondContact CA-O 3.38Å; Q269-R292 HydrophobicContact CB-CG 3.71Å; H270-R292 PolarHBondContact N-O 3.3Å; R292-N294 PolarHBondContact O-ND2 2.94Å; R292-E315 CarbonylContact C-O 3.27Å; R292-E315 VanDerWaalsContact CA-O 3.23Å; R292-E315 WeakPolarHBondContact CA-O 3.49Å; R292-E315 HydrophobicContact CB-CB 4.17Å
293	Y	98.1	Very high	96.1	Very high	75 Å²	75	44.7 Å²	44.7	29%	0.294	23%	0.23	S	C	.	.	S	Bend	trans	55.5	58	-179.8	-60.4	-91.9	0	0	0	112	H270 N271 E315 N316	H270-Y293 WeakPolarHBondContact CA-O 3.42Å; H270-Y293 AromaticContact CE1-CD1 3.69Å; H270-Y293 AromaticContact CE1-CD2 3.26Å; H270-Y293 WeakPolarHBondContact CE1-CD2 3.44Å; H270-Y293 AromaticContact CE1-CE2 3.79Å; H270-Y293 AromaticContact CE1-CG 3.24Å; H270-Y293 PolarHBondContact N-O 3.28Å; H270-Y293 VanDerWaalsContact ND1-CB 3.34Å; H270-Y293 WeakPolarHBondContact ND1-CB 3.02Å; H270-Y293 AromaticContact ND1-CD2 3.91Å; H270-Y293 AromaticContact ND1-CG 3.5Å; H270-Y293 AromaticContact NE2-CD2 3.45Å; H270-Y293 WeakPolarHBondContact NE2-CD2 3.25Å; H270-Y293 AromaticContact NE2-CE2 3.94Å; H270-Y293 AromaticContact NE2-CG 3.88Å; N271-Y293 PolarHBondContact N-O 2.99Å; Y293-E315 PolarHBondContact N-O 3.02Å; Y293-N316 WeakPolarHBondContact CA-O 3.32Å; Y293-N316 HydrophobicContact CD1-CB 3.9Å; Y293-N316 WeakPolarHBondContact CD1-ND2 3.48Å; Y293-N316 HydrophobicContact CE1-CB 3.99Å; Y293-N316 VanDerWaalsContact CE1-ND2 3.3Å; Y293-N316 WeakPolarHBondContact CE1-ND2 3.35Å; Y293-N316 HydrophobicContact CG-CB 4.27Å; Y293-N316 PolarHBondContact N-O 3.23Å
294	N	98.4	Very high	96	Very high	10 Å²	10	45.7 Å²	45.7	5%	0.053	24%	0.238	C	C	.	.	S	Bend	trans	-126.5	-167.6	172	-84.7	-72.4	0	0	0	109.3	L268 N271 L273 L291 R292 L296 N316 N317	L268-N294 PolarHBondContact O-ND2 2.93Å; N271-N294 VanDerWaalsContact CA-OD1 3.27Å; N271-N294 WeakPolarHBondContact CA-OD1 3.18Å; N271-N294 WeakPolarHBondContact CB-OD1 3.37Å; N271-N294 PolarHBondContact N-OD1 2.83Å; N271-N294 PolarHBondContact O-OD1 3.18Å; L273-N294 HydrophobicContact CB-CB 4.16Å; L273-N294 VanDerWaalsContact CB-OD1 3.32Å; L273-N294 WeakPolarHBondContact CB-OD1 3.35Å; L273-N294 WeakPolarHBondContact CG-OD1 3.22Å; L273-N294 PolarHBondContact N-OD1 2.97Å; L291-N294 PolarHBondContact O-ND2 3.24Å; R292-N294 PolarHBondContact O-ND2 2.94Å; N294-L296 HydrophobicContact CB-CD1 4.46Å; N294-L296 HydrophobicContact CB-CG 4.1Å; N294-N316 PolarHBondContact N-O 3.29Å; N294-N316 VanDerWaalsContact O-O 3.11Å; N294-N317 WeakPolarHBondContact CA-OD1 3.42Å; N294-N317 WeakPolarHBondContact CB-OD1 3.45Å; N294-N317 PolarHBondContact O-OD1 3.09Å
295	R	98	Very high	96.2	Very high	122 Å²	122	49 Å²	49	46%	0.46	24%	0.242	S	C	.	.			trans	-118.9	30.2	177	-62.5	-176.4	-174.5	148.7	11.1	111.3	E272 L273 L274 S297 N317 N318	E272-R295 VanDerWaalsContact CD-NH2 3.26Å; E272-R295 IonicContact OE1-NH2 2.58Å; E272-R295 IonicContact OE2-CZ 2.7Å; E272-R295 IonicContact OE2-NH1 3.4Å; E272-R295 PolarHBondContact OE2-NH1 3.45Å; E272-R295 IonicContact OE2-NH2 3.28Å; E272-R295 PolarHBondContact OE2-NH2 3.01Å; L273-R295 CarbonylContact O-C 3.6Å; L273-R295 VanDerWaalsContact O-CA 3.26Å; L273-R295 WeakPolarHBondContact O-CA 3.38Å; L273-R295 PolarHBondContact O-N 3.3Å; L274-R295 HydrophobicContact CD2-CB 3.98Å; R295-S297 PolarHBondContact O-N 2.89Å; R295-N317 PolarHBondContact N-OD1 3.15Å; R295-N318 WeakPolarHBondContact CA-OD1 3.46Å
296	L	98.1	Very high	96.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.222	C	C	.	.			trans	-64.2	127.1	-173.8	-64.6	170.6	0	0	0	109.7	L273 L276 L291 N294 I299 N317 N318 I319	L273-L296 HydrophobicContact CB-CD2 3.91Å; L273-L296 HydrophobicContact CB-CG 4.49Å; L273-L296 PolarHBondContact O-N 2.97Å; L276-L296 HydrophobicContact CD1-CD1 4.32Å; L276-L296 HydrophobicContact CG-CD2 3.98Å; L291-L296 HydrophobicContact CB-CD1 4.17Å; L291-L296 HydrophobicContact CD1-CD1 4.43Å; L291-L296 HydrophobicContact CD2-CD1 4.18Å; L291-L296 HydrophobicContact CG-CD1 4.49Å; N294-L296 HydrophobicContact CB-CD1 4.46Å; N294-L296 HydrophobicContact CB-CG 4.1Å; L296-I299 HydrophobicContact CD1-CD1 3.98Å; L296-N317 HydrophobicContact CB-CB 4.26Å; L296-N317 VanDerWaalsContact CB-OD1 3.26Å; L296-N317 WeakPolarHBondContact CB-OD1 3.18Å; L296-N317 WeakPolarHBondContact CG-OD1 3.08Å; L296-N317 PolarHBondContact N-OD1 3.21Å; L296-N318 CarbonylContact O-C 3.02Å; L296-N318 VanDerWaalsContact O-CA 3.25Å; L296-N318 WeakPolarHBondContact O-CA 3.14Å; L296-N318 PolarHBondContact O-N 2.95Å; L296-I319 HydrophobicContact CB-CD1 4.37Å; L296-I319 HydrophobicContact CB-CG1 4.23Å; L296-I319 VanDerWaalsContact O-CG1 3.31Å; L296-I319 WeakPolarHBondContact O-CG1 3.32Å; L296-I319 PolarHBondContact O-N 3.18Å
297	S	96.3	Very high	96.1	Very high	71 Å²	71	53.6 Å²	53.6	50%	0.497	25%	0.25	S	S	.	.	S	Bend	trans	-91.7	-26.2	175.3	58.9	0	0	0	0	112.8	L274 R295	L274-S297 PolarHBondContact O-N 2.86Å; R295-S297 PolarHBondContact O-N 2.89Å
298	A	95.5	Very high	96.2	Very high	53 Å²	53	54.7 Å²	54.7	44%	0.438	25%	0.253	S	S	.	.			trans	-152	164.7	-179.6	0	0	0	0	0	111
299	I	96.2	Very high	96.2	Very high	8 Å²	8	47.8 Å²	47.8	4%	0.041	23%	0.227	C	C	.	.			trans	-116.3	136.1	173.9	-61.8	-62.8	0	0	0	108.5	L276 L291 L296 L303 L314 I319 L322 P323 L326	L276-I299 HydrophobicContact CD1-CD1 4.14Å; L291-I299 HydrophobicContact CD1-CD1 4.43Å; L296-I299 HydrophobicContact CD1-CD1 3.98Å; I299-L303 HydrophobicContact CG2-CB 4.17Å; I299-L303 HydrophobicContact CG2-CD2 3.46Å; I299-L303 VanDerWaalsContact CG2-CD2 3.46Å; I299-L303 HydrophobicContact CG2-CG 4.45Å; I299-L314 HydrophobicContact CD1-CD1 4.21Å; I299-L314 HydrophobicContact CD1-CD2 3.77Å; I299-L314 HydrophobicContact CG1-CD1 3.92Å; I299-L314 HydrophobicContact CG1-CD2 4.41Å; I299-I319 HydrophobicContact CD1-CD1 3.96Å; I299-I319 HydrophobicContact CG1-CD1 3.85Å; I299-L322 HydrophobicContact CG1-CD2 4.32Å; I299-P323 WeakPolarHBondContact O-CG 3.3Å; I299-L326 HydrophobicContact CG2-CD2 4.07Å
300	P	96	Very high	96.1	Very high	8 Å²	8	52.9 Å²	52.9	5%	0.052	25%	0.251	C	S	.	.			trans	-65.3	145.4	-179.7	25.3	-35.2	0	0	0	112	L276 E278 I280 S302 L303	L276-P300 HydrophobicContact CB-CG 3.91Å; E278-P300 HydrophobicContact CG-CB 4.17Å; E278-P300 WeakPolarHBondContact OE1-CA 3.39Å; E278-P300 WeakPolarHBondContact OE1-CB 3.24Å; E278-P300 WeakPolarHBondContact OE2-CB 3.12Å; I280-P300 HydrophobicContact CG2-CG 3.55Å; P300-S302 PolarHBondContact O-N 2.85Å; P300-L303 WeakPolarHBondContact O-CB 3.13Å; P300-L303 PolarHBondContact O-N 3.17Å
301	K	95.2	Very high	96.1	Very high	152 Å²	152	56.6 Å²	56.6	66%	0.661	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-67	-30.7	-176.8	-52.5	-163.2	176.8	176.7	0	111.8	E278 L303 A304 P323	E278-K301 PolarHBondContact OE1-N 3.19Å; E278-K301 VanDerWaalsContact OE1-N 3.12Å; E278-K301 PolarHBondContact OE2-N 3.27Å; K301-L303 PolarHBondContact O-N 3.49Å; K301-L303 VanDerWaalsContact O-N 3.17Å; K301-A304 WeakPolarHBondContact O-CB 3.37Å; K301-A304 PolarHBondContact O-N 2.92Å; K301-P323 HydrophobicContact CB-CB 4.31Å; K301-P323 HydrophobicContact CG-CB 3.93Å; K301-P323 HydrophobicContact CG-CG 4.19Å
302	S	96.3	Very high	96	Very high	11 Å²	11	56.6 Å²	56.6	8%	0.077	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-57.6	-22.2	176.4	54.5	0	0	0	0	114.4	E278 G281 P300 A304 K305	E278-S302 WeakPolarHBondContact CA-OG 3.45Å; E278-S302 WeakPolarHBondContact O-CB 3.33Å; E278-S302 PolarHBondContact O-OG 2.96Å; E278-S302 WeakPolarHBondContact OE2-CB 3.5Å; E278-S302 PolarHBondContact OE2-N 3.02Å; E278-S302 PolarHBondContact OE2-OG 3.04Å; G281-S302 WeakPolarHBondContact CA-O 3.45Å; P300-S302 PolarHBondContact O-N 2.85Å; S302-A304 PolarHBondContact O-N 3.43Å; S302-K305 WeakPolarHBondContact O-CB 3.46Å; S302-K305 WeakPolarHBondContact O-CG 3.45Å; S302-K305 PolarHBondContact O-N 3.08Å
303	L	96.3	Very high	96	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-57.5	-23	177.2	-169.8	68.5	0	0	0	112.2	I280 L289 I299 P300 K301 K305 C306 L312 L326	I280-L303 HydrophobicContact CG2-CD1 4.25Å; L289-L303 HydrophobicContact CD2-CD1 3.64Å; L289-L303 HydrophobicContact CD2-CD2 4.48Å; I299-L303 HydrophobicContact CG2-CB 4.17Å; I299-L303 HydrophobicContact CG2-CD2 3.46Å; I299-L303 VanDerWaalsContact CG2-CD2 3.46Å; I299-L303 HydrophobicContact CG2-CG 4.45Å; P300-L303 WeakPolarHBondContact O-CB 3.13Å; P300-L303 PolarHBondContact O-N 3.17Å; K301-L303 PolarHBondContact O-N 3.49Å; K301-L303 VanDerWaalsContact O-N 3.17Å; L303-K305 PolarHBondContact O-N 3.34Å; L303-C306 HydrophobicContact CD1-CB 4.37Å; L303-C306 WeakPolarHBondContact O-CB 3.46Å; L303-C306 PolarHBondContact O-N 3.35Å; L303-L312 HydrophobicContact CD2-CD1 4.43Å; L303-L326 HydrophobicContact CB-CD1 3.84Å; L303-L326 HydrophobicContact CD2-CD1 4.38Å; L303-L326 HydrophobicContact CG-CD1 4.2Å
304	A	94.5	Very high	96	Very high	21 Å²	21	50.3 Å²	50.3	17%	0.174	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-58	-16.5	172.8	0	0	0	0	0	114.5	K301 S302 L326 S329	K301-A304 WeakPolarHBondContact O-CB 3.37Å; K301-A304 PolarHBondContact O-N 2.92Å; S302-A304 PolarHBondContact O-N 3.43Å; A304-L326 HydrophobicContact CB-CD1 3.98Å; A304-L326 VanDerWaalsContact N-CD1 3.28Å; A304-S329 WeakPolarHBondContact O-CB 3.17Å
305	K	95.1	Very high	96	Very high	125 Å²	125	51.2 Å²	51.2	54%	0.543	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-80.4	-16.5	176	-64.7	177.5	-178.6	177.8	0	113.5	G281 S302 L303 R307	G281-K305 WeakPolarHBondContact O-CB 3.47Å; S302-K305 WeakPolarHBondContact O-CB 3.46Å; S302-K305 WeakPolarHBondContact O-CG 3.45Å; S302-K305 PolarHBondContact O-N 3.08Å; L303-K305 PolarHBondContact O-N 3.34Å; K305-R307 VanDerWaalsContact C-N 3.28Å; K305-R307 PolarHBondContact O-N 3.25Å
306	C	95.1	Very high	96	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.241	C	C	.	.			trans	-81.1	70	-177.6	-62	0	0	0	0	110.9	I286 L303 E308 L309 L330	I286-C306 HydrophobicContact CG2-CB 3.6Å; L303-C306 HydrophobicContact CD1-CB 4.37Å; L303-C306 WeakPolarHBondContact O-CB 3.46Å; L303-C306 PolarHBondContact O-N 3.35Å; C306-E308 VanDerWaalsContact C-N 3.3Å; C306-E308 PolarHBondContact O-N 3.32Å; C306-L309 WeakPolarHBondContact O-CB 3.4Å; C306-L309 PolarHBondContact O-N 3.32Å; C306-L330 WeakPolarHBondContact O-CD2 3.36Å
307	R	93.4	Very high	96	Very high	156 Å²	156	48.8 Å²	48.8	59%	0.589	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-19.8	-168.5	-66.7	-178.7	178.6	166.2	-0.2	115	K305 L309	K305-R307 VanDerWaalsContact C-N 3.28Å; K305-R307 PolarHBondContact O-N 3.25Å; R307-L309 PolarHBondContact O-N 3.01Å
308	E	95.1	Very high	96.1	Very high	91 Å²	91	49.5 Å²	49.5	43%	0.425	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	2.1	178.6	-57.9	-56.2	143.5	0	0	113.3	I286 N287 C306 E310 N332	I286-E308 CarbonylContact O-C 3.55Å; N287-E308 WeakPolarHBondContact OD1-CB 3.46Å; C306-E308 VanDerWaalsContact C-N 3.3Å; C306-E308 PolarHBondContact O-N 3.32Å; E308-E310 PolarHBondContact O-N 3.34Å; E308-N332 PolarHBondContact OE2-ND2 2.87Å
309	L	95.4	Very high	96.2	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.22	C	C	.	.			trans	-69.6	115.2	-179.1	-166.4	74.7	0	0	0	111.1	I286 L289 C306 R307 L312 L330 N332 L333	I286-L309 PolarHBondContact O-N 3.25Å; L289-L309 HydrophobicContact CB-CD1 3.97Å; C306-L309 WeakPolarHBondContact O-CB 3.4Å; C306-L309 PolarHBondContact O-N 3.32Å; R307-L309 PolarHBondContact O-N 3.01Å; L309-L312 HydrophobicContact CD2-CB 3.87Å; L309-L312 HydrophobicContact CD2-CD1 4.05Å; L309-L312 HydrophobicContact CD2-CG 4.37Å; L309-L330 HydrophobicContact CB-CD2 4.46Å; L309-L330 HydrophobicContact CD2-CD1 4.29Å; L309-N332 CarbonylContact O-C 3.4Å; L309-L333 WeakPolarHBondContact O-CA 3.26Å; L309-L333 PolarHBondContact O-N 3.03Å
310	E	94.3	Very high	96.2	Very high	113 Å²	113	49.2 Å²	49.2	53%	0.528	24%	0.237	S	C	.	.			trans	-88.8	-33.2	-179.7	-65.5	-179.8	-178.8	0	0	112.8	E308 T334 S335	E308-E310 PolarHBondContact O-N 3.34Å; E310-T334 PolarHBondContact O-N 2.87Å; E310-T334 PolarHBondContact O-OG1 3.14Å; E310-S335 PolarHBondContact O-N 3.47Å
311	E	95.6	Very high	96.2	Very high	90 Å²	90	53 Å²	53	42%	0.421	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	129.8	-179.3	-177.8	-176.4	163.5	0	0	110.6	S335	E311-S335 WeakPolarHBondContact CA-O 3.26Å
312	L	96.5	Very high	96.2	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	106.1	171.5	-179.6	57.8	0	0	0	109.4	L303 L309 L314 L327 L330 L333 S335 L336 T337	L303-L312 HydrophobicContact CD2-CD1 4.43Å; L309-L312 HydrophobicContact CD2-CB 3.87Å; L309-L312 HydrophobicContact CD2-CD1 4.05Å; L309-L312 HydrophobicContact CD2-CG 4.37Å; L312-L314 HydrophobicContact CD1-CD1 4.32Å; L312-L314 HydrophobicContact CD1-CD2 3.97Å; L312-L314 HydrophobicContact CD1-CG 3.97Å; L312-L314 HydrophobicContact CD2-CD1 4.26Å; L312-L314 HydrophobicContact CG-CD1 4.24Å; L312-L314 HydrophobicContact CG-CG 4.11Å; L312-L327 HydrophobicContact CD2-CD2 4.39Å; L312-L330 HydrophobicContact CD2-CD1 4.29Å; L312-L333 HydrophobicContact CB-CD1 3.72Å; L312-L333 HydrophobicContact CB-CD2 4.45Å; L312-S335 PolarHBondContact N-O 3.27Å; L312-L336 HydrophobicContact CB-CD1 4.02Å; L312-L336 HydrophobicContact CD2-CD1 4.03Å; L312-L336 HydrophobicContact CG-CD1 4.09Å; L312-T337 PolarHBondContact O-N 3.34Å
313	N	97.4	Very high	96.1	Very high	25 Å²	25	46.1 Å²	46.1	13%	0.134	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	110	177.6	-170.7	-21.6	0	0	0	110.9	E315	N313-E315 WeakPolarHBondContact OD1-CB 3.4Å; N313-E315 PolarHBondContact OD1-N 3.02Å
314	L	97.8	Very high	95.9	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.267	C	S	.	.			trans	-111.2	19.8	179	-60.9	176.4	0	0	0	111.9	L291 I299 L312 N317 I319 L322 T337 L338 N341	L291-L314 HydrophobicContact CB-CD2 3.82Å; L291-L314 HydrophobicContact CD1-CD2 3.59Å; L291-L314 HydrophobicContact CG-CD2 4.38Å; I299-L314 HydrophobicContact CD1-CD1 4.21Å; I299-L314 HydrophobicContact CD1-CD2 3.77Å; I299-L314 HydrophobicContact CG1-CD1 3.92Å; I299-L314 HydrophobicContact CG1-CD2 4.41Å; L312-L314 HydrophobicContact CD1-CD1 4.32Å; L312-L314 HydrophobicContact CD1-CD2 3.97Å; L312-L314 HydrophobicContact CD1-CG 3.97Å; L312-L314 HydrophobicContact CD2-CD1 4.26Å; L312-L314 HydrophobicContact CG-CD1 4.24Å; L312-L314 HydrophobicContact CG-CG 4.11Å; L314-N317 PolarHBondContact O-ND2 2.87Å; L314-I319 HydrophobicContact CB-CD1 3.98Å; L314-I319 HydrophobicContact CD1-CD1 3.85Å; L314-I319 HydrophobicContact CD2-CD1 4.32Å; L314-I319 HydrophobicContact CG-CD1 4.27Å; L314-L322 HydrophobicContact CD1-CD2 4.04Å; L314-T337 PolarHBondContact N-O 3.28Å; L314-L338 HydrophobicContact CB-CD2 4.12Å; L314-L338 HydrophobicContact CD1-CD2 3.75Å; L314-L338 HydrophobicContact CG-CD2 4.32Å; L314-N341 PolarHBondContact O-ND2 3.48Å
315	E	98.1	Very high	95.7	Very high	30 Å²	30	54 Å²	54	14%	0.14	27%	0.269	C	S	.	.			trans	-53.5	140.3	-176.6	-177.4	-177.3	-179.5	0	0	112.4	R292 Y293 N313 N317 T337 A339 R340	R292-E315 CarbonylContact C-O 3.27Å; R292-E315 VanDerWaalsContact CA-O 3.23Å; R292-E315 WeakPolarHBondContact CA-O 3.49Å; R292-E315 HydrophobicContact CB-CB 4.17Å; Y293-E315 PolarHBondContact N-O 3.02Å; N313-E315 WeakPolarHBondContact OD1-CB 3.4Å; N313-E315 PolarHBondContact OD1-N 3.02Å; E315-N317 PolarHBondContact O-ND2 3.45Å; E315-T337 HydrophobicContact CB-CG2 4.03Å; E315-A339 VanDerWaalsContact CA-O 3.28Å; E315-A339 WeakPolarHBondContact CA-O 3.3Å; E315-A339 HydrophobicContact CG-CB 4.13Å; E315-R340 HydrophobicContact CG-CB 4.47Å; E315-R340 IonicContact OE1-NE 2.7Å
316	N	98.3	Very high	95.7	Very high	65 Å²	65	48.2 Å²	48.2	35%	0.348	24%	0.243	S	C	.	.	S	Bend	trans	57	64	173.5	-160.8	34.3	0	0	0	112.2	Y293 N294 A339 R340	Y293-N316 WeakPolarHBondContact CA-O 3.32Å; Y293-N316 HydrophobicContact CD1-CB 3.9Å; Y293-N316 WeakPolarHBondContact CD1-ND2 3.48Å; Y293-N316 HydrophobicContact CE1-CB 3.99Å; Y293-N316 VanDerWaalsContact CE1-ND2 3.3Å; Y293-N316 WeakPolarHBondContact CE1-ND2 3.35Å; Y293-N316 HydrophobicContact CG-CB 4.27Å; Y293-N316 PolarHBondContact N-O 3.23Å; N294-N316 PolarHBondContact N-O 3.29Å; N294-N316 VanDerWaalsContact O-O 3.11Å; N316-A339 PolarHBondContact N-O 3.11Å; N316-A339 VanDerWaalsContact N-O 3.07Å; N316-R340 WeakPolarHBondContact CA-O 3.33Å; N316-R340 HydrophobicContact CB-CB 4.1Å; N316-R340 PolarHBondContact N-O 3.24Å
317	N	98.4	Very high	95.7	Very high	5 Å²	5	48.5 Å²	48.5	3%	0.027	25%	0.245	C	C	.	.	S	Bend	trans	-132.6	-173.9	173.5	-83.8	-78.6	0	0	0	109.2	L291 N294 R295 L296 L314 E315 I319 R340 N341	L291-N317 PolarHBondContact O-ND2 3Å; N294-N317 WeakPolarHBondContact CA-OD1 3.42Å; N294-N317 WeakPolarHBondContact CB-OD1 3.45Å; N294-N317 PolarHBondContact O-OD1 3.09Å; R295-N317 PolarHBondContact N-OD1 3.15Å; L296-N317 HydrophobicContact CB-CB 4.26Å; L296-N317 VanDerWaalsContact CB-OD1 3.26Å; L296-N317 WeakPolarHBondContact CB-OD1 3.18Å; L296-N317 WeakPolarHBondContact CG-OD1 3.08Å; L296-N317 PolarHBondContact N-OD1 3.21Å; L314-N317 PolarHBondContact O-ND2 2.87Å; E315-N317 PolarHBondContact O-ND2 3.45Å; N317-I319 HydrophobicContact CB-CD1 4.11Å; N317-I319 HydrophobicContact CB-CG1 4.02Å; N317-R340 PolarHBondContact N-O 2.98Å; N317-N341 WeakPolarHBondContact CA-OD1 3.41Å; N317-N341 VanDerWaalsContact CB-OD1 3.22Å; N317-N341 WeakPolarHBondContact CB-OD1 3.36Å; N317-N341 PolarHBondContact O-OD1 2.86Å
318	N	97.7	Very high	95.7	Very high	86 Å²	86	43 Å²	43	46%	0.46	23%	0.231	S	C	.	.			trans	-108.2	26.5	179.5	-64.9	94.9	0	0	0	112.3	R295 L296	R295-N318 WeakPolarHBondContact CA-OD1 3.46Å; L296-N318 CarbonylContact O-C 3.02Å; L296-N318 VanDerWaalsContact O-CA 3.25Å; L296-N318 WeakPolarHBondContact O-CA 3.14Å; L296-N318 PolarHBondContact O-N 2.95Å
319	I	97.3	Very high	95.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.225	C	C	.	.			trans	-76.6	133.1	-173.1	-56.3	169.4	0	0	0	109.6	L296 I299 L314 N317 V321 L322 N341 C342 F343	L296-I319 HydrophobicContact CB-CD1 4.37Å; L296-I319 HydrophobicContact CB-CG1 4.23Å; L296-I319 VanDerWaalsContact O-CG1 3.31Å; L296-I319 WeakPolarHBondContact O-CG1 3.32Å; L296-I319 PolarHBondContact O-N 3.18Å; I299-I319 HydrophobicContact CD1-CD1 3.96Å; I299-I319 HydrophobicContact CG1-CD1 3.85Å; L314-I319 HydrophobicContact CB-CD1 3.98Å; L314-I319 HydrophobicContact CD1-CD1 3.85Å; L314-I319 HydrophobicContact CD2-CD1 4.32Å; L314-I319 HydrophobicContact CG-CD1 4.27Å; N317-I319 HydrophobicContact CB-CD1 4.11Å; N317-I319 HydrophobicContact CB-CG1 4.02Å; I319-V321 WeakPolarHBondContact CG2-O 3.15Å; I319-L322 HydrophobicContact CG2-CD2 4.16Å; I319-N341 WeakPolarHBondContact CB-OD1 3.32Å; I319-N341 PolarHBondContact N-OD1 3.28Å; I319-C342 CarbonylContact O-C 3.22Å; I319-C342 WeakPolarHBondContact O-CA 3.27Å; I319-C342 WeakPolarHBondContact O-CB 3.25Å; I319-C342 PolarHBondContact O-N 2.9Å; I319-F343 HydrophobicContact CB-CE2 4.31Å; I319-F343 HydrophobicContact CB-CZ 4.25Å; I319-F343 HydrophobicContact CG2-CE1 4.24Å; I319-F343 HydrophobicContact CG2-CE2 4.16Å; I319-F343 HydrophobicContact CG2-CZ 3.59Å
320	S	96.1	Very high	95.5	Very high	56 Å²	56	40.8 Å²	40.8	39%	0.392	23%	0.225	S	C	.	.			trans	-112.2	-25.1	176.1	55.3	0	0	0	0	113.6	F343	S320-F343 WeakPolarHBondContact O-CD1 3.34Å
321	V	95.7	Very high	95.4	Very high	86 Å²	86	40.3 Å²	40.3	52%	0.521	23%	0.226	S	C	.	.			trans	-146.1	142.8	-176.3	179.7	0	0	0	0	109.4	I319	I319-V321 WeakPolarHBondContact CG2-O 3.15Å
322	L	96.3	Very high	95.3	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-98.9	148.4	167.7	-63.6	-179.6	0	0	0	110.5	I299 L314 I319 L327 L338 F343 P347	I299-L322 HydrophobicContact CG1-CD2 4.32Å; L314-L322 HydrophobicContact CD1-CD2 4.04Å; I319-L322 HydrophobicContact CG2-CD2 4.16Å; L322-L327 HydrophobicContact CD1-CD1 3.87Å; L322-L327 HydrophobicContact CD1-CD2 4.26Å; L322-L327 HydrophobicContact CD1-CG 4.1Å; L322-L338 HydrophobicContact CD1-CD1 3.93Å; L322-L338 HydrophobicContact CD1-CD2 4.14Å; L322-F343 HydrophobicContact CD2-CZ 4.14Å; L322-F343 HydrophobicContact CG-CE1 4.07Å; L322-F343 HydrophobicContact CG-CZ 3.94Å; L322-P347 HydrophobicContact CB-CB 4.37Å; L322-P347 HydrophobicContact CD1-CB 4.07Å; L322-P347 HydrophobicContact CD1-CG 3.94Å; L322-P347 HydrophobicContact CG-CB 4.47Å; L322-P347 HydrophobicContact CG-CG 4.48Å
323	P	94.6	Very high	95.3	Very high	18 Å²	18	39.4 Å²	39.4	12%	0.117	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-54.1	139.3	172	-26.5	34.2	0	0	0	113.3	I299 K301 G325 L326	I299-P323 WeakPolarHBondContact O-CG 3.3Å; K301-P323 HydrophobicContact CB-CB 4.31Å; K301-P323 HydrophobicContact CG-CB 3.93Å; K301-P323 HydrophobicContact CG-CG 4.19Å; P323-G325 PolarHBondContact O-N 3.14Å; P323-L326 HydrophobicContact CB-CB 4.21Å; P323-L326 HydrophobicContact CG-CD2 4.41Å; P323-L326 VanDerWaalsContact O-CB 3.28Å; P323-L326 WeakPolarHBondContact O-CB 3.4Å; P323-L326 PolarHBondContact O-N 3.36Å
324	E	91.8	Very high	95.2	Very high	167 Å²	167	41.6 Å²	41.6	78%	0.78	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	132.4	175.1	-171.9	178.6	-176.5	0	0	111.2	L326 V348	E324-L326 PolarHBondContact O-N 2.79Å; E324-V348 HydrophobicContact CB-CG2 4.04Å; E324-V348 HydrophobicContact CG-CG2 4.46Å
325	G	90	Very high	95.2	Very high	21 Å²	21	42.9 Å²	42.9	22%	0.216	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	0.3	179.2	0	0	0	0	0	115.3	P323 S328 S329	P323-G325 PolarHBondContact O-N 3.14Å; G325-S328 WeakPolarHBondContact CA-OG 3.47Å; G325-S328 PolarHBondContact O-OG 2.91Å; G325-S328 VanDerWaalsContact O-OG 3.09Å; G325-S329 WeakPolarHBondContact O-CB 3.26Å; G325-S329 PolarHBondContact O-N 3.21Å; G325-S329 PolarHBondContact O-OG 3.43Å
326	L	95	Very high	95.2	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-58.2	-59.1	177.4	173.8	61.6	0	0	0	110.7	I299 L303 A304 P323 E324 S328 S329 L330	I299-L326 HydrophobicContact CG2-CD2 4.07Å; L303-L326 HydrophobicContact CB-CD1 3.84Å; L303-L326 HydrophobicContact CD2-CD1 4.38Å; L303-L326 HydrophobicContact CG-CD1 4.2Å; A304-L326 HydrophobicContact CB-CD1 3.98Å; A304-L326 VanDerWaalsContact N-CD1 3.28Å; P323-L326 HydrophobicContact CB-CB 4.21Å; P323-L326 HydrophobicContact CG-CD2 4.41Å; P323-L326 VanDerWaalsContact O-CB 3.28Å; P323-L326 WeakPolarHBondContact O-CB 3.4Å; P323-L326 PolarHBondContact O-N 3.36Å; E324-L326 PolarHBondContact O-N 2.79Å; L326-S328 VanDerWaalsContact C-N 3.34Å; L326-S328 PolarHBondContact O-N 2.75Å; L326-S329 PolarHBondContact O-N 3.22Å; L326-S329 VanDerWaalsContact O-N 3.14Å; L326-L330 HydrophobicContact CD1-CD1 4.42Å; L326-L330 WeakPolarHBondContact O-CG 3.32Å
327	L	94.9	Very high	95.2	Very high	6 Å²	6	39 Å²	39	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-66.8	-34.1	-174.9	-67.1	-177.9	0	0	0	112.6	L312 L322 S329 L330 L333 L336 P347 Q353 F354	L312-L327 HydrophobicContact CD2-CD2 4.39Å; L322-L327 HydrophobicContact CD1-CD1 3.87Å; L322-L327 HydrophobicContact CD1-CD2 4.26Å; L322-L327 HydrophobicContact CD1-CG 4.1Å; L327-S329 PolarHBondContact O-N 3.35Å; L327-L330 PolarHBondContact O-N 3.34Å; L327-L333 HydrophobicContact CD2-CD2 4Å; L327-L336 HydrophobicContact CD1-CD2 3.68Å; L327-L336 HydrophobicContact CD2-CD1 4.12Å; L327-L336 HydrophobicContact CD2-CD2 3.77Å; L327-L336 HydrophobicContact CG-CD2 4.38Å; L327-P347 HydrophobicContact CD1-CB 4.16Å; L327-P347 HydrophobicContact CD1-CG 4.39Å; L327-Q353 HydrophobicContact CB-CB 3.78Å; L327-F354 HydrophobicContact CD1-CE1 4.46Å
328	S	93.3	Very high	95.2	Very high	42 Å²	42	38.8 Å²	38.8	29%	0.294	23%	0.227	S	C	.	.	H	α-helix	trans	-71.8	-16.3	176.2	57.6	0	0	0	0	113.9	G325 L326	G325-S328 WeakPolarHBondContact CA-OG 3.47Å; G325-S328 PolarHBondContact O-OG 2.91Å; G325-S328 VanDerWaalsContact O-OG 3.09Å; L326-S328 VanDerWaalsContact C-N 3.34Å; L326-S328 PolarHBondContact O-N 2.75Å
329	S	93.3	Very high	95.2	Very high	42 Å²	42	34.7 Å²	34.7	29%	0.294	21%	0.205	S	C	.	.	H	α-helix	trans	-87.5	-19.7	176.9	-58.3	0	0	0	0	113.3	A304 G325 L326 L327 L331	A304-S329 WeakPolarHBondContact O-CB 3.17Å; G325-S329 WeakPolarHBondContact O-CB 3.26Å; G325-S329 PolarHBondContact O-N 3.21Å; G325-S329 PolarHBondContact O-OG 3.43Å; L326-S329 PolarHBondContact O-N 3.22Å; L326-S329 VanDerWaalsContact O-N 3.14Å; L327-S329 PolarHBondContact O-N 3.35Å; S329-L331 PolarHBondContact O-N 2.9Å
330	L	93.8	Very high	95.2	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.223	C	C	.	.			trans	-87.2	82.3	-177.4	-59.9	175.3	0	0	0	110.1	C306 L309 L312 L326 L327 N332 L333	C306-L330 WeakPolarHBondContact O-CD2 3.36Å; L309-L330 HydrophobicContact CB-CD2 4.46Å; L309-L330 HydrophobicContact CD2-CD1 4.29Å; L312-L330 HydrophobicContact CD2-CD1 4.29Å; L326-L330 HydrophobicContact CD1-CD1 4.42Å; L326-L330 WeakPolarHBondContact O-CG 3.32Å; L327-L330 PolarHBondContact O-N 3.34Å; L330-N332 VanDerWaalsContact C-N 3.29Å; L330-N332 PolarHBondContact O-N 3.08Å; L330-L333 HydrophobicContact CB-CB 3.83Å; L330-L333 HydrophobicContact CB-CD2 4.28Å; L330-L333 HydrophobicContact CD1-CD2 3.97Å; L330-L333 WeakPolarHBondContact O-CB 3.44Å; L330-L333 PolarHBondContact O-N 3.1Å
331	L	90.8	Very high	95.3	Very high	104 Å²	104	37.4 Å²	37.4	55%	0.545	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-20.6	-169.3	-57.6	177.6	0	0	0	114.6	S329 T356	S329-L331 PolarHBondContact O-N 2.9Å; L331-T356 VanDerWaalsContact O-CG2 3.23Å; L331-T356 WeakPolarHBondContact O-CG2 3.23Å
332	N	94.5	Very high	95.4	Very high	70 Å²	70	34.9 Å²	34.9	37%	0.374	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	3.2	179	-66.1	-3.2	0	0	0	112.6	E308 L309 L330 T334	E308-N332 PolarHBondContact OE2-ND2 2.87Å; L309-N332 CarbonylContact O-C 3.4Å; L330-N332 VanDerWaalsContact C-N 3.29Å; L330-N332 PolarHBondContact O-N 3.08Å; N332-T334 PolarHBondContact O-N 3.13Å
333	L	95.8	Very high	95.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.193	C	C	.	.			trans	-72.4	114	-175.8	-175.1	69.8	0	0	0	110.6	L309 L312 L327 L330 S335 L336 T356 I357	L309-L333 WeakPolarHBondContact O-CA 3.26Å; L309-L333 PolarHBondContact O-N 3.03Å; L312-L333 HydrophobicContact CB-CD1 3.72Å; L312-L333 HydrophobicContact CB-CD2 4.45Å; L327-L333 HydrophobicContact CD2-CD2 4Å; L330-L333 HydrophobicContact CB-CB 3.83Å; L330-L333 HydrophobicContact CB-CD2 4.28Å; L330-L333 HydrophobicContact CD1-CD2 3.97Å; L330-L333 WeakPolarHBondContact O-CB 3.44Å; L330-L333 PolarHBondContact O-N 3.1Å; L333-S335 WeakPolarHBondContact CD1-O 3.14Å; L333-L336 HydrophobicContact CD2-CB 4.45Å; L333-L336 HydrophobicContact CD2-CD1 4.46Å; L333-T356 CarbonylContact O-C 3.13Å; L333-T356 WeakPolarHBondContact O-CB 3.37Å; L333-T356 PolarHBondContact O-OG1 3.26Å; L333-I357 HydrophobicContact CD2-CD1 4.18Å; L333-I357 HydrophobicContact CD2-CG1 4.44Å; L333-I357 HydrophobicContact CG-CG1 4.48Å
334	T	96.4	Very high	95.6	Very high	71 Å²	71	40.1 Å²	40.1	44%	0.436	22%	0.216	S	C	.	.			trans	-105.7	-30.5	-179.8	62.1	0	0	0	0	112.5	E310 N332 Y358 T359	E310-T334 PolarHBondContact O-N 2.87Å; E310-T334 PolarHBondContact O-OG1 3.14Å; N332-T334 PolarHBondContact O-N 3.13Å; T334-Y358 PolarHBondContact O-N 2.81Å; T334-T359 PolarHBondContact O-N 3.31Å; T334-T359 VanDerWaalsContact O-N 3.13Å
335	S	97.5	Very high	95.7	Very high	28 Å²	28	35.5 Å²	35.5	20%	0.196	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.2	-177.6	-177.6	0	0	0	0	111	E310 E311 L312 L333	E310-S335 PolarHBondContact O-N 3.47Å; E311-S335 WeakPolarHBondContact CA-O 3.26Å; L312-S335 PolarHBondContact N-O 3.27Å; L333-S335 WeakPolarHBondContact CD1-O 3.14Å
336	L	97.6	Very high	95.9	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	117.3	179.1	178.6	59.6	0	0	0	110.4	L312 L327 L333 L338 F354 I357 T359 L360 N361	L312-L336 HydrophobicContact CB-CD1 4.02Å; L312-L336 HydrophobicContact CD2-CD1 4.03Å; L312-L336 HydrophobicContact CG-CD1 4.09Å; L327-L336 HydrophobicContact CD1-CD2 3.68Å; L327-L336 HydrophobicContact CD2-CD1 4.12Å; L327-L336 HydrophobicContact CD2-CD2 3.77Å; L327-L336 HydrophobicContact CG-CD2 4.38Å; L333-L336 HydrophobicContact CD2-CB 4.45Å; L333-L336 HydrophobicContact CD2-CD1 4.46Å; L336-L338 HydrophobicContact CD1-CD1 4.37Å; L336-L338 HydrophobicContact CD1-CD2 3.9Å; L336-L338 HydrophobicContact CD1-CG 3.96Å; L336-L338 HydrophobicContact CD2-CD1 4.07Å; L336-L338 HydrophobicContact CD2-CG 4.43Å; L336-L338 HydrophobicContact CG-CD1 4.2Å; L336-L338 HydrophobicContact CG-CG 4.02Å; L336-F354 HydrophobicContact CD2-CE1 4.21Å; L336-I357 HydrophobicContact CB-CD1 3.98Å; L336-I357 HydrophobicContact CB-CG2 4.46Å; L336-I357 HydrophobicContact CD2-CD1 3.72Å; L336-T359 PolarHBondContact N-O 3.25Å; L336-L360 HydrophobicContact CB-CD1 4.09Å; L336-L360 HydrophobicContact CD2-CD1 3.83Å; L336-L360 HydrophobicContact CG-CD1 3.93Å; L336-L360 WeakPolarHBondContact O-CA 3.46Å; L336-N361 PolarHBondContact O-N 3.06Å
337	T	98.1	Very high	95.8	Very high	14 Å²	14	35.2 Å²	35.2	9%	0.086	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	115.5	175.2	-59.7	0	0	0	0	110.3	L312 L314 E315 A339 N361	L312-T337 PolarHBondContact O-N 3.34Å; L314-T337 PolarHBondContact N-O 3.28Å; E315-T337 HydrophobicContact CB-CG2 4.03Å; T337-A339 HydrophobicContact CG2-CB 3.94Å; T337-N361 HydrophobicContact CG2-CB 4.18Å
338	L	98	Very high	95.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.216	C	C	.	.			trans	-118.5	18	177.1	-58.7	176.9	0	0	0	111.3	L314 L322 L336 N341 F343 P347 N361 M362 N365	L314-L338 HydrophobicContact CB-CD2 4.12Å; L314-L338 HydrophobicContact CD1-CD2 3.75Å; L314-L338 HydrophobicContact CG-CD2 4.32Å; L322-L338 HydrophobicContact CD1-CD1 3.93Å; L322-L338 HydrophobicContact CD1-CD2 4.14Å; L336-L338 HydrophobicContact CD1-CD1 4.37Å; L336-L338 HydrophobicContact CD1-CD2 3.9Å; L336-L338 HydrophobicContact CD1-CG 3.96Å; L336-L338 HydrophobicContact CD2-CD1 4.07Å; L336-L338 HydrophobicContact CD2-CG 4.43Å; L336-L338 HydrophobicContact CG-CD1 4.2Å; L336-L338 HydrophobicContact CG-CG 4.02Å; L338-N341 PolarHBondContact O-ND2 3.14Å; L338-F343 HydrophobicContact CB-CD2 4.36Å; L338-F343 HydrophobicContact CB-CE2 3.89Å; L338-F343 HydrophobicContact CD1-CE2 4.38Å; L338-F343 HydrophobicContact CD1-CZ 4.29Å; L338-F343 HydrophobicContact CD2-CE2 4.29Å; L338-F343 HydrophobicContact CD2-CZ 4.33Å; L338-F343 HydrophobicContact CG-CE2 4.41Å; L338-P347 HydrophobicContact CD1-CG 3.98Å; L338-N361 PolarHBondContact N-O 2.79Å; L338-M362 HydrophobicContact CB-CE 4.2Å; L338-M362 HydrophobicContact CB-CG 4.25Å; L338-M362 HydrophobicContact CD1-CE 3.64Å; L338-M362 HydrophobicContact CD1-CG 4.48Å; L338-M362 HydrophobicContact CD1-SD 4.4Å; L338-N365 PolarHBondContact O-ND2 2.75Å
339	A	98.3	Very high	95	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.214	C	C	.	.			trans	-60.4	154	-176.9	0	0	0	0	0	112.6	E315 N316 T337 N341 N361 E363	E315-A339 VanDerWaalsContact CA-O 3.28Å; E315-A339 WeakPolarHBondContact CA-O 3.3Å; E315-A339 HydrophobicContact CG-CB 4.13Å; N316-A339 PolarHBondContact N-O 3.11Å; N316-A339 VanDerWaalsContact N-O 3.07Å; T337-A339 HydrophobicContact CG2-CB 3.94Å; A339-N341 PolarHBondContact O-N 2.76Å; A339-N341 PolarHBondContact O-ND2 3.11Å; A339-N361 PolarHBondContact N-O 2.99Å; A339-E363 CarbonylContact C-O 3.42Å; A339-E363 WeakPolarHBondContact CA-O 3.45Å; A339-E363 HydrophobicContact CB-CG 3.57Å
340	R	98.3	Very high	94.8	Very high	102 Å²	102	37.3 Å²	37.3	39%	0.385	22%	0.216	S	C	.	.	S	Bend	trans	53.8	52.4	174.6	-60.4	174	178.3	-85.3	-11.3	112.4	E315 N316 N317 E363 H364	E315-R340 HydrophobicContact CG-CB 4.47Å; E315-R340 IonicContact OE1-NE 2.7Å; N316-R340 WeakPolarHBondContact CA-O 3.33Å; N316-R340 HydrophobicContact CB-CB 4.1Å; N316-R340 PolarHBondContact N-O 3.24Å; N317-R340 PolarHBondContact N-O 2.98Å; R340-E363 PolarHBondContact N-O 3.14Å; R340-H364 VanDerWaalsContact CA-O 3.24Å; R340-H364 WeakPolarHBondContact CA-O 2.99Å; R340-H364 HydrophobicContact CB-CB 4.29Å; R340-H364 HydrophobicContact CG-CB 3.61Å; R340-H364 PolarHBondContact N-O 2.93Å; R340-H364 PolarHBondContact NH2-NE2 2.93Å
341	N	98.4	Very high	94.8	Very high	11 Å²	11	39.1 Å²	39.1	6%	0.059	23%	0.228	C	C	.	.	S	Bend	trans	-127	-166.7	178.3	-89.1	-80.8	0	0	0	110.1	L314 N317 I319 L338 A339 F343 H364 N365	L314-N341 PolarHBondContact O-ND2 3.48Å; N317-N341 WeakPolarHBondContact CA-OD1 3.41Å; N317-N341 VanDerWaalsContact CB-OD1 3.22Å; N317-N341 WeakPolarHBondContact CB-OD1 3.36Å; N317-N341 PolarHBondContact O-OD1 2.86Å; I319-N341 WeakPolarHBondContact CB-OD1 3.32Å; I319-N341 PolarHBondContact N-OD1 3.28Å; L338-N341 PolarHBondContact O-ND2 3.14Å; A339-N341 PolarHBondContact O-N 2.76Å; A339-N341 PolarHBondContact O-ND2 3.11Å; N341-F343 HydrophobicContact CB-CD2 3.62Å; N341-F343 HydrophobicContact CB-CE2 3.75Å; N341-H364 PolarHBondContact N-O 2.94Å; N341-N365 WeakPolarHBondContact CA-OD1 3.4Å; N341-N365 WeakPolarHBondContact CB-OD1 3.36Å; N341-N365 PolarHBondContact N-OD1 2.95Å; N341-N365 PolarHBondContact O-OD1 3.33Å; N341-N365 VanDerWaalsContact O-OD1 3.1Å
342	C	97.5	Very high	94.8	Very high	33 Å²	33	36.6 Å²	36.6	22%	0.223	22%	0.218	C	C	.	.			trans	-108.2	24.1	-177.7	-66.6	0	0	0	0	112.6	I319 Q344	I319-C342 CarbonylContact O-C 3.22Å; I319-C342 WeakPolarHBondContact O-CA 3.27Å; I319-C342 WeakPolarHBondContact O-CB 3.25Å; I319-C342 PolarHBondContact O-N 2.9Å; C342-Q344 PolarHBondContact O-N 3.15Å
343	F	97.7	Very high	94.8	Very high	1 Å²	1	33.3 Å²	33.3	0%	0.004	20%	0.201	C	C	.	.			trans	-66.5	122	-178.5	-71.3	-80.7	0	0	0	110.9	I319 S320 L322 L338 N341 P347 M362 N365 R366 I367	I319-F343 HydrophobicContact CB-CE2 4.31Å; I319-F343 HydrophobicContact CB-CZ 4.25Å; I319-F343 HydrophobicContact CG2-CE1 4.24Å; I319-F343 HydrophobicContact CG2-CE2 4.16Å; I319-F343 HydrophobicContact CG2-CZ 3.59Å; S320-F343 WeakPolarHBondContact O-CD1 3.34Å; L322-F343 HydrophobicContact CD2-CZ 4.14Å; L322-F343 HydrophobicContact CG-CE1 4.07Å; L322-F343 HydrophobicContact CG-CZ 3.94Å; L338-F343 HydrophobicContact CB-CD2 4.36Å; L338-F343 HydrophobicContact CB-CE2 3.89Å; L338-F343 HydrophobicContact CD1-CE2 4.38Å; L338-F343 HydrophobicContact CD1-CZ 4.29Å; L338-F343 HydrophobicContact CD2-CE2 4.29Å; L338-F343 HydrophobicContact CD2-CZ 4.33Å; L338-F343 HydrophobicContact CG-CE2 4.41Å; N341-F343 HydrophobicContact CB-CD2 3.62Å; N341-F343 HydrophobicContact CB-CE2 3.75Å; F343-P347 HydrophobicContact CE1-CG 4.46Å; F343-M362 HydrophobicContact CD2-CE 4.44Å; F343-M362 HydrophobicContact CG-CE 4.31Å; F343-N365 HydrophobicContact CB-CB 4.29Å; F343-N365 WeakPolarHBondContact CB-OD1 3.36Å; F343-N365 WeakPolarHBondContact CD2-OD1 3.25Å; F343-N365 PolarHBondContact N-OD1 3.12Å; F343-N365 VanDerWaalsContact N-OD1 3.08Å; F343-R366 CarbonylContact O-C 3.21Å; F343-R366 VanDerWaalsContact O-CA 3.29Å; F343-R366 WeakPolarHBondContact O-CA 3.06Å; F343-R366 PolarHBondContact O-N 3.09Å; F343-I367 HydrophobicContact CB-CD1 4.16Å; F343-I367 HydrophobicContact CB-CG1 4.04Å; F343-I367 PolarHBondContact O-N 2.96Å
344	Q	96.2	Very high	94.8	Very high	128 Å²	128	33.3 Å²	33.3	60%	0.598	20%	0.201	S	C	*	.	S	Bend	trans	-95.9	-20.8	173.2	-63.2	178.7	34.9	0	0	112.2	C342 R366	C342-Q344 PolarHBondContact O-N 3.15Å; Q344-R366 WeakPolarHBondContact CA-O 3.5Å; Q344-R366 HydrophobicContact CG-CB 4.31Å
345	S	95.2	Very high	94.7	Very high	69 Å²	69	32.5 Å²	32.5	48%	0.483	20%	0.198	S	C	.	.	S	Bend	trans	-141.5	166.1	177	62.7	0	0	0	0	110.1
346	Y	94.3	Very high	94.6	Very high	10 Å²	10	33 Å²	33	4%	0.039	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-60.6	151.4	171.9	-91.1	-105.9	0	0	0	112	F354 M362 I367 I370 P371 I374 F375 M386	Y346-F354 HydrophobicContact CD1-CE2 4.37Å; Y346-F354 HydrophobicContact CD1-CZ 4.3Å; Y346-M362 HydrophobicContact CD1-SD 4.19Å; Y346-M362 HydrophobicContact CE1-SD 3.92Å; Y346-I367 HydrophobicContact CD2-CD1 4.49Å; Y346-I367 HydrophobicContact CD2-CG2 3.74Å; Y346-I367 HydrophobicContact CE2-CD1 4.46Å; Y346-I367 HydrophobicContact CE2-CG2 3.74Å; Y346-I370 HydrophobicContact CE1-CG2 4.5Å; Y346-I370 HydrophobicContact CE2-CB 3.98Å; Y346-I370 HydrophobicContact CE2-CG1 3.68Å; Y346-I370 HydrophobicContact CE2-CG2 4.01Å; Y346-P371 HydrophobicContact CD2-CG 4.48Å; Y346-P371 HydrophobicContact CG-CG 4.28Å; Y346-I374 HydrophobicContact CD1-CG1 4.39Å; Y346-F375 HydrophobicContact CE1-CE1 4.42Å; Y346-F375 AromaticContact CE1-CZ 3.79Å; Y346-F375 HydrophobicContact CE1-CZ 3.79Å; Y346-M386 HydrophobicContact CE2-CE 3.66Å; Y346-M386 HydrophobicContact CE2-SD 4.47Å; Y346-M386 VanDerWaalsContact OH-CE 3.24Å; Y346-M386 WeakPolarHBondContact OH-CE 3.35Å; Y346-M386 PolarHBondContact OH-SD 3.15Å
347	P	92.6	Very high	94.6	Very high	8 Å²	8	33 Å²	33	5%	0.052	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-55.9	140.4	173	-26.1	35.2	0	0	0	113.1	L322 L327 L338 F343 Q353 M362	L322-P347 HydrophobicContact CB-CB 4.37Å; L322-P347 HydrophobicContact CD1-CB 4.07Å; L322-P347 HydrophobicContact CD1-CG 3.94Å; L322-P347 HydrophobicContact CG-CB 4.47Å; L322-P347 HydrophobicContact CG-CG 4.48Å; L327-P347 HydrophobicContact CD1-CB 4.16Å; L327-P347 HydrophobicContact CD1-CG 4.39Å; L338-P347 HydrophobicContact CD1-CG 3.98Å; F343-P347 HydrophobicContact CE1-CG 4.46Å; P347-Q353 PolarHBondContact O-NE2 3.46Å; P347-M362 HydrophobicContact CG-CE 4.12Å
348	V	86.6	Confident	94.6	Very high	77 Å²	77	37.8 Å²	37.8	47%	0.467	22%	0.218	S	C	.	.	S	Bend	trans	-73	143.2	174.3	-65.3	0	0	0	0	110.4	E324 Q353	E324-V348 HydrophobicContact CB-CG2 4.04Å; E324-V348 HydrophobicContact CG-CG2 4.46Å; V348-Q353 PolarHBondContact O-OE1 3.46Å
349	G	84.6	Confident	94.6	Very high	25 Å²	25	39.6 Å²	39.6	26%	0.258	23%	0.229	S	C	.	.	S	Bend	trans	145	-4.4	-177.1	0	0	0	0	0	115.3
350	G	89.5	Confident	94.6	Very high	31 Å²	31	39.7 Å²	39.7	32%	0.32	23%	0.229	S	C	.	.			trans	67.7	-170.3	177.5	0	0	0	0	0	113.4	S352 Q353	G350-S352 VanDerWaalsContact C-N 3.34Å; G350-S352 PolarHBondContact O-N 2.8Å; G350-Q353 WeakPolarHBondContact O-CG 3.31Å; G350-Q353 PolarHBondContact O-N 2.87Å; G350-Q353 PolarHBondContact O-NE2 2.57Å
351	P	92.4	Very high	94.6	Very high	40 Å²	40	36.2 Å²	36.2	26%	0.26	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-72.7	-21.9	-169	-21.1	33.9	0	0	0	115.3	Q353 F354 G373 I374 S376 R377	P351-Q353 PolarHBondContact O-N 3.34Å; P351-F354 PolarHBondContact O-N 2.97Å; P351-G373 WeakPolarHBondContact CB-O 3.4Å; P351-G373 WeakPolarHBondContact CG-O 3.41Å; P351-I374 WeakPolarHBondContact CA-O 3.4Å; P351-S376 VanDerWaalsContact CB-OG 3.3Å; P351-S376 WeakPolarHBondContact CB-OG 3.05Å; P351-R377 HydrophobicContact CB-CB 4.27Å; P351-R377 HydrophobicContact CB-CG 4.09Å
352	S	92.3	Very high	94.6	Very high	50 Å²	50	35.7 Å²	35.7	35%	0.35	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-63.5	-24.4	-179.9	47.9	0	0	0	0	112.5	G350 F354 S355	G350-S352 VanDerWaalsContact C-N 3.34Å; G350-S352 PolarHBondContact O-N 2.8Å; S352-F354 PolarHBondContact O-N 3.42Å; S352-S355 WeakPolarHBondContact O-CB 3.21Å; S352-S355 PolarHBondContact O-N 3.33Å; S352-S355 PolarHBondContact O-OG 2.95Å
353	Q	94	Very high	94.6	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-63.2	-22.4	-177.5	83.5	-176	-34.5	0	0	114.4	L327 P347 V348 G350 P351 I357	L327-Q353 HydrophobicContact CB-CB 3.78Å; P347-Q353 PolarHBondContact O-NE2 3.46Å; V348-Q353 PolarHBondContact O-OE1 3.46Å; G350-Q353 WeakPolarHBondContact O-CG 3.31Å; G350-Q353 PolarHBondContact O-N 2.87Å; G350-Q353 PolarHBondContact O-NE2 2.57Å; P351-Q353 PolarHBondContact O-N 3.34Å; Q353-I357 WeakPolarHBondContact O-CD1 3.23Å
354	F	95	Very high	94.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-109.6	12	-179	-60.8	-66.3	0	0	0	112.9	L327 L336 Y346 P351 S352 T356 I357 L360 I374 F375 A378	L327-F354 HydrophobicContact CD1-CE1 4.46Å; L336-F354 HydrophobicContact CD2-CE1 4.21Å; Y346-F354 HydrophobicContact CD1-CE2 4.37Å; Y346-F354 HydrophobicContact CD1-CZ 4.3Å; P351-F354 PolarHBondContact O-N 2.97Å; S352-F354 PolarHBondContact O-N 3.42Å; F354-T356 VanDerWaalsContact C-N 3.28Å; F354-T356 PolarHBondContact O-N 3.07Å; F354-I357 HydrophobicContact CD1-CD1 3.56Å; F354-I357 HydrophobicContact CE1-CD1 4.11Å; F354-I357 PolarHBondContact O-N 3.19Å; F354-L360 HydrophobicContact CD1-CD2 3.99Å; F354-L360 HydrophobicContact CE1-CD1 4.12Å; F354-L360 HydrophobicContact CE1-CD2 3.6Å; F354-L360 HydrophobicContact CZ-CD2 4.11Å; F354-I374 HydrophobicContact CD2-CG1 4.04Å; F354-I374 HydrophobicContact CE2-CD1 4.23Å; F354-I374 HydrophobicContact CE2-CG1 3.66Å; F354-F375 HydrophobicContact CB-CD1 4.08Å; F354-F375 HydrophobicContact CB-CE1 4.4Å; F354-F375 HydrophobicContact CD1-CE1 4.24Å; F354-F375 AromaticContact CD2-CD1 3.75Å; F354-F375 HydrophobicContact CD2-CD1 3.75Å; F354-F375 AromaticContact CD2-CE1 3.64Å; F354-F375 HydrophobicContact CD2-CE1 3.64Å; F354-F375 HydrophobicContact CE2-CD1 4.4Å; F354-F375 AromaticContact CE2-CE1 3.89Å; F354-F375 HydrophobicContact CE2-CE1 3.89Å; F354-F375 AromaticContact CG-CD1 3.96Å; F354-F375 HydrophobicContact CG-CD1 3.96Å; F354-F375 AromaticContact CG-CE1 3.85Å; F354-F375 HydrophobicContact CG-CE1 3.85Å; F354-F375 HydrophobicContact CZ-CE1 4.36Å; F354-A378 HydrophobicContact CB-CB 3.82Å; F354-A378 WeakPolarHBondContact O-CA 3.15Å; F354-A378 VanDerWaalsContact O-CB 3.23Å; F354-A378 WeakPolarHBondContact O-CB 3.2Å
355	S	94.6	Very high	94.8	Very high	54 Å²	54	32.7 Å²	32.7	38%	0.378	20%	0.198	S	C	.	.	S	Bend	trans	-66.1	-27.2	-173.8	58.3	0	0	0	0	114.5	S352	S352-S355 WeakPolarHBondContact O-CB 3.21Å; S352-S355 PolarHBondContact O-N 3.33Å; S352-S355 PolarHBondContact O-OG 2.95Å
356	T	95.4	Very high	94.9	Very high	40 Å²	40	35.9 Å²	35.9	25%	0.245	20%	0.2	C	C	.	.	S	Bend	trans	-105.5	-13.2	-178.2	58.8	0	0	0	0	112.7	L331 L333 F354 Y358	L331-T356 VanDerWaalsContact O-CG2 3.23Å; L331-T356 WeakPolarHBondContact O-CG2 3.23Å; L333-T356 CarbonylContact O-C 3.13Å; L333-T356 WeakPolarHBondContact O-CB 3.37Å; L333-T356 PolarHBondContact O-OG1 3.26Å; F354-T356 VanDerWaalsContact C-N 3.28Å; F354-T356 PolarHBondContact O-N 3.07Å; T356-Y358 PolarHBondContact O-N 3.03Å
357	I	97.1	Very high	95.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.198	C	C	.	.			trans	-78.2	121.3	-170.6	-67.4	174.5	0	0	0	109.8	L333 L336 Q353 F354 T359 L360 L381	L333-I357 HydrophobicContact CD2-CD1 4.18Å; L333-I357 HydrophobicContact CD2-CG1 4.44Å; L333-I357 HydrophobicContact CG-CG1 4.48Å; L336-I357 HydrophobicContact CB-CD1 3.98Å; L336-I357 HydrophobicContact CB-CG2 4.46Å; L336-I357 HydrophobicContact CD2-CD1 3.72Å; Q353-I357 WeakPolarHBondContact O-CD1 3.23Å; F354-I357 HydrophobicContact CD1-CD1 3.56Å; F354-I357 HydrophobicContact CE1-CD1 4.11Å; F354-I357 PolarHBondContact O-N 3.19Å; I357-T359 WeakPolarHBondContact CG2-O 3.3Å; I357-L360 HydrophobicContact CG2-CB 4.18Å; I357-L381 HydrophobicContact CG2-CD1 4.14Å; I357-L381 VanDerWaalsContact O-CA 3.29Å; I357-L381 WeakPolarHBondContact O-CA 3.48Å; I357-L381 PolarHBondContact O-N 3.29Å
358	Y	97.9	Very high	95.3	Very high	114 Å²	114	39.1 Å²	39.1	45%	0.447	22%	0.217	S	C	.	.	S	Bend	trans	-89.7	-40.2	175.1	180	-97.9	0	0	0	111.9	T334 T356 V380 S382 K383	T334-Y358 PolarHBondContact O-N 2.81Å; T356-Y358 PolarHBondContact O-N 3.03Å; Y358-V380 VanDerWaalsContact CD2-O 3.3Å; Y358-V380 WeakPolarHBondContact CD2-O 3.36Å; Y358-S382 VanDerWaalsContact CZ-CB 3.49Å; Y358-S382 PolarHBondContact O-N 3.16Å; Y358-S382 PolarHBondContact OH-OG 3.44Å; Y358-K383 PolarHBondContact O-N 3.34Å; Y358-K383 VanDerWaalsContact O-N 3.1Å
359	T	98.4	Very high	95.7	Very high	38 Å²	38	41.7 Å²	41.7	23%	0.233	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	124.3	179.5	-64	0	0	0	0	110.9	T334 L336 I357 K383	T334-T359 PolarHBondContact O-N 3.31Å; T334-T359 VanDerWaalsContact O-N 3.13Å; L336-T359 PolarHBondContact N-O 3.25Å; I357-T359 WeakPolarHBondContact CG2-O 3.3Å; T359-K383 HydrophobicContact CG2-CB 4.05Å
360	L	98.4	Very high	96.3	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	118.5	175.5	178.5	57.5	0	0	0	110.1	L336 F354 I357 M362 F375 L381 K383 L384 N385	L336-L360 HydrophobicContact CB-CD1 4.09Å; L336-L360 HydrophobicContact CD2-CD1 3.83Å; L336-L360 HydrophobicContact CG-CD1 3.93Å; L336-L360 WeakPolarHBondContact O-CA 3.46Å; F354-L360 HydrophobicContact CD1-CD2 3.99Å; F354-L360 HydrophobicContact CE1-CD1 4.12Å; F354-L360 HydrophobicContact CE1-CD2 3.6Å; F354-L360 HydrophobicContact CZ-CD2 4.11Å; I357-L360 HydrophobicContact CG2-CB 4.18Å; L360-M362 HydrophobicContact CD1-CG 3.81Å; L360-M362 HydrophobicContact CD1-SD 4.29Å; L360-M362 HydrophobicContact CD2-SD 4.41Å; L360-M362 HydrophobicContact CG-CG 4.06Å; L360-F375 HydrophobicContact CD2-CE1 3.83Å; L360-F375 HydrophobicContact CD2-CZ 3.88Å; L360-L381 HydrophobicContact CB-CD1 3.95Å; L360-K383 PolarHBondContact N-O 3.22Å; L360-L384 HydrophobicContact CB-CD1 4.06Å; L360-L384 HydrophobicContact CD2-CD1 3.83Å; L360-L384 HydrophobicContact CG-CD1 3.93Å; L360-L384 WeakPolarHBondContact O-CA 3.48Å; L360-N385 PolarHBondContact O-N 3.07Å
361	N	98.6	Very high	96.6	Very high	30 Å²	30	41.4 Å²	41.4	16%	0.16	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	116.9	173.3	-175.9	2.2	0	0	0	110.6	L336 T337 L338 A339 E363 N385	L336-N361 PolarHBondContact O-N 3.06Å; T337-N361 HydrophobicContact CG2-CB 4.18Å; L338-N361 PolarHBondContact N-O 2.79Å; A339-N361 PolarHBondContact N-O 2.99Å; N361-E363 WeakPolarHBondContact OD1-CG 3.1Å; N361-E363 PolarHBondContact OD1-N 3.23Å; N361-N385 HydrophobicContact CB-CB 4.39Å; N361-N385 PolarHBondContact OD1-ND2 3.08Å
362	M	98.1	Very high	96.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.229	C	C	.	.			trans	-127.2	29.8	174.4	-54	-167.6	75.6	0	0	111.8	L338 F343 Y346 P347 L360 N365 I367 N385 M386 N389	L338-M362 HydrophobicContact CB-CE 4.2Å; L338-M362 HydrophobicContact CB-CG 4.25Å; L338-M362 HydrophobicContact CD1-CE 3.64Å; L338-M362 HydrophobicContact CD1-CG 4.48Å; L338-M362 HydrophobicContact CD1-SD 4.4Å; F343-M362 HydrophobicContact CD2-CE 4.44Å; F343-M362 HydrophobicContact CG-CE 4.31Å; Y346-M362 HydrophobicContact CD1-SD 4.19Å; Y346-M362 HydrophobicContact CE1-SD 3.92Å; P347-M362 HydrophobicContact CG-CE 4.12Å; L360-M362 HydrophobicContact CD1-CG 3.81Å; L360-M362 HydrophobicContact CD1-SD 4.29Å; L360-M362 HydrophobicContact CD2-SD 4.41Å; L360-M362 HydrophobicContact CG-CG 4.06Å; M362-N365 PolarHBondContact O-ND2 2.91Å; M362-I367 HydrophobicContact CB-CD1 4.22Å; M362-I367 HydrophobicContact CE-CD1 3.58Å; M362-I367 HydrophobicContact SD-CD1 4.03Å; M362-N385 PolarHBondContact N-O 3.14Å; M362-M386 HydrophobicContact CB-SD 3.72Å; M362-M386 HydrophobicContact CG-SD 4.25Å; M362-M386 HydrophobicContact SD-SD 4.42Å; M362-N389 PolarHBondContact O-ND2 3.13Å
363	E	98.4	Very high	96.9	Very high	32 Å²	32	44.7 Å²	44.7	15%	0.15	22%	0.217	C	C	.	.			trans	-62.3	161.6	179.5	73.9	172.8	-156.9	0	0	113.4	A339 R340 N361 N365 N385 K387	A339-E363 CarbonylContact C-O 3.42Å; A339-E363 WeakPolarHBondContact CA-O 3.45Å; A339-E363 HydrophobicContact CB-CG 3.57Å; R340-E363 PolarHBondContact N-O 3.14Å; N361-E363 WeakPolarHBondContact OD1-CG 3.1Å; N361-E363 PolarHBondContact OD1-N 3.23Å; E363-N365 PolarHBondContact O-N 3Å; E363-N365 PolarHBondContact O-ND2 2.75Å; E363-N365 VanDerWaalsContact O-ND2 3.16Å; E363-N385 PolarHBondContact OE2-ND2 2.95Å; E363-K387 CarbonylContact C-O 3.2Å; E363-K387 WeakPolarHBondContact CA-O 3.21Å; E363-K387 HydrophobicContact CB-CB 4.04Å; E363-K387 VanDerWaalsContact CB-O 3.25Å; E363-K387 WeakPolarHBondContact CB-O 3.21Å
364	H	98.4	Very high	97	Very high	57 Å²	57	45.2 Å²	45.2	26%	0.264	22%	0.22	S	C	.	.	S	Bend	trans	53.4	54	177.3	-73.5	-72.5	0	0	0	112.1	R340 N341 K387 D388	R340-H364 VanDerWaalsContact CA-O 3.24Å; R340-H364 WeakPolarHBondContact CA-O 2.99Å; R340-H364 HydrophobicContact CB-CB 4.29Å; R340-H364 HydrophobicContact CG-CB 3.61Å; R340-H364 PolarHBondContact N-O 2.93Å; R340-H364 PolarHBondContact NH2-NE2 2.93Å; N341-H364 PolarHBondContact N-O 2.94Å; H364-K387 PolarHBondContact N-O 2.98Å; H364-D388 CarbonylContact C-O 3.58Å; H364-D388 WeakPolarHBondContact CA-O 3.3Å; H364-D388 IonicContact CE1-OD2 3.88Å; H364-D388 PolarHBondContact CE1-OD2 2.91Å; H364-D388 IonicContact CG-OD2 3.14Å; H364-D388 PolarHBondContact N-O 3.1Å; H364-D388 VanDerWaalsContact N-O 3.12Å; H364-D388 IonicContact ND1-OD2 3.75Å; H364-D388 PolarHBondContact ND1-OD2 2.99Å
365	N	98.5	Very high	97	Very high	10 Å²	10	45.7 Å²	45.7	5%	0.053	22%	0.222	C	C	.	.	S	Bend	trans	-127.4	-168	175	-84.3	-73.6	0	0	0	109.7	L338 N341 F343 M362 E363 I367 D388 N389	L338-N365 PolarHBondContact O-ND2 2.75Å; N341-N365 WeakPolarHBondContact CA-OD1 3.4Å; N341-N365 WeakPolarHBondContact CB-OD1 3.36Å; N341-N365 PolarHBondContact N-OD1 2.95Å; N341-N365 PolarHBondContact O-OD1 3.33Å; N341-N365 VanDerWaalsContact O-OD1 3.1Å; F343-N365 HydrophobicContact CB-CB 4.29Å; F343-N365 WeakPolarHBondContact CB-OD1 3.36Å; F343-N365 WeakPolarHBondContact CD2-OD1 3.25Å; F343-N365 PolarHBondContact N-OD1 3.12Å; F343-N365 VanDerWaalsContact N-OD1 3.08Å; M362-N365 PolarHBondContact O-ND2 2.91Å; E363-N365 PolarHBondContact O-N 3Å; E363-N365 PolarHBondContact O-ND2 2.75Å; E363-N365 VanDerWaalsContact O-ND2 3.16Å; N365-I367 HydrophobicContact CB-CD1 4.28Å; N365-I367 HydrophobicContact CB-CG1 4.16Å; N365-D388 PolarHBondContact N-O 2.92Å; N365-D388 VanDerWaalsContact N-O 3.11Å; N365-N389 WeakPolarHBondContact CA-OD1 3.46Å; N365-N389 WeakPolarHBondContact CB-OD1 3.21Å; N365-N389 PolarHBondContact O-OD1 3.32Å
366	R	97.9	Very high	97	Very high	135 Å²	135	46.4 Å²	46.4	51%	0.509	23%	0.227	S	C	.	.			trans	-119.2	29.3	179.5	-57.6	179.6	-171.3	168.5	3.5	111.2	F343 Q344 N368	F343-R366 CarbonylContact O-C 3.21Å; F343-R366 VanDerWaalsContact O-CA 3.29Å; F343-R366 WeakPolarHBondContact O-CA 3.06Å; F343-R366 PolarHBondContact O-N 3.09Å; Q344-R366 WeakPolarHBondContact CA-O 3.5Å; Q344-R366 HydrophobicContact CG-CB 4.31Å; R366-N368 PolarHBondContact O-N 2.92Å
367	I	98.1	Very high	96.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.245	C	C	.	.			trans	-75.3	123	-175.6	-59.9	170.2	0	0	0	108.8	F343 Y346 M362 N365 K369 M386 N389 Q390 L391	F343-I367 HydrophobicContact CB-CD1 4.16Å; F343-I367 HydrophobicContact CB-CG1 4.04Å; F343-I367 PolarHBondContact O-N 2.96Å; Y346-I367 HydrophobicContact CD2-CD1 4.49Å; Y346-I367 HydrophobicContact CD2-CG2 3.74Å; Y346-I367 HydrophobicContact CE2-CD1 4.46Å; Y346-I367 HydrophobicContact CE2-CG2 3.74Å; M362-I367 HydrophobicContact CB-CD1 4.22Å; M362-I367 HydrophobicContact CE-CD1 3.58Å; M362-I367 HydrophobicContact SD-CD1 4.03Å; N365-I367 HydrophobicContact CB-CD1 4.28Å; N365-I367 HydrophobicContact CB-CG1 4.16Å; I367-K369 WeakPolarHBondContact CG2-O 3.42Å; I367-M386 HydrophobicContact CB-CE 4.24Å; I367-M386 HydrophobicContact CD1-CE 3.93Å; I367-M386 HydrophobicContact CG2-CE 4.08Å; I367-N389 WeakPolarHBondContact CB-OD1 3.31Å; I367-N389 PolarHBondContact N-OD1 3.27Å; I367-Q390 CarbonylContact O-C 3.49Å; I367-Q390 VanDerWaalsContact O-C 3.31Å; I367-Q390 WeakPolarHBondContact O-CA 3.36Å; I367-Q390 PolarHBondContact O-N 3.34Å; I367-L391 HydrophobicContact CG2-CD2 4.07Å; I367-L391 PolarHBondContact O-N 2.96Å
368	N	96.5	Very high	96.8	Very high	86 Å²	86	52.6 Å²	52.6	46%	0.46	25%	0.247	S	C	.	.			trans	-99.7	-14.7	-177.6	66.3	13	0	0	0	114.8	R366 Q390 L391 T392	R366-N368 PolarHBondContact O-N 2.92Å; N368-Q390 VanDerWaalsContact CA-O 3.3Å; N368-Q390 WeakPolarHBondContact CA-O 3.31Å; N368-Q390 HydrophobicContact CB-CB 4.19Å; N368-L391 WeakPolarHBondContact O-CA 3.46Å; N368-T392 PolarHBondContact O-N 2.97Å
369	K	96.6	Very high	96.6	Very high	131 Å²	131	55.7 Å²	55.7	57%	0.57	26%	0.263	S	S	*	.			trans	-154.8	140.4	-177.4	-176.6	174.1	179.5	-179.9	0	111.8	I367	I367-K369 WeakPolarHBondContact CG2-O 3.42Å
370	I	96.7	Very high	96.5	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.005	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-88.6	123.9	166	-50.5	-179.2	0	0	0	108.1	Y346 I374 F375 L391 L394 P395 W401	Y346-I370 HydrophobicContact CE1-CG2 4.5Å; Y346-I370 HydrophobicContact CE2-CB 3.98Å; Y346-I370 HydrophobicContact CE2-CG1 3.68Å; Y346-I370 HydrophobicContact CE2-CG2 4.01Å; I370-I374 HydrophobicContact CG2-CG2 3.73Å; I370-F375 HydrophobicContact CG2-CE2 4.11Å; I370-L391 HydrophobicContact CD1-CD1 4.18Å; I370-L391 HydrophobicContact CG1-CD1 4.34Å; I370-L391 HydrophobicContact CG1-CD2 3.92Å; I370-L394 HydrophobicContact CD1-CD2 4.18Å; I370-P395 HydrophobicContact CB-CG 4.16Å; I370-P395 HydrophobicContact CG2-CG 4.13Å; I370-W401 HydrophobicContact CD1-CH2 3.77Å; I370-W401 HydrophobicContact CG2-CH2 4.32Å; I370-W401 HydrophobicContact CG2-CZ2 4.24Å
371	P	96.1	Very high	96.5	Very high	49 Å²	49	57.2 Å²	57.2	32%	0.318	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-65.4	145.7	179.5	-20.5	31.6	0	0	0	112.8	Y346 I374	Y346-P371 HydrophobicContact CD2-CG 4.48Å; Y346-P371 HydrophobicContact CG-CG 4.28Å; P371-I374 HydrophobicContact CB-CB 4.27Å; P371-I374 WeakPolarHBondContact O-CB 3.37Å; P371-I374 WeakPolarHBondContact O-CG2 3.14Å; P371-I374 PolarHBondContact O-N 3.22Å
372	F	95.5	Very high	96.4	Very high	149 Å²	149	56.1 Å²	56.1	65%	0.654	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	135.9	173.7	177.5	-90.2	0	0	0	110.8	I374 L396 D397	F372-I374 PolarHBondContact O-N 3.31Å; F372-L396 HydrophobicContact CD2-CB 4.06Å; F372-L396 HydrophobicContact CE2-CB 4.07Å; F372-D397 WeakPolarHBondContact CA-OD1 3.44Å; F372-D397 HydrophobicContact CD2-CB 3.97Å; F372-D397 VanDerWaalsContact CD2-OD1 3.3Å; F372-D397 WeakPolarHBondContact CD2-OD1 3.21Å; F372-D397 HydrophobicContact CE2-CB 3.62Å; F372-D397 HydrophobicContact CZ-CB 4.18Å
373	G	94.9	Very high	96.5	Very high	10 Å²	10	59.2 Å²	59.2	10%	0.103	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	-0.8	174.9	0	0	0	0	0	114.4	P351 F375 S376 D397	P351-G373 WeakPolarHBondContact CB-O 3.4Å; P351-G373 WeakPolarHBondContact CG-O 3.41Å; G373-F375 PolarHBondContact O-N 3.41Å; G373-F375 VanDerWaalsContact O-N 3.16Å; G373-S376 VanDerWaalsContact O-CB 3.23Å; G373-S376 WeakPolarHBondContact O-CB 3.46Å; G373-S376 PolarHBondContact O-N 3.2Å; G373-S376 PolarHBondContact O-OG 3.32Å; G373-D397 WeakPolarHBondContact CA-OD2 3.33Å; G373-D397 PolarHBondContact N-OD1 2.96Å; G373-D397 PolarHBondContact N-OD2 3.12Å
374	I	95.3	Very high	96.5	Very high	12 Å²	12	57.8 Å²	57.8	6%	0.062	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-28.8	-171.5	-161.1	61.9	0	0	0	112.9	Y346 P351 F354 I370 P371 F372	Y346-I374 HydrophobicContact CD1-CG1 4.39Å; P351-I374 WeakPolarHBondContact CA-O 3.4Å; F354-I374 HydrophobicContact CD2-CG1 4.04Å; F354-I374 HydrophobicContact CE2-CD1 4.23Å; F354-I374 HydrophobicContact CE2-CG1 3.66Å; I370-I374 HydrophobicContact CG2-CG2 3.73Å; P371-I374 HydrophobicContact CB-CB 4.27Å; P371-I374 WeakPolarHBondContact O-CB 3.37Å; P371-I374 WeakPolarHBondContact O-CG2 3.14Å; P371-I374 PolarHBondContact O-N 3.22Å; F372-I374 PolarHBondContact O-N 3.31Å
375	F	95.7	Very high	96.5	Very high	11 Å²	11	56.4 Å²	56.4	5%	0.048	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105	9.5	176.8	-58.6	-47	0	0	0	113.5	Y346 F354 L360 I370 G373 R377 A378 L381 L384 W401	Y346-F375 HydrophobicContact CE1-CE1 4.42Å; Y346-F375 AromaticContact CE1-CZ 3.79Å; Y346-F375 HydrophobicContact CE1-CZ 3.79Å; F354-F375 HydrophobicContact CB-CD1 4.08Å; F354-F375 HydrophobicContact CB-CE1 4.4Å; F354-F375 HydrophobicContact CD1-CE1 4.24Å; F354-F375 AromaticContact CD2-CD1 3.75Å; F354-F375 HydrophobicContact CD2-CD1 3.75Å; F354-F375 AromaticContact CD2-CE1 3.64Å; F354-F375 HydrophobicContact CD2-CE1 3.64Å; F354-F375 HydrophobicContact CE2-CD1 4.4Å; F354-F375 AromaticContact CE2-CE1 3.89Å; F354-F375 HydrophobicContact CE2-CE1 3.89Å; F354-F375 AromaticContact CG-CD1 3.96Å; F354-F375 HydrophobicContact CG-CD1 3.96Å; F354-F375 AromaticContact CG-CE1 3.85Å; F354-F375 HydrophobicContact CG-CE1 3.85Å; F354-F375 HydrophobicContact CZ-CE1 4.36Å; L360-F375 HydrophobicContact CD2-CE1 3.83Å; L360-F375 HydrophobicContact CD2-CZ 3.88Å; I370-F375 HydrophobicContact CG2-CE2 4.11Å; G373-F375 PolarHBondContact O-N 3.41Å; G373-F375 VanDerWaalsContact O-N 3.16Å; F375-R377 PolarHBondContact O-N 3.41Å; F375-A378 HydrophobicContact CB-CB 4.01Å; F375-A378 HydrophobicContact CD1-CB 4.23Å; F375-A378 WeakPolarHBondContact O-CB 3.27Å; F375-A378 PolarHBondContact O-N 3.46Å; F375-L381 HydrophobicContact CD1-CD2 3.62Å; F375-L381 HydrophobicContact CD2-CD2 4.25Å; F375-L381 HydrophobicContact CE1-CD2 3.74Å; F375-L381 HydrophobicContact CE2-CD2 4.35Å; F375-L381 HydrophobicContact CG-CD2 3.89Å; F375-L381 HydrophobicContact CZ-CD2 4.1Å; F375-L384 HydrophobicContact CE2-CD2 3.77Å; F375-L384 HydrophobicContact CZ-CD1 4.3Å; F375-L384 HydrophobicContact CZ-CD2 4.15Å; F375-W401 HydrophobicContact CD2-CD2 4.15Å; F375-W401 AromaticContact CD2-CE2 3.56Å; F375-W401 HydrophobicContact CD2-CH2 4.14Å; F375-W401 AromaticContact CD2-CZ2 3.57Å; F375-W401 HydrophobicContact CD2-CZ2 3.57Å; F375-W401 AromaticContact CD2-NE1 3.79Å; F375-W401 HydrophobicContact CE2-CH2 4.08Å; F375-W401 AromaticContact CE2-CZ2 3.94Å; F375-W401 HydrophobicContact CE2-CZ2 3.94Å
376	S	94	Very high	96.5	Very high	69 Å²	69	55.9 Å²	55.9	48%	0.483	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.5	-178.2	59.3	0	0	0	0	114.7	P351 G373	P351-S376 VanDerWaalsContact CB-OG 3.3Å; P351-S376 WeakPolarHBondContact CB-OG 3.05Å; G373-S376 VanDerWaalsContact O-CB 3.23Å; G373-S376 WeakPolarHBondContact O-CB 3.46Å; G373-S376 PolarHBondContact O-N 3.2Å; G373-S376 PolarHBondContact O-OG 3.32Å
377	R	94.7	Very high	96.5	Very high	162 Å²	162	53.1 Å²	53.1	61%	0.611	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-2.4	174.8	-64.9	-177.3	177.7	-94.6	-0.7	113.7	P351 F375 K379	P351-R377 HydrophobicContact CB-CB 4.27Å; P351-R377 HydrophobicContact CB-CG 4.09Å; F375-R377 PolarHBondContact O-N 3.41Å; R377-K379 VanDerWaalsContact C-N 3.28Å; R377-K379 PolarHBondContact O-N 2.68Å
378	A	95.1	Very high	96.6	Very high	7 Å²	7	56 Å²	56	6%	0.058	27%	0.273	C	S	.	.			trans	-84.5	65.6	-175.8	0	0	0	0	0	111.2	F354 F375 V380 L381	F354-A378 HydrophobicContact CB-CB 3.82Å; F354-A378 WeakPolarHBondContact O-CA 3.15Å; F354-A378 VanDerWaalsContact O-CB 3.23Å; F354-A378 WeakPolarHBondContact O-CB 3.2Å; F375-A378 HydrophobicContact CB-CB 4.01Å; F375-A378 HydrophobicContact CD1-CB 4.23Å; F375-A378 WeakPolarHBondContact O-CB 3.27Å; F375-A378 PolarHBondContact O-N 3.46Å; A378-V380 PolarHBondContact O-N 2.68Å; A378-L381 HydrophobicContact CB-CB 3.9Å; A378-L381 HydrophobicContact CB-CD2 4.35Å; A378-L381 PolarHBondContact O-N 3.13Å
379	K	93.3	Very high	96.7	Very high	179 Å²	179	52.3 Å²	52.3	78%	0.778	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-15.9	-173.2	-64.7	-174.4	177.8	-176.1	0	114.6	R377 S403	R377-K379 VanDerWaalsContact C-N 3.28Å; R377-K379 PolarHBondContact O-N 2.68Å; K379-S403 VanDerWaalsContact O-CB 3.29Å; K379-S403 WeakPolarHBondContact O-CB 3.36Å; K379-S403 PolarHBondContact O-OG 2.86Å
380	V	96.3	Very high	96.7	Very high	70 Å²	70	50 Å²	50	42%	0.424	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	0.1	-176.9	-61.1	0	0	0	0	112.6	Y358 A378 S382	Y358-V380 VanDerWaalsContact CD2-O 3.3Å; Y358-V380 WeakPolarHBondContact CD2-O 3.36Å; A378-V380 PolarHBondContact O-N 2.68Å; V380-S382 PolarHBondContact O-N 3.18Å; V380-S382 VanDerWaalsContact O-N 3.07Å
381	L	97.4	Very high	96.8	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.01	24%	0.244	C	C	.	.			trans	-67.8	111.4	-179.3	-179	65.9	0	0	0	109.2	I357 L360 F375 A378 S403 M404	I357-L381 HydrophobicContact CG2-CD1 4.14Å; I357-L381 VanDerWaalsContact O-CA 3.29Å; I357-L381 WeakPolarHBondContact O-CA 3.48Å; I357-L381 PolarHBondContact O-N 3.29Å; L360-L381 HydrophobicContact CB-CD1 3.95Å; F375-L381 HydrophobicContact CD1-CD2 3.62Å; F375-L381 HydrophobicContact CD2-CD2 4.25Å; F375-L381 HydrophobicContact CE1-CD2 3.74Å; F375-L381 HydrophobicContact CE2-CD2 4.35Å; F375-L381 HydrophobicContact CG-CD2 3.89Å; F375-L381 HydrophobicContact CZ-CD2 4.1Å; A378-L381 HydrophobicContact CB-CB 3.9Å; A378-L381 HydrophobicContact CB-CD2 4.35Å; A378-L381 PolarHBondContact O-N 3.13Å; L381-S403 CarbonylContact O-C 3.46Å; L381-S403 WeakPolarHBondContact O-CB 3.25Å; L381-S403 PolarHBondContact O-OG 3.13Å; L381-M404 HydrophobicContact CD2-CE 3.96Å; L381-M404 HydrophobicContact CG-CE 4.08Å
382	S	98.1	Very high	96.9	Very high	6 Å²	6	50.9 Å²	50.9	4%	0.042	25%	0.249	C	C	.	.			trans	-110.8	-30.9	-172.9	-176.3	0	0	0	0	112	Y358 V380 V405 E406	Y358-S382 VanDerWaalsContact CZ-CB 3.49Å; Y358-S382 PolarHBondContact O-N 3.16Å; Y358-S382 PolarHBondContact OH-OG 3.44Å; V380-S382 PolarHBondContact O-N 3.18Å; V380-S382 VanDerWaalsContact O-N 3.07Å; S382-V405 PolarHBondContact O-N 3.03Å; S382-V405 WeakPolarHBondContact OG-CB 3.12Å; S382-V405 WeakPolarHBondContact OG-CG2 3.25Å; S382-E406 PolarHBondContact O-N 2.81Å
383	K	98.8	Very high	96.9	Very high	65 Å²	65	45.6 Å²	45.6	28%	0.283	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	123.6	-178.6	-55.6	-167.8	172.2	-137	0	111	Y358 T359 L360 E406	Y358-K383 PolarHBondContact O-N 3.34Å; Y358-K383 VanDerWaalsContact O-N 3.1Å; T359-K383 HydrophobicContact CG2-CB 4.05Å; L360-K383 PolarHBondContact N-O 3.22Å; K383-E406 WeakPolarHBondContact CA-O 3.49Å; K383-E406 HydrophobicContact CB-CB 4.44Å; K383-E406 WeakPolarHBondContact CE-OE2 3.49Å; K383-E406 HydrophobicContact CG-CB 4.09Å; K383-E406 IonicContact NZ-OE2 3.74Å; K383-E406 PolarHBondContact NZ-OE2 3.28Å
384	L	98.6	Very high	97.1	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	114.4	174.9	177.5	59.6	0	0	0	110.1	L360 F375 M386 W401 M404 E406 L407 N408	L360-L384 HydrophobicContact CB-CD1 4.06Å; L360-L384 HydrophobicContact CD2-CD1 3.83Å; L360-L384 HydrophobicContact CG-CD1 3.93Å; L360-L384 WeakPolarHBondContact O-CA 3.48Å; F375-L384 HydrophobicContact CE2-CD2 3.77Å; F375-L384 HydrophobicContact CZ-CD1 4.3Å; F375-L384 HydrophobicContact CZ-CD2 4.15Å; L384-M386 HydrophobicContact CD1-CG 3.83Å; L384-M386 HydrophobicContact CD1-SD 4.07Å; L384-M386 HydrophobicContact CD2-CG 4.31Å; L384-M386 HydrophobicContact CG-CG 3.92Å; L384-W401 HydrophobicContact CD2-CE3 4.45Å; L384-W401 HydrophobicContact CD2-CH2 4.32Å; L384-W401 HydrophobicContact CD2-CZ3 3.86Å; L384-M404 HydrophobicContact CB-CE 3.73Å; L384-M404 HydrophobicContact CB-SD 3.7Å; L384-M404 HydrophobicContact CD2-CE 4.08Å; L384-E406 PolarHBondContact N-O 2.92Å; L384-L407 HydrophobicContact CB-CD1 4.05Å; L384-L407 HydrophobicContact CD2-CD1 3.93Å; L384-L407 HydrophobicContact CG-CD1 4.1Å; L384-N408 PolarHBondContact O-N 2.8Å
385	N	98.8	Very high	97.1	Very high	28 Å²	28	45.8 Å²	45.8	15%	0.15	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	116.4	171.7	-176.1	6.1	0	0	0	110.5	L360 N361 M362 E363 K387 N408	L360-N385 PolarHBondContact O-N 3.07Å; N361-N385 HydrophobicContact CB-CB 4.39Å; N361-N385 PolarHBondContact OD1-ND2 3.08Å; M362-N385 PolarHBondContact N-O 3.14Å; E363-N385 PolarHBondContact OE2-ND2 2.95Å; N385-K387 WeakPolarHBondContact OD1-CB 3.38Å; N385-K387 PolarHBondContact OD1-N 2.76Å; N385-N408 HydrophobicContact CB-CB 4.43Å
386	M	98.4	Very high	97	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.266	C	S	.	.			trans	-123.8	23.2	176.4	-63.6	-67.3	-63.6	0	0	111.5	Y346 M362 I367 L384 N389 L391 N408 L409 N412	Y346-M386 HydrophobicContact CE2-CE 3.66Å; Y346-M386 HydrophobicContact CE2-SD 4.47Å; Y346-M386 VanDerWaalsContact OH-CE 3.24Å; Y346-M386 WeakPolarHBondContact OH-CE 3.35Å; Y346-M386 PolarHBondContact OH-SD 3.15Å; M362-M386 HydrophobicContact CB-SD 3.72Å; M362-M386 HydrophobicContact CG-SD 4.25Å; M362-M386 HydrophobicContact SD-SD 4.42Å; I367-M386 HydrophobicContact CB-CE 4.24Å; I367-M386 HydrophobicContact CD1-CE 3.93Å; I367-M386 HydrophobicContact CG2-CE 4.08Å; L384-M386 HydrophobicContact CD1-CG 3.83Å; L384-M386 HydrophobicContact CD1-SD 4.07Å; L384-M386 HydrophobicContact CD2-CG 4.31Å; L384-M386 HydrophobicContact CG-CG 3.92Å; M386-N389 PolarHBondContact O-ND2 3.01Å; M386-N389 VanDerWaalsContact O-ND2 3.11Å; M386-L391 HydrophobicContact CB-CD1 4.02Å; M386-L391 HydrophobicContact CE-CD1 4.16Å; M386-L391 HydrophobicContact CE-CD2 4.39Å; M386-N408 PolarHBondContact N-O 2.99Å; M386-L409 HydrophobicContact CB-CD2 3.89Å; M386-L409 HydrophobicContact CG-CD2 4.26Å; M386-N412 PolarHBondContact O-ND2 2.82Å
387	K	98.6	Very high	97	Very high	77 Å²	77	49.7 Å²	49.7	34%	0.335	25%	0.247	S	C	.	.			trans	-55.9	147.3	179.1	174.9	175.3	176.8	179.1	0	112	E363 H364 N385 N389 A410	E363-K387 CarbonylContact C-O 3.2Å; E363-K387 WeakPolarHBondContact CA-O 3.21Å; E363-K387 HydrophobicContact CB-CB 4.04Å; E363-K387 VanDerWaalsContact CB-O 3.25Å; E363-K387 WeakPolarHBondContact CB-O 3.21Å; H364-K387 PolarHBondContact N-O 2.98Å; N385-K387 WeakPolarHBondContact OD1-CB 3.38Å; N385-K387 PolarHBondContact OD1-N 2.76Å; K387-N389 PolarHBondContact O-ND2 2.78Å; K387-A410 CarbonylContact C-O 3.56Å; K387-A410 WeakPolarHBondContact CA-O 3.16Å; K387-A410 HydrophobicContact CB-CB 4.46Å; K387-A410 HydrophobicContact CD-CB 4.3Å; K387-A410 HydrophobicContact CG-CB 4.06Å
388	D	98.6	Very high	97	Very high	60 Å²	60	42 Å²	42	32%	0.321	22%	0.218	S	C	.	.	S	Bend	trans	52.5	66.8	177	-163.6	15	0	0	0	112.4	H364 N365 A410 T411	H364-D388 CarbonylContact C-O 3.58Å; H364-D388 WeakPolarHBondContact CA-O 3.3Å; H364-D388 IonicContact CE1-OD2 3.88Å; H364-D388 PolarHBondContact CE1-OD2 2.91Å; H364-D388 IonicContact CG-OD2 3.14Å; H364-D388 PolarHBondContact N-O 3.1Å; H364-D388 VanDerWaalsContact N-O 3.12Å; H364-D388 IonicContact ND1-OD2 3.75Å; H364-D388 PolarHBondContact ND1-OD2 2.99Å; N365-D388 PolarHBondContact N-O 2.92Å; N365-D388 VanDerWaalsContact N-O 3.11Å; D388-A410 PolarHBondContact N-O 3.04Å; D388-T411 WeakPolarHBondContact CA-O 3.3Å; D388-T411 HydrophobicContact CB-CG2 4.21Å; D388-T411 PolarHBondContact N-O 2.78Å
389	N	98.7	Very high	96.9	Very high	9 Å²	9	42.5 Å²	42.5	5%	0.048	22%	0.224	C	C	.	.	S	Bend	trans	-134.7	-167.3	175.7	-89.7	-79.5	0	0	0	109.1	M362 N365 I367 M386 K387 L391 T411 N412	M362-N389 PolarHBondContact O-ND2 3.13Å; N365-N389 WeakPolarHBondContact CA-OD1 3.46Å; N365-N389 WeakPolarHBondContact CB-OD1 3.21Å; N365-N389 PolarHBondContact O-OD1 3.32Å; I367-N389 WeakPolarHBondContact CB-OD1 3.31Å; I367-N389 PolarHBondContact N-OD1 3.27Å; M386-N389 PolarHBondContact O-ND2 3.01Å; M386-N389 VanDerWaalsContact O-ND2 3.11Å; K387-N389 PolarHBondContact O-ND2 2.78Å; N389-L391 HydrophobicContact CB-CG 4.36Å; N389-T411 PolarHBondContact N-O 2.85Å; N389-N412 WeakPolarHBondContact CA-OD1 3.26Å; N389-N412 WeakPolarHBondContact CB-OD1 3.36Å; N389-N412 PolarHBondContact O-OD1 3.02Å
390	Q	98.3	Very high	97	Very high	81 Å²	81	37.6 Å²	37.6	38%	0.379	21%	0.209	S	C	.	.			trans	-116.4	25.9	-177.2	-60	178.2	16.2	0	0	111.6	I367 N368 T392 N412	I367-Q390 CarbonylContact O-C 3.49Å; I367-Q390 VanDerWaalsContact O-C 3.31Å; I367-Q390 WeakPolarHBondContact O-CA 3.36Å; I367-Q390 PolarHBondContact O-N 3.34Å; N368-Q390 VanDerWaalsContact CA-O 3.3Å; N368-Q390 WeakPolarHBondContact CA-O 3.31Å; N368-Q390 HydrophobicContact CB-CB 4.19Å; Q390-T392 PolarHBondContact O-N 3.01Å; Q390-N412 PolarHBondContact N-OD1 3.06Å
391	L	98.3	Very high	97	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.19	C	C	.	.			trans	-62.9	123.5	-174.6	-62.9	177.4	0	0	0	110.6	I367 N368 I370 M386 N389 L409 N412 Q413 L414	I367-L391 HydrophobicContact CG2-CD2 4.07Å; I367-L391 PolarHBondContact O-N 2.96Å; N368-L391 WeakPolarHBondContact O-CA 3.46Å; I370-L391 HydrophobicContact CD1-CD1 4.18Å; I370-L391 HydrophobicContact CG1-CD1 4.34Å; I370-L391 HydrophobicContact CG1-CD2 3.92Å; M386-L391 HydrophobicContact CB-CD1 4.02Å; M386-L391 HydrophobicContact CE-CD1 4.16Å; M386-L391 HydrophobicContact CE-CD2 4.39Å; N389-L391 HydrophobicContact CB-CG 4.36Å; L391-L409 HydrophobicContact CD1-CD2 4.13Å; L391-N412 HydrophobicContact CB-CB 4.17Å; L391-N412 VanDerWaalsContact CB-OD1 3.23Å; L391-N412 WeakPolarHBondContact CB-OD1 3.5Å; L391-N412 VanDerWaalsContact CG-OD1 3.32Å; L391-N412 WeakPolarHBondContact CG-OD1 3.29Å; L391-N412 PolarHBondContact N-OD1 3.45Å; L391-Q413 CarbonylContact O-C 3.12Å; L391-Q413 VanDerWaalsContact O-CA 3.25Å; L391-Q413 WeakPolarHBondContact O-CA 3.35Å; L391-Q413 WeakPolarHBondContact O-CB 3.33Å; L391-Q413 PolarHBondContact O-N 2.78Å; L391-L414 HydrophobicContact CB-CD2 4.06Å; L391-L414 PolarHBondContact O-N 2.82Å
392	T	97	Very high	96.9	Very high	69 Å²	69	38.5 Å²	38.5	42%	0.423	21%	0.214	S	C	.	.			trans	-98.9	-26.1	179	54	0	0	0	0	113	N368 Q390 Q413	N368-T392 PolarHBondContact O-N 2.97Å; Q390-T392 PolarHBondContact O-N 3.01Å; T392-Q413 HydrophobicContact CG2-CB 4.3Å
393	A	97.1	Very high	96.8	Very high	38 Å²	38	39.6 Å²	39.6	31%	0.314	22%	0.222	S	C	.	.			trans	-156.8	158.2	177.6	0	0	0	0	0	111.5
394	L	97.4	Very high	96.8	Very high	17 Å²	17	36.6 Å²	36.6	9%	0.089	21%	0.208	C	C	.	.			trans	-87.4	153.4	169.9	-66.1	173.1	0	0	0	111.1	I370 F398 L409 L414 I417 P418	I370-L394 HydrophobicContact CD1-CD2 4.18Å; L394-F398 HydrophobicContact CB-CB 4.48Å; L394-F398 HydrophobicContact CB-CD2 4.36Å; L394-F398 HydrophobicContact CB-CG 4.35Å; L394-F398 HydrophobicContact CD1-CD1 4.34Å; L394-F398 HydrophobicContact CD1-CD2 4.01Å; L394-F398 HydrophobicContact CD1-CE1 4.12Å; L394-F398 HydrophobicContact CD1-CE2 3.8Å; L394-F398 HydrophobicContact CD1-CG 4.28Å; L394-F398 HydrophobicContact CD1-CZ 3.86Å; L394-F398 HydrophobicContact CD2-CD2 4.39Å; L394-F398 HydrophobicContact CD2-CE2 4.45Å; L394-F398 HydrophobicContact CG-CD2 4.49Å; L394-L409 HydrophobicContact CD1-CD1 4.1Å; L394-L409 HydrophobicContact CD2-CD1 3.84Å; L394-L409 HydrophobicContact CD2-CD2 4.47Å; L394-L409 HydrophobicContact CG-CD1 4.47Å; L394-L414 HydrophobicContact CG-CD2 4.39Å; L394-I417 HydrophobicContact CD1-CD1 3.9Å; L394-P418 HydrophobicContact CB-CG 4.18Å
395	P	96	Very high	96.8	Very high	9 Å²	9	38.3 Å²	38.3	6%	0.058	22%	0.219	C	C	.	.			trans	-74.5	161.1	-177.9	31.8	-34.1	0	0	0	112.2	I370 D397 F398 W401	I370-P395 HydrophobicContact CB-CG 4.16Å; I370-P395 HydrophobicContact CG2-CG 4.13Å; P395-D397 VanDerWaalsContact C-N 3.26Å; P395-D397 WeakPolarHBondContact CB-OD1 3.36Å; P395-D397 PolarHBondContact O-N 3.14Å; P395-F398 WeakPolarHBondContact O-CB 3.38Å; P395-F398 PolarHBondContact O-N 2.95Å; P395-F398 VanDerWaalsContact O-N 3.14Å; P395-W401 HydrophobicContact CG-CH2 4.28Å; P395-W401 HydrophobicContact CG-CZ2 3.72Å
396	L	93.2	Very high	96.8	Very high	148 Å²	148	40 Å²	40	78%	0.775	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-22.4	-175.8	-63.9	175.6	0	0	0	113.9	F372 F398	F372-L396 HydrophobicContact CD2-CB 4.06Å; F372-L396 HydrophobicContact CE2-CB 4.07Å; L396-F398 VanDerWaalsContact C-N 3.31Å
397	D	94.5	Very high	96.8	Very high	15 Å²	15	40 Å²	40	8%	0.08	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	13.9	175.9	64.4	-47.7	0	0	0	112.9	F372 G373 P395 G399 T400	F372-D397 WeakPolarHBondContact CA-OD1 3.44Å; F372-D397 HydrophobicContact CD2-CB 3.97Å; F372-D397 VanDerWaalsContact CD2-OD1 3.3Å; F372-D397 WeakPolarHBondContact CD2-OD1 3.21Å; F372-D397 HydrophobicContact CE2-CB 3.62Å; F372-D397 HydrophobicContact CZ-CB 4.18Å; G373-D397 WeakPolarHBondContact CA-OD2 3.33Å; G373-D397 PolarHBondContact N-OD1 2.96Å; G373-D397 PolarHBondContact N-OD2 3.12Å; P395-D397 VanDerWaalsContact C-N 3.26Å; P395-D397 WeakPolarHBondContact CB-OD1 3.36Å; P395-D397 PolarHBondContact O-N 3.14Å; D397-G399 PolarHBondContact O-N 2.99Å; D397-G399 VanDerWaalsContact O-N 3.17Å; D397-T400 HydrophobicContact CB-CG2 4.24Å; D397-T400 WeakPolarHBondContact O-CB 3.44Å; D397-T400 WeakPolarHBondContact O-CG2 3.48Å; D397-T400 PolarHBondContact O-N 2.97Å; D397-T400 PolarHBondContact O-OG1 2.92Å
398	F	94	Very high	96.8	Very high	1 Å²	1	37.6 Å²	37.6	0%	0.004	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-50.8	-39.2	179.8	172	-109.2	0	0	0	113.1	L394 P395 L396 T400 W401 L407 I421 L424	L394-F398 HydrophobicContact CB-CB 4.48Å; L394-F398 HydrophobicContact CB-CD2 4.36Å; L394-F398 HydrophobicContact CB-CG 4.35Å; L394-F398 HydrophobicContact CD1-CD1 4.34Å; L394-F398 HydrophobicContact CD1-CD2 4.01Å; L394-F398 HydrophobicContact CD1-CE1 4.12Å; L394-F398 HydrophobicContact CD1-CE2 3.8Å; L394-F398 HydrophobicContact CD1-CG 4.28Å; L394-F398 HydrophobicContact CD1-CZ 3.86Å; L394-F398 HydrophobicContact CD2-CD2 4.39Å; L394-F398 HydrophobicContact CD2-CE2 4.45Å; L394-F398 HydrophobicContact CG-CD2 4.49Å; P395-F398 WeakPolarHBondContact O-CB 3.38Å; P395-F398 PolarHBondContact O-N 2.95Å; P395-F398 VanDerWaalsContact O-N 3.14Å; L396-F398 VanDerWaalsContact C-N 3.31Å; F398-T400 PolarHBondContact O-N 2.93Å; F398-W401 AromaticContact CD2-CD2 3.93Å; F398-W401 HydrophobicContact CD2-CD2 3.93Å; F398-W401 AromaticContact CD2-CE3 3.51Å; F398-W401 HydrophobicContact CD2-CE3 3.51Å; F398-W401 AromaticContact CD2-CH2 3.69Å; F398-W401 HydrophobicContact CD2-CH2 3.69Å; F398-W401 HydrophobicContact CD2-CZ2 4.07Å; F398-W401 AromaticContact CD2-CZ3 3.4Å; F398-W401 HydrophobicContact CD2-CZ3 3.4Å; F398-W401 HydrophobicContact CE2-CD2 4.38Å; F398-W401 AromaticContact CE2-CE3 3.57Å; F398-W401 HydrophobicContact CE2-CE3 3.57Å; F398-W401 HydrophobicContact CE2-CH2 4.21Å; F398-W401 AromaticContact CE2-CZ3 3.49Å; F398-W401 HydrophobicContact CE2-CZ3 3.49Å; F398-W401 VanDerWaalsContact CE2-CZ3 3.49Å; F398-W401 VanDerWaalsContact O-CG 3.29Å; F398-W401 PolarHBondContact O-N 2.96Å; F398-L407 HydrophobicContact CE2-CD2 3.76Å; F398-L407 HydrophobicContact CZ-CD2 3.89Å; F398-I421 HydrophobicContact CE1-CB 3.74Å; F398-I421 HydrophobicContact CE1-CD1 4.26Å; F398-I421 HydrophobicContact CE1-CG1 3.84Å; F398-I421 HydrophobicContact CZ-CD1 4.44Å; F398-I421 HydrophobicContact CZ-CG1 4.31Å; F398-L424 HydrophobicContact CD1-CD1 4.23Å; F398-L424 HydrophobicContact CE1-CD1 3.93Å; F398-L424 HydrophobicContact CE1-CD2 4.13Å; F398-L424 HydrophobicContact CE2-CD1 4.45Å; F398-L424 HydrophobicContact CE2-CD2 3.86Å; F398-L424 HydrophobicContact CZ-CD1 4.04Å; F398-L424 HydrophobicContact CZ-CD2 3.46Å; F398-L424 VanDerWaalsContact CZ-CD2 3.46Å; F398-L424 HydrophobicContact CZ-CG 4.42Å; F398-L424 WeakPolarHBondContact O-CD1 3.24Å
399	G	94.5	Very high	96.8	Very high	17 Å²	17	34.8 Å²	34.8	18%	0.175	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-65	-8.9	177.9	0	0	0	0	0	115.4	D397 W401 D420 G423	D397-G399 PolarHBondContact O-N 2.99Å; D397-G399 VanDerWaalsContact O-N 3.17Å; G399-W401 VanDerWaalsContact C-N 3.3Å; G399-D420 WeakPolarHBondContact CA-O 3.46Å; G399-G423 WeakPolarHBondContact O-CA 3.29Å
400	T	94.9	Very high	96.8	Very high	76 Å²	76	34.5 Å²	34.5	47%	0.466	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-81.2	-7.5	177.5	67.5	0	0	0	0	113.6	D397 F398 T402	D397-T400 HydrophobicContact CB-CG2 4.24Å; D397-T400 WeakPolarHBondContact O-CB 3.44Å; D397-T400 WeakPolarHBondContact O-CG2 3.48Å; D397-T400 PolarHBondContact O-N 2.97Å; D397-T400 PolarHBondContact O-OG1 2.92Å; F398-T400 PolarHBondContact O-N 2.93Å; T400-T402 PolarHBondContact O-N 2.94Å
401	W	96	Very high	96.9	Very high	8 Å²	8	32.7 Å²	32.7	3%	0.03	20%	0.195	C	C	.	.			trans	-79.4	50.9	-175.8	-53.9	-4.3	0	0	0	112.5	I370 F375 L384 P395 F398 G399 S403 M404 L407 L424	I370-W401 HydrophobicContact CD1-CH2 3.77Å; I370-W401 HydrophobicContact CG2-CH2 4.32Å; I370-W401 HydrophobicContact CG2-CZ2 4.24Å; F375-W401 HydrophobicContact CD2-CD2 4.15Å; F375-W401 AromaticContact CD2-CE2 3.56Å; F375-W401 HydrophobicContact CD2-CH2 4.14Å; F375-W401 AromaticContact CD2-CZ2 3.57Å; F375-W401 HydrophobicContact CD2-CZ2 3.57Å; F375-W401 AromaticContact CD2-NE1 3.79Å; F375-W401 HydrophobicContact CE2-CH2 4.08Å; F375-W401 AromaticContact CE2-CZ2 3.94Å; F375-W401 HydrophobicContact CE2-CZ2 3.94Å; L384-W401 HydrophobicContact CD2-CE3 4.45Å; L384-W401 HydrophobicContact CD2-CH2 4.32Å; L384-W401 HydrophobicContact CD2-CZ3 3.86Å; P395-W401 HydrophobicContact CG-CH2 4.28Å; P395-W401 HydrophobicContact CG-CZ2 3.72Å; F398-W401 AromaticContact CD2-CD2 3.93Å; F398-W401 HydrophobicContact CD2-CD2 3.93Å; F398-W401 AromaticContact CD2-CE3 3.51Å; F398-W401 HydrophobicContact CD2-CE3 3.51Å; F398-W401 AromaticContact CD2-CH2 3.69Å; F398-W401 HydrophobicContact CD2-CH2 3.69Å; F398-W401 HydrophobicContact CD2-CZ2 4.07Å; F398-W401 AromaticContact CD2-CZ3 3.4Å; F398-W401 HydrophobicContact CD2-CZ3 3.4Å; F398-W401 HydrophobicContact CE2-CD2 4.38Å; F398-W401 AromaticContact CE2-CE3 3.57Å; F398-W401 HydrophobicContact CE2-CE3 3.57Å; F398-W401 HydrophobicContact CE2-CH2 4.21Å; F398-W401 AromaticContact CE2-CZ3 3.49Å; F398-W401 HydrophobicContact CE2-CZ3 3.49Å; F398-W401 VanDerWaalsContact CE2-CZ3 3.49Å; F398-W401 VanDerWaalsContact O-CG 3.29Å; F398-W401 PolarHBondContact O-N 2.96Å; G399-W401 VanDerWaalsContact C-N 3.3Å; W401-S403 VanDerWaalsContact C-N 3.26Å; W401-S403 PolarHBondContact O-N 3.02Å; W401-M404 HydrophobicContact CB-CB 4.43Å; W401-M404 HydrophobicContact CB-CE 4.27Å; W401-M404 HydrophobicContact CD2-CE 4.38Å; W401-M404 HydrophobicContact CE3-CE 3.9Å; W401-M404 VanDerWaalsContact O-CB 3.25Å; W401-M404 WeakPolarHBondContact O-CB 3.43Å; W401-M404 PolarHBondContact O-N 2.97Å; W401-M404 VanDerWaalsContact O-N 3.11Å; W401-L407 HydrophobicContact CZ3-CD1 4.42Å; W401-L424 HydrophobicContact CB-CD1 4.43Å; W401-L424 HydrophobicContact CB-CG 4.37Å
402	T	95.4	Very high	96.9	Very high	83 Å²	83	33.1 Å²	33.1	51%	0.509	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-21.8	-170.3	54.5	0	0	0	0	114.7	T400 G423 S426	T400-T402 PolarHBondContact O-N 2.94Å; T402-G423 WeakPolarHBondContact CG2-O 3.26Å; T402-S426 VanDerWaalsContact O-CB 3.28Å; T402-S426 WeakPolarHBondContact O-CB 3.42Å; T402-S426 PolarHBondContact O-OG 3.07Å
403	S	96.6	Very high	96.9	Very high	29 Å²	29	34.3 Å²	34.3	20%	0.203	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-8.6	176.9	57	0	0	0	0	114.1	K379 L381 W401 V405	K379-S403 VanDerWaalsContact O-CB 3.29Å; K379-S403 WeakPolarHBondContact O-CB 3.36Å; K379-S403 PolarHBondContact O-OG 2.86Å; L381-S403 CarbonylContact O-C 3.46Å; L381-S403 WeakPolarHBondContact O-CB 3.25Å; L381-S403 PolarHBondContact O-OG 3.13Å; W401-S403 VanDerWaalsContact C-N 3.26Å; W401-S403 PolarHBondContact O-N 3.02Å; S403-V405 PolarHBondContact O-N 3.2Å
404	M	97.9	Very high	97	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.183	C	C	.	.			trans	-67.1	130.4	-175.8	-159.6	70.6	69.2	0	0	110.8	L381 L384 W401 L407 S426 L427	L381-M404 HydrophobicContact CD2-CE 3.96Å; L381-M404 HydrophobicContact CG-CE 4.08Å; L384-M404 HydrophobicContact CB-CE 3.73Å; L384-M404 HydrophobicContact CB-SD 3.7Å; L384-M404 HydrophobicContact CD2-CE 4.08Å; W401-M404 HydrophobicContact CB-CB 4.43Å; W401-M404 HydrophobicContact CB-CE 4.27Å; W401-M404 HydrophobicContact CD2-CE 4.38Å; W401-M404 HydrophobicContact CE3-CE 3.9Å; W401-M404 VanDerWaalsContact O-CB 3.25Å; W401-M404 WeakPolarHBondContact O-CB 3.43Å; W401-M404 PolarHBondContact O-N 2.97Å; W401-M404 VanDerWaalsContact O-N 3.11Å; M404-L407 HydrophobicContact CG-CB 4.18Å; M404-S426 CarbonylContact O-C 3.41Å; M404-S426 WeakPolarHBondContact O-CB 3.41Å; M404-L427 HydrophobicContact CB-CD1 4.15Å; M404-L427 HydrophobicContact CG-CD1 3.79Å; M404-L427 WeakPolarHBondContact O-CA 3.36Å; M404-L427 PolarHBondContact O-N 2.86Å; M404-L427 VanDerWaalsContact O-N 3.15Å
405	V	98.6	Very high	97	Very high	38 Å²	38	36 Å²	36	23%	0.23	20%	0.202	C	C	.	.	S	Bend	trans	-112.6	-38.4	177.1	176.1	0	0	0	0	110.3	S382 S403 E428 V429	S382-V405 PolarHBondContact O-N 3.03Å; S382-V405 WeakPolarHBondContact OG-CB 3.12Å; S382-V405 WeakPolarHBondContact OG-CG2 3.25Å; S403-V405 PolarHBondContact O-N 3.2Å; V405-E428 HydrophobicContact CG1-CB 3.96Å; V405-E428 HydrophobicContact CG1-CG 3.94Å; V405-E428 PolarHBondContact O-N 3.36Å; V405-V429 PolarHBondContact O-N 3.04Å
406	E	98.8	Very high	97	Very high	65 Å²	65	41.9 Å²	41.9	30%	0.304	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	119.1	-179.6	-175.1	-179.7	156	0	0	110	S382 K383 L384 V429	S382-E406 PolarHBondContact O-N 2.81Å; K383-E406 WeakPolarHBondContact CA-O 3.49Å; K383-E406 HydrophobicContact CB-CB 4.44Å; K383-E406 WeakPolarHBondContact CE-OE2 3.49Å; K383-E406 HydrophobicContact CG-CB 4.09Å; K383-E406 IonicContact NZ-OE2 3.74Å; K383-E406 PolarHBondContact NZ-OE2 3.28Å; L384-E406 PolarHBondContact N-O 2.92Å; E406-V429 WeakPolarHBondContact CA-O 3.24Å; E406-V429 HydrophobicContact CB-CB 4.41Å; E406-V429 HydrophobicContact CG-CB 4.07Å; E406-V429 HydrophobicContact CG-CG1 4.19Å
407	L	98.8	Very high	97.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	112.4	178.3	179.4	59.1	0	0	0	109.8	L384 F398 W401 M404 L409 L424 L427 V429 L430 I431	L384-L407 HydrophobicContact CB-CD1 4.05Å; L384-L407 HydrophobicContact CD2-CD1 3.93Å; L384-L407 HydrophobicContact CG-CD1 4.1Å; F398-L407 HydrophobicContact CE2-CD2 3.76Å; F398-L407 HydrophobicContact CZ-CD2 3.89Å; W401-L407 HydrophobicContact CZ3-CD1 4.42Å; M404-L407 HydrophobicContact CG-CB 4.18Å; L407-L409 HydrophobicContact CD1-CD1 4.3Å; L407-L409 HydrophobicContact CD1-CD2 3.88Å; L407-L409 HydrophobicContact CD1-CG 3.92Å; L407-L409 HydrophobicContact CD2-CD1 4.03Å; L407-L409 HydrophobicContact CD2-CG 4.45Å; L407-L409 HydrophobicContact CG-CD1 4.1Å; L407-L409 HydrophobicContact CG-CD2 4.47Å; L407-L409 HydrophobicContact CG-CG 3.97Å; L407-L424 HydrophobicContact CD2-CD2 3.98Å; L407-L427 HydrophobicContact CB-CD1 3.79Å; L407-V429 PolarHBondContact N-O 3.13Å; L407-L430 HydrophobicContact CB-CD1 4.18Å; L407-L430 HydrophobicContact CD2-CD1 4.01Å; L407-L430 HydrophobicContact CG-CD1 4.15Å; L407-I431 PolarHBondContact O-N 2.92Å
408	N	98.9	Very high	97.3	Very high	25 Å²	25	36.2 Å²	36.2	13%	0.134	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	113.3	176.1	-172.9	-12.3	0	0	0	110.5	L384 N385 M386 A410 I431	L384-N408 PolarHBondContact O-N 2.8Å; N385-N408 HydrophobicContact CB-CB 4.43Å; M386-N408 PolarHBondContact N-O 2.99Å; N408-A410 VanDerWaalsContact OD1-CB 3.29Å; N408-A410 WeakPolarHBondContact OD1-CB 3.28Å; N408-A410 PolarHBondContact OD1-N 2.86Å; N408-I431 HydrophobicContact CB-CB 4.25Å; N408-I431 HydrophobicContact CB-CG1 4.48Å
409	L	98.8	Very high	97.4	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.219	C	C	.	.			trans	-121.7	21.8	177.4	-55.1	171.1	0	0	0	111.2	M386 L391 L394 L407 N412 L414 I431 L432 N435	M386-L409 HydrophobicContact CB-CD2 3.89Å; M386-L409 HydrophobicContact CG-CD2 4.26Å; L391-L409 HydrophobicContact CD1-CD2 4.13Å; L394-L409 HydrophobicContact CD1-CD1 4.1Å; L394-L409 HydrophobicContact CD2-CD1 3.84Å; L394-L409 HydrophobicContact CD2-CD2 4.47Å; L394-L409 HydrophobicContact CG-CD1 4.47Å; L407-L409 HydrophobicContact CD1-CD1 4.3Å; L407-L409 HydrophobicContact CD1-CD2 3.88Å; L407-L409 HydrophobicContact CD1-CG 3.92Å; L407-L409 HydrophobicContact CD2-CD1 4.03Å; L407-L409 HydrophobicContact CD2-CG 4.45Å; L407-L409 HydrophobicContact CG-CD1 4.1Å; L407-L409 HydrophobicContact CG-CD2 4.47Å; L407-L409 HydrophobicContact CG-CG 3.97Å; L409-N412 PolarHBondContact O-ND2 2.95Å; L409-L414 HydrophobicContact CB-CD1 3.99Å; L409-L414 HydrophobicContact CD1-CD1 3.97Å; L409-I431 PolarHBondContact N-O 2.9Å; L409-L432 HydrophobicContact CB-CD2 4.05Å; L409-L432 HydrophobicContact CD1-CD2 3.87Å; L409-L432 HydrophobicContact CG-CD2 4.47Å; L409-N435 PolarHBondContact O-ND2 3.39Å
410	A	98.8	Very high	97.4	Very high	3 Å²	3	43.5 Å²	43.5	3%	0.025	23%	0.231	C	C	.	.			trans	-60	154.2	-177.4	0	0	0	0	0	112.6	K387 D388 N408 N412 I431 S433	K387-A410 CarbonylContact C-O 3.56Å; K387-A410 WeakPolarHBondContact CA-O 3.16Å; K387-A410 HydrophobicContact CB-CB 4.46Å; K387-A410 HydrophobicContact CD-CB 4.3Å; K387-A410 HydrophobicContact CG-CB 4.06Å; D388-A410 PolarHBondContact N-O 3.04Å; N408-A410 VanDerWaalsContact OD1-CB 3.29Å; N408-A410 WeakPolarHBondContact OD1-CB 3.28Å; N408-A410 PolarHBondContact OD1-N 2.86Å; A410-N412 PolarHBondContact O-ND2 3.47Å; A410-N412 VanDerWaalsContact O-ND2 3.1Å; A410-I431 HydrophobicContact CB-CG2 3.89Å; A410-S433 CarbonylContact C-O 3.14Å; A410-S433 WeakPolarHBondContact CA-O 3.4Å; A410-S433 WeakPolarHBondContact CB-OG 3.28Å
411	T	98.6	Very high	97.5	Very high	43 Å²	43	40 Å²	40	26%	0.264	21%	0.209	S	C	.	.	S	Bend	trans	55	63.2	176.3	-44.9	0	0	0	0	111.1	D388 N389 S433 N434	D388-T411 WeakPolarHBondContact CA-O 3.3Å; D388-T411 HydrophobicContact CB-CG2 4.21Å; D388-T411 PolarHBondContact N-O 2.78Å; N389-T411 PolarHBondContact N-O 2.85Å; T411-S433 PolarHBondContact N-O 3.1Å; T411-N434 WeakPolarHBondContact CA-O 3.22Å; T411-N434 PolarHBondContact N-O 2.77Å
412	N	98.8	Very high	97.5	Very high	10 Å²	10	41.8 Å²	41.8	5%	0.053	22%	0.222	C	C	.	.	S	Bend	trans	-136.4	-168.7	177.1	-86.3	-79.1	0	0	0	109.6	M386 N389 Q390 L391 L409 A410 L414 N434 N435	M386-N412 PolarHBondContact O-ND2 2.82Å; N389-N412 WeakPolarHBondContact CA-OD1 3.26Å; N389-N412 WeakPolarHBondContact CB-OD1 3.36Å; N389-N412 PolarHBondContact O-OD1 3.02Å; Q390-N412 PolarHBondContact N-OD1 3.06Å; L391-N412 HydrophobicContact CB-CB 4.17Å; L391-N412 VanDerWaalsContact CB-OD1 3.23Å; L391-N412 WeakPolarHBondContact CB-OD1 3.5Å; L391-N412 VanDerWaalsContact CG-OD1 3.32Å; L391-N412 WeakPolarHBondContact CG-OD1 3.29Å; L391-N412 PolarHBondContact N-OD1 3.45Å; L409-N412 PolarHBondContact O-ND2 2.95Å; A410-N412 PolarHBondContact O-ND2 3.47Å; A410-N412 VanDerWaalsContact O-ND2 3.1Å; N412-L414 HydrophobicContact CB-CG 4.29Å; N412-N434 PolarHBondContact N-O 3.28Å; N412-N434 VanDerWaalsContact N-O 3.12Å; N412-N435 WeakPolarHBondContact CA-OD1 3.23Å; N412-N435 WeakPolarHBondContact CB-OD1 3.39Å; N412-N435 PolarHBondContact O-OD1 2.82Å
413	Q	98.3	Very high	97.6	Very high	93 Å²	93	38.4 Å²	38.4	44%	0.435	20%	0.204	S	C	.	.			trans	-115.7	28.7	-178.6	-59.7	174	37.3	0	0	111.4	L391 T392 N415 N435 L436	L391-Q413 CarbonylContact O-C 3.12Å; L391-Q413 VanDerWaalsContact O-CA 3.25Å; L391-Q413 WeakPolarHBondContact O-CA 3.35Å; L391-Q413 WeakPolarHBondContact O-CB 3.33Å; L391-Q413 PolarHBondContact O-N 2.78Å; T392-Q413 HydrophobicContact CG2-CB 4.3Å; Q413-N415 PolarHBondContact O-N 3.36Å; Q413-N435 PolarHBondContact N-OD1 2.97Å; Q413-L436 HydrophobicContact CB-CD1 4.42Å
414	L	98.4	Very high	97.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.195	C	C	.	.			trans	-70.1	124.1	-177.2	-61.4	173.5	0	0	0	110	L391 L394 L409 N412 I417 L432 N435 L436 L437	L391-L414 HydrophobicContact CB-CD2 4.06Å; L391-L414 PolarHBondContact O-N 2.82Å; L394-L414 HydrophobicContact CG-CD2 4.39Å; L409-L414 HydrophobicContact CB-CD1 3.99Å; L409-L414 HydrophobicContact CD1-CD1 3.97Å; N412-L414 HydrophobicContact CB-CG 4.29Å; L414-I417 HydrophobicContact CD1-CD1 4.26Å; L414-L432 HydrophobicContact CD1-CD2 4.45Å; L414-N435 HydrophobicContact CB-CB 4.4Å; L414-N435 VanDerWaalsContact CB-OD1 3.29Å; L414-N435 WeakPolarHBondContact CB-OD1 3.43Å; L414-N435 WeakPolarHBondContact CG-OD1 3.38Å; L414-N435 PolarHBondContact N-OD1 2.58Å; L414-L436 CarbonylContact O-C 3.26Å; L414-L436 VanDerWaalsContact O-C 3.26Å; L414-L436 VanDerWaalsContact O-CA 3.3Å; L414-L436 WeakPolarHBondContact O-CA 3.37Å; L414-L436 WeakPolarHBondContact O-CB 3.45Å; L414-L436 PolarHBondContact O-N 3.34Å; L414-L437 HydrophobicContact CB-CD2 4.23Å; L414-L437 PolarHBondContact O-N 2.95Å
415	N	97.2	Very high	97.5	Very high	91 Å²	91	43 Å²	43	49%	0.487	22%	0.224	S	C	.	.			trans	-99.3	-15	176.9	62.6	31.5	0	0	0	113.8	Q413 L436	Q413-N415 PolarHBondContact O-N 3.36Å; N415-L436 HydrophobicContact CB-CB 4.48Å
416	K	97	Very high	97.4	Very high	133 Å²	133	42.8 Å²	42.8	58%	0.578	22%	0.224	S	C	*	.			trans	-154.8	153.9	178.6	70.2	-172.1	180	172.6	0	111.1
417	I	97.6	Very high	97.4	Very high	13 Å²	13	39.7 Å²	39.7	7%	0.067	21%	0.21	C	C	.	.			trans	-108.8	131.7	166.7	-56.7	-58.7	0	0	0	108	L394 L414 I421 L432 L437 P441	L394-I417 HydrophobicContact CD1-CD1 3.9Å; L414-I417 HydrophobicContact CD1-CD1 4.26Å; I417-I421 HydrophobicContact CG2-CB 4.14Å; I417-I421 HydrophobicContact CG2-CD1 3.61Å; I417-I421 HydrophobicContact CG2-CG1 4.43Å; I417-L432 HydrophobicContact CD1-CD1 4.21Å; I417-L432 HydrophobicContact CD1-CD2 3.76Å; I417-L432 HydrophobicContact CG1-CD1 4.07Å; I417-L437 HydrophobicContact CD1-CD1 4.47Å; I417-L437 HydrophobicContact CD1-CD2 4.14Å; I417-L437 HydrophobicContact CG1-CD1 4.14Å; I417-L437 HydrophobicContact CG1-CD2 3.93Å; I417-P441 HydrophobicContact CB-CG 4.07Å; I417-P441 HydrophobicContact CG2-CG 4.04Å
418	P	96.4	Very high	97.4	Very high	30 Å²	30	42.2 Å²	42.2	20%	0.195	22%	0.222	C	C	.	.			trans	-63.9	151.9	178	-21.3	33.2	0	0	0	113.4	L394 D420 I421	L394-P418 HydrophobicContact CB-CG 4.18Å; P418-D420 PolarHBondContact O-N 3.06Å; P418-I421 WeakPolarHBondContact O-CB 3.26Å; P418-I421 WeakPolarHBondContact O-CG2 3.32Å; P418-I421 PolarHBondContact O-N 3.2Å; P418-I421 VanDerWaalsContact O-N 3.17Å
419	E	94.9	Very high	97.4	Very high	91 Å²	91	42.5 Å²	42.5	43%	0.425	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-61.3	-24.8	173.4	-73.2	-64.8	159.2	0	0	112.8	I421 C422 P441 H442 G443	E419-I421 PolarHBondContact O-N 2.93Å; E419-C422 PolarHBondContact O-N 2.8Å; E419-C422 PolarHBondContact O-SG 3.37Å; E419-P441 HydrophobicContact CG-CB 4.19Å; E419-P441 WeakPolarHBondContact OE1-CA 3.43Å; E419-P441 WeakPolarHBondContact OE1-CB 3.19Å; E419-H442 IonicContact OE1-CD2 3.83Å; E419-H442 PolarHBondContact OE1-N 3.03Å; E419-H442 PolarHBondContact OE2-N 3.3Å; E419-G443 PolarHBondContact OE2-N 2.92Å
420	D	94.5	Very high	97.4	Very high	81 Å²	81	42.5 Å²	42.5	43%	0.433	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-62.3	-6.6	175.8	-57.6	-41.8	0	0	0	113.5	G399 P418 C422 G423	G399-D420 WeakPolarHBondContact CA-O 3.46Å; P418-D420 PolarHBondContact O-N 3.06Å; D420-C422 PolarHBondContact O-N 2.88Å; D420-G423 PolarHBondContact O-N 2.95Å
421	I	97.1	Very high	97.4	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-52.3	-26.2	169.5	-166.9	159.1	0	0	0	112.8	F398 I417 P418 E419 G423 L424 L430 P441 I444 L447	F398-I421 HydrophobicContact CE1-CB 3.74Å; F398-I421 HydrophobicContact CE1-CD1 4.26Å; F398-I421 HydrophobicContact CE1-CG1 3.84Å; F398-I421 HydrophobicContact CZ-CD1 4.44Å; F398-I421 HydrophobicContact CZ-CG1 4.31Å; I417-I421 HydrophobicContact CG2-CB 4.14Å; I417-I421 HydrophobicContact CG2-CD1 3.61Å; I417-I421 HydrophobicContact CG2-CG1 4.43Å; P418-I421 WeakPolarHBondContact O-CB 3.26Å; P418-I421 WeakPolarHBondContact O-CG2 3.32Å; P418-I421 PolarHBondContact O-N 3.2Å; P418-I421 VanDerWaalsContact O-N 3.17Å; E419-I421 PolarHBondContact O-N 2.93Å; I421-G423 PolarHBondContact O-N 3.28Å; I421-L424 PolarHBondContact O-N 2.85Å; I421-L430 HydrophobicContact CD1-CD2 3.87Å; I421-P441 HydrophobicContact CG2-CG 3.77Å; I421-I444 HydrophobicContact CD1-CD1 3.88Å; I421-L447 HydrophobicContact CD1-CD1 4.16Å; I421-L447 HydrophobicContact CG1-CD1 4.09Å; I421-L447 HydrophobicContact CG1-CD2 4.41Å; I421-L447 WeakPolarHBondContact O-CD2 3.34Å
422	C	96.4	Very high	97.4	Very high	46 Å²	46	41.3 Å²	41.3	31%	0.311	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-55.7	-21.1	174.4	59.8	0	0	0	0	114.3	E419 D420	E419-C422 PolarHBondContact O-N 2.8Å; E419-C422 PolarHBondContact O-SG 3.37Å; D420-C422 PolarHBondContact O-N 2.88Å
423	G	96.5	Very high	97.4	Very high	13 Å²	13	41.6 Å²	41.6	13%	0.134	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-74.9	-17	175.6	0	0	0	0	0	115	G399 T402 D420 I421 M425	G399-G423 WeakPolarHBondContact O-CA 3.29Å; T402-G423 WeakPolarHBondContact CG2-O 3.26Å; D420-G423 PolarHBondContact O-N 2.95Å; I421-G423 PolarHBondContact O-N 3.28Å; G423-M425 PolarHBondContact O-N 3.38Å
424	L	97.4	Very high	97.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.215	C	C	.	.			trans	-81.5	51.6	-178.8	-76.5	65.3	0	0	0	111.6	F398 W401 L407 I421 S426 L427 L447	F398-L424 HydrophobicContact CD1-CD1 4.23Å; F398-L424 HydrophobicContact CE1-CD1 3.93Å; F398-L424 HydrophobicContact CE1-CD2 4.13Å; F398-L424 HydrophobicContact CE2-CD1 4.45Å; F398-L424 HydrophobicContact CE2-CD2 3.86Å; F398-L424 HydrophobicContact CZ-CD1 4.04Å; F398-L424 HydrophobicContact CZ-CD2 3.46Å; F398-L424 VanDerWaalsContact CZ-CD2 3.46Å; F398-L424 HydrophobicContact CZ-CG 4.42Å; F398-L424 WeakPolarHBondContact O-CD1 3.24Å; W401-L424 HydrophobicContact CB-CD1 4.43Å; W401-L424 HydrophobicContact CB-CG 4.37Å; L407-L424 HydrophobicContact CD2-CD2 3.98Å; I421-L424 PolarHBondContact O-N 2.85Å; L424-S426 PolarHBondContact O-N 3.4Å; L424-L427 HydrophobicContact CB-CB 4.22Å; L424-L427 HydrophobicContact CB-CD2 4.5Å; L424-L427 HydrophobicContact CD2-CD2 4.19Å; L424-L427 VanDerWaalsContact O-CB 3.24Å; L424-L427 WeakPolarHBondContact O-CB 3.37Å; L424-L427 PolarHBondContact O-N 3.3Å; L424-L447 HydrophobicContact CB-CD2 3.94Å; L424-L447 WeakPolarHBondContact O-CD2 3.19Å
425	M	95.2	Very high	97.5	Very high	126 Å²	126	40.7 Å²	40.7	62%	0.621	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-16	-169.7	-59.6	179.2	-176.1	0	0	114.9	G423	G423-M425 PolarHBondContact O-N 3.38Å
426	S	97.6	Very high	97.5	Very high	34 Å²	34	39.7 Å²	39.7	24%	0.238	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-3.8	177.6	-56.9	0	0	0	0	113.8	T402 M404 L424 E428	T402-S426 VanDerWaalsContact O-CB 3.28Å; T402-S426 WeakPolarHBondContact O-CB 3.42Å; T402-S426 PolarHBondContact O-OG 3.07Å; M404-S426 CarbonylContact O-C 3.41Å; M404-S426 WeakPolarHBondContact O-CB 3.41Å; L424-S426 PolarHBondContact O-N 3.4Å; S426-E428 PolarHBondContact O-N 2.94Å
427	L	98.6	Very high	97.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.183	C	C	.	.			trans	-69.5	126.6	-170.8	-158.9	71.9	0	0	0	111.5	M404 L407 L424 L430 L447 K449 L450	M404-L427 HydrophobicContact CB-CD1 4.15Å; M404-L427 HydrophobicContact CG-CD1 3.79Å; M404-L427 WeakPolarHBondContact O-CA 3.36Å; M404-L427 PolarHBondContact O-N 2.86Å; M404-L427 VanDerWaalsContact O-N 3.15Å; L407-L427 HydrophobicContact CB-CD1 3.79Å; L424-L427 HydrophobicContact CB-CB 4.22Å; L424-L427 HydrophobicContact CB-CD2 4.5Å; L424-L427 HydrophobicContact CD2-CD2 4.19Å; L424-L427 VanDerWaalsContact O-CB 3.24Å; L424-L427 WeakPolarHBondContact O-CB 3.37Å; L424-L427 PolarHBondContact O-N 3.3Å; L427-L430 HydrophobicContact CD2-CB 3.83Å; L427-L430 HydrophobicContact CD2-CD1 4.16Å; L427-L430 HydrophobicContact CD2-CD2 4.17Å; L427-L430 HydrophobicContact CD2-CG 4.27Å; L427-L447 HydrophobicContact CB-CD2 4.41Å; L427-L447 HydrophobicContact CD2-CD1 4.03Å; L427-K449 CarbonylContact O-C 3.55Å; L427-K449 VanDerWaalsContact O-C 3.31Å; L427-L450 HydrophobicContact CB-CD1 4.48Å; L427-L450 HydrophobicContact CD2-CD1 4.18Å; L427-L450 HydrophobicContact CG-CD1 4.15Å; L427-L450 WeakPolarHBondContact O-CA 3.24Å; L427-L450 PolarHBondContact O-N 3.15Å
428	E	98.8	Very high	97.6	Very high	52 Å²	52	38.3 Å²	38.3	24%	0.243	20%	0.204	C	C	.	.			trans	-109.1	-32.2	177.2	-65.9	-172.7	-159.4	0	0	111.7	V405 S426 K449 R451 E452	V405-E428 HydrophobicContact CG1-CB 3.96Å; V405-E428 HydrophobicContact CG1-CG 3.94Å; V405-E428 PolarHBondContact O-N 3.36Å; S426-E428 PolarHBondContact O-N 2.94Å; E428-K449 HydrophobicContact CG-CB 4.27Å; E428-R451 PolarHBondContact O-N 3.11Å; E428-R451 IonicContact OE2-CZ 2.88Å; E428-R451 IonicContact OE2-NE 3.54Å; E428-R451 IonicContact OE2-NH1 3.65Å; E428-R451 PolarHBondContact OE2-NH1 3.21Å; E428-R451 IonicContact OE2-NH2 2.84Å; E428-E452 PolarHBondContact O-N 2.72Å; E428-E452 VanDerWaalsContact O-N 3.08Å
429	V	98.9	Very high	97.7	Very high	32 Å²	32	42.9 Å²	42.9	19%	0.194	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	121.3	-177.6	179.5	0	0	0	0	109.6	V405 E406 L407 I431 E452	V405-V429 PolarHBondContact O-N 3.04Å; E406-V429 WeakPolarHBondContact CA-O 3.24Å; E406-V429 HydrophobicContact CB-CB 4.41Å; E406-V429 HydrophobicContact CG-CB 4.07Å; E406-V429 HydrophobicContact CG-CG1 4.19Å; L407-V429 PolarHBondContact N-O 3.13Å; V429-I431 HydrophobicContact CG1-CD1 3.74Å; V429-I431 HydrophobicContact CG1-CG1 3.94Å; V429-E452 HydrophobicContact CG1-CB 4.26Å; V429-E452 HydrophobicContact CG1-CG 4.46Å; V429-E452 HydrophobicContact CG2-CB 4.3Å
430	L	98.9	Very high	97.8	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	112	176.2	179.2	55.2	0	0	0	110	L407 I421 L427 L432 I444 L447 L450 E452 L453 D454	L407-L430 HydrophobicContact CB-CD1 4.18Å; L407-L430 HydrophobicContact CD2-CD1 4.01Å; L407-L430 HydrophobicContact CG-CD1 4.15Å; I421-L430 HydrophobicContact CD1-CD2 3.87Å; L427-L430 HydrophobicContact CD2-CB 3.83Å; L427-L430 HydrophobicContact CD2-CD1 4.16Å; L427-L430 HydrophobicContact CD2-CD2 4.17Å; L427-L430 HydrophobicContact CD2-CG 4.27Å; L430-L432 HydrophobicContact CD1-CD1 4.11Å; L430-L432 HydrophobicContact CD1-CD2 4.18Å; L430-L432 HydrophobicContact CD1-CG 3.85Å; L430-L432 HydrophobicContact CD2-CD1 3.89Å; L430-L432 HydrophobicContact CD2-CG 4.48Å; L430-L432 HydrophobicContact CG-CD1 3.91Å; L430-L432 HydrophobicContact CG-CG 3.95Å; L430-I444 HydrophobicContact CD2-CD1 3.91Å; L430-L447 HydrophobicContact CD2-CD1 4.29Å; L430-L450 HydrophobicContact CB-CD1 3.79Å; L430-E452 PolarHBondContact N-O 3.36Å; L430-L453 HydrophobicContact CB-CD1 4.12Å; L430-L453 HydrophobicContact CD2-CD1 3.92Å; L430-L453 HydrophobicContact CG-CD1 4.01Å; L430-L453 WeakPolarHBondContact O-CA 3.47Å; L430-D454 PolarHBondContact O-N 3.21Å
431	I	98.9	Very high	98	Very high	20 Å²	20	35.8 Å²	35.8	10%	0.103	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	115.3	178.8	-46	-58.6	0	0	0	108.9	L407 N408 L409 A410 V429 S433 E452 D454	L407-I431 PolarHBondContact O-N 2.92Å; N408-I431 HydrophobicContact CB-CB 4.25Å; N408-I431 HydrophobicContact CB-CG1 4.48Å; L409-I431 PolarHBondContact N-O 2.9Å; A410-I431 HydrophobicContact CB-CG2 3.89Å; V429-I431 HydrophobicContact CG1-CD1 3.74Å; V429-I431 HydrophobicContact CG1-CG1 3.94Å; I431-S433 WeakPolarHBondContact CG2-OG 3.19Å; I431-E452 HydrophobicContact CD1-CG 4.1Å; I431-D454 HydrophobicContact CB-CB 4.5Å; I431-D454 HydrophobicContact CD1-CB 3.68Å; I431-D454 HydrophobicContact CG2-CB 4.05Å; I431-D454 WeakPolarHBondContact CG2-OD2 3.21Å
432	L	98.8	Very high	97.9	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.211	C	C	.	.			trans	-125.9	13.7	-177.2	-70.8	173.7	0	0	0	111.8	L409 L414 I417 L430 N435 L437 D454 L455 N458	L409-L432 HydrophobicContact CB-CD2 4.05Å; L409-L432 HydrophobicContact CD1-CD2 3.87Å; L409-L432 HydrophobicContact CG-CD2 4.47Å; L414-L432 HydrophobicContact CD1-CD2 4.45Å; I417-L432 HydrophobicContact CD1-CD1 4.21Å; I417-L432 HydrophobicContact CD1-CD2 3.76Å; I417-L432 HydrophobicContact CG1-CD1 4.07Å; L430-L432 HydrophobicContact CD1-CD1 4.11Å; L430-L432 HydrophobicContact CD1-CD2 4.18Å; L430-L432 HydrophobicContact CD1-CG 3.85Å; L430-L432 HydrophobicContact CD2-CD1 3.89Å; L430-L432 HydrophobicContact CD2-CG 4.48Å; L430-L432 HydrophobicContact CG-CD1 3.91Å; L430-L432 HydrophobicContact CG-CG 3.95Å; L432-N435 PolarHBondContact O-ND2 3.21Å; L432-L437 HydrophobicContact CB-CD1 4.12Å; L432-L437 HydrophobicContact CD1-CD1 4.09Å; L432-D454 CarbonylContact C-O 3.52Å; L432-D454 WeakPolarHBondContact CA-O 3.39Å; L432-D454 WeakPolarHBondContact CB-O 3.47Å; L432-D454 PolarHBondContact N-O 3.44Å; L432-L455 HydrophobicContact CB-CD2 3.78Å; L432-L455 HydrophobicContact CD1-CD2 3.82Å; L432-L455 HydrophobicContact CG-CD2 4.43Å; L432-N458 PolarHBondContact O-ND2 3.44Å
433	S	98.8	Very high	97.9	Very high	16 Å²	16	39.2 Å²	39.2	11%	0.112	20%	0.2	C	C	.	.			trans	-59.7	152.1	-176.8	38.6	0	0	0	0	113.4	A410 T411 I431 N435 D454 E456	A410-S433 CarbonylContact C-O 3.14Å; A410-S433 WeakPolarHBondContact CA-O 3.4Å; A410-S433 WeakPolarHBondContact CB-OG 3.28Å; T411-S433 PolarHBondContact N-O 3.1Å; I431-S433 WeakPolarHBondContact CG2-OG 3.19Å; S433-N435 PolarHBondContact O-ND2 3.2Å; S433-D454 WeakPolarHBondContact CB-OD1 3.46Å; S433-D454 VanDerWaalsContact CB-OD2 3.31Å; S433-D454 WeakPolarHBondContact CB-OD2 3.39Å; S433-D454 PolarHBondContact N-O 3.31Å; S433-D454 PolarHBondContact OG-OD2 3.18Å; S433-E456 CarbonylContact C-O 3.22Å; S433-E456 WeakPolarHBondContact CA-O 3.36Å; S433-E456 WeakPolarHBondContact CB-O 3.43Å
434	N	98.7	Very high	98	Very high	67 Å²	67	38.7 Å²	38.7	36%	0.358	19%	0.194	S	C	.	.	S	Bend	trans	52.7	65.6	179.9	-162.4	-22	0	0	0	112.5	T411 N412 E456 E457	T411-N434 WeakPolarHBondContact CA-O 3.22Å; T411-N434 PolarHBondContact N-O 2.77Å; N412-N434 PolarHBondContact N-O 3.28Å; N412-N434 VanDerWaalsContact N-O 3.12Å; N434-E456 PolarHBondContact N-O 2.95Å; N434-E457 WeakPolarHBondContact CA-O 3.49Å; N434-E457 HydrophobicContact CB-CB 4.06Å; N434-E457 WeakPolarHBondContact CB-OE2 3.29Å; N434-E457 PolarHBondContact N-O 3.17Å; N434-E457 PolarHBondContact ND2-OE2 2.96Å
435	N	98.8	Very high	98	Very high	6 Å²	6	38.8 Å²	38.8	3%	0.032	20%	0.195	C	C	.	.	S	Bend	trans	-135.8	-168.4	176.5	-87.6	-77.9	0	0	0	109.6	L409 N412 Q413 L414 L432 S433 L437 E457 N458	L409-N435 PolarHBondContact O-ND2 3.39Å; N412-N435 WeakPolarHBondContact CA-OD1 3.23Å; N412-N435 WeakPolarHBondContact CB-OD1 3.39Å; N412-N435 PolarHBondContact O-OD1 2.82Å; Q413-N435 PolarHBondContact N-OD1 2.97Å; L414-N435 HydrophobicContact CB-CB 4.4Å; L414-N435 VanDerWaalsContact CB-OD1 3.29Å; L414-N435 WeakPolarHBondContact CB-OD1 3.43Å; L414-N435 WeakPolarHBondContact CG-OD1 3.38Å; L414-N435 PolarHBondContact N-OD1 2.58Å; L432-N435 PolarHBondContact O-ND2 3.21Å; S433-N435 PolarHBondContact O-ND2 3.2Å; N435-L437 HydrophobicContact CB-CG 4.22Å; N435-E457 PolarHBondContact N-O 3.22Å; N435-N458 WeakPolarHBondContact CA-OD1 3.28Å; N435-N458 WeakPolarHBondContact CB-OD1 3.35Å; N435-N458 PolarHBondContact O-OD1 2.9Å
436	L	98.5	Very high	98.1	Very high	70 Å²	70	35.3 Å²	35.3	37%	0.366	18%	0.183	S	C	.	.			trans	-114.1	25.2	-177.3	-57.4	174.6	0	0	0	111.9	Q413 L414 N415 K438	Q413-L436 HydrophobicContact CB-CD1 4.42Å; L414-L436 CarbonylContact O-C 3.26Å; L414-L436 VanDerWaalsContact O-C 3.26Å; L414-L436 VanDerWaalsContact O-CA 3.3Å; L414-L436 WeakPolarHBondContact O-CA 3.37Å; L414-L436 WeakPolarHBondContact O-CB 3.45Å; L414-L436 PolarHBondContact O-N 3.34Å; N415-L436 HydrophobicContact CB-CB 4.48Å; L436-K438 PolarHBondContact O-N 3.43Å
437	L	98.6	Very high	98.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.172	C	C	.	.			trans	-69.3	126.8	-174	-59.2	176.6	0	0	0	110.9	L414 I417 L432 N435 L455 N458 K459 L460	L414-L437 HydrophobicContact CB-CD2 4.23Å; L414-L437 PolarHBondContact O-N 2.95Å; I417-L437 HydrophobicContact CD1-CD1 4.47Å; I417-L437 HydrophobicContact CD1-CD2 4.14Å; I417-L437 HydrophobicContact CG1-CD1 4.14Å; I417-L437 HydrophobicContact CG1-CD2 3.93Å; L432-L437 HydrophobicContact CB-CD1 4.12Å; L432-L437 HydrophobicContact CD1-CD1 4.09Å; N435-L437 HydrophobicContact CB-CG 4.22Å; L437-L455 HydrophobicContact CD1-CD2 4.13Å; L437-N458 HydrophobicContact CB-CB 4.4Å; L437-N458 VanDerWaalsContact CB-OD1 3.27Å; L437-N458 WeakPolarHBondContact CB-OD1 3.38Å; L437-N458 WeakPolarHBondContact CG-OD1 3.34Å; L437-N458 PolarHBondContact N-OD1 3.4Å; L437-N458 VanDerWaalsContact N-OD1 3.07Å; L437-K459 CarbonylContact O-C 3.31Å; L437-K459 VanDerWaalsContact O-CA 3.23Å; L437-K459 WeakPolarHBondContact O-CA 3.44Å; L437-K459 WeakPolarHBondContact O-CB 3.01Å; L437-K459 PolarHBondContact O-N 3.35Å; L437-L460 HydrophobicContact CB-CD2 4.07Å; L437-L460 PolarHBondContact O-N 3.14Å
438	K	97.9	Very high	98	Very high	118 Å²	118	40.9 Å²	40.9	51%	0.513	20%	0.199	S	C	.	.	S	Bend	trans	-94.6	-30.5	174.6	-66	-171.2	176	-168.4	0	114	L436 K459 L460 E461	L436-K438 PolarHBondContact O-N 3.43Å; K438-K459 WeakPolarHBondContact CA-O 3.07Å; K438-K459 HydrophobicContact CG-CB 4.29Å; K438-L460 WeakPolarHBondContact O-CA 3.3Å; K438-E461 PolarHBondContact O-N 3.36Å; K438-E461 VanDerWaalsContact O-N 3.14Å
439	K	97.8	Very high	98	Very high	125 Å²	125	43.3 Å²	43.3	54%	0.543	21%	0.209	S	C	.	.			trans	-148.1	155.1	-177.8	-62.5	-173.8	179.3	-177	0	109.2
440	L	98	Very high	97.9	Very high	14 Å²	14	41.8 Å²	41.8	7%	0.073	20%	0.2	C	C	.	.			trans	-96.9	146.9	167.2	-62.2	173.6	0	0	0	110.4	L455 L460 L463 P464	L440-L455 HydrophobicContact CD1-CD1 3.57Å; L440-L455 HydrophobicContact CD2-CD1 4.27Å; L440-L455 HydrophobicContact CD2-CD2 3.76Å; L440-L455 HydrophobicContact CG-CD1 4.4Å; L440-L460 HydrophobicContact CD2-CD2 4.45Å; L440-L460 HydrophobicContact CG-CD2 4.18Å; L440-L463 HydrophobicContact CD1-CD2 4.02Å; L440-P464 HydrophobicContact CB-CG 4.02Å
441	P	97.2	Very high	97.9	Very high	9 Å²	9	46.9 Å²	46.9	6%	0.058	22%	0.219	C	C	.	.			trans	-68	154.9	173.1	29.2	-35.7	0	0	0	111.8	I417 E419 I421 G443 I444	I417-P441 HydrophobicContact CB-CG 4.07Å; I417-P441 HydrophobicContact CG2-CG 4.04Å; E419-P441 HydrophobicContact CG-CB 4.19Å; E419-P441 WeakPolarHBondContact OE1-CA 3.43Å; E419-P441 WeakPolarHBondContact OE1-CB 3.19Å; I421-P441 HydrophobicContact CG2-CG 3.77Å; P441-G443 PolarHBondContact O-N 3.27Å; P441-I444 VanDerWaalsContact O-CG2 3.27Å; P441-I444 WeakPolarHBondContact O-CG2 3.2Å; P441-I444 PolarHBondContact O-N 2.7Å
442	H	96.3	Very high	97.9	Very high	112 Å²	112	48.4 Å²	48.4	52%	0.519	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-65	-31.4	176	-63.2	-70.8	0	0	0	111.8	E419 I444 G445 E466	E419-H442 IonicContact OE1-CD2 3.83Å; E419-H442 PolarHBondContact OE1-N 3.03Å; E419-H442 PolarHBondContact OE2-N 3.3Å; H442-I444 PolarHBondContact O-N 3.41Å; H442-G445 PolarHBondContact O-N 2.82Å; H442-E466 HydrophobicContact CB-CG 4.35Å; H442-E466 IonicContact CE1-OE2 3.81Å; H442-E466 IonicContact CG-OE2 3.52Å; H442-E466 IonicContact ND1-OE1 3.85Å; H442-E466 IonicContact ND1-OE2 3.89Å; H442-E466 PolarHBondContact ND1-OE2 3.03Å; H442-E466 WeakPolarHBondContact O-CB 3.5Å
443	G	96.8	Very high	97.9	Very high	8 Å²	8	48.4 Å²	48.4	8%	0.082	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-54.5	-19.2	176.7	0	0	0	0	0	114.9	E419 P441 G445 S446	E419-G443 PolarHBondContact OE2-N 2.92Å; P441-G443 PolarHBondContact O-N 3.27Å; G443-G445 PolarHBondContact O-N 3.29Å; G443-S446 WeakPolarHBondContact O-CB 3.32Å; G443-S446 PolarHBondContact O-N 3.47Å; G443-S446 PolarHBondContact O-OG 3.03Å
444	I	97.4	Very high	98	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-54.8	-36.2	177	-162.2	73.7	0	0	0	112.2	I421 L430 P441 H442 S446 L447 P464 L470	I421-I444 HydrophobicContact CD1-CD1 3.88Å; L430-I444 HydrophobicContact CD2-CD1 3.91Å; P441-I444 VanDerWaalsContact O-CG2 3.27Å; P441-I444 WeakPolarHBondContact O-CG2 3.2Å; P441-I444 PolarHBondContact O-N 2.7Å; H442-I444 PolarHBondContact O-N 3.41Å; I444-S446 PolarHBondContact O-N 2.99Å; I444-L447 HydrophobicContact CD1-CD1 3.59Å; I444-L447 HydrophobicContact CG1-CD1 4.38Å; I444-L447 WeakPolarHBondContact O-CB 3.28Å; I444-L447 WeakPolarHBondContact O-CG 3.44Å; I444-L447 PolarHBondContact O-N 3.1Å; I444-L447 VanDerWaalsContact O-N 3.09Å; I444-P464 HydrophobicContact CG2-CG 3.85Å; I444-L470 WeakPolarHBondContact O-CD2 3.29Å
445	G	96.8	Very high	98	Very high	2 Å²	2	45.3 Å²	45.3	2%	0.021	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-66.8	-7.7	-179.6	0	0	0	0	0	114.7	H442 G443 L447 E466 Y469	H442-G445 PolarHBondContact O-N 2.82Å; G443-G445 PolarHBondContact O-N 3.29Å; G445-L447 VanDerWaalsContact C-N 3.35Å; G445-E466 WeakPolarHBondContact CA-O 3.43Å; G445-Y469 WeakPolarHBondContact O-CB 3.39Å
446	S	97.4	Very high	98	Very high	54 Å²	54	48.5 Å²	48.5	38%	0.378	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-81.5	-15.1	175.1	-55.4	0	0	0	0	113	G443 I444 R448	G443-S446 WeakPolarHBondContact O-CB 3.32Å; G443-S446 PolarHBondContact O-N 3.47Å; G443-S446 PolarHBondContact O-OG 3.03Å; I444-S446 PolarHBondContact O-N 2.99Å; S446-R448 PolarHBondContact O-N 3.01Å
447	L	97.9	Very high	98	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	22%	0.222	C	C	.	.			trans	-77.5	60.4	-178.8	-55.4	-176.5	0	0	0	111.6	I421 L424 L427 L430 I444 G445 K449 L450 L470	I421-L447 HydrophobicContact CD1-CD1 4.16Å; I421-L447 HydrophobicContact CG1-CD1 4.09Å; I421-L447 HydrophobicContact CG1-CD2 4.41Å; I421-L447 WeakPolarHBondContact O-CD2 3.34Å; L424-L447 HydrophobicContact CB-CD2 3.94Å; L424-L447 WeakPolarHBondContact O-CD2 3.19Å; L427-L447 HydrophobicContact CB-CD2 4.41Å; L427-L447 HydrophobicContact CD2-CD1 4.03Å; L430-L447 HydrophobicContact CD2-CD1 4.29Å; I444-L447 HydrophobicContact CD1-CD1 3.59Å; I444-L447 HydrophobicContact CG1-CD1 4.38Å; I444-L447 WeakPolarHBondContact O-CB 3.28Å; I444-L447 WeakPolarHBondContact O-CG 3.44Å; I444-L447 PolarHBondContact O-N 3.1Å; I444-L447 VanDerWaalsContact O-N 3.09Å; G445-L447 VanDerWaalsContact C-N 3.35Å; L447-K449 PolarHBondContact O-N 2.86Å; L447-L450 HydrophobicContact CB-CB 4.06Å; L447-L450 HydrophobicContact CD1-CD1 4.46Å; L447-L450 HydrophobicContact CD1-CD2 4.28Å; L447-L450 WeakPolarHBondContact O-CB 3.43Å; L447-L450 PolarHBondContact O-N 3Å; L447-L470 HydrophobicContact CB-CD2 4.11Å; L447-L470 VanDerWaalsContact O-CD2 3.24Å; L447-L470 WeakPolarHBondContact O-CD2 3.43Å
448	R	96.7	Very high	98	Very high	151 Å²	151	49.4 Å²	49.4	57%	0.57	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-18.3	-169.1	-64.9	-177.3	-178	-82	-1.1	115	S446	S446-R448 PolarHBondContact O-N 3.01Å
449	K	98.2	Very high	98	Very high	103 Å²	103	48 Å²	48	45%	0.448	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-1.9	176.3	-63.5	-172.8	-177.8	177.4	0	113.7	L427 E428 L447 R451	L427-K449 CarbonylContact O-C 3.55Å; L427-K449 VanDerWaalsContact O-C 3.31Å; E428-K449 HydrophobicContact CG-CB 4.27Å; L447-K449 PolarHBondContact O-N 2.86Å; K449-R451 PolarHBondContact O-N 3Å
450	L	98.7	Very high	98	Very high	0 Å²	0	42 Å²	42	0%	0	19%	0.193	C	C	.	.			trans	-65.5	125.3	-175.1	-161.5	73.1	0	0	0	110.3	L427 L430 L447 L453 L470 D472 L473	L427-L450 HydrophobicContact CB-CD1 4.48Å; L427-L450 HydrophobicContact CD2-CD1 4.18Å; L427-L450 HydrophobicContact CG-CD1 4.15Å; L427-L450 WeakPolarHBondContact O-CA 3.24Å; L427-L450 PolarHBondContact O-N 3.15Å; L430-L450 HydrophobicContact CB-CD1 3.79Å; L447-L450 HydrophobicContact CB-CB 4.06Å; L447-L450 HydrophobicContact CD1-CD1 4.46Å; L447-L450 HydrophobicContact CD1-CD2 4.28Å; L447-L450 WeakPolarHBondContact O-CB 3.43Å; L447-L450 PolarHBondContact O-N 3Å; L450-L453 HydrophobicContact CD2-CB 3.91Å; L450-L453 HydrophobicContact CD2-CD1 4.31Å; L450-L453 HydrophobicContact CD2-CD2 4.28Å; L450-L453 HydrophobicContact CD2-CG 4.4Å; L450-L470 HydrophobicContact CB-CD2 4.39Å; L450-L470 HydrophobicContact CD2-CD1 3.99Å; L450-D472 CarbonylContact O-C 3.17Å; L450-D472 VanDerWaalsContact O-C 3.26Å; L450-L473 HydrophobicContact CB-CD1 4.4Å; L450-L473 HydrophobicContact CD2-CD1 4.11Å; L450-L473 HydrophobicContact CG-CD1 4.06Å; L450-L473 VanDerWaalsContact O-CA 3.25Å; L450-L473 WeakPolarHBondContact O-CA 3.41Å; L450-L473 PolarHBondContact O-N 3.46Å; L450-L473 VanDerWaalsContact O-N 3.14Å
451	R	98.7	Very high	98	Very high	108 Å²	108	45.3 Å²	45.3	41%	0.408	21%	0.208	S	C	.	.			trans	-109.6	-35.6	-179.9	-65.5	-179.5	-179.8	161.9	4	112	E428 K449 Q474 K475	E428-R451 PolarHBondContact O-N 3.11Å; E428-R451 IonicContact OE2-CZ 2.88Å; E428-R451 IonicContact OE2-NE 3.54Å; E428-R451 IonicContact OE2-NH1 3.65Å; E428-R451 PolarHBondContact OE2-NH1 3.21Å; E428-R451 IonicContact OE2-NH2 2.84Å; K449-R451 PolarHBondContact O-N 3Å; R451-Q474 WeakPolarHBondContact O-CA 3.18Å; R451-Q474 PolarHBondContact O-N 2.79Å; R451-K475 PolarHBondContact O-N 3.46Å
452	E	98.9	Very high	98	Very high	52 Å²	52	47.5 Å²	47.5	24%	0.243	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123.9	178.9	-178.6	164.7	-173.5	0	0	110.4	E428 V429 L430 I431 K475	E428-E452 PolarHBondContact O-N 2.72Å; E428-E452 VanDerWaalsContact O-N 3.08Å; V429-E452 HydrophobicContact CG1-CB 4.26Å; V429-E452 HydrophobicContact CG1-CG 4.46Å; V429-E452 HydrophobicContact CG2-CB 4.3Å; L430-E452 PolarHBondContact N-O 3.36Å; I431-E452 HydrophobicContact CD1-CG 4.1Å; E452-K475 WeakPolarHBondContact CA-O 3.45Å; E452-K475 HydrophobicContact CB-CB 4.45Å; E452-K475 HydrophobicContact CG-CB 4.23Å; E452-K475 HydrophobicContact CG-CD 4.1Å; E452-K475 HydrophobicContact CG-CG 4.31Å; E452-K475 WeakPolarHBondContact OE1-CD 3.28Å; E452-K475 WeakPolarHBondContact OE1-CE 3.48Å; E452-K475 IonicContact OE1-NZ 3.68Å; E452-K475 PolarHBondContact OE1-NZ 3.45Å
453	L	98.9	Very high	98	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	107.8	172.4	179.8	55.6	0	0	0	108.9	L430 L450 L455 I467 L473 K475 L476 V477	L430-L453 HydrophobicContact CB-CD1 4.12Å; L430-L453 HydrophobicContact CD2-CD1 3.92Å; L430-L453 HydrophobicContact CG-CD1 4.01Å; L430-L453 WeakPolarHBondContact O-CA 3.47Å; L450-L453 HydrophobicContact CD2-CB 3.91Å; L450-L453 HydrophobicContact CD2-CD1 4.31Å; L450-L453 HydrophobicContact CD2-CD2 4.28Å; L450-L453 HydrophobicContact CD2-CG 4.4Å; L453-L455 HydrophobicContact CD1-CD1 3.99Å; L453-L455 HydrophobicContact CD1-CD2 4.42Å; L453-L455 HydrophobicContact CD1-CG 3.96Å; L453-L455 HydrophobicContact CD2-CD1 3.8Å; L453-L455 HydrophobicContact CG-CD1 3.71Å; L453-L455 HydrophobicContact CG-CG 4.04Å; L453-I467 HydrophobicContact CD2-CD1 3.85Å; L453-L473 HydrophobicContact CB-CD1 3.92Å; L453-K475 PolarHBondContact N-O 3Å; L453-L476 HydrophobicContact CB-CD1 4.07Å; L453-L476 HydrophobicContact CD2-CD1 3.92Å; L453-L476 HydrophobicContact CG-CD1 4.02Å; L453-L476 WeakPolarHBondContact O-CA 3.14Å; L453-V477 PolarHBondContact O-N 3.07Å
454	D	98.9	Very high	98	Very high	19 Å²	19	42.9 Å²	42.9	10%	0.102	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	118.7	175.6	178.3	12.7	0	0	0	110.4	L430 I431 L432 S433 E456 V477	L430-D454 PolarHBondContact O-N 3.21Å; I431-D454 HydrophobicContact CB-CB 4.5Å; I431-D454 HydrophobicContact CD1-CB 3.68Å; I431-D454 HydrophobicContact CG2-CB 4.05Å; I431-D454 WeakPolarHBondContact CG2-OD2 3.21Å; L432-D454 CarbonylContact C-O 3.52Å; L432-D454 WeakPolarHBondContact CA-O 3.39Å; L432-D454 WeakPolarHBondContact CB-O 3.47Å; L432-D454 PolarHBondContact N-O 3.44Å; S433-D454 WeakPolarHBondContact CB-OD1 3.46Å; S433-D454 VanDerWaalsContact CB-OD2 3.31Å; S433-D454 WeakPolarHBondContact CB-OD2 3.39Å; S433-D454 PolarHBondContact N-O 3.31Å; S433-D454 PolarHBondContact OG-OD2 3.18Å; D454-E456 VanDerWaalsContact OD1-CB 3.29Å; D454-E456 WeakPolarHBondContact OD1-CB 3.34Å; D454-E456 PolarHBondContact OD1-N 2.8Å; D454-V477 HydrophobicContact CB-CB 4.47Å
455	L	98.8	Very high	98	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.231	C	C	.	.			trans	-129.2	19	-178.6	-70	162.9	0	0	0	111.5	L432 L437 L440 L453 N458 L460 V477 L478 N481	L432-L455 HydrophobicContact CB-CD2 3.78Å; L432-L455 HydrophobicContact CD1-CD2 3.82Å; L432-L455 HydrophobicContact CG-CD2 4.43Å; L437-L455 HydrophobicContact CD1-CD2 4.13Å; L440-L455 HydrophobicContact CD1-CD1 3.57Å; L440-L455 HydrophobicContact CD2-CD1 4.27Å; L440-L455 HydrophobicContact CD2-CD2 3.76Å; L440-L455 HydrophobicContact CG-CD1 4.4Å; L453-L455 HydrophobicContact CD1-CD1 3.99Å; L453-L455 HydrophobicContact CD1-CD2 4.42Å; L453-L455 HydrophobicContact CD1-CG 3.96Å; L453-L455 HydrophobicContact CD2-CD1 3.8Å; L453-L455 HydrophobicContact CG-CD1 3.71Å; L453-L455 HydrophobicContact CG-CG 4.04Å; L455-N458 PolarHBondContact O-ND2 3Å; L455-N458 VanDerWaalsContact O-ND2 3.15Å; L455-L460 HydrophobicContact CB-CD1 3.95Å; L455-L460 HydrophobicContact CD1-CD1 4Å; L455-L460 HydrophobicContact CD2-CD1 4.27Å; L455-L460 HydrophobicContact CG-CD1 4.32Å; L455-V477 CarbonylContact C-O 3.51Å; L455-V477 WeakPolarHBondContact CA-O 3.41Å; L455-V477 WeakPolarHBondContact CB-O 3.29Å; L455-V477 PolarHBondContact N-O 2.99Å; L455-L478 HydrophobicContact CB-CD2 3.88Å; L455-L478 HydrophobicContact CD1-CD2 3.72Å; L455-L478 HydrophobicContact CG-CD2 4.47Å; L455-N481 PolarHBondContact O-ND2 2.83Å
456	E	98.7	Very high	98	Very high	73 Å²	73	51.7 Å²	51.7	34%	0.341	24%	0.241	S	C	.	.			trans	-52.7	149.9	177.6	177.5	170.6	-150.8	0	0	111.9	S433 N434 D454 N458 V477 T479	S433-E456 CarbonylContact C-O 3.22Å; S433-E456 WeakPolarHBondContact CA-O 3.36Å; S433-E456 WeakPolarHBondContact CB-O 3.43Å; N434-E456 PolarHBondContact N-O 2.95Å; D454-E456 VanDerWaalsContact OD1-CB 3.29Å; D454-E456 WeakPolarHBondContact OD1-CB 3.34Å; D454-E456 PolarHBondContact OD1-N 2.8Å; E456-N458 PolarHBondContact O-N 3.07Å; E456-N458 PolarHBondContact O-ND2 3.11Å; E456-N458 VanDerWaalsContact O-ND2 3.08Å; E456-V477 HydrophobicContact CB-CG1 3.94Å; E456-T479 CarbonylContact C-O 3.51Å; E456-T479 VanDerWaalsContact CA-O 3.26Å; E456-T479 WeakPolarHBondContact CA-O 3.26Å
457	E	98.6	Very high	98	Very high	78 Å²	78	49.1 Å²	49.1	36%	0.364	22%	0.223	S	C	.	.	S	Bend	trans	53.8	56.9	174.6	-73.5	-178.3	-179.8	0	0	112.8	N434 N435 T479 N480	N434-E457 WeakPolarHBondContact CA-O 3.49Å; N434-E457 HydrophobicContact CB-CB 4.06Å; N434-E457 WeakPolarHBondContact CB-OE2 3.29Å; N434-E457 PolarHBondContact N-O 3.17Å; N434-E457 PolarHBondContact ND2-OE2 2.96Å; N435-E457 PolarHBondContact N-O 3.22Å; E457-T479 PolarHBondContact N-O 2.84Å; E457-N480 VanDerWaalsContact CA-O 3.29Å; E457-N480 WeakPolarHBondContact CA-O 3.48Å; E457-N480 HydrophobicContact CG-CB 4.09Å; E457-N480 PolarHBondContact N-O 2.8Å
458	N	98.8	Very high	97.9	Very high	10 Å²	10	49.4 Å²	49.4	5%	0.053	23%	0.226	C	C	.	.	S	Bend	trans	-125.5	-165.3	175	-88.1	-82.4	0	0	0	110.5	L432 N435 L437 L455 E456 L460 N480 N481	L432-N458 PolarHBondContact O-ND2 3.44Å; N435-N458 WeakPolarHBondContact CA-OD1 3.28Å; N435-N458 WeakPolarHBondContact CB-OD1 3.35Å; N435-N458 PolarHBondContact O-OD1 2.9Å; L437-N458 HydrophobicContact CB-CB 4.4Å; L437-N458 VanDerWaalsContact CB-OD1 3.27Å; L437-N458 WeakPolarHBondContact CB-OD1 3.38Å; L437-N458 WeakPolarHBondContact CG-OD1 3.34Å; L437-N458 PolarHBondContact N-OD1 3.4Å; L437-N458 VanDerWaalsContact N-OD1 3.07Å; L455-N458 PolarHBondContact O-ND2 3Å; L455-N458 VanDerWaalsContact O-ND2 3.15Å; E456-N458 PolarHBondContact O-N 3.07Å; E456-N458 PolarHBondContact O-ND2 3.11Å; E456-N458 VanDerWaalsContact O-ND2 3.08Å; N458-L460 HydrophobicContact CB-CG 4.21Å; N458-N480 PolarHBondContact N-O 3.11Å; N458-N480 VanDerWaalsContact N-O 3.15Å; N458-N481 WeakPolarHBondContact CA-OD1 3.1Å; N458-N481 WeakPolarHBondContact CB-OD1 3.42Å; N458-N481 PolarHBondContact O-OD1 3.12Å
459	K	98.4	Very high	98	Very high	88 Å²	88	48 Å²	48	38%	0.383	22%	0.221	S	C	.	.			trans	-120.3	30.5	178.6	-59	-175.5	-180	-177.5	0	111.1	L437 K438 E461 N481	L437-K459 CarbonylContact O-C 3.31Å; L437-K459 VanDerWaalsContact O-CA 3.23Å; L437-K459 WeakPolarHBondContact O-CA 3.44Å; L437-K459 WeakPolarHBondContact O-CB 3.01Å; L437-K459 PolarHBondContact O-N 3.35Å; K438-K459 WeakPolarHBondContact CA-O 3.07Å; K438-K459 HydrophobicContact CG-CB 4.29Å; K459-E461 PolarHBondContact O-N 3.41Å; K459-N481 PolarHBondContact N-OD1 3.34Å
460	L	98.6	Very high	98	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.2	C	C	.	.			trans	-66.6	122.7	-173.2	-65.1	174.7	0	0	0	110.9	L437 K438 L440 L455 N458 L478 N481 Q482 L483	L437-L460 HydrophobicContact CB-CD2 4.07Å; L437-L460 PolarHBondContact O-N 3.14Å; K438-L460 WeakPolarHBondContact O-CA 3.3Å; L440-L460 HydrophobicContact CD2-CD2 4.45Å; L440-L460 HydrophobicContact CG-CD2 4.18Å; L455-L460 HydrophobicContact CB-CD1 3.95Å; L455-L460 HydrophobicContact CD1-CD1 4Å; L455-L460 HydrophobicContact CD2-CD1 4.27Å; L455-L460 HydrophobicContact CG-CD1 4.32Å; N458-L460 HydrophobicContact CB-CG 4.21Å; L460-L478 HydrophobicContact CD1-CD2 3.99Å; L460-N481 HydrophobicContact CB-CB 4.31Å; L460-N481 VanDerWaalsContact CB-OD1 3.26Å; L460-N481 WeakPolarHBondContact CB-OD1 3.42Å; L460-N481 WeakPolarHBondContact CG-OD1 3.42Å; L460-N481 PolarHBondContact N-OD1 2.97Å; L460-Q482 CarbonylContact O-C 3.04Å; L460-Q482 VanDerWaalsContact O-CA 3.23Å; L460-Q482 WeakPolarHBondContact O-CA 3.16Å; L460-Q482 WeakPolarHBondContact O-CB 3.49Å; L460-Q482 PolarHBondContact O-N 3.12Å; L460-L483 HydrophobicContact CB-CD2 4.08Å; L460-L483 PolarHBondContact O-N 3.01Å; L460-L483 VanDerWaalsContact O-N 3.16Å
461	E	97	Very high	97.8	Very high	83 Å²	83	49 Å²	49	39%	0.388	23%	0.225	S	C	.	.			trans	-87.5	-33.4	178.1	-64.9	168.2	-164.8	0	0	111.8	K438 K459	K438-E461 PolarHBondContact O-N 3.36Å; K438-E461 VanDerWaalsContact O-N 3.14Å; K459-E461 PolarHBondContact O-N 3.41Å
462	C	96.7	Very high	97.8	Very high	55 Å²	55	47.1 Å²	47.1	37%	0.372	22%	0.223	S	C	.	.			trans	-155	164.3	177.3	64.1	0	0	0	0	111.6
463	L	97.9	Very high	97.8	Very high	9 Å²	9	44.7 Å²	44.7	5%	0.047	21%	0.212	C	C	.	.			trans	-99.2	145.1	168.7	-62	175.8	0	0	0	110.8	L440 L478 L483 L486 P487	L440-L463 HydrophobicContact CD1-CD2 4.02Å; L463-L478 HydrophobicContact CD1-CD1 3.69Å; L463-L478 HydrophobicContact CD2-CD1 4.35Å; L463-L478 HydrophobicContact CD2-CD2 3.8Å; L463-L478 HydrophobicContact CG-CD1 4.47Å; L463-L483 HydrophobicContact CG-CD2 4.33Å; L463-L486 HydrophobicContact CD1-CD2 3.9Å; L463-P487 HydrophobicContact CB-CG 4.14Å
464	P	97.1	Very high	97.8	Very high	14 Å²	14	49 Å²	49	9%	0.091	23%	0.232	C	C	.	.			trans	-68.1	150.4	172.4	29.4	-34.4	0	0	0	111.1	L440 I444 E466 I467	L440-P464 HydrophobicContact CB-CG 4.02Å; I444-P464 HydrophobicContact CG2-CG 3.85Å; P464-E466 WeakPolarHBondContact CB-OE2 3.43Å; P464-E466 PolarHBondContact O-N 2.95Å; P464-I467 WeakPolarHBondContact O-CB 3.29Å; P464-I467 VanDerWaalsContact O-CG2 3.28Å; P464-I467 WeakPolarHBondContact O-CG2 3.45Å; P464-I467 PolarHBondContact O-N 2.93Å
465	H	96.1	Very high	97.8	Very high	140 Å²	140	51.5 Å²	51.5	65%	0.648	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-63.7	-26.9	178.4	-65.9	-61	0	0	0	112.5	I467 A468	H465-I467 PolarHBondContact O-N 2.94Å; H465-I467 VanDerWaalsContact O-N 3.16Å; H465-A468 WeakPolarHBondContact O-CB 3.35Å; H465-A468 PolarHBondContact O-N 2.91Å
466	E	97.6	Very high	97.8	Very high	49 Å²	49	51.5 Å²	51.5	23%	0.229	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-64	-14.3	177.9	-67.1	75.6	-164.3	0	0	113.7	H442 G445 P464 A468 Y469	H442-E466 HydrophobicContact CB-CG 4.35Å; H442-E466 IonicContact CE1-OE2 3.81Å; H442-E466 IonicContact CG-OE2 3.52Å; H442-E466 IonicContact ND1-OE1 3.85Å; H442-E466 IonicContact ND1-OE2 3.89Å; H442-E466 PolarHBondContact ND1-OE2 3.03Å; H442-E466 WeakPolarHBondContact O-CB 3.5Å; G445-E466 WeakPolarHBondContact CA-O 3.43Å; P464-E466 WeakPolarHBondContact CB-OE2 3.43Å; P464-E466 PolarHBondContact O-N 2.95Å; E466-A468 PolarHBondContact O-N 2.92Å; E466-A468 VanDerWaalsContact O-N 3.11Å; E466-Y469 HydrophobicContact CB-CD2 4.1Å; E466-Y469 HydrophobicContact CB-CE2 4.19Å; E466-Y469 HydrophobicContact CG-CD2 4.31Å; E466-Y469 HydrophobicContact CG-CE2 3.94Å; E466-Y469 WeakPolarHBondContact O-CB 3.48Å; E466-Y469 PolarHBondContact O-N 3.03Å
467	I	97	Very high	97.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-54.3	-31.2	172.3	-160.4	75.5	0	0	0	111.2	L453 P464 H465 Y469 L470 P487 L493	L453-I467 HydrophobicContact CD2-CD1 3.85Å; P464-I467 WeakPolarHBondContact O-CB 3.29Å; P464-I467 VanDerWaalsContact O-CG2 3.28Å; P464-I467 WeakPolarHBondContact O-CG2 3.45Å; P464-I467 PolarHBondContact O-N 2.93Å; H465-I467 PolarHBondContact O-N 2.94Å; H465-I467 VanDerWaalsContact O-N 3.16Å; I467-Y469 PolarHBondContact O-N 3.22Å; I467-L470 HydrophobicContact CD1-CD1 3.55Å; I467-L470 HydrophobicContact CG1-CD1 4.26Å; I467-L470 WeakPolarHBondContact O-CB 3.06Å; I467-L470 WeakPolarHBondContact O-CG 3.38Å; I467-L470 PolarHBondContact O-N 3.17Å; I467-L470 VanDerWaalsContact O-N 3.1Å; I467-P487 HydrophobicContact CG2-CG 3.89Å; I467-L493 WeakPolarHBondContact O-CD2 3.38Å
468	A	96.7	Very high	97.8	Very high	6 Å²	6	44.8 Å²	44.8	5%	0.05	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-62	-12.2	178.2	0	0	0	0	0	114.4	H465 E466 G489 H492	H465-A468 WeakPolarHBondContact O-CB 3.35Å; H465-A468 PolarHBondContact O-N 2.91Å; E466-A468 PolarHBondContact O-N 2.92Å; E466-A468 VanDerWaalsContact O-N 3.11Å; A468-G489 WeakPolarHBondContact CB-O 3.19Å; A468-H492 HydrophobicContact CB-CB 4.27Å
469	Y	97.8	Very high	97.8	Very high	121 Å²	121	45.3 Å²	45.3	48%	0.475	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-85.8	-11.1	178	-59	-24.7	0	0	0	113.5	G445 E466 I467 K471	G445-Y469 WeakPolarHBondContact O-CB 3.39Å; E466-Y469 HydrophobicContact CB-CD2 4.1Å; E466-Y469 HydrophobicContact CB-CE2 4.19Å; E466-Y469 HydrophobicContact CG-CD2 4.31Å; E466-Y469 HydrophobicContact CG-CE2 3.94Å; E466-Y469 WeakPolarHBondContact O-CB 3.48Å; E466-Y469 PolarHBondContact O-N 3.03Å; I467-Y469 PolarHBondContact O-N 3.22Å; Y469-K471 PolarHBondContact O-N 3Å
470	L	97.8	Very high	97.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.213	C	C	.	.			trans	-81.1	60.1	-178.9	-55.6	-176.9	0	0	0	111.9	I444 L447 L450 I467 D472 L473 L493	I444-L470 WeakPolarHBondContact O-CD2 3.29Å; L447-L470 HydrophobicContact CB-CD2 4.11Å; L447-L470 VanDerWaalsContact O-CD2 3.24Å; L447-L470 WeakPolarHBondContact O-CD2 3.43Å; L450-L470 HydrophobicContact CB-CD2 4.39Å; L450-L470 HydrophobicContact CD2-CD1 3.99Å; I467-L470 HydrophobicContact CD1-CD1 3.55Å; I467-L470 HydrophobicContact CG1-CD1 4.26Å; I467-L470 WeakPolarHBondContact O-CB 3.06Å; I467-L470 WeakPolarHBondContact O-CG 3.38Å; I467-L470 PolarHBondContact O-N 3.17Å; I467-L470 VanDerWaalsContact O-N 3.1Å; L470-D472 PolarHBondContact O-N 3.32Å; L470-D472 VanDerWaalsContact O-N 3.12Å; L470-L473 HydrophobicContact CB-CB 4.06Å; L470-L473 HydrophobicContact CD1-CD2 4.43Å; L470-L473 WeakPolarHBondContact O-CB 3.42Å; L470-L473 PolarHBondContact O-N 3.24Å; L470-L493 HydrophobicContact CB-CD2 4.1Å; L470-L493 WeakPolarHBondContact O-CD2 3.42Å
471	K	95.9	Very high	97.8	Very high	124 Å²	124	44.7 Å²	44.7	54%	0.539	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-22.6	-172.1	-62.7	-173.7	177.9	-172.2	0	114.5	Y469 L473 N495	Y469-K471 PolarHBondContact O-N 3Å; K471-L473 VanDerWaalsContact C-N 3.31Å; K471-N495 WeakPolarHBondContact O-CB 3.15Å; K471-N495 PolarHBondContact O-ND2 2.8Å
472	D	97.8	Very high	97.8	Very high	69 Å²	69	44.8 Å²	44.8	37%	0.369	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	0.3	177.4	-69.7	-5.2	0	0	0	112.9	L450 L470 Q474	L450-D472 CarbonylContact O-C 3.17Å; L450-D472 VanDerWaalsContact O-C 3.26Å; L470-D472 PolarHBondContact O-N 3.32Å; L470-D472 VanDerWaalsContact O-N 3.12Å; D472-Q474 PolarHBondContact O-N 2.86Å
473	L	98.6	Very high	97.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.199	C	C	.	.			trans	-66.9	124.4	-177.9	-161.5	73.3	0	0	0	110.5	L450 L453 L470 K471 L476 L493 N495 L496	L450-L473 HydrophobicContact CB-CD1 4.4Å; L450-L473 HydrophobicContact CD2-CD1 4.11Å; L450-L473 HydrophobicContact CG-CD1 4.06Å; L450-L473 VanDerWaalsContact O-CA 3.25Å; L450-L473 WeakPolarHBondContact O-CA 3.41Å; L450-L473 PolarHBondContact O-N 3.46Å; L450-L473 VanDerWaalsContact O-N 3.14Å; L453-L473 HydrophobicContact CB-CD1 3.92Å; L470-L473 HydrophobicContact CB-CB 4.06Å; L470-L473 HydrophobicContact CD1-CD2 4.43Å; L470-L473 WeakPolarHBondContact O-CB 3.42Å; L470-L473 PolarHBondContact O-N 3.24Å; K471-L473 VanDerWaalsContact C-N 3.31Å; L473-L476 HydrophobicContact CD2-CB 3.92Å; L473-L476 HydrophobicContact CD2-CD1 4.3Å; L473-L476 HydrophobicContact CD2-CD2 4.3Å; L473-L476 HydrophobicContact CD2-CG 4.41Å; L473-L493 HydrophobicContact CB-CD2 4.42Å; L473-L493 HydrophobicContact CD2-CD1 4.07Å; L473-N495 CarbonylContact O-C 3.34Å; L473-N495 VanDerWaalsContact O-C 3.22Å; L473-L496 HydrophobicContact CD2-CD1 4.16Å; L473-L496 HydrophobicContact CG-CD1 4.15Å; L473-L496 WeakPolarHBondContact O-CA 3.44Å; L473-L496 PolarHBondContact O-N 3.08Å; L473-L496 VanDerWaalsContact O-N 3.14Å
474	Q	98.7	Very high	97.9	Very high	90 Å²	90	44.4 Å²	44.4	42%	0.421	21%	0.213	S	C	.	.			trans	-107.5	-33.1	-178.7	-68.1	172.2	2.1	0	0	111.6	R451 D472 T497 H498	R451-Q474 WeakPolarHBondContact O-CA 3.18Å; R451-Q474 PolarHBondContact O-N 2.79Å; D472-Q474 PolarHBondContact O-N 2.86Å; Q474-T497 PolarHBondContact O-N 3.15Å; Q474-T497 PolarHBondContact O-OG1 2.82Å; Q474-H498 PolarHBondContact O-N 3.23Å; Q474-H498 VanDerWaalsContact O-N 3.11Å
475	K	98.9	Very high	97.9	Very high	72 Å²	72	46 Å²	46	31%	0.313	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	122.3	-177	-177.9	173.5	171.5	-155	0	110.5	R451 E452 L453 V477 H498	R451-K475 PolarHBondContact O-N 3.46Å; E452-K475 WeakPolarHBondContact CA-O 3.45Å; E452-K475 HydrophobicContact CB-CB 4.45Å; E452-K475 HydrophobicContact CG-CB 4.23Å; E452-K475 HydrophobicContact CG-CD 4.1Å; E452-K475 HydrophobicContact CG-CG 4.31Å; E452-K475 WeakPolarHBondContact OE1-CD 3.28Å; E452-K475 WeakPolarHBondContact OE1-CE 3.48Å; E452-K475 IonicContact OE1-NZ 3.68Å; E452-K475 PolarHBondContact OE1-NZ 3.45Å; L453-K475 PolarHBondContact N-O 3Å; K475-V477 HydrophobicContact CD-CG2 4.39Å; K475-V477 HydrophobicContact CG-CG2 4.01Å; K475-H498 HydrophobicContact CB-CB 4.46Å; K475-H498 HydrophobicContact CG-CB 4.13Å
476	L	98.8	Very high	97.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	112.4	175	179.3	56.5	0	0	0	109.1	L453 L473 L478 I490 L493 L496 H498 L499 G500	L453-L476 HydrophobicContact CB-CD1 4.07Å; L453-L476 HydrophobicContact CD2-CD1 3.92Å; L453-L476 HydrophobicContact CG-CD1 4.02Å; L453-L476 WeakPolarHBondContact O-CA 3.14Å; L473-L476 HydrophobicContact CD2-CB 3.92Å; L473-L476 HydrophobicContact CD2-CD1 4.3Å; L473-L476 HydrophobicContact CD2-CD2 4.3Å; L473-L476 HydrophobicContact CD2-CG 4.41Å; L476-L478 HydrophobicContact CD1-CD1 4.1Å; L476-L478 HydrophobicContact CD1-CD2 4.36Å; L476-L478 HydrophobicContact CD1-CG 4.04Å; L476-L478 HydrophobicContact CD2-CD1 3.89Å; L476-L478 HydrophobicContact CG-CD1 3.8Å; L476-L478 HydrophobicContact CG-CG 4.08Å; L476-I490 HydrophobicContact CD2-CD1 3.9Å; L476-L493 HydrophobicContact CD2-CD1 4.36Å; L476-L496 HydrophobicContact CB-CD1 3.82Å; L476-H498 PolarHBondContact N-O 3.22Å; L476-L499 HydrophobicContact CB-CD1 4.13Å; L476-L499 HydrophobicContact CD2-CD1 3.97Å; L476-L499 HydrophobicContact CG-CD1 4.08Å; L476-L499 WeakPolarHBondContact O-CA 3.37Å; L476-G500 PolarHBondContact O-N 2.94Å
477	V	98.8	Very high	97.9	Very high	10 Å²	10	38.1 Å²	38.1	6%	0.061	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	118	179.3	-168.8	0	0	0	0	109.2	L453 D454 L455 E456 K475	L453-V477 PolarHBondContact O-N 3.07Å; D454-V477 HydrophobicContact CB-CB 4.47Å; L455-V477 CarbonylContact C-O 3.51Å; L455-V477 WeakPolarHBondContact CA-O 3.41Å; L455-V477 WeakPolarHBondContact CB-O 3.29Å; L455-V477 PolarHBondContact N-O 2.99Å; E456-V477 HydrophobicContact CB-CG1 3.94Å; K475-V477 HydrophobicContact CD-CG2 4.39Å; K475-V477 HydrophobicContact CG-CG2 4.01Å
478	L	98.7	Very high	97.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.22	C	C	.	.			trans	-128.3	14.3	-179.3	-65	160.6	0	0	0	111.8	L455 L460 L463 L476 N481 L483 G500 L501 N504	L455-L478 HydrophobicContact CB-CD2 3.88Å; L455-L478 HydrophobicContact CD1-CD2 3.72Å; L455-L478 HydrophobicContact CG-CD2 4.47Å; L460-L478 HydrophobicContact CD1-CD2 3.99Å; L463-L478 HydrophobicContact CD1-CD1 3.69Å; L463-L478 HydrophobicContact CD2-CD1 4.35Å; L463-L478 HydrophobicContact CD2-CD2 3.8Å; L463-L478 HydrophobicContact CG-CD1 4.47Å; L476-L478 HydrophobicContact CD1-CD1 4.1Å; L476-L478 HydrophobicContact CD1-CD2 4.36Å; L476-L478 HydrophobicContact CD1-CG 4.04Å; L476-L478 HydrophobicContact CD2-CD1 3.89Å; L476-L478 HydrophobicContact CG-CD1 3.8Å; L476-L478 HydrophobicContact CG-CG 4.08Å; L478-N481 PolarHBondContact O-ND2 2.62Å; L478-L483 HydrophobicContact CB-CD1 3.93Å; L478-L483 HydrophobicContact CD1-CD1 3.98Å; L478-L483 HydrophobicContact CD2-CD1 4.27Å; L478-L483 HydrophobicContact CG-CD1 4.3Å; L478-G500 CarbonylContact C-O 3.2Å; L478-G500 WeakPolarHBondContact CA-O 3.43Å; L478-G500 VanDerWaalsContact CB-O 3.31Å; L478-G500 WeakPolarHBondContact CB-O 3.31Å; L478-G500 PolarHBondContact N-O 3.1Å; L478-L501 HydrophobicContact CB-CD2 4.2Å; L478-L501 HydrophobicContact CD1-CD2 3.82Å; L478-N504 PolarHBondContact O-ND2 3.12Å
479	T	98.4	Very high	97.8	Very high	21 Å²	21	47.4 Å²	47.4	13%	0.129	23%	0.226	C	C	.	.			trans	-55.1	143.5	180	-51.5	0	0	0	0	111.1	E456 E457 N481 G502	E456-T479 CarbonylContact C-O 3.51Å; E456-T479 VanDerWaalsContact CA-O 3.26Å; E456-T479 WeakPolarHBondContact CA-O 3.26Å; E457-T479 PolarHBondContact N-O 2.84Å; T479-N481 PolarHBondContact O-ND2 3.43Å; T479-G502 CarbonylContact C-O 3.52Å; T479-G502 VanDerWaalsContact CA-O 3.25Å; T479-G502 WeakPolarHBondContact CA-O 3.42Å
480	N	98.4	Very high	97.8	Very high	65 Å²	65	41.6 Å²	41.6	35%	0.348	20%	0.203	S	C	.	.	S	Bend	trans	57.9	65.8	178.3	-162.9	-1.8	0	0	0	112.6	E457 N458 G502 E503	E457-N480 VanDerWaalsContact CA-O 3.29Å; E457-N480 WeakPolarHBondContact CA-O 3.48Å; E457-N480 HydrophobicContact CG-CB 4.09Å; E457-N480 PolarHBondContact N-O 2.8Å; N458-N480 PolarHBondContact N-O 3.11Å; N458-N480 VanDerWaalsContact N-O 3.15Å; N480-G502 PolarHBondContact N-O 3.27Å; N480-E503 WeakPolarHBondContact CA-O 3.2Å; N480-E503 HydrophobicContact CB-CB 4.13Å; N480-E503 PolarHBondContact N-O 3.02Å
481	N	98.8	Very high	97.7	Very high	10 Å²	10	41.7 Å²	41.7	5%	0.053	20%	0.204	C	C	.	.	S	Bend	trans	-137	-169.3	177.1	-87.5	-78.6	0	0	0	110.3	L455 N458 K459 L460 L478 T479 L483 E503 N504	L455-N481 PolarHBondContact O-ND2 2.83Å; N458-N481 WeakPolarHBondContact CA-OD1 3.1Å; N458-N481 WeakPolarHBondContact CB-OD1 3.42Å; N458-N481 PolarHBondContact O-OD1 3.12Å; K459-N481 PolarHBondContact N-OD1 3.34Å; L460-N481 HydrophobicContact CB-CB 4.31Å; L460-N481 VanDerWaalsContact CB-OD1 3.26Å; L460-N481 WeakPolarHBondContact CB-OD1 3.42Å; L460-N481 WeakPolarHBondContact CG-OD1 3.42Å; L460-N481 PolarHBondContact N-OD1 2.97Å; L478-N481 PolarHBondContact O-ND2 2.62Å; T479-N481 PolarHBondContact O-ND2 3.43Å; N481-L483 HydrophobicContact CB-CG 4.28Å; N481-E503 PolarHBondContact N-O 3Å; N481-E503 VanDerWaalsContact N-O 3.16Å; N481-N504 WeakPolarHBondContact CA-OD1 3.25Å; N481-N504 WeakPolarHBondContact CB-OD1 3.45Å; N481-N504 PolarHBondContact O-OD1 2.89Å
482	Q	98.3	Very high	97.7	Very high	86 Å²	86	41.3 Å²	41.3	40%	0.402	20%	0.204	S	C	.	.			trans	-116.6	28.4	-178.1	-59.6	177.4	20.7	0	0	111.5	L460 T484 N504	L460-Q482 CarbonylContact O-C 3.04Å; L460-Q482 VanDerWaalsContact O-CA 3.23Å; L460-Q482 WeakPolarHBondContact O-CA 3.16Å; L460-Q482 WeakPolarHBondContact O-CB 3.49Å; L460-Q482 PolarHBondContact O-N 3.12Å; Q482-T484 PolarHBondContact O-N 3.12Å; Q482-N504 PolarHBondContact N-OD1 3.44Å
483	L	98.4	Very high	97.7	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.			trans	-69.7	128.7	-175.7	-62.2	174.2	0	0	0	110.3	L460 L463 L478 N481 L486 L501 N504 L505 L506	L460-L483 HydrophobicContact CB-CD2 4.08Å; L460-L483 PolarHBondContact O-N 3.01Å; L460-L483 VanDerWaalsContact O-N 3.16Å; L463-L483 HydrophobicContact CG-CD2 4.33Å; L478-L483 HydrophobicContact CB-CD1 3.93Å; L478-L483 HydrophobicContact CD1-CD1 3.98Å; L478-L483 HydrophobicContact CD2-CD1 4.27Å; L478-L483 HydrophobicContact CG-CD1 4.3Å; N481-L483 HydrophobicContact CB-CG 4.28Å; L483-L486 HydrophobicContact CD1-CD2 4.34Å; L483-L501 HydrophobicContact CD1-CD2 4.47Å; L483-N504 HydrophobicContact CB-CB 4.48Å; L483-N504 VanDerWaalsContact CB-OD1 3.28Å; L483-N504 WeakPolarHBondContact CB-OD1 3.36Å; L483-N504 WeakPolarHBondContact CG-OD1 3.16Å; L483-N504 PolarHBondContact N-OD1 3.36Å; L483-L505 CarbonylContact O-C 3.03Å; L483-L505 VanDerWaalsContact O-CA 3.28Å; L483-L505 WeakPolarHBondContact O-CA 3.13Å; L483-L505 PolarHBondContact O-N 3.24Å; L483-L506 HydrophobicContact CB-CD2 4.07Å; L483-L506 PolarHBondContact O-N 3.1Å; L483-L506 VanDerWaalsContact O-N 3.12Å
484	T	97.3	Very high	97.5	Very high	55 Å²	55	41 Å²	41	34%	0.337	21%	0.205	S	C	.	.			trans	-97.6	-28.9	176.2	54.4	0	0	0	0	113.1	Q482 L505 L506 Q507	Q482-T484 PolarHBondContact O-N 3.12Å; T484-L505 WeakPolarHBondContact CA-O 3.38Å; T484-L505 HydrophobicContact CG2-CB 4.33Å; T484-L506 WeakPolarHBondContact O-CA 3.33Å; T484-Q507 PolarHBondContact O-N 3.16Å
485	T	96.8	Very high	97.4	Very high	49 Å²	49	39.7 Å²	39.7	30%	0.301	20%	0.201	S	C	.	.			trans	-149.8	164.5	180	59	0	0	0	0	110	H508	T485-H508 VanDerWaalsContact CG2-CE1 3.49Å; T485-H508 WeakPolarHBondContact CG2-CE1 3.25Å
486	L	97.6	Very high	97.4	Very high	10 Å²	10	36.3 Å²	36.3	5%	0.052	19%	0.186	C	C	.	.			trans	-110.1	146	168.2	-63.3	174.5	0	0	0	110.2	L463 L483 L501 L506 L509 P510	L463-L486 HydrophobicContact CD1-CD2 3.9Å; L483-L486 HydrophobicContact CD1-CD2 4.34Å; L486-L501 HydrophobicContact CD1-CD1 3.64Å; L486-L501 HydrophobicContact CD1-CD2 3.97Å; L486-L501 HydrophobicContact CD1-CG 4.47Å; L486-L501 HydrophobicContact CD2-CD2 3.81Å; L486-L501 HydrophobicContact CG-CD2 4.39Å; L486-L506 HydrophobicContact CG-CD2 4.29Å; L486-L509 HydrophobicContact CD1-CD2 3.94Å; L486-P510 HydrophobicContact CB-CG 4.18Å
487	P	96.8	Very high	97.4	Very high	12 Å²	12	38.5 Å²	38.5	8%	0.078	20%	0.199	C	C	.	.			trans	-66.4	141.3	173.4	28.4	-33.7	0	0	0	110.3	L463 I467 G489 I490	L463-P487 HydrophobicContact CB-CG 4.14Å; I467-P487 HydrophobicContact CG2-CG 3.89Å; P487-G489 PolarHBondContact O-N 3.02Å; P487-G489 VanDerWaalsContact O-N 3.07Å; P487-I490 WeakPolarHBondContact O-CB 3.2Å; P487-I490 WeakPolarHBondContact O-CG2 3.46Å; P487-I490 PolarHBondContact O-N 3.5Å
488	R	95.9	Very high	97.4	Very high	185 Å²	185	39.5 Å²	39.5	70%	0.698	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-51.8	-33.1	175.5	-67.7	-176.1	-179.3	-168.8	-0.2	113.5	I490 G491 P510 E512	R488-I490 PolarHBondContact O-N 3.36Å; R488-G491 PolarHBondContact O-N 3.34Å; R488-P510 HydrophobicContact CG-CB 4.48Å; R488-E512 HydrophobicContact CB-CG 4.39Å; R488-E512 WeakPolarHBondContact CD-OE1 3.45Å; R488-E512 WeakPolarHBondContact CG-OE2 3.49Å; R488-E512 VanDerWaalsContact O-CB 3.3Å; R488-E512 WeakPolarHBondContact O-CB 3.4Å
489	G	95.9	Very high	97.4	Very high	16 Å²	16	39.5 Å²	39.5	17%	0.165	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-61.4	-8.8	176.7	0	0	0	0	0	115.1	A468 P487 G491 H492	A468-G489 WeakPolarHBondContact CB-O 3.19Å; P487-G489 PolarHBondContact O-N 3.02Å; P487-G489 VanDerWaalsContact O-N 3.07Å; G489-G491 PolarHBondContact O-N 2.98Å; G489-H492 WeakPolarHBondContact O-CB 3.35Å; G489-H492 PolarHBondContact O-N 3.16Å
490	I	96.6	Very high	97.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-54.7	-33.8	172.1	-161.8	75.4	0	0	0	111.7	L476 P487 R488 H492 L493 P510 L516	L476-I490 HydrophobicContact CD2-CD1 3.9Å; P487-I490 WeakPolarHBondContact O-CB 3.2Å; P487-I490 WeakPolarHBondContact O-CG2 3.46Å; P487-I490 PolarHBondContact O-N 3.5Å; R488-I490 PolarHBondContact O-N 3.36Å; I490-H492 PolarHBondContact O-N 3.15Å; I490-H492 VanDerWaalsContact O-N 3.13Å; I490-L493 HydrophobicContact CD1-CD1 3.54Å; I490-L493 HydrophobicContact CG1-CD1 4.27Å; I490-L493 WeakPolarHBondContact O-CB 3.17Å; I490-L493 WeakPolarHBondContact O-CG 3.03Å; I490-L493 PolarHBondContact O-N 2.91Å; I490-P510 HydrophobicContact CG2-CG 3.6Å; I490-L516 WeakPolarHBondContact O-CD2 3.36Å
491	G	95.7	Very high	97.4	Very high	2 Å²	2	35.4 Å²	35.4	2%	0.021	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-63	-18.1	177.9	0	0	0	0	0	114.6	R488 G489 L493 E512 T515	R488-G491 PolarHBondContact O-N 3.34Å; G489-G491 PolarHBondContact O-N 2.98Å; G491-L493 PolarHBondContact O-N 2.91Å; G491-E512 WeakPolarHBondContact CA-O 3.41Å; G491-T515 WeakPolarHBondContact CA-OG1 3.33Å; G491-T515 PolarHBondContact O-OG1 3.42Å
492	H	96.5	Very high	97.3	Very high	115 Å²	115	35 Å²	35	53%	0.532	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-74.3	-10.4	175.5	-63.1	168.7	0	0	0	113.6	A468 G489 I490 T494	A468-H492 HydrophobicContact CB-CB 4.27Å; G489-H492 WeakPolarHBondContact O-CB 3.35Å; G489-H492 PolarHBondContact O-N 3.16Å; I490-H492 PolarHBondContact O-N 3.15Å; I490-H492 VanDerWaalsContact O-N 3.13Å; H492-T494 PolarHBondContact O-N 3.35Å
493	L	97.4	Very high	97.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.179	C	C	.	.			trans	-80.7	57.1	178.9	-55.7	-178.5	0	0	0	111	I467 L470 L473 L476 I490 G491 N495 L496 L516	I467-L493 WeakPolarHBondContact O-CD2 3.38Å; L470-L493 HydrophobicContact CB-CD2 4.1Å; L470-L493 WeakPolarHBondContact O-CD2 3.42Å; L473-L493 HydrophobicContact CB-CD2 4.42Å; L473-L493 HydrophobicContact CD2-CD1 4.07Å; L476-L493 HydrophobicContact CD2-CD1 4.36Å; I490-L493 HydrophobicContact CD1-CD1 3.54Å; I490-L493 HydrophobicContact CG1-CD1 4.27Å; I490-L493 WeakPolarHBondContact O-CB 3.17Å; I490-L493 WeakPolarHBondContact O-CG 3.03Å; I490-L493 PolarHBondContact O-N 2.91Å; G491-L493 PolarHBondContact O-N 2.91Å; L493-N495 PolarHBondContact O-N 3.4Å; L493-L496 HydrophobicContact CB-CB 4.08Å; L493-L496 HydrophobicContact CD1-CD2 4.46Å; L493-L496 WeakPolarHBondContact O-CB 3.47Å; L493-L496 PolarHBondContact O-N 3.44Å; L493-L516 HydrophobicContact CB-CD2 4.13Å; L493-L516 WeakPolarHBondContact O-CD2 3.26Å
494	T	94.8	Very high	97.3	Very high	63 Å²	63	35.3 Å²	35.3	39%	0.387	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17	-170.2	56.1	0	0	0	0	114.3	H492 N518	H492-T494 PolarHBondContact O-N 3.35Å; T494-N518 WeakPolarHBondContact O-CB 3.33Å; T494-N518 PolarHBondContact O-ND2 3.09Å
495	N	97.5	Very high	97.4	Very high	63 Å²	63	35.9 Å²	35.9	34%	0.337	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-0.4	174.9	-70.3	-28.6	0	0	0	113.6	K471 L473 L493 T497	K471-N495 WeakPolarHBondContact O-CB 3.15Å; K471-N495 PolarHBondContact O-ND2 2.8Å; L473-N495 CarbonylContact O-C 3.34Å; L473-N495 VanDerWaalsContact O-C 3.22Å; L493-N495 PolarHBondContact O-N 3.4Å; N495-T497 PolarHBondContact O-N 2.96Å
496	L	98.4	Very high	97.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.			trans	-68.2	125.2	-177.5	-162	74.5	0	0	0	110.1	L473 L476 L493 L499 L516 N518 L519	L473-L496 HydrophobicContact CD2-CD1 4.16Å; L473-L496 HydrophobicContact CG-CD1 4.15Å; L473-L496 WeakPolarHBondContact O-CA 3.44Å; L473-L496 PolarHBondContact O-N 3.08Å; L473-L496 VanDerWaalsContact O-N 3.14Å; L476-L496 HydrophobicContact CB-CD1 3.82Å; L493-L496 HydrophobicContact CB-CB 4.08Å; L493-L496 HydrophobicContact CD1-CD2 4.46Å; L493-L496 WeakPolarHBondContact O-CB 3.47Å; L493-L496 PolarHBondContact O-N 3.44Å; L496-L499 HydrophobicContact CD2-CB 3.91Å; L496-L499 HydrophobicContact CD2-CD1 4.21Å; L496-L499 HydrophobicContact CD2-CD2 4.14Å; L496-L499 HydrophobicContact CD2-CG 4.31Å; L496-L516 HydrophobicContact CB-CD2 4.46Å; L496-L516 HydrophobicContact CD2-CD1 4.17Å; L496-N518 CarbonylContact O-C 3.45Å; L496-L519 HydrophobicContact CD2-CD1 4.38Å; L496-L519 HydrophobicContact CG-CD1 4.45Å; L496-L519 VanDerWaalsContact O-CA 3.24Å; L496-L519 WeakPolarHBondContact O-CA 3.33Å; L496-L519 PolarHBondContact O-N 3.2Å; L496-L519 VanDerWaalsContact O-N 3.13Å
497	T	98.5	Very high	97.3	Very high	46 Å²	46	38.1 Å²	38.1	28%	0.282	19%	0.187	S	C	.	.			trans	-108.8	-32.5	179.5	59.4	0	0	0	0	111.7	Q474 N495 N518 E520 E521	Q474-T497 PolarHBondContact O-N 3.15Å; Q474-T497 PolarHBondContact O-OG1 2.82Å; N495-T497 PolarHBondContact O-N 2.96Å; T497-N518 WeakPolarHBondContact CA-O 3.34Å; T497-E520 PolarHBondContact O-N 3Å; T497-E521 PolarHBondContact O-N 3.36Å
498	H	98.8	Very high	97.3	Very high	32 Å²	32	41.7 Å²	41.7	15%	0.148	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	124.2	-178.9	174.8	98.6	0	0	0	110.6	Q474 K475 L476 E521 Y523	Q474-H498 PolarHBondContact O-N 3.23Å; Q474-H498 VanDerWaalsContact O-N 3.11Å; K475-H498 HydrophobicContact CB-CB 4.46Å; K475-H498 HydrophobicContact CG-CB 4.13Å; L476-H498 PolarHBondContact N-O 3.22Å; H498-E521 IonicContact CE1-OE2 2.91Å; H498-E521 IonicContact CG-OE2 2.97Å; H498-E521 IonicContact ND1-OE2 2.75Å; H498-E521 PolarHBondContact ND1-OE2 3.26Å; H498-Y523 AromaticContact CE1-CD2 3.73Å; H498-Y523 AromaticContact CE1-CE2 3.36Å; H498-Y523 WeakPolarHBondContact CE1-CE2 3.45Å; H498-Y523 AromaticContact ND1-CE2 3.69Å
499	L	98.6	Very high	97.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	105.3	175	-178.1	51.9	0	0	0	110.7	L476 L496 L501 I513 L516 L519 E521 L522 Y523	L476-L499 HydrophobicContact CB-CD1 4.13Å; L476-L499 HydrophobicContact CD2-CD1 3.97Å; L476-L499 HydrophobicContact CG-CD1 4.08Å; L476-L499 WeakPolarHBondContact O-CA 3.37Å; L496-L499 HydrophobicContact CD2-CB 3.91Å; L496-L499 HydrophobicContact CD2-CD1 4.21Å; L496-L499 HydrophobicContact CD2-CD2 4.14Å; L496-L499 HydrophobicContact CD2-CG 4.31Å; L499-L501 HydrophobicContact CD1-CD1 4.15Å; L499-L501 HydrophobicContact CD1-CD2 4.16Å; L499-L501 HydrophobicContact CD1-CG 3.92Å; L499-L501 HydrophobicContact CD2-CD1 3.83Å; L499-L501 HydrophobicContact CD2-CG 4.5Å; L499-L501 HydrophobicContact CG-CD1 3.73Å; L499-L501 HydrophobicContact CG-CG 3.9Å; L499-I513 HydrophobicContact CD2-CD1 3.85Å; L499-L516 HydrophobicContact CD2-CD1 4.42Å; L499-L519 HydrophobicContact CB-CD1 3.81Å; L499-E521 PolarHBondContact N-O 2.83Å; L499-L522 HydrophobicContact CB-CD1 4.04Å; L499-L522 HydrophobicContact CD2-CD1 3.95Å; L499-L522 HydrophobicContact CG-CD1 3.95Å; L499-L522 WeakPolarHBondContact O-CA 3.32Å; L499-Y523 PolarHBondContact O-N 2.9Å
500	G	98.5	Very high	97.3	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	116.6	174.9	0	0	0	0	0	111.4	L476 L478	L476-G500 PolarHBondContact O-N 2.94Å; L478-G500 CarbonylContact C-O 3.2Å; L478-G500 WeakPolarHBondContact CA-O 3.43Å; L478-G500 VanDerWaalsContact CB-O 3.31Å; L478-G500 WeakPolarHBondContact CB-O 3.31Å; L478-G500 PolarHBondContact N-O 3.1Å
501	L	98.3	Very high	97.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.195	C	C	.	.			trans	-132.5	14.6	-179.6	-65.8	165	0	0	0	112	L478 L483 L486 L499 N504 L506 L509 L522 Y523 L524 N527	L478-L501 HydrophobicContact CB-CD2 4.2Å; L478-L501 HydrophobicContact CD1-CD2 3.82Å; L483-L501 HydrophobicContact CD1-CD2 4.47Å; L486-L501 HydrophobicContact CD1-CD1 3.64Å; L486-L501 HydrophobicContact CD1-CD2 3.97Å; L486-L501 HydrophobicContact CD1-CG 4.47Å; L486-L501 HydrophobicContact CD2-CD2 3.81Å; L486-L501 HydrophobicContact CG-CD2 4.39Å; L499-L501 HydrophobicContact CD1-CD1 4.15Å; L499-L501 HydrophobicContact CD1-CD2 4.16Å; L499-L501 HydrophobicContact CD1-CG 3.92Å; L499-L501 HydrophobicContact CD2-CD1 3.83Å; L499-L501 HydrophobicContact CD2-CG 4.5Å; L499-L501 HydrophobicContact CG-CD1 3.73Å; L499-L501 HydrophobicContact CG-CG 3.9Å; L501-N504 PolarHBondContact O-ND2 3.29Å; L501-L506 HydrophobicContact CB-CD1 3.94Å; L501-L506 HydrophobicContact CD1-CD1 4.22Å; L501-L506 HydrophobicContact CD2-CD1 4.37Å; L501-L506 HydrophobicContact CG-CD1 4.42Å; L501-L509 HydrophobicContact CD1-CD2 4.16Å; L501-L522 HydrophobicContact CD1-CD1 4.12Å; L501-Y523 CarbonylContact C-O 3.29Å; L501-Y523 VanDerWaalsContact C-O 3.29Å; L501-Y523 VanDerWaalsContact CA-O 3.26Å; L501-Y523 WeakPolarHBondContact CA-O 3.49Å; L501-Y523 VanDerWaalsContact CB-O 3.3Å; L501-Y523 WeakPolarHBondContact CB-O 3.39Å; L501-Y523 PolarHBondContact N-O 3.01Å; L501-L524 HydrophobicContact CB-CD2 4.03Å; L501-L524 HydrophobicContact CD1-CD2 3.8Å; L501-N527 PolarHBondContact O-ND2 2.98Å
502	G	97.8	Very high	97.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.207	C	C	.	.			trans	-63.5	160	-179.2	0	0	0	0	0	112.1	T479 N480 N504 Y523 N525	T479-G502 CarbonylContact C-O 3.52Å; T479-G502 VanDerWaalsContact CA-O 3.25Å; T479-G502 WeakPolarHBondContact CA-O 3.42Å; N480-G502 PolarHBondContact N-O 3.27Å; G502-N504 PolarHBondContact O-N 2.96Å; G502-N504 PolarHBondContact O-ND2 3.11Å; G502-Y523 PolarHBondContact N-O 2.84Å; G502-N525 CarbonylContact C-O 3.21Å; G502-N525 WeakPolarHBondContact CA-O 3.41Å
503	E	98.2	Very high	97.2	Very high	90 Å²	90	36.2 Å²	36.2	42%	0.421	18%	0.182	S	C	.	.	S	Bend	trans	52.1	54.4	175.1	-61.8	176.8	-124.7	0	0	112.3	N480 N481 N525 D526	N480-E503 WeakPolarHBondContact CA-O 3.2Å; N480-E503 HydrophobicContact CB-CB 4.13Å; N480-E503 PolarHBondContact N-O 3.02Å; N481-E503 PolarHBondContact N-O 3Å; N481-E503 VanDerWaalsContact N-O 3.16Å; E503-N525 PolarHBondContact N-O 3.19Å; E503-D526 WeakPolarHBondContact CA-O 3.47Å; E503-D526 HydrophobicContact CB-CB 4.37Å; E503-D526 HydrophobicContact CG-CB 3.72Å
504	N	98.6	Very high	97	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.016	19%	0.185	C	C	.	.	S	Bend	trans	-129.5	-171.8	179.1	-88.8	-83.2	0	0	0	110.5	L478 N481 Q482 L483 L501 G502 L506 D526 N527 P528	L478-N504 PolarHBondContact O-ND2 3.12Å; N481-N504 WeakPolarHBondContact CA-OD1 3.25Å; N481-N504 WeakPolarHBondContact CB-OD1 3.45Å; N481-N504 PolarHBondContact O-OD1 2.89Å; Q482-N504 PolarHBondContact N-OD1 3.44Å; L483-N504 HydrophobicContact CB-CB 4.48Å; L483-N504 VanDerWaalsContact CB-OD1 3.28Å; L483-N504 WeakPolarHBondContact CB-OD1 3.36Å; L483-N504 WeakPolarHBondContact CG-OD1 3.16Å; L483-N504 PolarHBondContact N-OD1 3.36Å; L501-N504 PolarHBondContact O-ND2 3.29Å; G502-N504 PolarHBondContact O-N 2.96Å; G502-N504 PolarHBondContact O-ND2 3.11Å; N504-L506 HydrophobicContact CB-CG 4.2Å; N504-D526 PolarHBondContact N-O 3.16Å; N504-N527 WeakPolarHBondContact CA-OD1 3.28Å; N504-N527 WeakPolarHBondContact CB-OD1 3.46Å; N504-N527 PolarHBondContact O-OD1 3.24Å; N504-P528 WeakPolarHBondContact O-CD 3.35Å
505	L	97.8	Very high	97	Very high	68 Å²	68	36.6 Å²	36.6	36%	0.356	19%	0.185	S	C	.	.			trans	-114.5	30	179.4	-60.2	175.3	0	0	0	111.4	L483 T484 Q507 P528	L483-L505 CarbonylContact O-C 3.03Å; L483-L505 VanDerWaalsContact O-CA 3.28Å; L483-L505 WeakPolarHBondContact O-CA 3.13Å; L483-L505 PolarHBondContact O-N 3.24Å; T484-L505 WeakPolarHBondContact CA-O 3.38Å; T484-L505 HydrophobicContact CG2-CB 4.33Å; L505-Q507 PolarHBondContact O-N 3Å; L505-P528 HydrophobicContact CD2-CG 4.45Å
506	L	97.9	Very high	97	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.			trans	-62.9	128.5	-172.5	-67.5	175.1	0	0	0	111.2	L483 T484 L486 L501 N504 L509 L524 N527 H529 L530	L483-L506 HydrophobicContact CB-CD2 4.07Å; L483-L506 PolarHBondContact O-N 3.1Å; L483-L506 VanDerWaalsContact O-N 3.12Å; T484-L506 WeakPolarHBondContact O-CA 3.33Å; L486-L506 HydrophobicContact CG-CD2 4.29Å; L501-L506 HydrophobicContact CB-CD1 3.94Å; L501-L506 HydrophobicContact CD1-CD1 4.22Å; L501-L506 HydrophobicContact CD2-CD1 4.37Å; L501-L506 HydrophobicContact CG-CD1 4.42Å; N504-L506 HydrophobicContact CB-CG 4.2Å; L506-L509 HydrophobicContact CD1-CD2 4.12Å; L506-L524 HydrophobicContact CD1-CD2 4.32Å; L506-N527 HydrophobicContact CB-CB 4.47Å; L506-N527 VanDerWaalsContact CB-OD1 3.29Å; L506-N527 WeakPolarHBondContact CB-OD1 3.23Å; L506-N527 WeakPolarHBondContact CG-OD1 3.1Å; L506-N527 PolarHBondContact N-OD1 3.47Å; L506-H529 CarbonylContact O-C 3.14Å; L506-L530 WeakPolarHBondContact O-CA 3.38Å; L506-L530 PolarHBondContact O-N 3.08Å; L506-L530 VanDerWaalsContact O-N 3.12Å
507	Q	95.9	Very high	96.6	Very high	106 Å²	106	39.7 Å²	39.7	50%	0.495	20%	0.198	S	C	.	.			trans	-89.5	-36.5	176.2	-62.4	179.1	16.4	0	0	111.9	T484 L505 H529	T484-Q507 PolarHBondContact O-N 3.16Å; L505-Q507 PolarHBondContact O-N 3Å; Q507-H529 WeakPolarHBondContact CA-O 3.32Å; Q507-H529 HydrophobicContact CG-CB 4.21Å
508	H	95.2	Very high	96.5	Very high	87 Å²	87	39.6 Å²	39.6	40%	0.403	20%	0.195	S	C	.	.			trans	-156.2	162	179.2	58.5	-82.4	0	0	0	110.1	T485	T485-H508 VanDerWaalsContact CG2-CE1 3.49Å; T485-H508 WeakPolarHBondContact CG2-CE1 3.25Å
509	L	96.5	Very high	96.5	Very high	8 Å²	8	38.1 Å²	38.1	4%	0.042	19%	0.188	C	C	.	.			trans	-100.9	145.8	166	-61.9	175.4	0	0	0	109.6	L486 L501 L506 L524 L533 P534	L486-L509 HydrophobicContact CD1-CD2 3.94Å; L501-L509 HydrophobicContact CD1-CD2 4.16Å; L506-L509 HydrophobicContact CD1-CD2 4.12Å; L509-L524 HydrophobicContact CD1-CD1 3.79Å; L509-L524 HydrophobicContact CD1-CD2 3.89Å; L509-L524 HydrophobicContact CD2-CD2 3.89Å; L509-L524 HydrophobicContact CG-CD2 4.35Å; L509-L533 HydrophobicContact CD1-CD2 3.8Å; L509-P534 HydrophobicContact CB-CG 4.05Å
510	P	96.3	Very high	96.4	Very high	10 Å²	10	42.2 Å²	42.2	7%	0.065	21%	0.208	C	C	.	.			trans	-66.8	148.3	173.9	27.8	-33.5	0	0	0	111.4	L486 R488 I490 E512 I513	L486-P510 HydrophobicContact CB-CG 4.18Å; R488-P510 HydrophobicContact CG-CB 4.48Å; I490-P510 HydrophobicContact CG2-CG 3.6Å; P510-E512 WeakPolarHBondContact CB-OE2 3.27Å; P510-E512 PolarHBondContact O-N 2.94Å; P510-I513 WeakPolarHBondContact O-CB 3.38Å; P510-I513 VanDerWaalsContact O-CG2 3.27Å; P510-I513 WeakPolarHBondContact O-CG2 3.34Å; P510-I513 PolarHBondContact O-N 3.2Å; P510-I513 VanDerWaalsContact O-N 3.12Å
511	E	95.1	Very high	96.4	Very high	125 Å²	125	44.9 Å²	44.9	58%	0.584	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-61.1	-31.4	176.7	-66	176.7	-177.9	0	0	111.2	I513 G514 P534 E536	E511-I513 PolarHBondContact O-N 3Å; E511-G514 PolarHBondContact O-N 2.84Å; E511-G514 VanDerWaalsContact O-N 3.14Å; E511-P534 HydrophobicContact CG-CB 4.41Å; E511-E536 HydrophobicContact CB-CG 4.06Å; E511-E536 WeakPolarHBondContact O-CB 3.18Å; E511-E536 WeakPolarHBondContact O-CG 3.39Å
512	E	96.4	Very high	96.4	Very high	60 Å²	60	44.9 Å²	44.9	28%	0.28	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-61.8	-8.6	176.6	-62.5	85.4	171.2	0	0	113.7	R488 G491 P510 G514 T515	R488-E512 HydrophobicContact CB-CG 4.39Å; R488-E512 WeakPolarHBondContact CD-OE1 3.45Å; R488-E512 WeakPolarHBondContact CG-OE2 3.49Å; R488-E512 VanDerWaalsContact O-CB 3.3Å; R488-E512 WeakPolarHBondContact O-CB 3.4Å; G491-E512 WeakPolarHBondContact CA-O 3.41Å; P510-E512 WeakPolarHBondContact CB-OE2 3.27Å; P510-E512 PolarHBondContact O-N 2.94Å; E512-G514 PolarHBondContact O-N 3.4Å; E512-T515 PolarHBondContact O-N 3.11Å; E512-T515 VanDerWaalsContact O-N 3.15Å; E512-T515 PolarHBondContact O-OG1 2.85Å
513	I	95.6	Very high	96.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-56.9	-29.5	170.7	-160.4	75.3	0	0	0	112.2	L499 P510 E511 T515 L516 P534 L537 C540	L499-I513 HydrophobicContact CD2-CD1 3.85Å; P510-I513 WeakPolarHBondContact O-CB 3.38Å; P510-I513 VanDerWaalsContact O-CG2 3.27Å; P510-I513 WeakPolarHBondContact O-CG2 3.34Å; P510-I513 PolarHBondContact O-N 3.2Å; P510-I513 VanDerWaalsContact O-N 3.12Å; E511-I513 PolarHBondContact O-N 3Å; I513-T515 PolarHBondContact O-N 3.18Å; I513-L516 HydrophobicContact CD1-CD1 3.47Å; I513-L516 VanDerWaalsContact CD1-CD1 3.47Å; I513-L516 HydrophobicContact CD1-CG 4.5Å; I513-L516 HydrophobicContact CG1-CD1 4.15Å; I513-L516 WeakPolarHBondContact O-CB 3.24Å; I513-L516 WeakPolarHBondContact O-CG 3.43Å; I513-L516 PolarHBondContact O-N 3.18Å; I513-P534 HydrophobicContact CG2-CG 3.71Å; I513-L537 HydrophobicContact CG1-CD1 4.22Å; I513-L537 HydrophobicContact CG2-CB 4.37Å; I513-L537 HydrophobicContact CG2-CD1 4.16Å; I513-C540 PolarHBondContact O-SG 3.42Å
514	G	93	Very high	96.4	Very high	6 Å²	6	43.8 Å²	43.8	6%	0.062	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-67.5	-13.6	179.6	0	0	0	0	0	114.9	E511 E512 L516 E536 L539	E511-G514 PolarHBondContact O-N 2.84Å; E511-G514 VanDerWaalsContact O-N 3.14Å; E512-G514 PolarHBondContact O-N 3.4Å; G514-L516 VanDerWaalsContact C-N 3.26Å; G514-E536 WeakPolarHBondContact CA-O 3.18Å; G514-L539 WeakPolarHBondContact O-CB 3.4Å
515	T	95.1	Very high	96.2	Very high	65 Å²	65	45 Å²	45	40%	0.399	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-83.7	-3.2	176.2	66.9	0	0	0	0	112.8	G491 E512 I513 E517	G491-T515 WeakPolarHBondContact CA-OG1 3.33Å; G491-T515 PolarHBondContact O-OG1 3.42Å; E512-T515 PolarHBondContact O-N 3.11Å; E512-T515 VanDerWaalsContact O-N 3.15Å; E512-T515 PolarHBondContact O-OG1 2.85Å; I513-T515 PolarHBondContact O-N 3.18Å; T515-E517 PolarHBondContact O-N 2.86Å
516	L	96	Very high	96.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.216	C	C	.	.			trans	-79.3	68.5	176.1	-58.3	-178	0	0	0	111	I490 L493 L496 L499 I513 G514 N518 L519	I490-L516 WeakPolarHBondContact O-CD2 3.36Å; L493-L516 HydrophobicContact CB-CD2 4.13Å; L493-L516 WeakPolarHBondContact O-CD2 3.26Å; L496-L516 HydrophobicContact CB-CD2 4.46Å; L496-L516 HydrophobicContact CD2-CD1 4.17Å; L499-L516 HydrophobicContact CD2-CD1 4.42Å; I513-L516 HydrophobicContact CD1-CD1 3.47Å; I513-L516 VanDerWaalsContact CD1-CD1 3.47Å; I513-L516 HydrophobicContact CD1-CG 4.5Å; I513-L516 HydrophobicContact CG1-CD1 4.15Å; I513-L516 WeakPolarHBondContact O-CB 3.24Å; I513-L516 WeakPolarHBondContact O-CG 3.43Å; I513-L516 PolarHBondContact O-N 3.18Å; G514-L516 VanDerWaalsContact C-N 3.26Å; L516-N518 PolarHBondContact O-N 3.03Å; L516-N518 VanDerWaalsContact O-N 3.13Å; L516-L519 HydrophobicContact CB-CB 3.9Å; L516-L519 HydrophobicContact CB-CD2 4.44Å; L516-L519 HydrophobicContact CD1-CD2 4.18Å; L516-L519 VanDerWaalsContact O-CB 3.3Å; L516-L519 WeakPolarHBondContact O-CB 3.49Å; L516-L519 PolarHBondContact O-N 2.89Å
517	E	90.4	Very high	96.2	Very high	128 Å²	128	44.3 Å²	44.3	60%	0.598	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.6	-174.9	-64.6	179.6	-177.2	0	0	113.9	T515 K542	T515-E517 PolarHBondContact O-N 2.86Å; E517-K542 WeakPolarHBondContact O-CG 3.41Å
518	N	96.5	Very high	96.2	Very high	44 Å²	44	42.5 Å²	42.5	24%	0.235	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	2.4	178.9	-68	-54.3	0	0	0	114.3	T494 L496 T497 L516 E520 K542	T494-N518 WeakPolarHBondContact O-CB 3.33Å; T494-N518 PolarHBondContact O-ND2 3.09Å; L496-N518 CarbonylContact O-C 3.45Å; T497-N518 WeakPolarHBondContact CA-O 3.34Å; L516-N518 PolarHBondContact O-N 3.03Å; L516-N518 VanDerWaalsContact O-N 3.13Å; N518-E520 PolarHBondContact O-N 3.03Å; N518-K542 PolarHBondContact OD1-NZ 3.33Å
519	L	98	Very high	96.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.214	C	C	.	.			trans	-68.5	121.5	-177.4	-170.2	68.9	0	0	0	110.6	L496 L499 L516 L522 K542 L543	L496-L519 HydrophobicContact CD2-CD1 4.38Å; L496-L519 HydrophobicContact CG-CD1 4.45Å; L496-L519 VanDerWaalsContact O-CA 3.24Å; L496-L519 WeakPolarHBondContact O-CA 3.33Å; L496-L519 PolarHBondContact O-N 3.2Å; L496-L519 VanDerWaalsContact O-N 3.13Å; L499-L519 HydrophobicContact CB-CD1 3.81Å; L516-L519 HydrophobicContact CB-CB 3.9Å; L516-L519 HydrophobicContact CB-CD2 4.44Å; L516-L519 HydrophobicContact CD1-CD2 4.18Å; L516-L519 VanDerWaalsContact O-CB 3.3Å; L516-L519 WeakPolarHBondContact O-CB 3.49Å; L516-L519 PolarHBondContact O-N 2.89Å; L519-L522 HydrophobicContact CD2-CB 4.21Å; L519-L522 HydrophobicContact CD2-CD2 4.42Å; L519-K542 CarbonylContact O-C 3.4Å; L519-L543 HydrophobicContact CD2-CD1 4.27Å; L519-L543 HydrophobicContact CG-CD1 4.22Å; L519-L543 WeakPolarHBondContact O-CA 3.07Å; L519-L543 PolarHBondContact O-N 2.96Å
520	E	97.8	Very high	96.2	Very high	87 Å²	87	42.3 Å²	42.3	41%	0.407	21%	0.212	S	C	.	.			trans	-106.3	-36.5	-179.2	-66.2	-180	-175.8	0	0	111.5	T497 N518 K542 S544 I545	T497-E520 PolarHBondContact O-N 3Å; N518-E520 PolarHBondContact O-N 3.03Å; E520-K542 HydrophobicContact CG-CB 4.33Å; E520-S544 PolarHBondContact O-N 3.43Å; E520-S544 PolarHBondContact O-OG 3.48Å; E520-I545 PolarHBondContact O-N 3.18Å
521	E	98.3	Very high	96.1	Very high	55 Å²	55	45.3 Å²	45.3	26%	0.257	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	126.4	-176.1	-49.4	-173.1	172.8	0	0	112.2	T497 H498 L499 Y523 I545	T497-E521 PolarHBondContact O-N 3.36Å; H498-E521 IonicContact CE1-OE2 2.91Å; H498-E521 IonicContact CG-OE2 2.97Å; H498-E521 IonicContact ND1-OE2 2.75Å; H498-E521 PolarHBondContact ND1-OE2 3.26Å; L499-E521 PolarHBondContact N-O 2.83Å; E521-Y523 HydrophobicContact CB-CE2 3.78Å; E521-Y523 WeakPolarHBondContact OE2-CE2 3.27Å; E521-Y523 PolarHBondContact OE2-OH 3.02Å; E521-I545 WeakPolarHBondContact CA-O 3.42Å; E521-I545 HydrophobicContact CB-CB 4.32Å; E521-I545 HydrophobicContact CG-CB 4.14Å; E521-I545 HydrophobicContact CG-CD1 4.11Å; E521-I545 HydrophobicContact CG-CG1 4.5Å
522	L	98	Very high	96	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	110.6	176.8	179.3	58.3	0	0	0	111.3	L499 L501 L519 L524 L537 L543 I545 M546 S547	L499-L522 HydrophobicContact CB-CD1 4.04Å; L499-L522 HydrophobicContact CD2-CD1 3.95Å; L499-L522 HydrophobicContact CG-CD1 3.95Å; L499-L522 WeakPolarHBondContact O-CA 3.32Å; L501-L522 HydrophobicContact CD1-CD1 4.12Å; L519-L522 HydrophobicContact CD2-CB 4.21Å; L519-L522 HydrophobicContact CD2-CD2 4.42Å; L522-L524 HydrophobicContact CD1-CD2 4.24Å; L522-L524 HydrophobicContact CD1-CG 4.17Å; L522-L524 HydrophobicContact CD2-CD1 3.92Å; L522-L524 HydrophobicContact CD2-CG 4.39Å; L522-L524 HydrophobicContact CG-CD1 4.02Å; L522-L524 HydrophobicContact CG-CG 3.98Å; L522-L537 HydrophobicContact CD2-CD1 3.62Å; L522-L537 HydrophobicContact CD2-CD2 4.34Å; L522-L543 HydrophobicContact CB-CD1 3.73Å; L522-I545 PolarHBondContact N-O 2.88Å; L522-M546 CarbonylContact O-C 2.98Å; L522-M546 WeakPolarHBondContact O-CA 3.3Å; L522-S547 PolarHBondContact O-N 3.38Å
523	Y	98	Very high	95.9	Very high	68 Å²	68	39 Å²	39	27%	0.267	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116.5	178.1	-59.1	-91.4	0	0	0	110.3	H498 L499 L501 G502 E521 I545	H498-Y523 AromaticContact CE1-CD2 3.73Å; H498-Y523 AromaticContact CE1-CE2 3.36Å; H498-Y523 WeakPolarHBondContact CE1-CE2 3.45Å; H498-Y523 AromaticContact ND1-CE2 3.69Å; L499-Y523 PolarHBondContact O-N 2.9Å; L501-Y523 CarbonylContact C-O 3.29Å; L501-Y523 VanDerWaalsContact C-O 3.29Å; L501-Y523 VanDerWaalsContact CA-O 3.26Å; L501-Y523 WeakPolarHBondContact CA-O 3.49Å; L501-Y523 VanDerWaalsContact CB-O 3.3Å; L501-Y523 WeakPolarHBondContact CB-O 3.39Å; L501-Y523 PolarHBondContact N-O 3.01Å; G502-Y523 PolarHBondContact N-O 2.84Å; E521-Y523 HydrophobicContact CB-CE2 3.78Å; E521-Y523 WeakPolarHBondContact OE2-CE2 3.27Å; E521-Y523 PolarHBondContact OE2-OH 3.02Å; Y523-I545 HydrophobicContact CE1-CG2 4.2Å
524	L	97.2	Very high	95.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.205	C	C	.	.			trans	-122	5.4	-179.9	-64.1	164.5	0	0	0	112.8	L501 L506 L509 L522 N527 L530 L533 M546 S547 I548 C551	L501-L524 HydrophobicContact CB-CD2 4.03Å; L501-L524 HydrophobicContact CD1-CD2 3.8Å; L506-L524 HydrophobicContact CD1-CD2 4.32Å; L509-L524 HydrophobicContact CD1-CD1 3.79Å; L509-L524 HydrophobicContact CD1-CD2 3.89Å; L509-L524 HydrophobicContact CD2-CD2 3.89Å; L509-L524 HydrophobicContact CG-CD2 4.35Å; L522-L524 HydrophobicContact CD1-CD2 4.24Å; L522-L524 HydrophobicContact CD1-CG 4.17Å; L522-L524 HydrophobicContact CD2-CD1 3.92Å; L522-L524 HydrophobicContact CD2-CG 4.39Å; L522-L524 HydrophobicContact CG-CD1 4.02Å; L522-L524 HydrophobicContact CG-CG 3.98Å; L524-N527 PolarHBondContact O-ND2 3.32Å; L524-L530 HydrophobicContact CB-CD2 4.3Å; L524-L530 HydrophobicContact CD1-CD2 4.44Å; L524-L530 HydrophobicContact CD2-CD2 4.43Å; L524-L533 HydrophobicContact CD1-CD2 3.89Å; L524-M546 HydrophobicContact CD1-CE 3.83Å; L524-S547 CarbonylContact C-O 3.32Å; L524-S547 WeakPolarHBondContact CA-O 3.23Å; L524-S547 VanDerWaalsContact CB-O 3.32Å; L524-S547 WeakPolarHBondContact CB-O 3.43Å; L524-S547 PolarHBondContact N-O 3.07Å; L524-I548 HydrophobicContact CB-CG2 4.43Å; L524-I548 HydrophobicContact CD1-CG2 4.39Å; L524-C551 PolarHBondContact O-SG 3.19Å
525	N	95.9	Very high	95.8	Very high	27 Å²	27	43.3 Å²	43.3	14%	0.144	22%	0.219	C	C	.	.			trans	-54.1	154.5	-176.9	55.5	-76.9	0	0	0	112.7	G502 E503 N527 S547 E549	G502-N525 CarbonylContact C-O 3.21Å; G502-N525 WeakPolarHBondContact CA-O 3.41Å; E503-N525 PolarHBondContact N-O 3.19Å; N525-N527 VanDerWaalsContact C-N 3.28Å; N525-N527 PolarHBondContact O-N 3.2Å; N525-N527 PolarHBondContact O-ND2 3.44Å; N525-S547 WeakPolarHBondContact CB-OG 3.45Å; N525-S547 PolarHBondContact N-O 3.17Å; N525-S547 PolarHBondContact OD1-OG 2.86Å; N525-E549 CarbonylContact C-O 3.6Å; N525-E549 WeakPolarHBondContact CA-O 3.13Å; N525-E549 HydrophobicContact CB-CB 4.2Å; N525-E549 WeakPolarHBondContact CB-O 3.04Å
526	D	97.2	Very high	95.8	Very high	55 Å²	55	41.1 Å²	41.1	29%	0.294	21%	0.205	S	C	.	.	S	Bend	trans	57.8	40.5	174.2	-55.6	-69.7	0	0	0	113.1	E503 N504 P528 E549 N550	E503-D526 WeakPolarHBondContact CA-O 3.47Å; E503-D526 HydrophobicContact CB-CB 4.37Å; E503-D526 HydrophobicContact CG-CB 3.72Å; N504-D526 PolarHBondContact N-O 3.16Å; D526-P528 WeakPolarHBondContact O-CD 3.23Å; D526-E549 PolarHBondContact N-O 3Å; D526-N550 WeakPolarHBondContact OD1-CB 3.36Å; D526-N550 PolarHBondContact OD1-ND2 3.12Å
527	N	97.7	Very high	95.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.205	C	C	.	.			trans	-107.1	92.1	167.2	-80.6	-82.2	0	0	0	109.8	L501 N504 L506 L524 N525 H529 L530 P552	L501-N527 PolarHBondContact O-ND2 2.98Å; N504-N527 WeakPolarHBondContact CA-OD1 3.28Å; N504-N527 WeakPolarHBondContact CB-OD1 3.46Å; N504-N527 PolarHBondContact O-OD1 3.24Å; L506-N527 HydrophobicContact CB-CB 4.47Å; L506-N527 VanDerWaalsContact CB-OD1 3.29Å; L506-N527 WeakPolarHBondContact CB-OD1 3.23Å; L506-N527 WeakPolarHBondContact CG-OD1 3.1Å; L506-N527 PolarHBondContact N-OD1 3.47Å; L524-N527 PolarHBondContact O-ND2 3.32Å; N525-N527 VanDerWaalsContact C-N 3.28Å; N525-N527 PolarHBondContact O-N 3.2Å; N525-N527 PolarHBondContact O-ND2 3.44Å; N527-H529 PolarHBondContact O-N 3.25Å; N527-H529 VanDerWaalsContact O-N 3.17Å; N527-L530 HydrophobicContact CB-CB 3.86Å; N527-L530 HydrophobicContact CB-CD2 4.32Å; N527-L530 PolarHBondContact O-N 3.23Å; N527-P552 WeakPolarHBondContact O-CD 3.32Å
528	P	96.3	Very high	95.6	Very high	68 Å²	68	35.7 Å²	35.7	44%	0.442	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-12.9	-170.6	29.1	-36.2	0	0	0	113.9	N504 L505 D526 P552	N504-P528 WeakPolarHBondContact O-CD 3.35Å; L505-P528 HydrophobicContact CD2-CG 4.45Å; D526-P528 WeakPolarHBondContact O-CD 3.23Å; P528-P552 WeakPolarHBondContact O-CG 3.18Å
529	H	96	Very high	95.3	Very high	91 Å²	91	37.1 Å²	37.1	42%	0.421	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	2.8	178.8	-61.9	-51	0	0	0	113.4	L506 Q507 N527 H531	L506-H529 CarbonylContact O-C 3.14Å; Q507-H529 WeakPolarHBondContact CA-O 3.32Å; Q507-H529 HydrophobicContact CG-CB 4.21Å; N527-H529 PolarHBondContact O-N 3.25Å; N527-H529 VanDerWaalsContact O-N 3.17Å; H529-H531 PolarHBondContact O-CD2 2.74Å; H529-H531 PolarHBondContact O-N 3.09Å
530	L	96.4	Very high	95	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.191	C	C	.	.			trans	-86.5	92.9	-176.5	-171.2	61.7	0	0	0	110.7	L506 L524 N527 S532 L533 P552 L553	L506-L530 WeakPolarHBondContact O-CA 3.38Å; L506-L530 PolarHBondContact O-N 3.08Å; L506-L530 VanDerWaalsContact O-N 3.12Å; L524-L530 HydrophobicContact CB-CD2 4.3Å; L524-L530 HydrophobicContact CD1-CD2 4.44Å; L524-L530 HydrophobicContact CD2-CD2 4.43Å; N527-L530 HydrophobicContact CB-CB 3.86Å; N527-L530 HydrophobicContact CB-CD2 4.32Å; N527-L530 PolarHBondContact O-N 3.23Å; L530-S532 WeakPolarHBondContact CD1-O 3.16Å; L530-L533 HydrophobicContact CD2-CD2 4.03Å; L530-L533 HydrophobicContact CG-CD2 4.47Å; L530-P552 WeakPolarHBondContact O-CD 3.46Å; L530-P552 WeakPolarHBondContact O-CG 3.36Å; L530-L553 HydrophobicContact CG-CD2 4.3Å; L530-L553 PolarHBondContact O-N 2.86Å; L530-L553 VanDerWaalsContact O-N 3.1Å
531	H	93.9	Very high	94.6	Very high	72 Å²	72	37.9 Å²	37.9	33%	0.333	20%	0.204	S	C	.	.			trans	-91.3	-18.1	-176	-68.3	-79.6	0	0	0	114.5	H529 L553 T554 H555	H529-H531 PolarHBondContact O-CD2 2.74Å; H529-H531 PolarHBondContact O-N 3.09Å; H531-L553 CarbonylContact O-C 3.51Å; H531-L553 WeakPolarHBondContact O-CA 3.4Å; H531-T554 PolarHBondContact ND1-OG1 2.89Å; H531-T554 PolarHBondContact O-N 3.38Å; H531-H555 WeakPolarHBondContact O-CB 3.47Å; H531-H555 PolarHBondContact O-N 3.48Å; H531-H555 VanDerWaalsContact O-N 3.13Å
532	S	93.1	Very high	94.3	Very high	41 Å²	41	40.1 Å²	40.1	29%	0.287	21%	0.213	S	C	.	.			trans	-147.2	157.2	-180	50.7	0	0	0	0	112.5	L530	L530-S532 WeakPolarHBondContact CD1-O 3.16Å
533	L	94.4	Very high	94.2	Very high	12 Å²	12	41.7 Å²	41.7	6%	0.063	22%	0.221	C	C	.	.			trans	-119.4	141.3	171.2	-63.5	169.2	0	0	0	109.1	L509 L524 L530 L537 M546 L553 I568 L572	L509-L533 HydrophobicContact CD1-CD2 3.8Å; L524-L533 HydrophobicContact CD1-CD2 3.89Å; L530-L533 HydrophobicContact CD2-CD2 4.03Å; L530-L533 HydrophobicContact CG-CD2 4.47Å; L533-L537 HydrophobicContact CD1-CD2 4.47Å; L533-M546 HydrophobicContact CD1-CE 3.58Å; L533-L553 HydrophobicContact CD1-CD1 4.24Å; L533-L553 HydrophobicContact CD1-CD2 4.03Å; L533-L553 HydrophobicContact CD2-CD2 4.36Å; L533-L553 HydrophobicContact CG-CD2 3.79Å; L533-I568 HydrophobicContact CD1-CG2 3.93Å; L533-L572 HydrophobicContact CB-CD1 4.33Å
534	P	94.1	Very high	93.9	Very high	16 Å²	16	43 Å²	43	10%	0.104	24%	0.239	C	C	.	.			trans	-66.9	148.6	178.4	28	-34.4	0	0	0	111.4	L509 E511 I513 E536 L537	L509-P534 HydrophobicContact CB-CG 4.05Å; E511-P534 HydrophobicContact CG-CB 4.41Å; I513-P534 HydrophobicContact CG2-CG 3.71Å; P534-E536 WeakPolarHBondContact CB-OE2 3.16Å; P534-E536 PolarHBondContact O-N 3.24Å; P534-L537 WeakPolarHBondContact O-CB 3.4Å; P534-L537 PolarHBondContact O-N 3.13Å
535	F	92.1	Very high	93.8	Very high	81 Å²	81	46.3 Å²	46.3	36%	0.355	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-64.9	-30.1	178.3	-68.2	-69.5	0	0	0	111.9	L537 A538 L572 Q575	F535-L537 PolarHBondContact O-N 3.47Å; F535-L537 VanDerWaalsContact O-N 3.14Å; F535-A538 WeakPolarHBondContact O-CB 3.39Å; F535-A538 PolarHBondContact O-N 3.04Å; F535-L572 HydrophobicContact CD1-CB 4.41Å; F535-L572 HydrophobicContact CD1-CD2 3.76Å; F535-L572 HydrophobicContact CE1-CD2 4.1Å; F535-Q575 HydrophobicContact CE1-CB 3.97Å
536	E	93.9	Very high	93.8	Very high	19 Å²	19	46 Å²	46	9%	0.089	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-59.3	-22.5	178.8	-69.3	70.8	-152.8	0	0	112.4	E511 G514 P534 A538 L539 Y578	E511-E536 HydrophobicContact CB-CG 4.06Å; E511-E536 WeakPolarHBondContact O-CB 3.18Å; E511-E536 WeakPolarHBondContact O-CG 3.39Å; G514-E536 WeakPolarHBondContact CA-O 3.18Å; P534-E536 WeakPolarHBondContact CB-OE2 3.16Å; P534-E536 PolarHBondContact O-N 3.24Å; E536-A538 PolarHBondContact O-N 3.3Å; E536-A538 VanDerWaalsContact O-N 3.1Å; E536-L539 HydrophobicContact CB-CD1 4.29Å; E536-L539 HydrophobicContact CG-CD1 4.39Å; E536-L539 WeakPolarHBondContact O-CB 3.35Å; E536-L539 WeakPolarHBondContact O-CG 3.29Å; E536-L539 PolarHBondContact O-N 3.2Å; E536-Y578 HydrophobicContact CG-CE2 4.07Å; E536-Y578 VanDerWaalsContact OE1-CE2 3.22Å; E536-Y578 WeakPolarHBondContact OE1-CE2 3.49Å; E536-Y578 PolarHBondContact OE1-OH 3.24Å
537	L	92.6	Very high	93.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-58.6	-25.6	174	-171.2	65.6	0	0	0	112.5	I513 L522 L533 P534 F535 L539 C540 L543 M546 I569 L572	I513-L537 HydrophobicContact CG1-CD1 4.22Å; I513-L537 HydrophobicContact CG2-CB 4.37Å; I513-L537 HydrophobicContact CG2-CD1 4.16Å; L522-L537 HydrophobicContact CD2-CD1 3.62Å; L522-L537 HydrophobicContact CD2-CD2 4.34Å; L533-L537 HydrophobicContact CD1-CD2 4.47Å; P534-L537 WeakPolarHBondContact O-CB 3.4Å; P534-L537 PolarHBondContact O-N 3.13Å; F535-L537 PolarHBondContact O-N 3.47Å; F535-L537 VanDerWaalsContact O-N 3.14Å; L537-L539 PolarHBondContact O-N 3.4Å; L537-C540 PolarHBondContact O-N 3Å; L537-L543 HydrophobicContact CD1-CD2 4.22Å; L537-L543 HydrophobicContact CG-CD2 4.42Å; L537-M546 HydrophobicContact CD2-CE 3.69Å; L537-M546 HydrophobicContact CD2-SD 4.06Å; L537-I569 HydrophobicContact CD2-CD1 4Å; L537-I569 HydrophobicContact CG-CD1 3.93Å; L537-L572 HydrophobicContact CB-CD1 4.29Å; L537-L572 HydrophobicContact CD2-CD1 4.43Å
538	A	90.5	Very high	93.4	Very high	13 Å²	13	45.4 Å²	45.4	11%	0.107	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-62.7	-21.3	172.1	0	0	0	0	0	114.4	F535 E536 C540 L572 K573	F535-A538 WeakPolarHBondContact O-CB 3.39Å; F535-A538 PolarHBondContact O-N 3.04Å; E536-A538 PolarHBondContact O-N 3.3Å; E536-A538 VanDerWaalsContact O-N 3.1Å; A538-C540 VanDerWaalsContact C-N 3.34Å; A538-L572 HydrophobicContact CB-CB 4.2Å; A538-K573 HydrophobicContact CB-CB 4.39Å; A538-K573 HydrophobicContact CB-CG 3.49Å; A538-K573 VanDerWaalsContact CB-CG 3.49Å; A538-K573 VanDerWaalsContact O-CE 3.23Å; A538-K573 WeakPolarHBondContact O-CE 3.17Å
539	L	91	Very high	93.2	Very high	74 Å²	74	48.8 Å²	48.8	39%	0.387	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-80.2	-15.4	-179.4	-56	175.3	0	0	0	112.5	G514 E536 L537 S541	G514-L539 WeakPolarHBondContact O-CB 3.4Å; E536-L539 HydrophobicContact CB-CD1 4.29Å; E536-L539 HydrophobicContact CG-CD1 4.39Å; E536-L539 WeakPolarHBondContact O-CB 3.35Å; E536-L539 WeakPolarHBondContact O-CG 3.29Å; E536-L539 PolarHBondContact O-N 3.2Å; L537-L539 PolarHBondContact O-N 3.4Å; L539-S541 PolarHBondContact O-N 2.96Å
540	C	91.6	Very high	93	Very high	7 Å²	7	50.1 Å²	50.1	5%	0.047	27%	0.273	C	S	.	.			trans	-69.7	80.1	173.5	-59.5	0	0	0	0	110.4	I513 L537 A538 K542 L543	I513-C540 PolarHBondContact O-SG 3.42Å; L537-C540 PolarHBondContact O-N 3Å; A538-C540 VanDerWaalsContact C-N 3.34Å; C540-K542 VanDerWaalsContact C-N 3.25Å; C540-K542 PolarHBondContact O-N 3.16Å; C540-L543 HydrophobicContact CB-CB 3.91Å; C540-L543 HydrophobicContact CB-CD2 4.47Å; C540-L543 VanDerWaalsContact O-CB 3.29Å; C540-L543 WeakPolarHBondContact O-CB 3.21Å; C540-L543 PolarHBondContact O-N 3.03Å; C540-L543 VanDerWaalsContact O-N 3.1Å
541	S	87.5	Confident	92.9	Very high	97 Å²	97	50.8 Å²	50.8	68%	0.678	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-26.2	-169.6	64.2	0	0	0	0	114.6	L539	L539-S541 PolarHBondContact O-N 2.96Å
542	K	93.9	Very high	92.7	Very high	102 Å²	102	49.7 Å²	49.7	44%	0.443	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.2	178.3	-62.7	-167.3	-169.3	171.8	0	114.3	E517 N518 L519 E520 C540 S544	E517-K542 WeakPolarHBondContact O-CG 3.41Å; N518-K542 PolarHBondContact OD1-NZ 3.33Å; L519-K542 CarbonylContact O-C 3.4Å; E520-K542 HydrophobicContact CG-CB 4.33Å; C540-K542 VanDerWaalsContact C-N 3.25Å; C540-K542 PolarHBondContact O-N 3.16Å; K542-S544 PolarHBondContact O-N 2.93Å; K542-S544 VanDerWaalsContact O-N 3.08Å
543	L	94.3	Very high	92.7	Very high	33 Å²	33	47.8 Å²	47.8	17%	0.173	26%	0.264	C	S	.	.			trans	-64.4	115.1	-176.6	-175.1	66	0	0	0	109.6	L519 L522 L537 C540 I545 M546 I569	L519-L543 HydrophobicContact CD2-CD1 4.27Å; L519-L543 HydrophobicContact CG-CD1 4.22Å; L519-L543 WeakPolarHBondContact O-CA 3.07Å; L519-L543 PolarHBondContact O-N 2.96Å; L522-L543 HydrophobicContact CB-CD1 3.73Å; L537-L543 HydrophobicContact CD1-CD2 4.22Å; L537-L543 HydrophobicContact CG-CD2 4.42Å; C540-L543 HydrophobicContact CB-CB 3.91Å; C540-L543 HydrophobicContact CB-CD2 4.47Å; C540-L543 VanDerWaalsContact O-CB 3.29Å; C540-L543 WeakPolarHBondContact O-CB 3.21Å; C540-L543 PolarHBondContact O-N 3.03Å; C540-L543 VanDerWaalsContact O-N 3.1Å; L543-I545 WeakPolarHBondContact CD1-O 3.35Å; L543-M546 HydrophobicContact CD2-CB 4.49Å; L543-M546 HydrophobicContact CD2-SD 4.35Å; L543-I569 HydrophobicContact CD2-CD1 4.06Å
544	S	92.9	Very high	92.5	Very high	94 Å²	94	51.6 Å²	51.6	66%	0.657	29%	0.287	S	S	*	.			trans	-117.8	-33.9	-174.5	68.2	0	0	0	0	112.2	E520 K542	E520-S544 PolarHBondContact O-N 3.43Å; E520-S544 PolarHBondContact O-OG 3.48Å; K542-S544 PolarHBondContact O-N 2.93Å; K542-S544 VanDerWaalsContact O-N 3.08Å
545	I	94.3	Very high	92.3	Very high	71 Å²	71	57.4 Å²	57.4	36%	0.364	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.7	178.3	-59.5	177	0	0	0	108.2	E520 E521 L522 Y523 L543	E520-I545 PolarHBondContact O-N 3.18Å; E521-I545 WeakPolarHBondContact CA-O 3.42Å; E521-I545 HydrophobicContact CB-CB 4.32Å; E521-I545 HydrophobicContact CG-CB 4.14Å; E521-I545 HydrophobicContact CG-CD1 4.11Å; E521-I545 HydrophobicContact CG-CG1 4.5Å; L522-I545 PolarHBondContact N-O 2.88Å; Y523-I545 HydrophobicContact CE1-CG2 4.2Å; L543-I545 WeakPolarHBondContact CD1-O 3.35Å
546	M	95.5	Very high	92.1	Very high	19 Å²	19	54.4 Å²	54.4	9%	0.094	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	126.9	173.8	178.1	-179.3	178.7	0	0	109.5	L522 L524 L533 L537 L543 I548 P565 I569	L522-M546 CarbonylContact O-C 2.98Å; L522-M546 WeakPolarHBondContact O-CA 3.3Å; L524-M546 HydrophobicContact CD1-CE 3.83Å; L533-M546 HydrophobicContact CD1-CE 3.58Å; L537-M546 HydrophobicContact CD2-CE 3.69Å; L537-M546 HydrophobicContact CD2-SD 4.06Å; L543-M546 HydrophobicContact CD2-CB 4.49Å; L543-M546 HydrophobicContact CD2-SD 4.35Å; M546-I548 HydrophobicContact CE-CG2 3.32Å; M546-I548 HydrophobicContact CG-CG2 4.13Å; M546-I548 HydrophobicContact SD-CG2 4.41Å; M546-P565 HydrophobicContact CB-CB 3.78Å; M546-P565 HydrophobicContact CB-CG 4.36Å; M546-P565 HydrophobicContact CG-CB 4.05Å; M546-P565 WeakPolarHBondContact O-CG 3.49Å; M546-P565 HydrophobicContact SD-CB 4.16Å; M546-I569 HydrophobicContact SD-CD1 4.17Å; M546-I569 HydrophobicContact SD-CG1 4.4Å
547	S	93.9	Very high	91.8	Very high	24 Å²	24	56.2 Å²	56.2	17%	0.168	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	132.1	175.5	-174.6	0	0	0	0	110.2	L522 L524 N525	L522-S547 PolarHBondContact O-N 3.38Å; L524-S547 CarbonylContact C-O 3.32Å; L524-S547 WeakPolarHBondContact CA-O 3.23Å; L524-S547 VanDerWaalsContact CB-O 3.32Å; L524-S547 WeakPolarHBondContact CB-O 3.43Å; L524-S547 PolarHBondContact N-O 3.07Å; N525-S547 WeakPolarHBondContact CB-OG 3.45Å; N525-S547 PolarHBondContact N-O 3.17Å; N525-S547 PolarHBondContact OD1-OG 2.86Å
548	I	92.8	Very high	91.5	Very high	19 Å²	19	60.1 Å²	60.1	10%	0.097	35%	0.346	C	S	.	.			trans	-142.1	17.1	-176.9	53.8	159.1	0	0	0	112.2	L524 M546 C551 L553 P565 I568	L524-I548 HydrophobicContact CB-CG2 4.43Å; L524-I548 HydrophobicContact CD1-CG2 4.39Å; M546-I548 HydrophobicContact CE-CG2 3.32Å; M546-I548 HydrophobicContact CG-CG2 4.13Å; M546-I548 HydrophobicContact SD-CG2 4.41Å; I548-C551 WeakPolarHBondContact O-CB 3.49Å; I548-C551 PolarHBondContact O-N 3.3Å; I548-L553 HydrophobicContact CB-CD1 4.29Å; I548-L553 HydrophobicContact CD1-CD1 3.93Å; I548-P565 HydrophobicContact CG1-CG 4.26Å; I548-I568 HydrophobicContact CD1-CD1 3.14Å
549	E	92.3	Very high	91.3	Very high	139 Å²	139	67.6 Å²	67.6	65%	0.65	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	141.7	179.4	-62.3	-177.1	178.5	0	0	109.6	N525 D526 C551	N525-E549 CarbonylContact C-O 3.6Å; N525-E549 WeakPolarHBondContact CA-O 3.13Å; N525-E549 HydrophobicContact CB-CB 4.2Å; N525-E549 WeakPolarHBondContact CB-O 3.04Å; D526-E549 PolarHBondContact N-O 3Å; E549-C551 PolarHBondContact O-N 3.48Å; E549-C551 VanDerWaalsContact O-N 3.16Å
550	N	91.5	Very high	91.2	Very high	119 Å²	119	65.7 Å²	65.7	64%	0.636	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	25.3	-178.1	-54.4	-34.1	0	0	0	115.4	D526	D526-N550 WeakPolarHBondContact OD1-CB 3.36Å; D526-N550 PolarHBondContact OD1-ND2 3.12Å
551	C	93.9	Very high	91	Very high	14 Å²	14	67.2 Å²	67.2	10%	0.095	38%	0.378	C	S	.	.			trans	-97.1	131.4	163.8	-63.4	0	0	0	0	110.6	L524 I548 E549 L553	L524-C551 PolarHBondContact O-SG 3.19Å; I548-C551 WeakPolarHBondContact O-CB 3.49Å; I548-C551 PolarHBondContact O-N 3.3Å; E549-C551 PolarHBondContact O-N 3.48Å; E549-C551 VanDerWaalsContact O-N 3.16Å; C551-L553 HydrophobicContact CB-CD1 4.26Å; C551-L553 HydrophobicContact CB-CD2 4.33Å; C551-L553 HydrophobicContact CB-CG 3.82Å; C551-L553 PolarHBondContact O-N 3.29Å
552	P	91.4	Very high	90.8	Very high	50 Å²	50	66.8 Å²	66.8	33%	0.325	38%	0.38	S	S	.	.			trans	-68.1	-34.4	-176.6	26.6	-34.4	0	0	0	113.2	N527 P528 L530 T554	N527-P552 WeakPolarHBondContact O-CD 3.32Å; P528-P552 WeakPolarHBondContact O-CG 3.18Å; L530-P552 WeakPolarHBondContact O-CD 3.46Å; L530-P552 WeakPolarHBondContact O-CG 3.36Å; P552-T554 HydrophobicContact CB-CG2 4.21Å; P552-T554 PolarHBondContact O-N 3.19Å
553	L	92	Very high	90.4	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.005	37%	0.374	C	S	.	.			trans	41.8	37.3	175.4	-62.7	-178.9	0	0	0	114.8	L530 H531 L533 I548 C551 H555 L556 V561 I568	L530-L553 HydrophobicContact CG-CD2 4.3Å; L530-L553 PolarHBondContact O-N 2.86Å; L530-L553 VanDerWaalsContact O-N 3.1Å; H531-L553 CarbonylContact O-C 3.51Å; H531-L553 WeakPolarHBondContact O-CA 3.4Å; L533-L553 HydrophobicContact CD1-CD1 4.24Å; L533-L553 HydrophobicContact CD1-CD2 4.03Å; L533-L553 HydrophobicContact CD2-CD2 4.36Å; L533-L553 HydrophobicContact CG-CD2 3.79Å; I548-L553 HydrophobicContact CB-CD1 4.29Å; I548-L553 HydrophobicContact CD1-CD1 3.93Å; C551-L553 HydrophobicContact CB-CD1 4.26Å; C551-L553 HydrophobicContact CB-CD2 4.33Å; C551-L553 HydrophobicContact CB-CG 3.82Å; C551-L553 PolarHBondContact O-N 3.29Å; L553-H555 PolarHBondContact O-N 2.9Å; L553-L556 HydrophobicContact CB-CD1 4.4Å; L553-L556 HydrophobicContact CD1-CD1 4.44Å; L553-L556 PolarHBondContact O-N 3.01Å; L553-V561 HydrophobicContact CB-CG1 4.49Å; L553-V561 HydrophobicContact CB-CG2 4.09Å; L553-V561 HydrophobicContact CD1-CG1 4.41Å; L553-I568 HydrophobicContact CD1-CD1 4.07Å
554	T	90.4	Very high	90.1	Very high	91 Å²	91	62.6 Å²	62.6	56%	0.558	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-16.3	-169.4	46.1	0	0	0	0	114.4	H531 P552 L556	H531-T554 PolarHBondContact ND1-OG1 2.89Å; H531-T554 PolarHBondContact O-N 3.38Å; P552-T554 HydrophobicContact CB-CG2 4.21Å; P552-T554 PolarHBondContact O-N 3.19Å; T554-L556 VanDerWaalsContact C-N 3.29Å
555	H	88.9	Confident	89.9	Confident	138 Å²	138	60.1 Å²	60.1	64%	0.639	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-8.4	175.5	-63.1	168.6	0	0	0	113.3	H531 L553	H531-H555 WeakPolarHBondContact O-CB 3.47Å; H531-H555 PolarHBondContact O-N 3.48Å; H531-H555 VanDerWaalsContact O-N 3.13Å; L553-H555 PolarHBondContact O-N 2.9Å
556	L	88.7	Confident	89.6	Confident	19 Å²	19	60.7 Å²	60.7	10%	0.099	37%	0.366	C	S	.	.	S	Bend	trans	-100	146.9	174.7	-63.6	175.4	0	0	0	110.6	L553 T554 A558 V561 I568 F571 L572	L553-L556 HydrophobicContact CB-CD1 4.4Å; L553-L556 HydrophobicContact CD1-CD1 4.44Å; L553-L556 PolarHBondContact O-N 3.01Å; T554-L556 VanDerWaalsContact C-N 3.29Å; L556-A558 PolarHBondContact O-N 3.27Å; L556-V561 HydrophobicContact CB-CG2 3.68Å; L556-V561 HydrophobicContact CD1-CG2 4.44Å; L556-I568 HydrophobicContact CD1-CD1 4.41Å; L556-I568 HydrophobicContact CD1-CG1 4.18Å; L556-I568 HydrophobicContact CD1-CG2 3.91Å; L556-F571 HydrophobicContact CD2-CD1 3.71Å; L556-F571 HydrophobicContact CD2-CE1 3.59Å; L556-L572 HydrophobicContact CD2-CD2 4.39Å
557	P	87.9	Confident	89.2	Confident	56 Å²	56	64.7 Å²	64.7	36%	0.364	38%	0.383	S	S	.	.			trans	-58.6	132.1	175.2	-21	31.4	0	0	0	111	Q559 I560 V561 F571	P557-Q559 PolarHBondContact O-N 3.29Å; P557-I560 HydrophobicContact CB-CB 4.47Å; P557-I560 HydrophobicContact CB-CG1 4.04Å; P557-I560 HydrophobicContact CG-CG1 4.13Å; P557-I560 WeakPolarHBondContact O-CA 3.29Å; P557-I560 WeakPolarHBondContact O-CB 3.23Å; P557-I560 PolarHBondContact O-N 2.83Å; P557-V561 PolarHBondContact O-N 3.31Å; P557-V561 VanDerWaalsContact O-N 3.17Å; P557-F571 HydrophobicContact CG-CE2 3.83Å; P557-F571 HydrophobicContact CG-CZ 3.98Å
558	A	86.2	Confident	89	Confident	82 Å²	82	63.6 Å²	63.6	68%	0.678	38%	0.375	S	S	*	.	H	α-helix	trans	-55.1	-31.7	-175.9	0	0	0	0	0	113.7	L556 I560 V561 A562	L556-A558 PolarHBondContact O-N 3.27Å; A558-I560 VanDerWaalsContact C-N 3.35Å; A558-V561 PolarHBondContact O-N 3.23Å; A558-A562 WeakPolarHBondContact O-CB 3.39Å; A558-A562 PolarHBondContact O-N 2.97Å
559	Q	87.4	Confident	88.8	Confident	170 Å²	170	64.1 Å²	64.1	79%	0.794	38%	0.378	S	S	*	.	H	α-helix	trans	-65.2	-36.6	175.6	-65.3	171.6	-0.9	0	0	112.6	P557 G563	P557-Q559 PolarHBondContact O-N 3.29Å; Q559-G563 PolarHBondContact O-N 3.04Å; Q559-G563 VanDerWaalsContact O-N 3.11Å
560	I	88.1	Confident	88.5	Confident	34 Å²	34	63.3 Å²	63.3	17%	0.174	37%	0.374	C	S	.	.	H	α-helix	trans	-71.2	-43.6	177.3	-63	-61.7	0	0	0	109.8	P557 A558 A562 G563 F567 I568 F571	P557-I560 HydrophobicContact CB-CB 4.47Å; P557-I560 HydrophobicContact CB-CG1 4.04Å; P557-I560 HydrophobicContact CG-CG1 4.13Å; P557-I560 WeakPolarHBondContact O-CA 3.29Å; P557-I560 WeakPolarHBondContact O-CB 3.23Å; P557-I560 PolarHBondContact O-N 2.83Å; A558-I560 VanDerWaalsContact C-N 3.35Å; I560-A562 VanDerWaalsContact C-N 3.35Å; I560-A562 PolarHBondContact O-N 3.03Å; I560-G563 PolarHBondContact O-N 3.24Å; I560-F567 HydrophobicContact CG2-CB 4.33Å; I560-I568 HydrophobicContact CG2-CB 4.37Å; I560-I568 HydrophobicContact CG2-CG1 3.77Å; I560-F571 HydrophobicContact CD1-CB 4.32Å; I560-F571 HydrophobicContact CD1-CD2 4.21Å; I560-F571 HydrophobicContact CG1-CB 4.36Å; I560-F571 HydrophobicContact CG1-CD2 3.92Å; I560-F571 HydrophobicContact CG1-CG 4.27Å; I560-F571 HydrophobicContact CG2-CB 3.72Å; I560-F571 HydrophobicContact CG2-CG 4.13Å
561	V	86.4	Confident	88.4	Confident	39 Å²	39	59.9 Å²	59.9	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-62.5	-42.6	177.1	-177.3	0	0	0	0	111	L553 L556 P557 A558 G563 G564	L553-V561 HydrophobicContact CB-CG1 4.49Å; L553-V561 HydrophobicContact CB-CG2 4.09Å; L553-V561 HydrophobicContact CD1-CG1 4.41Å; L556-V561 HydrophobicContact CB-CG2 3.68Å; L556-V561 HydrophobicContact CD1-CG2 4.44Å; P557-V561 PolarHBondContact O-N 3.31Å; P557-V561 VanDerWaalsContact O-N 3.17Å; A558-V561 PolarHBondContact O-N 3.23Å; V561-G563 VanDerWaalsContact C-N 3.28Å; V561-G563 PolarHBondContact O-N 3.06Å; V561-G564 PolarHBondContact O-N 2.93Å; V561-G564 VanDerWaalsContact O-N 3.08Å
562	A	84.7	Confident	88.2	Confident	89 Å²	89	59.2 Å²	59.2	74%	0.736	35%	0.349	S	S	*	.	H	α-helix	trans	-66.7	-26.7	176.1	0	0	0	0	0	113.7	A558 I560 G564	A558-A562 WeakPolarHBondContact O-CB 3.39Å; A558-A562 PolarHBondContact O-N 2.97Å; I560-A562 VanDerWaalsContact C-N 3.35Å; I560-A562 PolarHBondContact O-N 3.03Å; A562-G564 PolarHBondContact O-N 2.66Å
563	G	84.3	Confident	87.9	Confident	30 Å²	30	62 Å²	62	31%	0.309	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-9.4	172.5	0	0	0	0	0	113.8	Q559 I560 V561 F567	Q559-G563 PolarHBondContact O-N 3.04Å; Q559-G563 VanDerWaalsContact O-N 3.11Å; I560-G563 PolarHBondContact O-N 3.24Å; V561-G563 VanDerWaalsContact C-N 3.28Å; V561-G563 PolarHBondContact O-N 3.06Å; G563-F567 WeakPolarHBondContact O-CD2 3.47Å
564	G	87.7	Confident	87.5	Confident	17 Å²	17	66.8 Å²	66.8	18%	0.175	38%	0.38	C	S	.	.			trans	82.2	-171.8	177.4	0	0	0	0	0	114	V561 A562 S566 F567 I568	V561-G564 PolarHBondContact O-N 2.93Å; V561-G564 VanDerWaalsContact O-N 3.08Å; A562-G564 PolarHBondContact O-N 2.66Å; G564-S566 VanDerWaalsContact C-N 3.32Å; G564-S566 PolarHBondContact O-N 2.68Å; G564-F567 PolarHBondContact O-N 2.99Å; G564-I568 PolarHBondContact O-N 3.37Å
565	P	88.8	Confident	87.1	Confident	42 Å²	42	67.9 Å²	67.9	27%	0.273	38%	0.378	S	S	.	.	H	α-helix	trans	-59.5	-36.5	-169.9	-19.3	25.4	0	0	0	114.5	M546 I548 F567 I568 I569	M546-P565 HydrophobicContact CB-CB 3.78Å; M546-P565 HydrophobicContact CB-CG 4.36Å; M546-P565 HydrophobicContact CG-CB 4.05Å; M546-P565 WeakPolarHBondContact O-CG 3.49Å; M546-P565 HydrophobicContact SD-CB 4.16Å; I548-P565 HydrophobicContact CG1-CG 4.26Å; P565-F567 PolarHBondContact O-N 2.89Å; P565-I568 PolarHBondContact O-N 2.81Å; P565-I569 WeakPolarHBondContact O-CG1 3.47Å; P565-I569 PolarHBondContact O-N 2.99Å
566	S	87.9	Confident	86.3	Confident	83 Å²	83	61.7 Å²	61.7	58%	0.58	35%	0.352	S	S	*	.	H	α-helix	trans	-63.8	-41.6	-180	54.3	0	0	0	0	112.7	G564 I569 Q570	G564-S566 VanDerWaalsContact C-N 3.32Å; G564-S566 PolarHBondContact O-N 2.68Å; S566-I569 PolarHBondContact O-N 3.21Å; S566-Q570 PolarHBondContact O-N 2.95Å
567	F	88.3	Confident	85.5	Confident	103 Å²	103	65.5 Å²	65.5	45%	0.452	38%	0.378	S	S	.	.	H	α-helix	trans	-67.2	-38.6	176.1	-82.5	-107.1	0	0	0	111.4	I560 G563 G564 P565 Q570 F571	I560-F567 HydrophobicContact CG2-CB 4.33Å; G563-F567 WeakPolarHBondContact O-CD2 3.47Å; G564-F567 PolarHBondContact O-N 2.99Å; P565-F567 PolarHBondContact O-N 2.89Å; F567-Q570 PolarHBondContact O-N 3.17Å; F567-F571 WeakPolarHBondContact O-CB 3.47Å; F567-F571 PolarHBondContact O-N 2.8Å
568	I	89.1	Confident	84.3	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-62.6	-49.9	175.8	-69.5	166.3	0	0	0	110.5	L533 I548 L553 L556 I560 G564 P565 Q570 F571 L572	L533-I568 HydrophobicContact CD1-CG2 3.93Å; I548-I568 HydrophobicContact CD1-CD1 3.14Å; L553-I568 HydrophobicContact CD1-CD1 4.07Å; L556-I568 HydrophobicContact CD1-CD1 4.41Å; L556-I568 HydrophobicContact CD1-CG1 4.18Å; L556-I568 HydrophobicContact CD1-CG2 3.91Å; I560-I568 HydrophobicContact CG2-CB 4.37Å; I560-I568 HydrophobicContact CG2-CG1 3.77Å; G564-I568 PolarHBondContact O-N 3.37Å; P565-I568 PolarHBondContact O-N 2.81Å; I568-Q570 VanDerWaalsContact C-N 3.28Å; I568-Q570 PolarHBondContact O-N 3.23Å; I568-F571 WeakPolarHBondContact O-CB 3.3Å; I568-F571 PolarHBondContact O-N 3.16Å; I568-F571 VanDerWaalsContact O-N 3.13Å; I568-L572 HydrophobicContact CG2-CD1 3.88Å; I568-L572 HydrophobicContact CG2-CG 4.25Å; I568-L572 VanDerWaalsContact O-CG 3.29Å; I568-L572 WeakPolarHBondContact O-CG 3.25Å; I568-L572 PolarHBondContact O-N 3.27Å
569	I	88.3	Confident	83	Confident	30 Å²	30	71.5 Å²	71.5	15%	0.154	38%	0.376	C	S	.	.	H	α-helix	trans	-59.3	-41.3	178	-66	-64.2	0	0	0	110.8	L537 L543 M546 P565 S566 L572 K573	L537-I569 HydrophobicContact CD2-CD1 4Å; L537-I569 HydrophobicContact CG-CD1 3.93Å; L543-I569 HydrophobicContact CD2-CD1 4.06Å; M546-I569 HydrophobicContact SD-CD1 4.17Å; M546-I569 HydrophobicContact SD-CG1 4.4Å; P565-I569 WeakPolarHBondContact O-CG1 3.47Å; P565-I569 PolarHBondContact O-N 2.99Å; S566-I569 PolarHBondContact O-N 3.21Å; I569-L572 PolarHBondContact O-N 3.43Å; I569-K573 HydrophobicContact CG2-CD 4.29Å; I569-K573 VanDerWaalsContact O-CG 3.32Å; I569-K573 WeakPolarHBondContact O-CG 3.22Å; I569-K573 PolarHBondContact O-N 3.14Å
570	Q	87.3	Confident	81.3	Confident	122 Å²	122	68.1 Å²	68.1	57%	0.57	38%	0.378	S	S	*	.	H	α-helix	trans	-65.4	-40.1	176	-170.9	177	3.9	0	0	112.6	S566 F567 I568 K573 M574	S566-Q570 PolarHBondContact O-N 2.95Å; F567-Q570 PolarHBondContact O-N 3.17Å; I568-Q570 VanDerWaalsContact C-N 3.28Å; I568-Q570 PolarHBondContact O-N 3.23Å; Q570-K573 WeakPolarHBondContact O-CB 3.5Å; Q570-K573 PolarHBondContact O-N 3.17Å; Q570-M574 WeakPolarHBondContact O-CB 3.3Å; Q570-M574 VanDerWaalsContact O-CG 3.28Å; Q570-M574 WeakPolarHBondContact O-CG 3.45Å; Q570-M574 PolarHBondContact O-N 3.14Å
571	F	89	Confident	79.5	Confident	47 Å²	47	74.3 Å²	74.3	21%	0.206	41%	0.408	C	S	.	.	H	α-helix	trans	-63	-46.1	175.4	177.7	-92	0	0	0	111.5	L556 P557 I560 F567 I568 K573 M574 Q575	L556-F571 HydrophobicContact CD2-CD1 3.71Å; L556-F571 HydrophobicContact CD2-CE1 3.59Å; P557-F571 HydrophobicContact CG-CE2 3.83Å; P557-F571 HydrophobicContact CG-CZ 3.98Å; I560-F571 HydrophobicContact CD1-CB 4.32Å; I560-F571 HydrophobicContact CD1-CD2 4.21Å; I560-F571 HydrophobicContact CG1-CB 4.36Å; I560-F571 HydrophobicContact CG1-CD2 3.92Å; I560-F571 HydrophobicContact CG1-CG 4.27Å; I560-F571 HydrophobicContact CG2-CB 3.72Å; I560-F571 HydrophobicContact CG2-CG 4.13Å; F567-F571 WeakPolarHBondContact O-CB 3.47Å; F567-F571 PolarHBondContact O-N 2.8Å; I568-F571 WeakPolarHBondContact O-CB 3.3Å; I568-F571 PolarHBondContact O-N 3.16Å; I568-F571 VanDerWaalsContact O-N 3.13Å; F571-K573 VanDerWaalsContact C-N 3.31Å; F571-K573 PolarHBondContact O-N 3.31Å; F571-M574 PolarHBondContact O-N 3.43Å; F571-M574 VanDerWaalsContact O-N 3.11Å; F571-Q575 HydrophobicContact CD2-CG 4.15Å; F571-Q575 HydrophobicContact CE1-CB 4.41Å; F571-Q575 HydrophobicContact CE1-CG 4.13Å; F571-Q575 HydrophobicContact CE2-CG 3.75Å; F571-Q575 HydrophobicContact CZ-CB 4.45Å; F571-Q575 HydrophobicContact CZ-CG 3.74Å; F571-Q575 PolarHBondContact O-N 3.34Å
572	L	88.8	Confident	77.3	Confident	1 Å²	1	82.4 Å²	82.4	1%	0.005	46%	0.457	C	S	.	.	H	α-helix	trans	-60.5	-41	176.5	-65.9	174.5	0	0	0	111.1	L533 F535 L537 A538 L556 I568 I569 M574 G576	L533-L572 HydrophobicContact CB-CD1 4.33Å; F535-L572 HydrophobicContact CD1-CB 4.41Å; F535-L572 HydrophobicContact CD1-CD2 3.76Å; F535-L572 HydrophobicContact CE1-CD2 4.1Å; L537-L572 HydrophobicContact CB-CD1 4.29Å; L537-L572 HydrophobicContact CD2-CD1 4.43Å; A538-L572 HydrophobicContact CB-CB 4.2Å; L556-L572 HydrophobicContact CD2-CD2 4.39Å; I568-L572 HydrophobicContact CG2-CD1 3.88Å; I568-L572 HydrophobicContact CG2-CG 4.25Å; I568-L572 VanDerWaalsContact O-CG 3.29Å; I568-L572 WeakPolarHBondContact O-CG 3.25Å; I568-L572 PolarHBondContact O-N 3.27Å; I569-L572 PolarHBondContact O-N 3.43Å; L572-M574 VanDerWaalsContact C-N 3.35Å; L572-M574 PolarHBondContact O-N 3.35Å; L572-G576 WeakPolarHBondContact O-CA 3.3Å; L572-G576 PolarHBondContact O-N 3.34Å
573	K	85.1	Confident	76.9	Confident	109 Å²	109	82.1 Å²	82.1	47%	0.474	44%	0.443	S	S	.	.	H	α-helix	trans	-59.5	-41.6	172.4	-76.7	177	-179.5	-175.4	0	113	A538 I569 Q570 F571	A538-K573 HydrophobicContact CB-CB 4.39Å; A538-K573 HydrophobicContact CB-CG 3.49Å; A538-K573 VanDerWaalsContact CB-CG 3.49Å; A538-K573 VanDerWaalsContact O-CE 3.23Å; A538-K573 WeakPolarHBondContact O-CE 3.17Å; I569-K573 HydrophobicContact CG2-CD 4.29Å; I569-K573 VanDerWaalsContact O-CG 3.32Å; I569-K573 WeakPolarHBondContact O-CG 3.22Å; I569-K573 PolarHBondContact O-N 3.14Å; Q570-K573 WeakPolarHBondContact O-CB 3.5Å; Q570-K573 PolarHBondContact O-N 3.17Å; F571-K573 VanDerWaalsContact C-N 3.31Å; F571-K573 PolarHBondContact O-N 3.31Å
574	M	84.8	Confident	76.5	Confident	100 Å²	100	84.8 Å²	84.8	49%	0.493	45%	0.45	S	S	.	.	H	α-helix	trans	-79.6	-30.2	-173.8	-76.4	-72.6	-70.8	0	0	114.1	Q570 F571 L572 R579	Q570-M574 WeakPolarHBondContact O-CB 3.3Å; Q570-M574 VanDerWaalsContact O-CG 3.28Å; Q570-M574 WeakPolarHBondContact O-CG 3.45Å; Q570-M574 PolarHBondContact O-N 3.14Å; F571-M574 PolarHBondContact O-N 3.43Å; F571-M574 VanDerWaalsContact O-N 3.11Å; L572-M574 VanDerWaalsContact C-N 3.35Å; L572-M574 PolarHBondContact O-N 3.35Å; M574-R579 VanDerWaalsContact O-CZ 3.27Å; M574-R579 PolarHBondContact O-NE 3.34Å; M574-R579 PolarHBondContact O-NH2 3.41Å
575	Q	82	Confident	75.9	Confident	114 Å²	114	88.6 Å²	88.6	53%	0.533	47%	0.465	S	S	.	.	H	α-helix	trans	-104.3	-14.7	-176.2	-64.8	-63.5	-22.9	0	0	113.3	F535 F571	F535-Q575 HydrophobicContact CE1-CB 3.97Å; F571-Q575 HydrophobicContact CD2-CG 4.15Å; F571-Q575 HydrophobicContact CE1-CB 4.41Å; F571-Q575 HydrophobicContact CE1-CG 4.13Å; F571-Q575 HydrophobicContact CE2-CG 3.75Å; F571-Q575 HydrophobicContact CZ-CB 4.45Å; F571-Q575 HydrophobicContact CZ-CG 3.74Å; F571-Q575 PolarHBondContact O-N 3.34Å
576	G	72.6	Confident	75.2	Confident	8 Å²	8	91.4 Å²	91.4	8%	0.082	48%	0.477	C	S	.	.	S	Bend	trans	-68.2	156.4	176.2	0	0	0	0	0	112.9	L572 Y578	L572-G576 WeakPolarHBondContact O-CA 3.3Å; L572-G576 PolarHBondContact O-N 3.34Å; G576-Y578 PolarHBondContact O-N 3.36Å; G576-Y578 VanDerWaalsContact O-N 3.09Å
577	P	71.3	Confident	74.4	Confident	100 Å²	100	91.9 Å²	91.9	65%	0.649	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-9.2	178.8	27	-33.2	0	0	0	113.7	R579	P577-R579 PolarHBondContact O-N 3.25Å
578	Y	63.2	Low	73.4	Confident	90 Å²	90	91.1 Å²	91.1	35%	0.353	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	22	-172.3	-48.1	-73.2	0	0	0	114.8	E536 G576 A580 M581	E536-Y578 HydrophobicContact CG-CE2 4.07Å; E536-Y578 VanDerWaalsContact OE1-CE2 3.22Å; E536-Y578 WeakPolarHBondContact OE1-CE2 3.49Å; E536-Y578 PolarHBondContact OE1-OH 3.24Å; G576-Y578 PolarHBondContact O-N 3.36Å; G576-Y578 VanDerWaalsContact O-N 3.09Å; Y578-A580 PolarHBondContact O-N 3.3Å; Y578-M581 PolarHBondContact O-N 3.2Å
579	R	58.9	Low	72.3	Confident	174 Å²	174	97.6 Å²	97.6	66%	0.657	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-13.8	-178.8	-113	-175.4	-171	-173.3	4.2	116.1	M574 P577	M574-R579 VanDerWaalsContact O-CZ 3.27Å; M574-R579 PolarHBondContact O-NE 3.34Å; M574-R579 PolarHBondContact O-NH2 3.41Å; P577-R579 PolarHBondContact O-N 3.25Å
580	A	51.2	Low	71.1	Confident	99 Å²	99	102.8 Å²	102.8	82%	0.818	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	6.8	-172.2	0	0	0	0	0	115.3	Y578	Y578-A580 PolarHBondContact O-N 3.3Å
581	M	49.9	Very low	69.7	Low	164 Å²	164	101.3 Å²	101.3	81%	0.808	53%	0.529	S	S	*	.			trans	-109.9	25.2	-174.5	-79.8	-171.2	168.7	0	0	115.6	Y578	Y578-M581 PolarHBondContact O-N 3.2Å
582	V	40.2	Very low	68	Low	209 Å²	209	106.2 Å²	106.2	100%	1.267	56%	0.558	S	S	*	*			trans	-116.4	0	173.3	-174.6	0	0	0	0	111

Retrieved 582 of 582 residues in 1129.4 ms (Link to these results)

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