A0A2K5VGW7_MACFA Loading...

BTB domain containing 3

AlphaFold DB , UniProt , Accession A0A2K5VGW7, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene BTBD3, Length 565 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.1	Very low	33.5	Very low	249 Å²	249	154.4 Å²	154.4	100%	1.227	85%	0.846	S	S	*	*				0	117.3	0	-76.6	179.8	170.8	0	0	108.3
2	L	32.6	Very low	32.9	Very low	160 Å²	160	149.3 Å²	149.3	84%	0.838	84%	0.839	S	S	*	*			trans	-68.7	162.6	159.4	-89.2	164.3	0	0	0	108.9
3	P	54.6	Low	32.5	Very low	112 Å²	112	155.9 Å²	155.9	73%	0.727	84%	0.843	S	S	*	*			cis	-152.2	156.7	47.8	38.4	-15.4	0	0	0	120.7
4	R	36	Very low	32.1	Very low	232 Å²	232	152.7 Å²	152.7	88%	0.875	84%	0.838	S	S	*	*			trans	44.5	126	132.2	-63	-179.3	171	-177.8	-2.5	122.8
5	S	28.2	Very low	32	Very low	124 Å²	124	153.9 Å²	153.9	87%	0.867	84%	0.842	S	S	*	*				-167.7	136.7	109	46.9	0	0	0	0	113.4
6	L	29.6	Very low	32.2	Very low	155 Å²	155	150.8 Å²	150.8	81%	0.812	83%	0.831	S	S	*	*			trans	-85.9	179.2	166.6	-90	160.7	0	0	0	109.1
7	P	44.2	Very low	31.9	Very low	111 Å²	111	152 Å²	152	72%	0.721	83%	0.83	S	S	*	*			cis	-148.6	158.3	24.5	36.1	-11.4	0	0	0	120.1
8	V	30.3	Very low	31.7	Very low	116 Å²	116	148.9 Å²	148.9	70%	0.703	82%	0.821	S	S	*	*				59.6	120.9	125.2	-178.7	0	0	0	0	122.1
9	L	28.5	Very low	31.5	Very low	169 Å²	169	148.3 Å²	148.3	89%	0.885	82%	0.821	S	S	*	*				165	133.1	109.7	-111.7	136.8	0	0	0	114.6
10	G	25.4	Very low	31.4	Very low	70 Å²	70	146.5 Å²	146.5	72%	0.722	82%	0.817	S	S	*	*				101.2	102	119.4	0	0	0	0	0	120.8
11	H	26.7	Very low	31.1	Very low	200 Å²	200	146 Å²	146	93%	0.926	82%	0.822	S	S	*	*			trans	-61.2	149.5	164.5	-78.8	-34.2	0	0	0	116
12	A	26.8	Very low	30.9	Very low	93 Å²	93	139.8 Å²	139.8	77%	0.769	80%	0.797	S	S	*	*			trans	167.7	149.4	134.7	0	0	0	0	0	109.5
13	R	28.2	Very low	30.7	Very low	236 Å²	236	143.9 Å²	143.9	89%	0.891	80%	0.802	S	S	*	*			cis	-169.7	164.2	-13.8	-112.5	178.8	180	-167.6	1.3	106
14	S	27	Very low	29.4	Very low	111 Å²	111	144.6 Å²	144.6	78%	0.776	80%	0.804	S	S	*	*			trans	71.3	101.1	153.9	59.7	0	0	0	0	121.6
15	L	30.1	Very low	29.1	Very low	171 Å²	171	138.3 Å²	138.3	90%	0.895	79%	0.793	S	S	*	*				-70.2	154.1	123.8	-83.8	160.1	0	0	0	108.9
16	P	34.6	Very low	29.2	Very low	103 Å²	103	137.3 Å²	137.3	67%	0.669	79%	0.793	S	S	*	*				-151.7	161.6	91.8	36.1	-15.7	0	0	0	117.8
17	Q	27.1	Very low	29.1	Very low	172 Å²	172	139.1 Å²	139.1	80%	0.804	79%	0.794	S	S	*	*			trans	80.6	101	141.5	-76.6	168.9	9.5	0	0	122.7
18	S	27.8	Very low	28.5	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	80%	0.798	S	S	*	*				34.8	115.9	118.7	59.1	0	0	0	0	123.3
19	V	28.7	Very low	28.4	Very low	137 Å²	137	139.5 Å²	139.5	83%	0.83	81%	0.808	S	S	*	*				63.4	147.7	128.9	-172.3	0	0	0	0	118.1
20	P	29.2	Very low	28.3	Very low	113 Å²	113	134.6 Å²	134.6	73%	0.734	80%	0.798	S	S	*	*			cis	-129.5	159.6	5.1	20.9	3.6	0	0	0	115.9
21	C	26.5	Very low	28.3	Very low	135 Å²	135	142.3 Å²	142.3	91%	0.912	81%	0.806	S	S	*	*			trans	-102.6	105.3	159.7	-124	0	0	0	0	110.9
22	V	27.6	Very low	28.1	Very low	119 Å²	119	144.5 Å²	144.5	72%	0.721	81%	0.806	S	S	*	*			trans	-11.7	112.8	160.4	-177.2	0	0	0	0	116.4	V24	V22-V24 HydrophobicContact CG1-CB 4.48Å; V22-V24 HydrophobicContact CG1-CG2 3.61Å
23	R	28.6	Very low	28	Very low	247 Å²	247	146.5 Å²	146.5	93%	0.932	80%	0.802	S	S	*	*			trans	-82.4	129.1	146.3	-86.9	-179.1	175.8	180	-1	108.1
24	V	27.2	Very low	27.9	Very low	126 Å²	126	140.7 Å²	140.7	76%	0.764	80%	0.798	S	S	*	*			trans	-129	141.7	157.6	169.5	0	0	0	0	108.5	V22	V22-V24 HydrophobicContact CG1-CB 4.48Å; V22-V24 HydrophobicContact CG1-CG2 3.61Å
25	P	29.1	Very low	27.8	Very low	100 Å²	100	143.7 Å²	143.7	65%	0.649	80%	0.8	S	S	*	*			trans	-107	159	-143.6	37.8	-28.4	0	0	0	113.5	K27	P25-K27 PolarHBondContact O-N 3.1Å
26	A	29.7	Very low	27.5	Very low	104 Å²	104	141.4 Å²	141.4	86%	0.86	80%	0.797	S	S	*	*			trans	-60.9	126.7	156.6	0	0	0	0	0	109.3
27	K	27.2	Very low	27.6	Very low	193 Å²	193	142.3 Å²	142.3	84%	0.839	80%	0.803	S	S	*	*			trans	-112.6	143.9	163.2	-95.8	-168.8	178.7	-178.1	0	110.8	P25	P25-K27 PolarHBondContact O-N 3.1Å
28	P	32.3	Very low	27.5	Very low	125 Å²	125	137.5 Å²	137.5	81%	0.812	80%	0.799	S	S	*	*			trans	-93.8	157.6	-179.3	38.2	-33.1	0	0	0	111.7
29	A	28.6	Very low	27.5	Very low	109 Å²	109	145.1 Å²	145.1	90%	0.901	81%	0.813	S	S	*	*			trans	-147.9	137	161.1	0	0	0	0	0	106.8
30	G	25.8	Very low	27.3	Very low	67 Å²	67	141.8 Å²	141.8	69%	0.691	81%	0.806	S	S	*	*			cis	178.8	131.1	-0.9	0	0	0	0	0	106.1
31	R	24.6	Very low	27.3	Very low	231 Å²	231	143.5 Å²	143.5	87%	0.872	81%	0.808	S	S	*	*			trans	-70.9	137.5	168.1	-82	-179.1	178.9	-166	-0.8	108.8
32	W	24.3	Very low	27.2	Very low	247 Å²	247	147 Å²	147	94%	0.936	80%	0.802	S	S	*	*			trans	-102.6	124.9	157.1	-77.4	82.3	0	0	0	108.4
33	I	24.9	Very low	27.2	Very low	134 Å²	134	146.8 Å²	146.8	69%	0.687	81%	0.806	S	S	*	*			trans	-119.6	128.9	162.1	-68.8	172.1	0	0	0	105.4
34	S	24.6	Very low	27.1	Very low	115 Å²	115	138.9 Å²	138.9	80%	0.804	80%	0.802	S	S	*	*			trans	-142.2	127.2	155	56.8	0	0	0	0	108.1
35	E	24.5	Very low	27.1	Very low	174 Å²	174	141.5 Å²	141.5	81%	0.813	81%	0.806	S	S	*	*			trans	-73.9	143.6	-175.6	-64.6	171.1	131.8	0	0	113.5
36	C	24.3	Very low	26.9	Very low	123 Å²	123	148 Å²	148	83%	0.831	82%	0.817	S	S	*	*			trans	45.4	156.9	130.7	-66.3	0	0	0	0	122.4
37	P	36.9	Very low	26.8	Very low	122 Å²	122	147.7 Å²	147.7	79%	0.792	81%	0.814	S	S	*	*			cis	-141.8	155	25.8	37.7	-16.5	0	0	0	118.9
38	G	25.8	Very low	26.8	Very low	70 Å²	70	149.9 Å²	149.9	72%	0.722	82%	0.817	S	S	*	*				59.7	116.1	125.6	0	0	0	0	0	122
39	R	27.3	Very low	26.6	Very low	257 Å²	257	155.7 Å²	155.7	97%	0.97	82%	0.823	S	S	*	*				-167.1	121.4	124.2	-104.3	175.7	-130.5	-123	4.5	109.8
40	G	25.3	Very low	26.5	Very low	67 Å²	67	161.7 Å²	161.7	69%	0.691	82%	0.822	S	S	*	*			trans	-88.5	168.9	174.9	0	0	0	0	0	113.2
41	L	27.3	Very low	26.6	Very low	149 Å²	149	165.6 Å²	165.6	78%	0.78	83%	0.833	S	S	*	*				163.3	138.3	114.3	-91.5	152.1	0	0	0	112.5
42	R	26.3	Very low	26.7	Very low	207 Å²	207	159.2 Å²	159.2	78%	0.781	83%	0.83	S	S	*	*			trans	80.7	99	144.3	-70.1	170.4	-166.3	-96.8	-0.2	120.5
43	S	26	Very low	26.8	Very low	115 Å²	115	152.4 Å²	152.4	80%	0.804	83%	0.826	S	S	*	*				14.7	135.9	112.8	64	0	0	0	0	119.7
44	G	26.5	Very low	26.7	Very low	82 Å²	82	151.3 Å²	151.3	85%	0.845	83%	0.83	S	S	*	*			trans	-179.8	113	159.4	0	0	0	0	0	115.1
45	H	27.5	Very low	28.2	Very low	181 Å²	181	151.1 Å²	151.1	84%	0.838	83%	0.826	S	S	*	*			trans	-64.4	161.8	-177.4	-89	-64.2	0	0	0	118.1
46	R	25.7	Very low	28.2	Very low	237 Å²	237	152 Å²	152	89%	0.894	83%	0.83	S	S	*	*			trans	61.8	133.6	142.4	-79.8	178.8	170	-168	-1.6	116.2
47	A	27.6	Very low	28.4	Very low	96 Å²	96	149.8 Å²	149.8	79%	0.793	82%	0.821	S	S	*	*				179.5	148.6	62.3	0	0	0	0	0	110.5
48	R	27.7	Very low	27.9	Very low	239 Å²	239	153.6 Å²	153.6	90%	0.902	82%	0.819	S	S	*	*			trans	-63.7	145.6	160.9	-69.8	171.1	165.6	-167.6	-4.5	110.4
49	R	26.6	Very low	28	Very low	248 Å²	248	159.6 Å²	159.6	94%	0.936	82%	0.82	S	S	*	*				-178.9	137.1	111.1	-101.8	178.1	-179.9	-162.3	0.3	112.2
50	R	27.4	Very low	27.9	Very low	235 Å²	235	152.2 Å²	152.2	89%	0.887	81%	0.808	S	S	*	*			trans	-54.8	150.5	163.3	-66.3	169.5	166.2	175.9	-6.7	110.9
51	T	27.4	Very low	27.9	Very low	148 Å²	148	154.1 Å²	154.1	91%	0.908	82%	0.817	S	S	*	*				-165.5	150.3	121.8	15.2	0	0	0	0	111.8
52	A	26.8	Very low	27.9	Very low	98 Å²	98	150.7 Å²	150.7	81%	0.81	82%	0.818	S	S	*	*			trans	-54.6	154	-173.9	0	0	0	0	0	116.3
53	A	26	Very low	27.8	Very low	104 Å²	104	149.4 Å²	149.4	86%	0.86	82%	0.821	S	S	*	*				-173.6	138.7	109.2	0	0	0	0	0	110.1
54	S	24.2	Very low	27.8	Very low	110 Å²	110	150 Å²	150	77%	0.769	82%	0.82	S	S	*	*			trans	-113.3	-171.4	171.4	-159.4	0	0	0	0	106.3
55	P	54.2	Low	27.9	Very low	111 Å²	111	151.8 Å²	151.8	72%	0.721	81%	0.814	S	S	*	*				-123.6	174.1	-72.5	35.2	-20	0	0	0	111
56	E	25.7	Very low	27.8	Very low	194 Å²	194	153 Å²	153	91%	0.907	82%	0.817	S	S	*	*			trans	175.9	147.7	153.2	-103.4	177.3	179.7	0	0	106.8
57	A	27.4	Very low	27.9	Very low	76 Å²	76	148.6 Å²	148.6	63%	0.628	81%	0.811	S	S	*	*			cis	-172.9	171	-20.8	0	0	0	0	0	105.7
58	R	26.9	Very low	27.7	Very low	202 Å²	202	156 Å²	156	76%	0.762	82%	0.818	S	S	*	*			trans	83.1	111	150.5	-72.4	178	179.8	-163.2	1.8	119.4
59	R	27.8	Very low	27.6	Very low	196 Å²	196	149.5 Å²	149.5	74%	0.74	81%	0.809	S	S	*	*				118.4	105.1	105.7	-89.6	175.1	-174.8	-170.1	-0.7	116
60	S	25.5	Very low	27.6	Very low	101 Å²	101	146.6 Å²	146.6	71%	0.706	80%	0.804	S	S	*	*				67.6	114.4	119.1	72.6	0	0	0	0	119.8
61	A	26.1	Very low	27.4	Very low	108 Å²	108	144.1 Å²	144.1	89%	0.893	80%	0.799	S	S	*	*				68.9	133.2	116	0	0	0	0	0	118.8
62	G	26.1	Very low	27.2	Very low	77 Å²	77	141.9 Å²	141.9	79%	0.794	79%	0.79	S	S	*	*			trans	156.3	94.4	159.8	0	0	0	0	0	112.8
63	E	25.2	Very low	27.1	Very low	180 Å²	180	142.1 Å²	142.1	84%	0.841	79%	0.785	S	S	*	*			trans	-44.1	154	164.8	-63.4	159.2	119.1	0	0	112.7
64	T	25.4	Very low	27.1	Very low	127 Å²	127	146.6 Å²	146.6	78%	0.779	79%	0.786	S	S	*	*				164.1	133.2	86.6	-31.4	0	0	0	0	110.9
65	V	29	Very low	27.1	Very low	119 Å²	119	151.4 Å²	151.4	72%	0.721	79%	0.793	S	S	*	*			trans	-17.6	138.2	152.2	-179.8	0	0	0	0	116.6
66	K	25.8	Very low	25.7	Very low	207 Å²	207	150.2 Å²	150.2	90%	0.9	79%	0.792	S	S	*	*			trans	-161.6	112.9	132.6	-109.6	164.7	-169.9	173.5	0	113.9
67	N	26.2	Very low	25.5	Very low	145 Å²	145	147.8 Å²	147.8	78%	0.775	79%	0.785	S	S	*	*			trans	-45.3	146.9	151.7	-89.7	-28.1	0	0	0	112.6
68	R	24.3	Very low	25.4	Very low	251 Å²	251	149.8 Å²	149.8	95%	0.947	79%	0.79	S	S	*	*			trans	-159.8	110.3	134.5	-116	175.8	-176.5	-171.6	1.2	112.4
69	S	26	Very low	25.2	Very low	102 Å²	102	145.6 Å²	145.6	71%	0.713	79%	0.791	S	S	*	*			trans	-66.2	149.9	151.8	-31.3	0	0	0	0	110.1
70	K	25.8	Very low	25	Very low	187 Å²	187	141 Å²	141	81%	0.813	79%	0.79	S	S	*	*				177	125.4	124.5	-102	175.8	-175.8	179.1	0	113.5
71	K	23.8	Very low	24.9	Very low	183 Å²	183	141.7 Å²	141.7	80%	0.796	79%	0.794	S	S	*	*				55.3	115.6	122.4	-82.6	-175.4	174.7	-176.3	0	119.5
72	S	23.7	Very low	24.8	Very low	102 Å²	102	142 Å²	142	71%	0.713	79%	0.79	S	S	*	*				121.1	147.4	87.4	66.4	0	0	0	0	117.5
73	S	23.9	Very low	24.9	Very low	102 Å²	102	143.7 Å²	143.7	71%	0.713	79%	0.79	S	S	*	*			trans	89.8	104.9	140.2	41.9	0	0	0	0	121
74	K	25.2	Very low	24.9	Very low	199 Å²	199	143 Å²	143	87%	0.865	79%	0.792	S	S	*	*				45.7	120.6	116.2	-78.1	-177.4	172.7	178	0	118.4
75	K	24.2	Very low	24.8	Very low	211 Å²	211	142 Å²	142	92%	0.917	79%	0.79	S	S	*	*				178.5	152.6	94.9	-110.9	177.4	178.1	179.5	0	111.7
76	A	24.7	Very low	24.7	Very low	86 Å²	86	141.7 Å²	141.7	71%	0.711	79%	0.793	S	S	*	*			trans	-76.5	153.4	179.7	0	0	0	0	0	113.7
77	N	23.4	Very low	24.7	Very low	142 Å²	142	141.2 Å²	141.2	76%	0.759	79%	0.791	S	S	*	*				-179	128.3	112.6	-105.7	1	0	0	0	113.9
78	T	24	Very low	24.7	Very low	119 Å²	119	141.9 Å²	141.9	73%	0.73	79%	0.794	S	S	*	*			trans	44.5	121.8	138.4	56.9	0	0	0	0	122.7
79	S	23.3	Very low	24.7	Very low	113 Å²	113	134.8 Å²	134.8	79%	0.79	78%	0.78	S	S	*	*				131.4	144.3	118.5	68.9	0	0	0	0	117.1
80	S	23	Very low	24.7	Very low	101 Å²	101	135.4 Å²	135.4	71%	0.706	78%	0.782	S	S	*	*			trans	71.6	98.5	163.4	64.9	0	0	0	0	121.1
81	S	23.9	Very low	24.8	Very low	114 Å²	114	131.9 Å²	131.9	80%	0.797	78%	0.775	S	S	*	*				40.2	116.6	120.6	62.6	0	0	0	0	120.5
82	S	24.5	Very low	24.7	Very low	115 Å²	115	128.5 Å²	128.5	80%	0.804	77%	0.774	S	S	*	*				-163.9	118	127.1	56.6	0	0	0	0	110.3
83	S	27.1	Very low	24.9	Very low	113 Å²	113	131.6 Å²	131.6	79%	0.79	77%	0.771	S	S	*	*			trans	-51.7	129.8	169.6	48.3	0	0	0	0	112.8
84	N	24.8	Very low	24.9	Very low	165 Å²	165	135 Å²	135	88%	0.882	78%	0.776	S	S	*	*			trans	-137.3	98.6	155.1	-107	-13.9	0	0	0	109	S86	N84-S86 PolarHBondContact O-N 3.04Å
85	S	24.9	Very low	25	Very low	107 Å²	107	133 Å²	133	75%	0.748	77%	0.772	S	S	*	*			trans	-68.5	102.5	170.9	55	0	0	0	0	109.5	K87	S85-K87 PolarHBondContact O-N 3.49Å
86	S	25.7	Very low	25	Very low	112 Å²	112	129 Å²	129	78%	0.783	76%	0.76	S	S	*	*			trans	-76.8	96.2	164.3	54.8	0	0	0	0	108.7	N84 L88	N84-S86 PolarHBondContact O-N 3.04Å; S86-L88 PolarHBondContact O-N 3.43Å
87	K	26.3	Very low	25	Very low	197 Å²	197	130.1 Å²	130.1	86%	0.857	76%	0.758	S	S	*	*			trans	-58.9	113.3	166.3	-75.3	178.3	175.7	178.8	0	108.6	S85	S85-K87 PolarHBondContact O-N 3.49Å
88	L	26.2	Very low	25.2	Very low	159 Å²	159	128.7 Å²	128.7	83%	0.832	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-70	138.1	161.6	-77.8	157.7	0	0	0	108.3	S86	S86-L88 PolarHBondContact O-N 3.43Å
89	P	24	Very low	25.2	Very low	102 Å²	102	131.6 Å²	131.6	66%	0.662	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-68.8	149.6	178.5	28.8	-32.5	0	0	0	110.5	V91	P89-V91 PolarHBondContact O-N 3.22Å
90	P	27.1	Very low	25.4	Very low	114 Å²	114	131 Å²	131	74%	0.74	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-68.5	122.3	176.7	28.1	-31.2	0	0	0	109.5	C92	P90-C92 PolarHBondContact O-N 3.42Å; P90-C92 VanDerWaalsContact O-N 3.15Å
91	V	26.3	Very low	25.7	Very low	113 Å²	113	134.3 Å²	134.3	69%	0.685	75%	0.746	S	S	*	*			trans	-78.1	94.4	168	-174.2	0	0	0	0	106.8	P89 Y93	P89-V91 PolarHBondContact O-N 3.22Å; V91-Y93 HydrophobicContact CG1-CD2 3.94Å; V91-Y93 HydrophobicContact CG1-CE2 3.51Å; V91-Y93 PolarHBondContact O-N 3.02Å
92	C	23.1	Very low	25.9	Very low	112 Å²	112	139.4 Å²	139.4	76%	0.757	75%	0.753	S	S	*	*			trans	-77.9	97.6	172.4	-70	0	0	0	0	109	P90 E94	P90-C92 PolarHBondContact O-N 3.42Å; P90-C92 VanDerWaalsContact O-N 3.15Å; C92-E94 PolarHBondContact O-N 3.2Å
93	Y	28	Very low	26.2	Very low	168 Å²	168	140.7 Å²	140.7	66%	0.659	75%	0.745	S	S	*	*			trans	-77.6	108.8	155.7	-69.4	-73.6	0	0	0	107.3	V91 I95	V91-Y93 HydrophobicContact CG1-CD2 3.94Å; V91-Y93 HydrophobicContact CG1-CE2 3.51Å; V91-Y93 PolarHBondContact O-N 3.02Å; Y93-I95 PolarHBondContact O-N 3.06Å
94	E	23.4	Very low	26.3	Very low	174 Å²	174	145.4 Å²	145.4	81%	0.813	75%	0.751	S	S	*	*			trans	-61.2	129.7	164	-82.6	-173.5	156.1	0	0	108.8	C92 I96	C92-E94 PolarHBondContact O-N 3.2Å; E94-I96 VanDerWaalsContact C-N 3.35Å; E94-I96 PolarHBondContact O-N 2.72Å
95	I	26.9	Very low	26.6	Very low	155 Å²	155	145.4 Å²	145.4	80%	0.795	75%	0.747	S	S	*	*			trans	-71	92	177.1	-58.8	171.3	0	0	0	107.7	Y93 T97	Y93-I95 PolarHBondContact O-N 3.06Å; I95-T97 HydrophobicContact CG2-CG2 4.1Å; I95-T97 PolarHBondContact O-N 3.1Å
96	I	24.5	Very low	27.1	Very low	128 Å²	128	143 Å²	143	66%	0.656	73%	0.734	S	S	*	*			trans	-77.3	98.4	158.9	-58.4	176.7	0	0	0	106.2	E94 L98	E94-I96 VanDerWaalsContact C-N 3.35Å; E94-I96 PolarHBondContact O-N 2.72Å; I96-L98 PolarHBondContact O-N 2.95Å
97	T	24	Very low	27.6	Very low	109 Å²	109	139.7 Å²	139.7	67%	0.669	71%	0.714	S	S	*	*			trans	-59.4	104.3	168.3	36.8	0	0	0	0	109.3	I95 K99	I95-T97 HydrophobicContact CG2-CG2 4.1Å; I95-T97 PolarHBondContact O-N 3.1Å; T97-K99 PolarHBondContact O-N 3.28Å
98	L	27.4	Very low	28.2	Very low	112 Å²	112	136.8 Å²	136.8	59%	0.586	71%	0.707	S	S	*	*			trans	-62.3	98.2	163.2	-74.1	166	0	0	0	107.7	I96 T100	I96-L98 PolarHBondContact O-N 2.95Å; L98-T100 PolarHBondContact O-N 3.27Å
99	K	25.4	Very low	28.8	Very low	180 Å²	180	131.3 Å²	131.3	78%	0.783	68%	0.678	S	S	*	*			trans	-70.7	84.3	164.8	-78.3	-176.8	178.1	174.2	0	107.8	T97 K101	T97-K99 PolarHBondContact O-N 3.28Å; K99-K101 PolarHBondContact O-N 2.84Å
100	T	27.3	Very low	29.6	Very low	100 Å²	100	128.4 Å²	128.4	61%	0.613	66%	0.656	S	S	*	*			trans	-69.3	82.3	165.2	50	0	0	0	0	108.7	L98	L98-T100 PolarHBondContact O-N 3.27Å
101	K	28.1	Very low	29.9	Very low	172 Å²	172	129 Å²	129	75%	0.748	66%	0.66	S	S	*	*			trans	-73	122.6	161.1	-76.5	-174	175.1	-175.9	0	107	K99 K103	K99-K101 PolarHBondContact O-N 2.84Å; K101-K103 PolarHBondContact O-N 3.46Å
102	K	28.5	Very low	30.3	Very low	220 Å²	220	134 Å²	134	96%	0.957	67%	0.666	S	S	*	*			trans	-21.1	100.5	178.7	-75	179.1	173.7	178.2	0	113
103	K	31.5	Very low	30.8	Very low	143 Å²	143	138.2 Å²	138.2	62%	0.622	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-92.4	135.9	164.6	-81.7	-167.7	173.4	-160.5	0	108.8	K101 D306	K101-K103 PolarHBondContact O-N 3.46Å; K103-D306 IonicContact NZ-OD1 3.39Å; K103-D306 PolarHBondContact NZ-OD1 3.45Å
104	K	29	Very low	30.7	Very low	212 Å²	212	139.8 Å²	139.8	92%	0.922	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-56.7	151.4	163	-86.5	177.4	173.5	177.7	0	109.1
105	M	31.4	Very low	31	Very low	164 Å²	164	137.4 Å²	137.4	81%	0.808	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-56.6	139.8	-158	-52	-161.3	-147.6	0	0	114.8	A107	M105-A107 HydrophobicContact CB-CB 4.22Å; M105-A107 PolarHBondContact O-N 3.21Å
106	A	34.6	Very low	31.1	Very low	56 Å²	56	134.7 Å²	134.7	46%	0.463	68%	0.682	S	S	.	*	G	3₁₀ helix	trans	-67.6	16.5	171.2	0	0	0	0	0	114.6	D108 D234	A106-D108 VanDerWaalsContact C-N 3.3Å; A106-D108 PolarHBondContact O-N 3.3Å; A106-D234 HydrophobicContact CB-CB 4.37Å
107	A	37	Very low	31.3	Very low	44 Å²	44	136.9 Å²	136.9	36%	0.364	70%	0.695	S	S	.	*	G	3₁₀ helix	trans	-75.5	-15.3	-171.5	0	0	0	0	0	113.8	M105	M105-A107 HydrophobicContact CB-CB 4.22Å; M105-A107 PolarHBondContact O-N 3.21Å
108	D	38.8	Very low	31.5	Very low	135 Å²	135	136.8 Å²	136.8	72%	0.722	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-97.6	-3.6	-169.1	-65.1	-36.7	0	0	0	114.6	A106	A106-D108 VanDerWaalsContact C-N 3.3Å; A106-D108 PolarHBondContact O-N 3.3Å
109	I	39.2	Very low	32	Very low	44 Å²	44	137.3 Å²	137.3	23%	0.226	71%	0.712	C	S	.	*	S	Bend	trans	-95	-20.8	-173.5	-61.8	177.2	0	0	0	112.8	N267	I109-N267 HydrophobicContact CG2-CB 3.48Å; I109-N267 VanDerWaalsContact CG2-CB 3.48Å
110	F	40	Very low	32.2	Very low	41 Å²	41	131.4 Å²	131.4	18%	0.18	69%	0.694	C	S	.	*	S	Bend	trans	-127.7	120.1	-174.4	-61.6	-85.9	0	0	0	111.9	R112 A233 N267	F110-R112 PolarHBondContact O-N 3.19Å; F110-A233 HydrophobicContact CB-CB 3.63Å; F110-A233 HydrophobicContact CD1-CB 3.75Å; F110-A233 HydrophobicContact CD2-CB 3.42Å; F110-A233 VanDerWaalsContact CD2-CB 3.42Å; F110-A233 HydrophobicContact CE1-CB 4.2Å; F110-A233 HydrophobicContact CE2-CB 3.91Å; F110-A233 HydrophobicContact CG-CB 3.32Å; F110-A233 HydrophobicContact CZ-CB 4.27Å; F110-N267 WeakPolarHBondContact CE1-ND2 3.48Å
111	P	34.3	Very low	32.7	Very low	128 Å²	128	132.3 Å²	132.3	83%	0.831	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-66.9	120	178.6	24.6	-30.7	0	0	0	111	K113	P111-K113 PolarHBondContact O-N 3.35Å
112	R	33.8	Very low	33.3	Very low	216 Å²	216	127.7 Å²	127.7	82%	0.815	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-69.4	121.3	176.3	-69.4	-178.5	177.3	-166.6	-2.9	110.8	F110	F110-R112 PolarHBondContact O-N 3.19Å
113	K	32.9	Very low	33.9	Very low	201 Å²	201	121.7 Å²	121.7	87%	0.874	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-86	127.6	162.2	-80.5	-176.7	177.3	177.5	0	109.5	P111	P111-K113 PolarHBondContact O-N 3.35Å
114	K	26.7	Very low	34.4	Very low	202 Å²	202	120.4 Å²	120.4	88%	0.878	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-75.7	133.1	169.1	-75	-178.4	176.8	179	0	109.4
115	P	30.7	Very low	34.8	Very low	124 Å²	124	117 Å²	117	81%	0.805	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-76.5	142.4	170.4	30.1	-29.6	0	0	0	110.4
116	A	27.6	Very low	35.4	Very low	97 Å²	97	113.7 Å²	113.7	80%	0.802	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-77.8	137.4	173.5	0	0	0	0	0	110.4	S118	A116-S118 PolarHBondContact O-N 3.4Å
117	N	28.4	Very low	35.8	Very low	175 Å²	175	113.9 Å²	113.9	94%	0.936	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-64.8	122.5	176.4	-91.1	-10	0	0	0	111
118	S	28.2	Very low	36.1	Very low	106 Å²	106	119.5 Å²	119.5	74%	0.741	64%	0.642	S	S	*	*			trans	-139	139.9	158	62	0	0	0	0	109.4	A116	A116-S118 PolarHBondContact O-N 3.4Å
119	S	39.7	Very low	36.3	Very low	123 Å²	123	117.7 Å²	117.7	86%	0.86	63%	0.63	S	S	*	*			trans	-83	122.7	-171.2	47.7	0	0	0	0	112.4
120	S	28.4	Very low	37	Very low	57 Å²	57	116.4 Å²	116.4	40%	0.399	62%	0.623	S	S	.	*			trans	-156.3	112.1	160.9	54.3	0	0	0	0	114.1	Q124	S120-Q124 PolarHBondContact O-OE1 3.05Å; S120-Q124 VanDerWaalsContact O-OE1 3.06Å; S120-Q124 VanDerWaalsContact OG-CD 3.28Å; S120-Q124 PolarHBondContact OG-NE2 2.88Å; S120-Q124 VanDerWaalsContact OG-NE2 3.1Å; S120-Q124 PolarHBondContact OG-OE1 3.12Å; S120-Q124 VanDerWaalsContact OG-OE1 3.14Å
121	T	38.5	Very low	37.6	Very low	119 Å²	119	120.4 Å²	120.4	73%	0.73	65%	0.646	S	S	*	*			trans	32	113.3	141.9	14.4	0	0	0	0	120.6	V123	T121-V123 PolarHBondContact O-N 3.19Å
122	S	40.7	Very low	38.3	Very low	74 Å²	74	118.1 Å²	118.1	52%	0.517	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	34.1	-42.5	152.5	49.6	0	0	0	0	121.5	Q125 Y126	S122-Q125 WeakPolarHBondContact O-CB 3.48Å; S122-Q125 PolarHBondContact O-N 3.2Å; S122-Y126 WeakPolarHBondContact O-CD2 3.31Å
123	V	40.5	Very low	39.1	Very low	94 Å²	94	110.7 Å²	110.7	57%	0.57	61%	0.609	S	S	*	*	H	α-helix	trans	-68.8	-38.5	178.1	-176.9	0	0	0	0	111.4	T121 Q125 Y126 H127	T121-V123 PolarHBondContact O-N 3.19Å; V123-Q125 PolarHBondContact O-N 2.73Å; V123-Y126 PolarHBondContact O-N 3.33Å; V123-H127 PolarHBondContact O-N 3.47Å
124	Q	41.3	Very low	39.8	Very low	116 Å²	116	107.5 Å²	107.5	54%	0.542	60%	0.602	S	S	.	*	H	α-helix	trans	-65.7	-24.9	174.9	-73.3	-179	-13.9	0	0	112.8	S120	S120-Q124 PolarHBondContact O-OE1 3.05Å; S120-Q124 VanDerWaalsContact O-OE1 3.06Å; S120-Q124 VanDerWaalsContact OG-CD 3.28Å; S120-Q124 PolarHBondContact OG-NE2 2.88Å; S120-Q124 VanDerWaalsContact OG-NE2 3.1Å; S120-Q124 PolarHBondContact OG-OE1 3.12Å; S120-Q124 VanDerWaalsContact OG-OE1 3.14Å
125	Q	38.7	Very low	41.2	Very low	140 Å²	140	99.8 Å²	99.8	65%	0.654	57%	0.57	S	S	*	*	H	α-helix	trans	-73.9	-29.4	-177.2	-139.7	171.2	0.3	0	0	112	S122 V123 Q129	S122-Q125 WeakPolarHBondContact O-CB 3.48Å; S122-Q125 PolarHBondContact O-N 3.2Å; V123-Q125 PolarHBondContact O-N 2.73Å; Q125-Q129 WeakPolarHBondContact O-CG 3.43Å
126	Y	43.3	Very low	42.3	Very low	95 Å²	95	101.8 Å²	101.8	37%	0.373	57%	0.573	S	S	.	*	H	α-helix	trans	-80.5	-34.8	175.4	-80.1	-77.6	0	0	0	112.8	S122 V123 Q128 Q129	S122-Y126 WeakPolarHBondContact O-CD2 3.31Å; V123-Y126 PolarHBondContact O-N 3.33Å; Y126-Q128 PolarHBondContact O-N 3.36Å; Y126-Q129 PolarHBondContact O-N 3.5Å
127	H	42.6	Very low	43.8	Very low	61 Å²	61	99.6 Å²	99.6	28%	0.282	55%	0.547	S	S	.	.	H	α-helix	trans	-56.9	-33	176.3	-104.2	59.4	0	0	0	113.9	V123 E228	V123-H127 PolarHBondContact O-N 3.47Å; H127-E228 IonicContact CD2-OE1 3.48Å; H127-E228 IonicContact CD2-OE2 2.83Å; H127-E228 PolarHBondContact CD2-OE2 3.46Å; H127-E228 VanDerWaalsContact CD2-OE2 3.28Å; H127-E228 IonicContact CE1-OE1 3.93Å; H127-E228 PolarHBondContact CE1-OE1 3.43Å; H127-E228 IonicContact CE1-OE2 3.4Å; H127-E228 IonicContact NE2-OE1 2.72Å; H127-E228 PolarHBondContact NE2-OE1 2.93Å; H127-E228 IonicContact NE2-OE2 2.66Å; H127-E228 PolarHBondContact NE2-OE2 3.32Å
128	Q	43.8	Very low	45.1	Very low	161 Å²	161	93.2 Å²	93.2	75%	0.752	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-17.8	179.4	-130.1	169.8	23.7	0	0	113.4	Y126	Y126-Q128 PolarHBondContact O-N 3.36Å
129	Q	44.2	Very low	46.6	Very low	97 Å²	97	91.6 Å²	91.6	45%	0.453	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-80.9	-18	179.9	-75.4	176	-14.3	0	0	113.6	Q125 Y126 L131	Q125-Q129 WeakPolarHBondContact O-CG 3.43Å; Y126-Q129 PolarHBondContact O-N 3.5Å; Q129-L131 VanDerWaalsContact C-N 3.34Å; Q129-L131 PolarHBondContact O-N 2.97Å
130	N	52.7	Low	48	Very low	17 Å²	17	91.4 Å²	91.4	9%	0.091	50%	0.504	C	S	.	.	G	3₁₀ helix	trans	-76.3	-7.8	-172.1	-73.2	-29.4	0	0	0	116	N135 F157 N158	N130-N135 PolarHBondContact OD1-ND2 2.99Å; N130-N135 PolarHBondContact OD1-OD1 3.43Å; N130-F157 HydrophobicContact CB-CD1 3.92Å; N130-F157 HydrophobicContact CB-CE1 4.06Å; N130-N158 PolarHBondContact O-ND2 3.14Å
131	L	53.5	Low	50.5	Low	126 Å²	126	95 Å²	95	66%	0.66	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-79	-18.5	176.6	-79.2	114.4	0	0	0	113.8	Q129	Q129-L131 VanDerWaalsContact C-N 3.34Å; Q129-L131 PolarHBondContact O-N 2.97Å
132	S	47.9	Very low	52.7	Low	79 Å²	79	90.3 Å²	90.3	55%	0.552	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	7.7	-164.6	-44	0	0	0	0	115.1	N134	S132-N134 PolarHBondContact O-N 3.27Å
133	N	51.8	Low	55.1	Low	60 Å²	60	90.6 Å²	90.6	32%	0.321	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	33.5	-178.5	-152.8	39.3	0	0	0	114.7	N158	N133-N158 PolarHBondContact OD1-O 3.13Å
134	N	47.6	Very low	57.4	Low	135 Å²	135	89.7 Å²	89.7	72%	0.722	49%	0.491	S	S	*	.			trans	-118.1	44.5	-175.4	-86	-13.1	0	0	0	112.6	S132 L136	S132-N134 PolarHBondContact O-N 3.27Å; N134-L136 PolarHBondContact O-N 2.8Å
135	N	55.9	Low	59.6	Low	40 Å²	40	89.6 Å²	89.6	21%	0.214	49%	0.494	C	S	.	.			trans	-81.8	99.2	-179.1	-77.7	-13.6	0	0	0	111.8	N130	N130-N135 PolarHBondContact OD1-ND2 2.99Å; N130-N135 PolarHBondContact OD1-OD1 3.43Å
136	L	54	Low	62	Low	166 Å²	166	85 Å²	85	87%	0.869	47%	0.471	S	S	*	.			trans	-80.8	106.5	156	-83.3	153.6	0	0	0	107.6	N134	N134-L136 PolarHBondContact O-N 2.8Å
137	I	58.5	Low	64.3	Low	50 Å²	50	85.7 Å²	85.7	26%	0.256	49%	0.487	S	S	.	.			trans	-61.2	129.4	176.2	-65.4	167.8	0	0	0	109	A139 W142 L161	I137-A139 PolarHBondContact O-N 3.23Å; I137-W142 HydrophobicContact CG2-CB 3.88Å; I137-W142 HydrophobicContact CG2-CD2 4.44Å; I137-W142 HydrophobicContact CG2-CG 3.6Å; I137-L161 HydrophobicContact CD1-CB 3.7Å; I137-L161 HydrophobicContact CD1-CD1 4.08Å; I137-L161 HydrophobicContact CD1-CD2 3.18Å; I137-L161 HydrophobicContact CD1-CG 3.77Å
138	P	56.1	Low	66.7	Low	42 Å²	42	85.8 Å²	85.8	27%	0.273	49%	0.491	S	S	.	.			trans	-74.7	104.2	178.6	29.2	-30.7	0	0	0	109.3
139	A	59.5	Low	69	Low	72 Å²	72	83 Å²	83	60%	0.595	48%	0.48	S	S	*	.	S	Bend	trans	62.8	157.1	166.3	0	0	0	0	0	116.9	I137 N141	I137-A139 PolarHBondContact O-N 3.23Å; A139-N141 PolarHBondContact O-N 3.4Å
140	P	67.6	Low	71.3	Confident	118 Å²	118	84.5 Å²	84.5	77%	0.766	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	138.7	166.3	22	-31.7	0	0	0	110.5
141	N	81.6	Confident	73.1	Confident	133 Å²	133	87.2 Å²	87.2	71%	0.711	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	25.6	-178.9	-46.9	-46	0	0	0	117.6	A139 Q143 G144	A139-N141 PolarHBondContact O-N 3.4Å; N141-Q143 PolarHBondContact O-N 3.19Å; N141-G144 PolarHBondContact O-N 3.21Å; N141-G144 VanDerWaalsContact O-N 3.1Å
142	W	86.1	Confident	74.9	Confident	20 Å²	20	85 Å²	85	8%	0.076	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-52.9	-26.8	175.4	70	-93.6	0	0	0	114.4	I137 G144 L145 Y146 R152 V155 M156	I137-W142 HydrophobicContact CG2-CB 3.88Å; I137-W142 HydrophobicContact CG2-CD2 4.44Å; I137-W142 HydrophobicContact CG2-CG 3.6Å; W142-G144 PolarHBondContact O-N 3.09Å; W142-L145 HydrophobicContact CB-CD1 4.49Å; W142-L145 VanDerWaalsContact O-CB 3.31Å; W142-L145 WeakPolarHBondContact O-CB 3.24Å; W142-L145 PolarHBondContact O-N 3.23Å; W142-Y146 HydrophobicContact CE3-CD2 4.02Å; W142-Y146 HydrophobicContact CE3-CE2 4.11Å; W142-Y146 HydrophobicContact CZ3-CD2 4.37Å; W142-Y146 WeakPolarHBondContact O-CD2 3.09Å; W142-R152 HydrophobicContact CH2-CB 4.43Å; W142-R152 HydrophobicContact CZ3-CB 4.1Å; W142-R152 HydrophobicContact CZ3-CG 4.13Å; W142-V155 HydrophobicContact CE3-CB 4.38Å; W142-V155 HydrophobicContact CE3-CG1 4.04Å; W142-V155 HydrophobicContact CH2-CB 4.4Å; W142-V155 HydrophobicContact CH2-CG1 4.36Å; W142-V155 HydrophobicContact CZ3-CB 3.88Å; W142-V155 HydrophobicContact CZ3-CG1 3.92Å; W142-V155 HydrophobicContact CZ3-CG2 4.29Å; W142-M156 HydrophobicContact CH2-CG 3.97Å; W142-M156 HydrophobicContact CH2-SD 3.67Å; W142-M156 HydrophobicContact CZ2-CG 4.41Å; W142-M156 HydrophobicContact CZ2-SD 3.54Å; W142-M156 VanDerWaalsContact CZ2-SD 3.54Å
143	Q	89.8	Confident	77.1	Confident	81 Å²	81	83.4 Å²	83.4	38%	0.379	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-60.7	-28.9	-179.8	-61.8	85	-6.8	0	0	112.4	N141 L145	N141-Q143 PolarHBondContact O-N 3.19Å; Q143-L145 PolarHBondContact O-N 3.49Å
144	G	88.1	Confident	78.9	Confident	74 Å²	74	81.1 Å²	81.1	76%	0.763	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-74.2	-12.2	177.7	0	0	0	0	0	114.2	N141 W142 Y146	N141-G144 PolarHBondContact O-N 3.21Å; N141-G144 VanDerWaalsContact O-N 3.1Å; W142-G144 PolarHBondContact O-N 3.09Å; G144-Y146 VanDerWaalsContact C-N 3.33Å
145	L	88.8	Confident	80.9	Confident	115 Å²	115	75.8 Å²	75.8	60%	0.602	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-80.3	-15.1	-179.3	-58.5	175.1	0	0	0	113	W142 Q143	W142-L145 HydrophobicContact CB-CD1 4.49Å; W142-L145 VanDerWaalsContact O-CB 3.31Å; W142-L145 WeakPolarHBondContact O-CB 3.24Å; W142-L145 PolarHBondContact O-N 3.23Å; Q143-L145 PolarHBondContact O-N 3.49Å
146	Y	89.6	Confident	82.6	Confident	44 Å²	44	74.7 Å²	74.7	17%	0.173	42%	0.418	C	S	.	.			trans	-124.2	116	-171.4	-60.7	-75.4	0	0	0	111.1	W142 G144 T148 E151 V155	W142-Y146 HydrophobicContact CE3-CD2 4.02Å; W142-Y146 HydrophobicContact CE3-CE2 4.11Å; W142-Y146 HydrophobicContact CZ3-CD2 4.37Å; W142-Y146 WeakPolarHBondContact O-CD2 3.09Å; G144-Y146 VanDerWaalsContact C-N 3.33Å; Y146-T148 PolarHBondContact O-N 3.27Å; Y146-E151 HydrophobicContact CD1-CB 4Å; Y146-E151 HydrophobicContact CG-CB 4.26Å; Y146-V155 HydrophobicContact CD2-CG2 4.1Å; Y146-V155 HydrophobicContact CE1-CG2 4.21Å; Y146-V155 HydrophobicContact CE2-CG2 3.58Å
147	P	90.8	Very high	84.4	Confident	109 Å²	109	67.3 Å²	67.3	71%	0.708	38%	0.379	S	S	*	.	S	Bend	trans	-69.6	-30.3	-171.5	24.4	-32.8	0	0	0	113.7	E151	P147-E151 WeakPolarHBondContact CD-OE2 3.46Å; P147-E151 VanDerWaalsContact CG-OE2 3.24Å; P147-E151 WeakPolarHBondContact CG-OE2 3.39Å
148	T	93.9	Very high	85.9	Confident	62 Å²	62	65 Å²	65	38%	0.38	37%	0.367	S	S	.	.	S	Bend	trans	-104.8	158.5	-175.5	70.4	0	0	0	0	112.9	Y146 R150 E151 R152	Y146-T148 PolarHBondContact O-N 3.27Å; T148-R150 VanDerWaalsContact C-N 3.28Å; T148-E151 WeakPolarHBondContact CB-OE2 3.34Å; T148-E151 PolarHBondContact N-OE2 2.91Å; T148-E151 WeakPolarHBondContact OG1-CB 3.24Å; T148-E151 VanDerWaalsContact OG1-CG 3.24Å; T148-E151 WeakPolarHBondContact OG1-CG 3.48Å; T148-E151 PolarHBondContact OG1-N 3.31Å; T148-E151 VanDerWaalsContact OG1-N 3.1Å; T148-E151 PolarHBondContact OG1-OE2 3.28Å; T148-R152 WeakPolarHBondContact O-CG 3.49Å; T148-R152 PolarHBondContact O-N 3.39Å; T148-R152 PolarHBondContact O-NE 3.32Å
149	I	91.6	Very high	87.5	Confident	102 Å²	102	63.5 Å²	63.5	52%	0.523	36%	0.357	S	S	.	.	H	α-helix	trans	-65.9	-36.4	170.4	-66.4	-72.1	0	0	0	110.5	E151 R152 N153	I149-E151 PolarHBondContact O-N 3.39Å; I149-R152 PolarHBondContact O-N 3.49Å; I149-N153 WeakPolarHBondContact O-CB 3.48Å; I149-N153 PolarHBondContact O-N 2.97Å
150	R	92.4	Very high	89	Confident	129 Å²	129	63.8 Å²	63.8	49%	0.487	35%	0.348	S	S	.	.	H	α-helix	trans	-56.2	-50.3	177.3	-179.6	-175.9	-73.6	-146.2	-0.1	111.8	T148 N153 A154 C226 D227	T148-R150 VanDerWaalsContact C-N 3.28Å; R150-N153 PolarHBondContact O-N 2.94Å; R150-A154 WeakPolarHBondContact O-CB 3.45Å; R150-A154 PolarHBondContact O-N 3.39Å; R150-C226 VanDerWaalsContact CD-O 3.22Å; R150-C226 WeakPolarHBondContact CD-O 2.97Å; R150-C226 HydrophobicContact CG-CB 3.97Å; R150-C226 VanDerWaalsContact CG-O 3.29Å; R150-C226 WeakPolarHBondContact CG-O 3.5Å; R150-D227 IonicContact CZ-OD2 2.88Å; R150-D227 VanDerWaalsContact CZ-OD2 3.3Å; R150-D227 IonicContact NE-OD2 3.15Å; R150-D227 IonicContact NH2-OD2 3.06Å; R150-D227 PolarHBondContact NH2-OD2 3.24Å
151	E	90.3	Very high	90	Very high	74 Å²	74	61.4 Å²	61.4	35%	0.346	33%	0.329	S	S	.	.	H	α-helix	trans	-66.3	-39.4	179.3	-69.8	157.1	149	0	0	111.7	Y146 P147 T148 I149 N153 A154 V155	Y146-E151 HydrophobicContact CD1-CB 4Å; Y146-E151 HydrophobicContact CG-CB 4.26Å; P147-E151 WeakPolarHBondContact CD-OE2 3.46Å; P147-E151 VanDerWaalsContact CG-OE2 3.24Å; P147-E151 WeakPolarHBondContact CG-OE2 3.39Å; T148-E151 WeakPolarHBondContact CB-OE2 3.34Å; T148-E151 PolarHBondContact N-OE2 2.91Å; T148-E151 WeakPolarHBondContact OG1-CB 3.24Å; T148-E151 VanDerWaalsContact OG1-CG 3.24Å; T148-E151 WeakPolarHBondContact OG1-CG 3.48Å; T148-E151 PolarHBondContact OG1-N 3.31Å; T148-E151 VanDerWaalsContact OG1-N 3.1Å; T148-E151 PolarHBondContact OG1-OE2 3.28Å; I149-E151 PolarHBondContact O-N 3.39Å; E151-N153 PolarHBondContact O-N 3.14Å; E151-A154 WeakPolarHBondContact O-CB 3.15Å; E151-A154 PolarHBondContact O-N 3.08Å; E151-V155 PolarHBondContact O-N 3.45Å
152	R	92.1	Very high	90.4	Very high	79 Å²	79	61.9 Å²	61.9	30%	0.298	33%	0.328	S	S	.	.	H	α-helix	trans	-63.4	-41.8	175.1	-73.5	-178	-82.1	175.6	-10	112.3	W142 T148 I149 A154 V155 M156	W142-R152 HydrophobicContact CH2-CB 4.43Å; W142-R152 HydrophobicContact CZ3-CB 4.1Å; W142-R152 HydrophobicContact CZ3-CG 4.13Å; T148-R152 WeakPolarHBondContact O-CG 3.49Å; T148-R152 PolarHBondContact O-N 3.39Å; T148-R152 PolarHBondContact O-NE 3.32Å; I149-R152 PolarHBondContact O-N 3.49Å; R152-A154 VanDerWaalsContact C-N 3.33Å; R152-V155 WeakPolarHBondContact O-CB 3.29Å; R152-V155 PolarHBondContact O-N 3.04Å; R152-M156 PolarHBondContact O-N 3.18Å
153	N	92.3	Very high	90.7	Very high	47 Å²	47	62.1 Å²	62.1	25%	0.251	33%	0.334	S	S	.	.	H	α-helix	trans	-67.5	-34.3	174.2	-73.2	-5.3	0	0	0	111.5	I149 R150 E151 V155 M156 F157 Y225	I149-N153 WeakPolarHBondContact O-CB 3.48Å; I149-N153 PolarHBondContact O-N 2.97Å; R150-N153 PolarHBondContact O-N 2.94Å; E151-N153 PolarHBondContact O-N 3.14Å; N153-V155 PolarHBondContact O-N 2.66Å; N153-M156 WeakPolarHBondContact O-CA 3.44Å; N153-M156 PolarHBondContact O-N 3.06Å; N153-F157 PolarHBondContact O-N 3.31Å; N153-F157 VanDerWaalsContact O-N 3.14Å; N153-Y225 WeakPolarHBondContact CB-O 3.36Å; N153-Y225 WeakPolarHBondContact O-CD1 3.23Å
154	A	91.3	Very high	90.9	Very high	11 Å²	11	61.5 Å²	61.5	9%	0.091	33%	0.334	C	S	.	.	H	α-helix	trans	-59.1	-32.8	174.4	0	0	0	0	0	112.6	R150 E151 R152 M156 F157 C226	R150-A154 WeakPolarHBondContact O-CB 3.45Å; R150-A154 PolarHBondContact O-N 3.39Å; E151-A154 WeakPolarHBondContact O-CB 3.15Å; E151-A154 PolarHBondContact O-N 3.08Å; R152-A154 VanDerWaalsContact C-N 3.33Å; A154-M156 VanDerWaalsContact C-N 3.33Å; A154-F157 WeakPolarHBondContact O-CB 3.22Å; A154-F157 PolarHBondContact O-N 2.83Å; A154-C226 HydrophobicContact CB-CB 3.67Å
155	V	89.7	Confident	91.2	Very high	23 Å²	23	58 Å²	58	14%	0.139	30%	0.298	C	S	.	.	H	α-helix	trans	-71.1	-28.1	173.8	177.5	0	0	0	0	112.6	W142 Y146 E151 R152 N153 N159	W142-V155 HydrophobicContact CE3-CB 4.38Å; W142-V155 HydrophobicContact CE3-CG1 4.04Å; W142-V155 HydrophobicContact CH2-CB 4.4Å; W142-V155 HydrophobicContact CH2-CG1 4.36Å; W142-V155 HydrophobicContact CZ3-CB 3.88Å; W142-V155 HydrophobicContact CZ3-CG1 3.92Å; W142-V155 HydrophobicContact CZ3-CG2 4.29Å; Y146-V155 HydrophobicContact CD2-CG2 4.1Å; Y146-V155 HydrophobicContact CE1-CG2 4.21Å; Y146-V155 HydrophobicContact CE2-CG2 3.58Å; E151-V155 PolarHBondContact O-N 3.45Å; R152-V155 WeakPolarHBondContact O-CB 3.29Å; R152-V155 PolarHBondContact O-N 3.04Å; N153-V155 PolarHBondContact O-N 2.66Å; V155-N159 PolarHBondContact O-ND2 3.43Å
156	M	91.1	Very high	91.5	Very high	17 Å²	17	53.8 Å²	53.8	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-84.7	-9.7	178.9	-60.4	-55.9	-62.5	0	0	113.2	W142 R152 N153 A154 N158 L161 M162 H181 Y225	W142-M156 HydrophobicContact CH2-CG 3.97Å; W142-M156 HydrophobicContact CH2-SD 3.67Å; W142-M156 HydrophobicContact CZ2-CG 4.41Å; W142-M156 HydrophobicContact CZ2-SD 3.54Å; W142-M156 VanDerWaalsContact CZ2-SD 3.54Å; R152-M156 PolarHBondContact O-N 3.18Å; N153-M156 WeakPolarHBondContact O-CA 3.44Å; N153-M156 PolarHBondContact O-N 3.06Å; A154-M156 VanDerWaalsContact C-N 3.33Å; M156-N158 PolarHBondContact O-N 3.03Å; M156-L161 HydrophobicContact CE-CB 4.15Å; M156-L161 HydrophobicContact CE-CD2 4.11Å; M156-L161 HydrophobicContact CE-CG 4.31Å; M156-L161 WeakPolarHBondContact CE-O 3.49Å; M156-L161 HydrophobicContact SD-CD2 4.22Å; M156-M162 HydrophobicContact CE-CB 4.31Å; M156-H181 VanDerWaalsContact CE-NE2 3.34Å; M156-H181 WeakPolarHBondContact CE-NE2 3.23Å; M156-H181 PolarHBondContact O-CE1 3.04Å; M156-Y225 HydrophobicContact CB-CD1 4.28Å; M156-Y225 HydrophobicContact CB-CE1 4.11Å
157	F	91.5	Very high	91.8	Very high	11 Å²	11	51.7 Å²	51.7	5%	0.048	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	129.1	173.6	165.4	-106.2	0	0	0	110.3	N130 N153 A154 N159 L218 L221 K222 Y225	N130-F157 HydrophobicContact CB-CD1 3.92Å; N130-F157 HydrophobicContact CB-CE1 4.06Å; N153-F157 PolarHBondContact O-N 3.31Å; N153-F157 VanDerWaalsContact O-N 3.14Å; A154-F157 WeakPolarHBondContact O-CB 3.22Å; A154-F157 PolarHBondContact O-N 2.83Å; F157-N159 VanDerWaalsContact C-N 3.28Å; F157-N159 PolarHBondContact O-N 3.1Å; F157-L218 HydrophobicContact CE2-CD2 4.01Å; F157-L218 WeakPolarHBondContact CE2-O 3.33Å; F157-L218 HydrophobicContact CZ-CB 4.31Å; F157-L218 HydrophobicContact CZ-CD2 3.81Å; F157-L221 HydrophobicContact CD2-CB 4.13Å; F157-L221 HydrophobicContact CE2-CB 3.77Å; F157-K222 HydrophobicContact CD1-CG 4.41Å; F157-K222 HydrophobicContact CD2-CB 4.04Å; F157-K222 HydrophobicContact CE1-CB 4.3Å; F157-K222 HydrophobicContact CE1-CD 4.42Å; F157-K222 HydrophobicContact CE1-CG 4.32Å; F157-K222 HydrophobicContact CE2-CB 3.68Å; F157-K222 HydrophobicContact CE2-CG 4.45Å; F157-K222 HydrophobicContact CG-CB 4.49Å; F157-K222 HydrophobicContact CZ-CB 3.82Å; F157-K222 HydrophobicContact CZ-CG 4.33Å; F157-Y225 HydrophobicContact CB-CD1 4.26Å; F157-Y225 HydrophobicContact CB-CG 4.23Å
158	N	90.8	Very high	92	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.016	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	44.6	179.1	-162.4	37.3	0	0	0	112.9	N130 N133 M156 L218	N130-N158 PolarHBondContact O-ND2 3.14Å; N133-N158 PolarHBondContact OD1-O 3.13Å; M156-N158 PolarHBondContact O-N 3.03Å; N158-L218 HydrophobicContact CB-CD2 4.29Å
159	N	89.7	Confident	92	Very high	10 Å²	10	44.7 Å²	44.7	5%	0.053	22%	0.222	C	C	.	.			trans	-127.7	133	-178.2	-168.4	-25.2	0	0	0	109.8	V155 F157 L161 P179	V155-N159 PolarHBondContact O-ND2 3.43Å; F157-N159 VanDerWaalsContact C-N 3.28Å; F157-N159 PolarHBondContact O-N 3.1Å; N159-L161 VanDerWaalsContact C-N 3.32Å; N159-L161 WeakPolarHBondContact OD1-CB 3.49Å; N159-L161 PolarHBondContact OD1-N 3.42Å; N159-P179 WeakPolarHBondContact O-CB 3.05Å
160	D	90.6	Very high	92	Very high	78 Å²	78	40 Å²	40	42%	0.417	20%	0.198	S	C	.	.			trans	-77.1	-15.2	178.8	-85.5	-70.2	0	0	0	113.3	M162 A163 H166	D160-M162 PolarHBondContact O-N 3.48Å; D160-A163 WeakPolarHBondContact O-CB 3.49Å; D160-A163 PolarHBondContact O-N 2.94Å; D160-H166 IonicContact OD1-CD2 2.7Å; D160-H166 IonicContact OD1-CE1 3.77Å; D160-H166 IonicContact OD1-NE2 3.21Å; D160-H166 PolarHBondContact OD1-NE2 3.22Å
161	L	89.3	Confident	91.9	Very high	68 Å²	68	36.4 Å²	36.4	36%	0.356	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	125.2	175.4	-178	78.1	0	0	0	109.6	I137 M156 N159 A163 H181	I137-L161 HydrophobicContact CD1-CB 3.7Å; I137-L161 HydrophobicContact CD1-CD1 4.08Å; I137-L161 HydrophobicContact CD1-CD2 3.18Å; I137-L161 HydrophobicContact CD1-CG 3.77Å; M156-L161 HydrophobicContact CE-CB 4.15Å; M156-L161 HydrophobicContact CE-CD2 4.11Å; M156-L161 HydrophobicContact CE-CG 4.31Å; M156-L161 WeakPolarHBondContact CE-O 3.49Å; M156-L161 HydrophobicContact SD-CD2 4.22Å; N159-L161 VanDerWaalsContact C-N 3.32Å; N159-L161 WeakPolarHBondContact OD1-CB 3.49Å; N159-L161 PolarHBondContact OD1-N 3.42Å; L161-A163 PolarHBondContact O-N 2.97Å; L161-A163 VanDerWaalsContact O-N 3.09Å; L161-H181 PolarHBondContact O-NE2 2.68Å
162	M	89.1	Confident	91.6	Very high	142 Å²	142	38.9 Å²	38.9	70%	0.7	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	11.7	179.1	-62.2	169.2	64.1	0	0	115	M156 D160 D164 H181	M156-M162 HydrophobicContact CE-CB 4.31Å; D160-M162 PolarHBondContact O-N 3.48Å; M162-D164 PolarHBondContact O-N 2.99Å; M162-H181 PolarHBondContact O-CD2 2.75Å; M162-H181 VanDerWaalsContact O-CD2 3.23Å
163	A	92.3	Very high	91.1	Very high	25 Å²	25	39.4 Å²	39.4	21%	0.207	24%	0.244	C	C	.	.			trans	-65.3	129.7	174.8	0	0	0	0	0	110.3	D160 L161 P179 G180	D160-A163 WeakPolarHBondContact O-CB 3.49Å; D160-A163 PolarHBondContact O-N 2.94Å; L161-A163 PolarHBondContact O-N 2.97Å; L161-A163 VanDerWaalsContact O-N 3.09Å; A163-P179 HydrophobicContact CB-CB 3.78Å; A163-G180 WeakPolarHBondContact CA-O 3.34Å
164	D	93.6	Very high	90.7	Very high	69 Å²	69	39.3 Å²	39.3	37%	0.369	25%	0.254	S	S	.	.			trans	-118.8	8.9	-177.7	60.7	-1	0	0	0	112.2	M162 G180 H181 K182	M162-D164 PolarHBondContact O-N 2.99Å; D164-G180 PolarHBondContact N-O 2.9Å; D164-H181 VanDerWaalsContact OD1-CA 3.23Å; D164-H181 WeakPolarHBondContact OD1-CA 3.34Å; D164-K182 WeakPolarHBondContact O-CE 3.34Å; D164-K182 PolarHBondContact O-NZ 2.68Å; D164-K182 WeakPolarHBondContact OD1-CG 3.45Å; D164-K182 PolarHBondContact OD1-N 3.39Å; D164-K182 WeakPolarHBondContact OD2-CB 3.44Å
165	V	94.3	Very high	90.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	147.9	171.6	62.9	0	0	0	0	110.7	F167 G180 K182 L185 F196 I207	V165-F167 HydrophobicContact CG1-CE2 3.94Å; V165-F167 HydrophobicContact CG1-CZ 4.21Å; V165-F167 HydrophobicContact CG2-CE2 4.45Å; V165-F167 HydrophobicContact CG2-CZ 4.29Å; V165-G180 PolarHBondContact N-O 2.81Å; V165-G180 PolarHBondContact O-N 2.87Å; V165-K182 HydrophobicContact CB-CG 4.1Å; V165-K182 HydrophobicContact CG1-CG 4.02Å; V165-L185 HydrophobicContact CG1-CD1 4.26Å; V165-F196 HydrophobicContact CG1-CZ 4.16Å; V165-F196 HydrophobicContact CG2-CE1 4.02Å; V165-F196 HydrophobicContact CG2-CZ 4.23Å; V165-I207 HydrophobicContact CG2-CD1 3.8Å; V165-I207 HydrophobicContact CG2-CG1 4.18Å
166	H	95.4	Very high	90.9	Very high	27 Å²	27	44.5 Å²	44.5	13%	0.125	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.9	172.7	-66.1	89.5	0	0	0	111.4	D160 R177 L178 D205 E206 I207	D160-H166 IonicContact OD1-CD2 2.7Å; D160-H166 IonicContact OD1-CE1 3.77Å; D160-H166 IonicContact OD1-NE2 3.21Å; D160-H166 PolarHBondContact OD1-NE2 3.22Å; H166-R177 HydrophobicContact CB-CG 4.35Å; H166-R177 PolarHBondContact CD2-NH1 3.07Å; H166-R177 VanDerWaalsContact CD2-NH1 3.34Å; H166-R177 PolarHBondContact CD2-NH2 3.5Å; H166-R177 VanDerWaalsContact CD2-NH2 3.28Å; H166-R177 PolarHBondContact CE1-NH2 2.95Å; H166-R177 VanDerWaalsContact CG-CZ 3.42Å; H166-R177 PolarHBondContact ND1-NH2 3.32Å; H166-R177 VanDerWaalsContact ND1-NH2 3.11Å; H166-R177 PolarHBondContact NE2-NH2 3.09Å; H166-L178 CarbonylContact C-O 3.57Å; H166-L178 WeakPolarHBondContact CA-O 3.36Å; H166-D205 PolarHBondContact N-O 2.8Å; H166-E206 CarbonylContact O-C 3.54Å; H166-E206 VanDerWaalsContact O-CA 3.31Å; H166-E206 WeakPolarHBondContact O-CA 3.41Å; H166-I207 PolarHBondContact O-N 3.38Å
167	F	95.1	Very high	91	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.1	176.5	-61	-82.3	0	0	0	110.8	V165 V169 R177 L178 L185 F192 F196 I207 I209 F217	V165-F167 HydrophobicContact CG1-CE2 3.94Å; V165-F167 HydrophobicContact CG1-CZ 4.21Å; V165-F167 HydrophobicContact CG2-CE2 4.45Å; V165-F167 HydrophobicContact CG2-CZ 4.29Å; F167-V169 HydrophobicContact CB-CG2 3.72Å; F167-R177 CarbonylContact O-C 3.52Å; F167-R177 VanDerWaalsContact O-CA 3.25Å; F167-R177 WeakPolarHBondContact O-CA 3.43Å; F167-L178 PolarHBondContact N-O 3.16Å; F167-L178 PolarHBondContact O-N 3.46Å; F167-L185 HydrophobicContact CE2-CD1 3.58Å; F167-L185 HydrophobicContact CZ-CD1 3.64Å; F167-F192 AromaticContact CE1-CE1 3.84Å; F167-F192 HydrophobicContact CE1-CE1 3.84Å; F167-F192 HydrophobicContact CZ-CD1 4.41Å; F167-F192 AromaticContact CZ-CE1 3.81Å; F167-F192 HydrophobicContact CZ-CE1 3.81Å; F167-F192 HydrophobicContact CZ-CZ 4.37Å; F167-F196 HydrophobicContact CE1-CZ 4.48Å; F167-F196 AromaticContact CZ-CZ 3.95Å; F167-F196 HydrophobicContact CZ-CZ 3.95Å; F167-I207 CarbonylContact C-O 3.58Å; F167-I207 VanDerWaalsContact CA-O 3.28Å; F167-I207 WeakPolarHBondContact CA-O 3.5Å; F167-I207 HydrophobicContact CD1-CB 3.81Å; F167-I207 HydrophobicContact CD1-CG2 3.96Å; F167-I207 HydrophobicContact CE1-CB 4.06Å; F167-I207 HydrophobicContact CE1-CD1 4.11Å; F167-I207 HydrophobicContact CE1-CG2 4.1Å; F167-I209 HydrophobicContact CB-CD1 4.26Å; F167-I209 HydrophobicContact CD1-CD1 3.47Å; F167-I209 VanDerWaalsContact CD1-CD1 3.47Å; F167-I209 HydrophobicContact CD1-CG1 4.38Å; F167-I209 HydrophobicContact CE1-CD1 4.15Å; F167-I209 HydrophobicContact CG-CD1 4.16Å; F167-F217 HydrophobicContact CB-CE1 4.05Å; F167-F217 HydrophobicContact CB-CZ 4.35Å; F167-F217 HydrophobicContact CD1-CE1 4.47Å; F167-F217 AromaticContact CD1-CZ 3.98Å; F167-F217 HydrophobicContact CD1-CZ 3.98Å; F167-F217 AromaticContact CD2-CE1 3.89Å; F167-F217 HydrophobicContact CD2-CE1 3.89Å; F167-F217 HydrophobicContact CD2-CZ 4.01Å; F167-F217 HydrophobicContact CE1-CZ 4.23Å; F167-F217 HydrophobicContact CE2-CE1 4.45Å; F167-F217 HydrophobicContact CE2-CZ 4.26Å; F167-F217 AromaticContact CG-CE1 3.87Å; F167-F217 HydrophobicContact CG-CE1 3.87Å; F167-F217 AromaticContact CG-CZ 3.84Å; F167-F217 HydrophobicContact CG-CZ 3.84Å; F167-F217 HydrophobicContact CZ-CZ 4.34Å
168	V	95.3	Very high	91.2	Very high	24 Å²	24	49.4 Å²	49.4	15%	0.145	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	99.4	168.3	179.6	0	0	0	0	107.8	T175 R177 E206 I207 R208 I209	V168-T175 HydrophobicContact CG1-CG2 3.93Å; V168-R177 HydrophobicContact CG2-CG 4.41Å; V168-E206 HydrophobicContact CG2-CG 3.72Å; V168-E206 VanDerWaalsContact CG2-OE1 3.24Å; V168-E206 WeakPolarHBondContact CG2-OE1 3.48Å; V168-I207 PolarHBondContact N-O 3.18Å; V168-R208 HydrophobicContact CB-CG 4.29Å; V168-R208 WeakPolarHBondContact O-CA 3.46Å; V168-I209 PolarHBondContact O-N 3.18Å
169	V	95.2	Very high	91.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	138.1	-169.8	-175	0	0	0	0	110.6	F167 T175 Q176 L178 I209 V212 P214 F217	F167-V169 HydrophobicContact CB-CG2 3.72Å; V169-T175 CarbonylContact O-C 3.51Å; V169-T175 VanDerWaalsContact O-CA 3.24Å; V169-T175 WeakPolarHBondContact O-CA 3.39Å; V169-Q176 PolarHBondContact N-O 3.27Å; V169-Q176 PolarHBondContact O-N 2.79Å; V169-L178 HydrophobicContact CB-CD1 4.37Å; V169-L178 HydrophobicContact CG2-CD1 3.99Å; V169-I209 WeakPolarHBondContact CA-O 3.42Å; V169-I209 HydrophobicContact CG2-CB 4.33Å; V169-I209 HydrophobicContact CG2-CD1 4.13Å; V169-V212 HydrophobicContact CG1-CB 4.32Å; V169-V212 WeakPolarHBondContact CG1-O 3.48Å; V169-P214 HydrophobicContact CG1-CG 4.43Å; V169-F217 HydrophobicContact CG1-CB 3.86Å; V169-F217 HydrophobicContact CG1-CG 4.2Å; V169-F217 HydrophobicContact CG2-CB 4.48Å; V169-F217 HydrophobicContact CG2-CD1 3.72Å; V169-F217 HydrophobicContact CG2-CE1 3.97Å; V169-F217 HydrophobicContact CG2-CG 4.03Å
170	G	91.9	Very high	91.6	Very high	2 Å²	2	48.9 Å²	48.9	2%	0.021	29%	0.294	C	S	.	.	S	Bend	trans	111.3	166.4	173.9	0	0	0	0	0	114.2	T175 I209 P210 V212	G170-T175 WeakPolarHBondContact O-CG2 3.49Å; G170-I209 PolarHBondContact N-O 2.91Å; G170-P210 CarbonylContact C-O 3.56Å; G170-P210 WeakPolarHBondContact O-CA 3.34Å; G170-V212 VanDerWaalsContact CA-O 3.31Å; G170-V212 WeakPolarHBondContact CA-O 3.28Å; G170-V212 PolarHBondContact N-O 2.78Å
171	P	89.1	Confident	91.8	Very high	55 Å²	55	46 Å²	46	36%	0.357	28%	0.279	S	S	.	.	S	Bend	trans	-68.9	159.1	-178.3	28.6	-34.8	0	0	0	111.9	G173 G174 T175	P171-G173 PolarHBondContact O-N 3.11Å; P171-G174 CarbonylContact O-C 3.56Å; P171-G174 PolarHBondContact O-N 3.4Å; P171-T175 PolarHBondContact O-N 3.03Å
172	P	84.7	Confident	92.1	Very high	126 Å²	126	44.3 Å²	44.3	82%	0.818	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	124.4	177	-24.9	33.8	0	0	0	111.9
173	G	80.6	Confident	92.4	Very high	89 Å²	89	45.3 Å²	45.3	92%	0.918	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	-4.7	-177.4	0	0	0	0	0	115.5	P171	P171-G173 PolarHBondContact O-N 3.11Å
174	G	84	Confident	92.5	Very high	45 Å²	45	45.3 Å²	45.3	46%	0.464	26%	0.263	S	S	.	.	S	Bend	trans	-133.5	27	172.8	0	0	0	0	0	112.6	P171	P171-G174 CarbonylContact O-C 3.56Å; P171-G174 PolarHBondContact O-N 3.4Å
175	T	91.2	Very high	92.6	Very high	76 Å²	76	42 Å²	42	47%	0.466	25%	0.245	S	C	.	.			trans	-76.1	139.3	-176.7	49.5	0	0	0	0	112	V168 V169 G170 P171	V168-T175 HydrophobicContact CG1-CG2 3.93Å; V169-T175 CarbonylContact O-C 3.51Å; V169-T175 VanDerWaalsContact O-CA 3.24Å; V169-T175 WeakPolarHBondContact O-CA 3.39Å; G170-T175 WeakPolarHBondContact O-CG2 3.49Å; P171-T175 PolarHBondContact O-N 3.03Å
176	Q	94	Very high	92.7	Very high	68 Å²	68	42.6 Å²	42.6	32%	0.318	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133.2	171.9	-171.9	174.7	-6.4	0	0	109.9	V169 L178 P214	V169-Q176 PolarHBondContact N-O 3.27Å; V169-Q176 PolarHBondContact O-N 2.79Å; Q176-L178 HydrophobicContact CG-CD2 3.77Å; Q176-L178 HydrophobicContact CG-CG 4.24Å; Q176-P214 HydrophobicContact CB-CB 3.98Å; Q176-P214 HydrophobicContact CB-CG 3.93Å; Q176-P214 VanDerWaalsContact OE1-CB 3.24Å
177	R	93.9	Very high	92.7	Very high	130 Å²	130	46.3 Å²	46.3	49%	0.491	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.6	173.7	-171.1	174.2	177.5	-93.1	1.6	109.3	H166 F167 V168	H166-R177 HydrophobicContact CB-CG 4.35Å; H166-R177 PolarHBondContact CD2-NH1 3.07Å; H166-R177 VanDerWaalsContact CD2-NH1 3.34Å; H166-R177 PolarHBondContact CD2-NH2 3.5Å; H166-R177 VanDerWaalsContact CD2-NH2 3.28Å; H166-R177 PolarHBondContact CE1-NH2 2.95Å; H166-R177 VanDerWaalsContact CG-CZ 3.42Å; H166-R177 PolarHBondContact ND1-NH2 3.32Å; H166-R177 VanDerWaalsContact ND1-NH2 3.11Å; H166-R177 PolarHBondContact NE2-NH2 3.09Å; F167-R177 CarbonylContact O-C 3.52Å; F167-R177 VanDerWaalsContact O-CA 3.25Å; F167-R177 WeakPolarHBondContact O-CA 3.43Å; V168-R177 HydrophobicContact CG2-CG 4.41Å
178	L	94.6	Very high	92.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.3	-173.3	-61.6	177.4	0	0	0	110.5	H166 F167 V169 Q176 F217 L218	H166-L178 CarbonylContact C-O 3.57Å; H166-L178 WeakPolarHBondContact CA-O 3.36Å; F167-L178 PolarHBondContact N-O 3.16Å; F167-L178 PolarHBondContact O-N 3.46Å; V169-L178 HydrophobicContact CB-CD1 4.37Å; V169-L178 HydrophobicContact CG2-CD1 3.99Å; Q176-L178 HydrophobicContact CG-CD2 3.77Å; Q176-L178 HydrophobicContact CG-CG 4.24Å; L178-F217 HydrophobicContact CD1-CD1 3.74Å; L178-F217 HydrophobicContact CD1-CE1 4.39Å; L178-L218 HydrophobicContact CD1-CD2 3.99Å; L178-L218 HydrophobicContact CD1-CG 3.94Å; L178-L218 HydrophobicContact CD2-CD1 4.37Å; L178-L218 HydrophobicContact CD2-CD2 3.93Å; L178-L218 HydrophobicContact CD2-CG 4.32Å
179	P	95.1	Very high	92.7	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.013	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	152.3	174.9	30.9	-34	0	0	0	111.9	N159 A163	N159-P179 WeakPolarHBondContact O-CB 3.05Å; A163-P179 HydrophobicContact CB-CB 3.78Å
180	G	94.8	Very high	92.8	Very high	0 Å²	0	50 Å²	50	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	170.2	176.5	0	0	0	0	0	113.4	A163 D164 V165	A163-G180 WeakPolarHBondContact CA-O 3.34Å; D164-G180 PolarHBondContact N-O 2.9Å; V165-G180 PolarHBondContact N-O 2.81Å; V165-G180 PolarHBondContact O-N 2.87Å
181	H	94.9	Very high	92.9	Very high	18 Å²	18	51.9 Å²	51.9	8%	0.083	32%	0.317	C	S	.	.			trans	-125.7	110	-177.7	-58.1	86.7	0	0	0	109.7	M156 L161 M162 D164 Y183 V184 L185 Y225	M156-H181 VanDerWaalsContact CE-NE2 3.34Å; M156-H181 WeakPolarHBondContact CE-NE2 3.23Å; M156-H181 PolarHBondContact O-CE1 3.04Å; L161-H181 PolarHBondContact O-NE2 2.68Å; M162-H181 PolarHBondContact O-CD2 2.75Å; M162-H181 VanDerWaalsContact O-CD2 3.23Å; D164-H181 VanDerWaalsContact OD1-CA 3.23Å; D164-H181 WeakPolarHBondContact OD1-CA 3.34Å; H181-Y183 VanDerWaalsContact C-N 3.28Å; H181-Y183 PolarHBondContact O-N 3.28Å; H181-V184 HydrophobicContact CB-CB 4.23Å; H181-V184 HydrophobicContact CB-CG2 4.01Å; H181-V184 PolarHBondContact O-N 3.11Å; H181-V184 VanDerWaalsContact O-N 3.12Å; H181-L185 VanDerWaalsContact O-CG 3.31Å; H181-L185 WeakPolarHBondContact O-CG 3.23Å; H181-L185 PolarHBondContact O-N 3.1Å; H181-Y225 PolarHBondContact N-OH 3.49Å; H181-Y225 VanDerWaalsContact N-OH 3.09Å; H181-Y225 AromaticContact ND1-CE1 3.49Å; H181-Y225 WeakPolarHBondContact ND1-CE1 3.29Å; H181-Y225 AromaticContact ND1-CZ 3.56Å; H181-Y225 PolarHBondContact ND1-OH 3.28Å
182	K	94.9	Very high	93.3	Very high	32 Å²	32	49.2 Å²	49.2	14%	0.139	30%	0.3	C	S	.	.	H	α-helix	trans	-51.6	-44.3	-172.7	-71.6	174.9	176.2	170	0	112	D164 V165 A186 F196 D203	D164-K182 WeakPolarHBondContact O-CE 3.34Å; D164-K182 PolarHBondContact O-NZ 2.68Å; D164-K182 WeakPolarHBondContact OD1-CG 3.45Å; D164-K182 PolarHBondContact OD1-N 3.39Å; D164-K182 WeakPolarHBondContact OD2-CB 3.44Å; V165-K182 HydrophobicContact CB-CG 4.1Å; V165-K182 HydrophobicContact CG1-CG 4.02Å; K182-A186 VanDerWaalsContact O-CB 3.23Å; K182-A186 WeakPolarHBondContact O-CB 3.45Å; K182-A186 PolarHBondContact O-N 3.02Å; K182-F196 HydrophobicContact CB-CB 4.45Å; K182-F196 HydrophobicContact CB-CD2 3.95Å; K182-F196 HydrophobicContact CB-CE2 4.35Å; K182-F196 HydrophobicContact CB-CG 4.1Å; K182-F196 HydrophobicContact CD-CD1 4.2Å; K182-F196 HydrophobicContact CD-CG 4.36Å; K182-F196 HydrophobicContact CG-CB 4.45Å; K182-F196 HydrophobicContact CG-CD1 3.88Å; K182-F196 HydrophobicContact CG-CD2 4.02Å; K182-F196 HydrophobicContact CG-CE1 4.05Å; K182-F196 HydrophobicContact CG-CE2 4.21Å; K182-F196 HydrophobicContact CG-CG 3.86Å; K182-F196 HydrophobicContact CG-CZ 4.22Å; K182-D203 IonicContact NZ-OD1 3.99Å; K182-D203 PolarHBondContact NZ-OD1 2.82Å
183	Y	95	Very high	93.8	Very high	164 Å²	164	48 Å²	48	64%	0.643	28%	0.283	S	S	*	.	H	α-helix	trans	-61.4	-50.9	178.6	176.9	-104.1	0	0	0	113	H181 L185 A186 V187	H181-Y183 VanDerWaalsContact C-N 3.28Å; H181-Y183 PolarHBondContact O-N 3.28Å; Y183-L185 VanDerWaalsContact C-N 3.31Å; Y183-L185 PolarHBondContact O-N 3.34Å; Y183-A186 PolarHBondContact O-N 3.48Å; Y183-V187 HydrophobicContact CD2-CG2 4.37Å; Y183-V187 HydrophobicContact CE1-CG2 4.28Å; Y183-V187 HydrophobicContact CE2-CG2 3.97Å; Y183-V187 WeakPolarHBondContact O-CG2 3.08Å; Y183-V187 PolarHBondContact O-N 3.42Å
184	V	95.6	Very high	94.4	Very high	24 Å²	24	46.4 Å²	46.4	15%	0.145	26%	0.261	C	S	.	.	H	α-helix	trans	-61.4	-43.9	-178.6	179.9	0	0	0	0	110.3	H181 V187 G188 I224 Y225	H181-V184 HydrophobicContact CB-CB 4.23Å; H181-V184 HydrophobicContact CB-CG2 4.01Å; H181-V184 PolarHBondContact O-N 3.11Å; H181-V184 VanDerWaalsContact O-N 3.12Å; V184-V187 PolarHBondContact O-N 3.26Å; V184-G188 PolarHBondContact O-N 3.22Å; V184-G188 VanDerWaalsContact O-N 3.1Å; V184-I224 HydrophobicContact CG1-CG2 4.2Å; V184-Y225 HydrophobicContact CB-CE1 4.46Å; V184-Y225 HydrophobicContact CG1-CD1 4.03Å; V184-Y225 HydrophobicContact CG1-CD2 3.94Å; V184-Y225 HydrophobicContact CG1-CE1 4.1Å; V184-Y225 HydrophobicContact CG1-CE2 4.04Å; V184-Y225 HydrophobicContact CG1-CG 3.99Å
185	L	95.7	Very high	94.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.7	-43.2	179.7	-64.5	175.6	0	0	0	112.6	V165 F167 H181 Y183 V187 G188 S189 F192 F196 L221 I224 Y225	V165-L185 HydrophobicContact CG1-CD1 4.26Å; F167-L185 HydrophobicContact CE2-CD1 3.58Å; F167-L185 HydrophobicContact CZ-CD1 3.64Å; H181-L185 VanDerWaalsContact O-CG 3.31Å; H181-L185 WeakPolarHBondContact O-CG 3.23Å; H181-L185 PolarHBondContact O-N 3.1Å; Y183-L185 VanDerWaalsContact C-N 3.31Å; Y183-L185 PolarHBondContact O-N 3.34Å; L185-V187 VanDerWaalsContact C-N 3.33Å; L185-V187 PolarHBondContact O-N 3.22Å; L185-G188 PolarHBondContact O-N 2.99Å; L185-S189 PolarHBondContact O-N 3.31Å; L185-F192 HydrophobicContact CB-CB 3.89Å; L185-F192 HydrophobicContact CB-CD2 3.79Å; L185-F192 HydrophobicContact CB-CG 3.85Å; L185-F192 HydrophobicContact CD2-CD2 4.16Å; L185-F192 HydrophobicContact CD2-CE2 4.09Å; L185-F192 HydrophobicContact CG-CD2 4.45Å; L185-F192 WeakPolarHBondContact O-CB 3.42Å; L185-F196 HydrophobicContact CB-CE2 3.98Å; L185-F196 HydrophobicContact CD1-CE2 4.03Å; L185-F196 HydrophobicContact CD1-CZ 4.29Å; L185-L221 HydrophobicContact CD2-CD2 3.33Å; L185-I224 HydrophobicContact CD2-CD1 4.45Å; L185-I224 HydrophobicContact CD2-CG2 4.18Å; L185-Y225 HydrophobicContact CD2-CE2 4.06Å
186	A	95.6	Very high	94.9	Very high	13 Å²	13	44.7 Å²	44.7	11%	0.107	24%	0.236	C	C	.	.	H	α-helix	trans	-67.2	-32.3	178.4	0	0	0	0	0	113	K182 Y183 H193 Y197	K182-A186 VanDerWaalsContact O-CB 3.23Å; K182-A186 WeakPolarHBondContact O-CB 3.45Å; K182-A186 PolarHBondContact O-N 3.02Å; Y183-A186 PolarHBondContact O-N 3.48Å; A186-H193 HydrophobicContact CB-CB 4.04Å; A186-Y197 HydrophobicContact CB-CD2 3.72Å; A186-Y197 HydrophobicContact CB-CE2 3.49Å; A186-Y197 VanDerWaalsContact CB-CE2 3.49Å
187	V	95.2	Very high	94.8	Very high	104 Å²	104	47 Å²	47	63%	0.63	24%	0.243	S	C	*	.	H	α-helix	trans	-69.3	-37.9	172.8	172.2	0	0	0	0	111	Y183 V184 L185	Y183-V187 HydrophobicContact CD2-CG2 4.37Å; Y183-V187 HydrophobicContact CE1-CG2 4.28Å; Y183-V187 HydrophobicContact CE2-CG2 3.97Å; Y183-V187 WeakPolarHBondContact O-CG2 3.08Å; Y183-V187 PolarHBondContact O-N 3.42Å; V184-V187 PolarHBondContact O-N 3.26Å; L185-V187 VanDerWaalsContact C-N 3.33Å; L185-V187 PolarHBondContact O-N 3.22Å
188	G	94	Very high	94.6	Very high	31 Å²	31	42 Å²	42	32%	0.32	23%	0.232	S	C	.	.	H	α-helix	trans	-82.1	-15.6	-178.3	0	0	0	0	0	115.8	V184 L185	V184-G188 PolarHBondContact O-N 3.22Å; V184-G188 VanDerWaalsContact O-N 3.1Å; L185-G188 PolarHBondContact O-N 2.99Å
189	S	97.3	Very high	94.1	Very high	4 Å²	4	52 Å²	52	3%	0.028	28%	0.279	C	S	.	.			trans	-152	128.6	-175	168.7	0	0	0	0	112	L185 V191 F192 H193 Y246	L185-S189 PolarHBondContact O-N 3.31Å; S189-V191 PolarHBondContact O-N 3.27Å; S189-V191 PolarHBondContact OG-N 2.95Å; S189-V191 VanDerWaalsContact OG-N 3.12Å; S189-F192 PolarHBondContact O-N 3.49Å; S189-F192 PolarHBondContact OG-N 3.27Å; S189-H193 PolarHBondContact O-N 3.3Å; S189-Y246 WeakPolarHBondContact CB-O 3.42Å; S189-Y246 PolarHBondContact OG-O 3.49Å
190	S	96.1	Very high	93.4	Very high	68 Å²	68	59.9 Å²	59.9	48%	0.476	32%	0.32	S	S	.	.	H	α-helix	trans	-63.7	-27	172.6	57.4	0	0	0	0	112.9	A194	S190-A194 WeakPolarHBondContact O-CB 3.31Å; S190-A194 PolarHBondContact O-N 3.32Å
191	V	95.6	Very high	92.8	Very high	40 Å²	40	61.8 Å²	61.8	24%	0.242	34%	0.336	C	S	.	.	H	α-helix	trans	-70.4	-46.3	177.3	179.3	0	0	0	0	110.1	S189 H193 A194 M195 Y246 I247	S189-V191 PolarHBondContact O-N 3.27Å; S189-V191 PolarHBondContact OG-N 2.95Å; S189-V191 VanDerWaalsContact OG-N 3.12Å; V191-H193 VanDerWaalsContact C-N 3.33Å; V191-H193 PolarHBondContact O-N 3.12Å; V191-A194 PolarHBondContact O-N 3.26Å; V191-M195 VanDerWaalsContact O-CB 3.31Å; V191-M195 WeakPolarHBondContact O-CB 3.24Å; V191-M195 PolarHBondContact O-N 2.61Å; V191-Y246 HydrophobicContact CB-CD1 4.17Å; V191-Y246 HydrophobicContact CG1-CD1 3.89Å; V191-Y246 HydrophobicContact CG1-CE1 4.3Å; V191-I247 HydrophobicContact CG2-CB 4.27Å; V191-I247 HydrophobicContact CG2-CD1 3.68Å; V191-I247 HydrophobicContact CG2-CG1 3.72Å
192	F	95.4	Very high	91.9	Very high	0 Å²	0	67 Å²	67	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-65.5	-36.5	173.8	-72.1	-49.9	0	0	0	112.1	F167 L185 S189 A194 M195 F196 F217 M220 I224 Y246	F167-F192 AromaticContact CE1-CE1 3.84Å; F167-F192 HydrophobicContact CE1-CE1 3.84Å; F167-F192 HydrophobicContact CZ-CD1 4.41Å; F167-F192 AromaticContact CZ-CE1 3.81Å; F167-F192 HydrophobicContact CZ-CE1 3.81Å; F167-F192 HydrophobicContact CZ-CZ 4.37Å; L185-F192 HydrophobicContact CB-CB 3.89Å; L185-F192 HydrophobicContact CB-CD2 3.79Å; L185-F192 HydrophobicContact CB-CG 3.85Å; L185-F192 HydrophobicContact CD2-CD2 4.16Å; L185-F192 HydrophobicContact CD2-CE2 4.09Å; L185-F192 HydrophobicContact CG-CD2 4.45Å; L185-F192 WeakPolarHBondContact O-CB 3.42Å; S189-F192 PolarHBondContact O-N 3.49Å; S189-F192 PolarHBondContact OG-N 3.27Å; F192-A194 PolarHBondContact O-N 2.9Å; F192-M195 HydrophobicContact CD1-SD 4.02Å; F192-M195 HydrophobicContact CE1-SD 4.33Å; F192-M195 PolarHBondContact O-N 3.05Å; F192-F196 HydrophobicContact CB-CD2 4.15Å; F192-F196 HydrophobicContact CB-CE2 3.85Å; F192-F196 AromaticContact CD1-CE2 3.91Å; F192-F196 HydrophobicContact CD1-CE2 3.91Å; F192-F196 HydrophobicContact CD1-CZ 4.13Å; F192-F196 HydrophobicContact CG-CE2 4.16Å; F192-F196 WeakPolarHBondContact O-CD2 3.41Å; F192-F196 WeakPolarHBondContact O-CG 3.17Å; F192-F196 PolarHBondContact O-N 2.97Å; F192-F217 AromaticContact CZ-CE2 4Å; F192-F217 HydrophobicContact CZ-CE2 4Å; F192-F217 HydrophobicContact CZ-CZ 4.02Å; F192-M220 HydrophobicContact CE2-CE 3.99Å; F192-M220 HydrophobicContact CZ-CE 4.09Å; F192-I224 HydrophobicContact CD2-CD1 4.37Å; F192-I224 HydrophobicContact CE2-CD1 4.06Å; F192-Y246 HydrophobicContact CD1-CD1 4.2Å; F192-Y246 HydrophobicContact CD1-CE1 4.16Å; F192-Y246 HydrophobicContact CD2-CD1 4.25Å; F192-Y246 AromaticContact CE1-CD1 3.68Å; F192-Y246 HydrophobicContact CE1-CD1 3.68Å; F192-Y246 AromaticContact CE1-CE1 3.38Å; F192-Y246 HydrophobicContact CE1-CE1 3.38Å; F192-Y246 AromaticContact CE2-CD1 3.72Å; F192-Y246 HydrophobicContact CE2-CD1 3.72Å; F192-Y246 HydrophobicContact CE2-CE1 4.2Å; F192-Y246 HydrophobicContact CE2-CG 4.11Å; F192-Y246 HydrophobicContact CG-CD1 4.45Å; F192-Y246 AromaticContact CZ-CD1 3.4Å; F192-Y246 HydrophobicContact CZ-CD1 3.4Å; F192-Y246 VanDerWaalsContact CZ-CD1 3.4Å; F192-Y246 AromaticContact CZ-CE1 3.39Å; F192-Y246 HydrophobicContact CZ-CE1 3.39Å; F192-Y246 HydrophobicContact CZ-CG 4.03Å; F192-Y246 AromaticContact CZ-CZ 4Å
193	H	95.3	Very high	91.1	Very high	99 Å²	99	72.3 Å²	72.3	46%	0.458	39%	0.39	S	S	.	.	H	α-helix	trans	-57.8	-49.7	172.4	178.1	-78.5	0	0	0	111.8	A186 S189 V191 M195 F196 Y197 G198	A186-H193 HydrophobicContact CB-CB 4.04Å; S189-H193 PolarHBondContact O-N 3.3Å; V191-H193 VanDerWaalsContact C-N 3.33Å; V191-H193 PolarHBondContact O-N 3.12Å; H193-M195 VanDerWaalsContact C-N 3.31Å; H193-M195 PolarHBondContact O-N 3.29Å; H193-F196 PolarHBondContact O-N 2.57Å; H193-Y197 WeakPolarHBondContact O-CA 2.99Å; H193-Y197 WeakPolarHBondContact O-CB 3.49Å; H193-Y197 PolarHBondContact O-N 3.11Å; H193-G198 PolarHBondContact O-N 3.3Å
194	A	94.1	Very high	90.4	Very high	56 Å²	56	69.7 Å²	69.7	46%	0.463	38%	0.382	S	S	.	.	H	α-helix	trans	-64.2	-36.7	177.6	0	0	0	0	0	112.4	S190 V191 F192 G198	S190-A194 WeakPolarHBondContact O-CB 3.31Å; S190-A194 PolarHBondContact O-N 3.32Å; V191-A194 PolarHBondContact O-N 3.26Å; F192-A194 PolarHBondContact O-N 2.9Å; A194-G198 VanDerWaalsContact O-CA 3.25Å; A194-G198 WeakPolarHBondContact O-CA 3.25Å; A194-G198 PolarHBondContact O-N 3.32Å; A194-G198 VanDerWaalsContact O-N 3.08Å
195	M	92.7	Very high	89.7	Confident	60 Å²	60	74.1 Å²	74.1	30%	0.296	41%	0.405	S	S	.	.	H	α-helix	trans	-64.7	-38.3	178.8	-175.7	179.4	-71.5	0	0	112.8	V191 F192 H193 A201 I207	V191-M195 VanDerWaalsContact O-CB 3.31Å; V191-M195 WeakPolarHBondContact O-CB 3.24Å; V191-M195 PolarHBondContact O-N 2.61Å; F192-M195 HydrophobicContact CD1-SD 4.02Å; F192-M195 HydrophobicContact CE1-SD 4.33Å; F192-M195 PolarHBondContact O-N 3.05Å; H193-M195 VanDerWaalsContact C-N 3.31Å; H193-M195 PolarHBondContact O-N 3.29Å; M195-A201 WeakPolarHBondContact O-CB 3.39Å; M195-I207 HydrophobicContact CG-CD1 4.23Å; M195-I207 HydrophobicContact SD-CD1 3.61Å; M195-I207 HydrophobicContact SD-CG2 4.27Å
196	F	93.3	Very high	89.5	Confident	25 Å²	25	78.1 Å²	78.1	11%	0.11	42%	0.424	C	S	.	.	H	α-helix	trans	-101.3	-31.7	-174.4	-58.2	-45.5	0	0	0	114.8	V165 F167 K182 L185 F192 H193 A201 I207	V165-F196 HydrophobicContact CG1-CZ 4.16Å; V165-F196 HydrophobicContact CG2-CE1 4.02Å; V165-F196 HydrophobicContact CG2-CZ 4.23Å; F167-F196 HydrophobicContact CE1-CZ 4.48Å; F167-F196 AromaticContact CZ-CZ 3.95Å; F167-F196 HydrophobicContact CZ-CZ 3.95Å; K182-F196 HydrophobicContact CB-CB 4.45Å; K182-F196 HydrophobicContact CB-CD2 3.95Å; K182-F196 HydrophobicContact CB-CE2 4.35Å; K182-F196 HydrophobicContact CB-CG 4.1Å; K182-F196 HydrophobicContact CD-CD1 4.2Å; K182-F196 HydrophobicContact CD-CG 4.36Å; K182-F196 HydrophobicContact CG-CB 4.45Å; K182-F196 HydrophobicContact CG-CD1 3.88Å; K182-F196 HydrophobicContact CG-CD2 4.02Å; K182-F196 HydrophobicContact CG-CE1 4.05Å; K182-F196 HydrophobicContact CG-CE2 4.21Å; K182-F196 HydrophobicContact CG-CG 3.86Å; K182-F196 HydrophobicContact CG-CZ 4.22Å; L185-F196 HydrophobicContact CB-CE2 3.98Å; L185-F196 HydrophobicContact CD1-CE2 4.03Å; L185-F196 HydrophobicContact CD1-CZ 4.29Å; F192-F196 HydrophobicContact CB-CD2 4.15Å; F192-F196 HydrophobicContact CB-CE2 3.85Å; F192-F196 AromaticContact CD1-CE2 3.91Å; F192-F196 HydrophobicContact CD1-CE2 3.91Å; F192-F196 HydrophobicContact CD1-CZ 4.13Å; F192-F196 HydrophobicContact CG-CE2 4.16Å; F192-F196 WeakPolarHBondContact O-CD2 3.41Å; F192-F196 WeakPolarHBondContact O-CG 3.17Å; F192-F196 PolarHBondContact O-N 2.97Å; H193-F196 PolarHBondContact O-N 2.57Å; F196-A201 WeakPolarHBondContact O-CB 3.31Å; F196-I207 HydrophobicContact CE1-CD1 3.56Å; F196-I207 HydrophobicContact CZ-CD1 4.19Å
197	Y	92.4	Very high	89.4	Confident	117 Å²	117	78.9 Å²	78.9	46%	0.459	43%	0.425	S	S	.	.	H	α-helix	trans	-126.5	5.6	-172.5	-55	-71.9	0	0	0	112.9	A186 H193	A186-Y197 HydrophobicContact CB-CD2 3.72Å; A186-Y197 HydrophobicContact CB-CE2 3.49Å; A186-Y197 VanDerWaalsContact CB-CE2 3.49Å; H193-Y197 WeakPolarHBondContact O-CA 2.99Å; H193-Y197 WeakPolarHBondContact O-CB 3.49Å; H193-Y197 PolarHBondContact O-N 3.11Å
198	G	89.8	Confident	89.3	Confident	26 Å²	26	83.2 Å²	83.2	27%	0.268	43%	0.431	S	S	.	.	S	Bend	trans	-78	169.7	176.2	0	0	0	0	0	113.4	H193 A194 L200 A201	H193-G198 PolarHBondContact O-N 3.3Å; A194-G198 VanDerWaalsContact O-CA 3.25Å; A194-G198 WeakPolarHBondContact O-CA 3.25Å; A194-G198 PolarHBondContact O-N 3.32Å; A194-G198 VanDerWaalsContact O-N 3.08Å; G198-L200 PolarHBondContact O-N 3.44Å; G198-L200 VanDerWaalsContact O-N 3.13Å; G198-A201 VanDerWaalsContact O-CB 3.23Å; G198-A201 WeakPolarHBondContact O-CB 3.11Å; G198-A201 PolarHBondContact O-N 2.81Å
199	E	83.2	Confident	89.3	Confident	210 Å²	210	82 Å²	82	98%	0.981	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.1	-179.1	-62.2	-178.7	170	0	0	113.8
200	L	80.7	Confident	89.1	Confident	167 Å²	167	85.6 Å²	85.6	87%	0.874	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	17.8	178.9	-67	165.2	0	0	0	112.1	G198 E202	G198-L200 PolarHBondContact O-N 3.44Å; G198-L200 VanDerWaalsContact O-N 3.13Å; L200-E202 PolarHBondContact O-N 2.81Å
201	A	81.1	Confident	88.8	Confident	40 Å²	40	85.3 Å²	85.3	33%	0.331	43%	0.433	S	S	.	.			trans	-63.5	123.8	179.1	0	0	0	0	0	110.2	M195 F196 G198	M195-A201 WeakPolarHBondContact O-CB 3.39Å; F196-A201 WeakPolarHBondContact O-CB 3.31Å; G198-A201 VanDerWaalsContact O-CB 3.23Å; G198-A201 WeakPolarHBondContact O-CB 3.11Å; G198-A201 PolarHBondContact O-N 2.81Å
202	E	76.6	Confident	88.7	Confident	127 Å²	127	83.6 Å²	83.6	59%	0.593	42%	0.423	S	S	*	.			trans	-95.7	131.9	173	-64.1	-179.9	151.4	0	0	108.5	L200 K204	L200-E202 PolarHBondContact O-N 2.81Å; E202-K204 HydrophobicContact CB-CD 4.29Å; E202-K204 HydrophobicContact CB-CG 4.26Å; E202-K204 PolarHBondContact O-N 3.32Å; E202-K204 IonicContact OE1-NZ 3.19Å; E202-K204 WeakPolarHBondContact OE2-CE 3.43Å; E202-K204 IonicContact OE2-NZ 2.87Å; E202-K204 PolarHBondContact OE2-NZ 2.81Å
203	D	77.9	Confident	88.5	Confident	143 Å²	143	88.2 Å²	88.2	77%	0.765	44%	0.444	S	S	*	.			trans	-79.6	79.9	176.6	-157.5	19.5	0	0	0	109.7	K182	K182-D203 IonicContact NZ-OD1 3.99Å; K182-D203 PolarHBondContact NZ-OD1 2.82Å
204	K	80.3	Confident	88.5	Confident	110 Å²	110	84.5 Å²	84.5	48%	0.478	43%	0.429	S	S	.	.			trans	-112.3	127.4	176.4	-72.9	176.7	175.9	167.1	0	109.3	E202 E206	E202-K204 HydrophobicContact CB-CD 4.29Å; E202-K204 HydrophobicContact CB-CG 4.26Å; E202-K204 PolarHBondContact O-N 3.32Å; E202-K204 IonicContact OE1-NZ 3.19Å; E202-K204 WeakPolarHBondContact OE2-CE 3.43Å; E202-K204 IonicContact OE2-NZ 2.87Å; E202-K204 PolarHBondContact OE2-NZ 2.81Å; K204-E206 VanDerWaalsContact C-N 3.26Å; K204-E206 PolarHBondContact O-N 2.85Å
205	D	81.9	Confident	88.4	Confident	116 Å²	116	84.2 Å²	84.2	62%	0.62	43%	0.427	S	S	*	.	S	Bend	trans	-73.3	-22.1	173.2	-63.4	-26.4	0	0	0	112	H166	H166-D205 PolarHBondContact N-O 2.8Å
206	E	91.9	Very high	88.5	Confident	85 Å²	85	81.4 Å²	81.4	40%	0.397	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.7	-177.5	-164.7	-177.9	125.9	0	0	112.7	H166 V168 K204 R208	H166-E206 CarbonylContact O-C 3.54Å; H166-E206 VanDerWaalsContact O-CA 3.31Å; H166-E206 WeakPolarHBondContact O-CA 3.41Å; V168-E206 HydrophobicContact CG2-CG 3.72Å; V168-E206 VanDerWaalsContact CG2-OE1 3.24Å; V168-E206 WeakPolarHBondContact CG2-OE1 3.48Å; K204-E206 VanDerWaalsContact C-N 3.26Å; K204-E206 PolarHBondContact O-N 2.85Å; E206-R208 IonicContact OE1-NE 3.33Å
207	I	92.9	Very high	88.6	Confident	28 Å²	28	80.2 Å²	80.2	14%	0.144	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	124	-177.5	-61.5	-179.7	0	0	0	110.1	V165 H166 F167 V168 M195 F196 I209	V165-I207 HydrophobicContact CG2-CD1 3.8Å; V165-I207 HydrophobicContact CG2-CG1 4.18Å; H166-I207 PolarHBondContact O-N 3.38Å; F167-I207 CarbonylContact C-O 3.58Å; F167-I207 VanDerWaalsContact CA-O 3.28Å; F167-I207 WeakPolarHBondContact CA-O 3.5Å; F167-I207 HydrophobicContact CD1-CB 3.81Å; F167-I207 HydrophobicContact CD1-CG2 3.96Å; F167-I207 HydrophobicContact CE1-CB 4.06Å; F167-I207 HydrophobicContact CE1-CD1 4.11Å; F167-I207 HydrophobicContact CE1-CG2 4.1Å; V168-I207 PolarHBondContact N-O 3.18Å; M195-I207 HydrophobicContact CG-CD1 4.23Å; M195-I207 HydrophobicContact SD-CD1 3.61Å; M195-I207 HydrophobicContact SD-CG2 4.27Å; F196-I207 HydrophobicContact CE1-CD1 3.56Å; F196-I207 HydrophobicContact CZ-CD1 4.19Å; I207-I209 HydrophobicContact CG2-CG1 4.36Å
208	R	92.8	Very high	88.7	Confident	196 Å²	196	75.5 Å²	75.5	74%	0.74	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	128.3	-178	-63.9	-174.9	174.8	177.8	-0.5	111.6	V168 E206	V168-R208 HydrophobicContact CB-CG 4.29Å; V168-R208 WeakPolarHBondContact O-CA 3.46Å; E206-R208 IonicContact OE1-NE 3.33Å
209	I	93.7	Very high	89	Confident	4 Å²	4	75.3 Å²	75.3	2%	0.021	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	82.1	179.5	-53.7	166.4	0	0	0	108.4	F167 V168 V169 G170 I207 D211 V212 F217 Y246	F167-I209 HydrophobicContact CB-CD1 4.26Å; F167-I209 HydrophobicContact CD1-CD1 3.47Å; F167-I209 VanDerWaalsContact CD1-CD1 3.47Å; F167-I209 HydrophobicContact CD1-CG1 4.38Å; F167-I209 HydrophobicContact CE1-CD1 4.15Å; F167-I209 HydrophobicContact CG-CD1 4.16Å; V168-I209 PolarHBondContact O-N 3.18Å; V169-I209 WeakPolarHBondContact CA-O 3.42Å; V169-I209 HydrophobicContact CG2-CB 4.33Å; V169-I209 HydrophobicContact CG2-CD1 4.13Å; G170-I209 PolarHBondContact N-O 2.91Å; I207-I209 HydrophobicContact CG2-CG1 4.36Å; I209-D211 VanDerWaalsContact C-N 3.3Å; I209-D211 PolarHBondContact O-N 3.43Å; I209-V212 HydrophobicContact CG2-CB 3.74Å; I209-V212 HydrophobicContact CG2-CG2 3.59Å; I209-F217 HydrophobicContact CD1-CD2 4.19Å; I209-F217 HydrophobicContact CD1-CE1 4.44Å; I209-F217 HydrophobicContact CD1-CE2 3.49Å; I209-F217 VanDerWaalsContact CD1-CE2 3.49Å; I209-F217 HydrophobicContact CD1-CZ 3.64Å; I209-Y246 WeakPolarHBondContact CD1-OH 3.44Å
210	P	92.6	Very high	89.6	Confident	80 Å²	80	65.3 Å²	65.3	52%	0.519	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-16.2	-173.2	30.8	-35.6	0	0	0	114.2	G170	G170-P210 CarbonylContact C-O 3.56Å; G170-P210 WeakPolarHBondContact O-CA 3.34Å
211	D	90.8	Very high	90.3	Very high	63 Å²	63	57.4 Å²	57.4	34%	0.337	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	4.4	-169	67.4	-48.3	0	0	0	114	I209 Y241 K245	I209-D211 VanDerWaalsContact C-N 3.3Å; I209-D211 PolarHBondContact O-N 3.43Å; D211-Y241 WeakPolarHBondContact O-CE1 3.28Å; D211-Y241 PolarHBondContact OD2-OH 3.29Å; D211-K245 IonicContact OD1-NZ 2.91Å; D211-K245 PolarHBondContact OD1-NZ 2.82Å; D211-K245 IonicContact OD2-NZ 3.74Å; D211-K245 PolarHBondContact OD2-NZ 2.87Å
212	V	93	Very high	91	Very high	4 Å²	4	57.1 Å²	57.1	2%	0.024	29%	0.289	C	S	.	.	S	Bend	trans	-121.9	137	176.8	-176.9	0	0	0	0	109	V169 G170 I209 A216 F217 Y241 A242 K245	V169-V212 HydrophobicContact CG1-CB 4.32Å; V169-V212 WeakPolarHBondContact CG1-O 3.48Å; G170-V212 VanDerWaalsContact CA-O 3.31Å; G170-V212 WeakPolarHBondContact CA-O 3.28Å; G170-V212 PolarHBondContact N-O 2.78Å; I209-V212 HydrophobicContact CG2-CB 3.74Å; I209-V212 HydrophobicContact CG2-CG2 3.59Å; V212-A216 HydrophobicContact CG1-CB 4.36Å; V212-F217 HydrophobicContact CG1-CB 3.94Å; V212-F217 HydrophobicContact CG1-CD2 4.39Å; V212-Y241 HydrophobicContact CG2-CD1 4.1Å; V212-Y241 HydrophobicContact CG2-CE1 3.83Å; V212-A242 HydrophobicContact CG1-CB 3.99Å; V212-K245 HydrophobicContact CG2-CD 4.2Å
213	E	92.4	Very high	91.9	Very high	96 Å²	96	52.5 Å²	52.5	45%	0.449	27%	0.267	S	S	.	.			trans	-73.4	140.9	174.4	-65.7	-176.8	178.3	0	0	111.2	A215 A216 F217	E213-A215 VanDerWaalsContact C-N 3.28Å; E213-A215 PolarHBondContact O-N 3.02Å; E213-A216 HydrophobicContact CB-CB 4.47Å; E213-A216 PolarHBondContact O-N 3.06Å; E213-A216 VanDerWaalsContact O-N 3.13Å; E213-F217 PolarHBondContact O-N 3.05Å
214	P	93.8	Very high	92.8	Very high	21 Å²	21	46.6 Å²	46.6	14%	0.136	24%	0.235	C	C	.	.	H	α-helix	trans	-54.6	-40.7	-178.3	-28	34.6	0	0	0	114.2	V169 Q176 A216 F217 L218	V169-P214 HydrophobicContact CG1-CG 4.43Å; Q176-P214 HydrophobicContact CB-CB 3.98Å; Q176-P214 HydrophobicContact CB-CG 3.93Å; Q176-P214 VanDerWaalsContact OE1-CB 3.24Å; P214-A216 PolarHBondContact O-N 3.04Å; P214-F217 PolarHBondContact O-N 3.31Å; P214-L218 WeakPolarHBondContact O-CB 3.31Å; P214-L218 WeakPolarHBondContact O-CG 3.35Å; P214-L218 PolarHBondContact O-N 3.13Å
215	A	93.3	Very high	93.5	Very high	51 Å²	51	41.6 Å²	41.6	42%	0.421	21%	0.213	S	C	.	.	H	α-helix	trans	-62.4	-43.4	179.2	0	0	0	0	0	112.5	E213 L218 A219 T235	E213-A215 VanDerWaalsContact C-N 3.28Å; E213-A215 PolarHBondContact O-N 3.02Å; A215-L218 PolarHBondContact O-N 3.38Å; A215-A219 PolarHBondContact O-N 2.92Å; A215-T235 HydrophobicContact CB-CG2 4.07Å
216	A	94.6	Very high	94.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.9	-40.3	177.3	0	0	0	0	0	112.3	V212 E213 P214 A219 M220 A238	V212-A216 HydrophobicContact CG1-CB 4.36Å; E213-A216 HydrophobicContact CB-CB 4.47Å; E213-A216 PolarHBondContact O-N 3.06Å; E213-A216 VanDerWaalsContact O-N 3.13Å; P214-A216 PolarHBondContact O-N 3.04Å; A216-A219 PolarHBondContact O-N 3.5Å; A216-M220 PolarHBondContact O-N 3.24Å; A216-A238 VanDerWaalsContact CB-C 3.41Å; A216-A238 HydrophobicContact CB-CB 3.59Å
217	F	95.4	Very high	94.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.1	-42.4	175.7	-167.7	-103.2	0	0	0	111.4	F167 V169 L178 F192 I209 V212 E213 P214 M220 L221 Y246	F167-F217 HydrophobicContact CB-CE1 4.05Å; F167-F217 HydrophobicContact CB-CZ 4.35Å; F167-F217 HydrophobicContact CD1-CE1 4.47Å; F167-F217 AromaticContact CD1-CZ 3.98Å; F167-F217 HydrophobicContact CD1-CZ 3.98Å; F167-F217 AromaticContact CD2-CE1 3.89Å; F167-F217 HydrophobicContact CD2-CE1 3.89Å; F167-F217 HydrophobicContact CD2-CZ 4.01Å; F167-F217 HydrophobicContact CE1-CZ 4.23Å; F167-F217 HydrophobicContact CE2-CE1 4.45Å; F167-F217 HydrophobicContact CE2-CZ 4.26Å; F167-F217 AromaticContact CG-CE1 3.87Å; F167-F217 HydrophobicContact CG-CE1 3.87Å; F167-F217 AromaticContact CG-CZ 3.84Å; F167-F217 HydrophobicContact CG-CZ 3.84Å; F167-F217 HydrophobicContact CZ-CZ 4.34Å; V169-F217 HydrophobicContact CG1-CB 3.86Å; V169-F217 HydrophobicContact CG1-CG 4.2Å; V169-F217 HydrophobicContact CG2-CB 4.48Å; V169-F217 HydrophobicContact CG2-CD1 3.72Å; V169-F217 HydrophobicContact CG2-CE1 3.97Å; V169-F217 HydrophobicContact CG2-CG 4.03Å; L178-F217 HydrophobicContact CD1-CD1 3.74Å; L178-F217 HydrophobicContact CD1-CE1 4.39Å; F192-F217 AromaticContact CZ-CE2 4Å; F192-F217 HydrophobicContact CZ-CE2 4Å; F192-F217 HydrophobicContact CZ-CZ 4.02Å; I209-F217 HydrophobicContact CD1-CD2 4.19Å; I209-F217 HydrophobicContact CD1-CE1 4.44Å; I209-F217 HydrophobicContact CD1-CE2 3.49Å; I209-F217 VanDerWaalsContact CD1-CE2 3.49Å; I209-F217 HydrophobicContact CD1-CZ 3.64Å; V212-F217 HydrophobicContact CG1-CB 3.94Å; V212-F217 HydrophobicContact CG1-CD2 4.39Å; E213-F217 PolarHBondContact O-N 3.05Å; P214-F217 PolarHBondContact O-N 3.31Å; F217-M220 HydrophobicContact CD2-CE 3.62Å; F217-M220 HydrophobicContact CE2-CE 3.53Å; F217-M220 HydrophobicContact CG-CE 4.49Å; F217-M220 HydrophobicContact CZ-CE 4.35Å; F217-M220 PolarHBondContact O-N 3.36Å; F217-L221 HydrophobicContact CD1-CD1 3.62Å; F217-L221 HydrophobicContact CD1-CG 3.85Å; F217-L221 HydrophobicContact CE1-CD1 3.46Å; F217-L221 VanDerWaalsContact CE1-CD1 3.46Å; F217-L221 HydrophobicContact CE1-CD2 4.06Å; F217-L221 HydrophobicContact CE1-CG 3.73Å; F217-L221 HydrophobicContact CZ-CD1 4.42Å; F217-L221 HydrophobicContact CZ-CD2 4.25Å; F217-L221 HydrophobicContact CZ-CG 4.3Å; F217-L221 WeakPolarHBondContact O-CB 3.35Å; F217-L221 WeakPolarHBondContact O-CG 3.25Å; F217-L221 PolarHBondContact O-N 3.29Å; F217-Y246 HydrophobicContact CD2-CE2 4.17Å; F217-Y246 AromaticContact CE2-CE2 3.86Å; F217-Y246 HydrophobicContact CE2-CE2 3.86Å; F217-Y246 AromaticContact CE2-CZ 3.96Å
218	L	94.7	Very high	94.1	Very high	19 Å²	19	37.5 Å²	37.5	10%	0.099	19%	0.192	C	C	.	.	H	α-helix	trans	-62.3	-41.7	174.8	-78.1	169.9	0	0	0	112.3	F157 N158 L178 P214 A215 M220 L221 K222	F157-L218 HydrophobicContact CE2-CD2 4.01Å; F157-L218 WeakPolarHBondContact CE2-O 3.33Å; F157-L218 HydrophobicContact CZ-CB 4.31Å; F157-L218 HydrophobicContact CZ-CD2 3.81Å; N158-L218 HydrophobicContact CB-CD2 4.29Å; L178-L218 HydrophobicContact CD1-CD2 3.99Å; L178-L218 HydrophobicContact CD1-CG 3.94Å; L178-L218 HydrophobicContact CD2-CD1 4.37Å; L178-L218 HydrophobicContact CD2-CD2 3.93Å; L178-L218 HydrophobicContact CD2-CG 4.32Å; P214-L218 WeakPolarHBondContact O-CB 3.31Å; P214-L218 WeakPolarHBondContact O-CG 3.35Å; P214-L218 PolarHBondContact O-N 3.13Å; A215-L218 PolarHBondContact O-N 3.38Å; L218-M220 VanDerWaalsContact C-N 3.34Å; L218-M220 PolarHBondContact O-N 2.92Å; L218-L221 PolarHBondContact O-N 3.05Å; L218-K222 WeakPolarHBondContact O-CB 3.24Å; L218-K222 PolarHBondContact O-N 3.47Å
219	A	94.9	Very high	94	Very high	22 Å²	22	31.9 Å²	31.9	18%	0.182	18%	0.176	C	C	.	.	H	α-helix	trans	-60.4	-43.8	175	0	0	0	0	0	111.6	A215 A216 K222 Y223 T239	A215-A219 PolarHBondContact O-N 2.92Å; A216-A219 PolarHBondContact O-N 3.5Å; A219-K222 PolarHBondContact O-N 3.29Å; A219-Y223 PolarHBondContact O-N 2.84Å; A219-Y223 VanDerWaalsContact O-N 3.11Å; A219-T239 HydrophobicContact CB-CG2 4Å
220	M	96.4	Very high	93.7	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-44.1	174.8	-178	-167.9	71.8	0	0	112.5	F192 A216 F217 L218 Y223 I224 A242 Y246 V248 L251	F192-M220 HydrophobicContact CE2-CE 3.99Å; F192-M220 HydrophobicContact CZ-CE 4.09Å; A216-M220 PolarHBondContact O-N 3.24Å; F217-M220 HydrophobicContact CD2-CE 3.62Å; F217-M220 HydrophobicContact CE2-CE 3.53Å; F217-M220 HydrophobicContact CG-CE 4.49Å; F217-M220 HydrophobicContact CZ-CE 4.35Å; F217-M220 PolarHBondContact O-N 3.36Å; L218-M220 VanDerWaalsContact C-N 3.34Å; L218-M220 PolarHBondContact O-N 2.92Å; M220-Y223 WeakPolarHBondContact O-CB 3.15Å; M220-Y223 PolarHBondContact O-N 2.94Å; M220-I224 HydrophobicContact CE-CD1 4.43Å; M220-I224 HydrophobicContact CG-CD1 4.14Å; M220-I224 WeakPolarHBondContact O-CG1 3.44Å; M220-I224 PolarHBondContact O-N 3.04Å; M220-A242 HydrophobicContact CB-CB 4.48Å; M220-A242 HydrophobicContact SD-CB 4.01Å; M220-Y246 HydrophobicContact CE-CD2 3.48Å; M220-Y246 VanDerWaalsContact CE-CD2 3.48Å; M220-Y246 HydrophobicContact CE-CE2 3.97Å; M220-Y246 HydrophobicContact CE-CG 3.88Å; M220-Y246 HydrophobicContact SD-CD2 3.48Å; M220-Y246 WeakPolarHBondContact SD-CD2 3.39Å; M220-Y246 HydrophobicContact SD-CE2 4.43Å; M220-Y246 HydrophobicContact SD-CG 3.85Å; M220-V248 HydrophobicContact CG-CG2 4.27Å; M220-V248 HydrophobicContact SD-CG2 4.3Å; M220-L251 HydrophobicContact CB-CD2 3.89Å; M220-L251 HydrophobicContact CG-CD2 3.92Å
221	L	95.3	Very high	93.7	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-59.8	-46.7	175.6	-78.2	-174.4	0	0	0	110.8	F157 L185 F217 L218 Y223 I224 Y225	F157-L221 HydrophobicContact CD2-CB 4.13Å; F157-L221 HydrophobicContact CE2-CB 3.77Å; L185-L221 HydrophobicContact CD2-CD2 3.33Å; F217-L221 HydrophobicContact CD1-CD1 3.62Å; F217-L221 HydrophobicContact CD1-CG 3.85Å; F217-L221 HydrophobicContact CE1-CD1 3.46Å; F217-L221 VanDerWaalsContact CE1-CD1 3.46Å; F217-L221 HydrophobicContact CE1-CD2 4.06Å; F217-L221 HydrophobicContact CE1-CG 3.73Å; F217-L221 HydrophobicContact CZ-CD1 4.42Å; F217-L221 HydrophobicContact CZ-CD2 4.25Å; F217-L221 HydrophobicContact CZ-CG 4.3Å; F217-L221 WeakPolarHBondContact O-CB 3.35Å; F217-L221 WeakPolarHBondContact O-CG 3.25Å; F217-L221 PolarHBondContact O-N 3.29Å; L218-L221 PolarHBondContact O-N 3.05Å; L221-Y223 VanDerWaalsContact C-N 3.26Å; L221-Y223 PolarHBondContact O-N 3.41Å; L221-I224 PolarHBondContact O-N 3.34Å; L221-Y225 HydrophobicContact CD2-CE2 4.37Å; L221-Y225 WeakPolarHBondContact O-CD2 3.49Å; L221-Y225 PolarHBondContact O-N 3.13Å
222	K	95	Very high	93.6	Very high	34 Å²	34	33.4 Å²	33.4	15%	0.148	19%	0.185	C	C	.	.	H	α-helix	trans	-56.9	-43.9	178.9	-169.1	177.9	177.2	-166.9	0	111	F157 L218 A219 Y225 C226 E228	F157-K222 HydrophobicContact CD1-CG 4.41Å; F157-K222 HydrophobicContact CD2-CB 4.04Å; F157-K222 HydrophobicContact CE1-CB 4.3Å; F157-K222 HydrophobicContact CE1-CD 4.42Å; F157-K222 HydrophobicContact CE1-CG 4.32Å; F157-K222 HydrophobicContact CE2-CB 3.68Å; F157-K222 HydrophobicContact CE2-CG 4.45Å; F157-K222 HydrophobicContact CG-CB 4.49Å; F157-K222 HydrophobicContact CZ-CB 3.82Å; F157-K222 HydrophobicContact CZ-CG 4.33Å; L218-K222 WeakPolarHBondContact O-CB 3.24Å; L218-K222 PolarHBondContact O-N 3.47Å; A219-K222 PolarHBondContact O-N 3.29Å; K222-Y225 PolarHBondContact O-N 3.41Å; K222-C226 PolarHBondContact O-N 3.21Å; K222-C226 PolarHBondContact O-SG 2.83Å; K222-E228 WeakPolarHBondContact CE-OE2 3.1Å; K222-E228 HydrophobicContact CG-CB 4.49Å; K222-E228 IonicContact NZ-OE2 3.88Å; K222-E228 PolarHBondContact NZ-OE2 2.98Å
223	Y	96.6	Very high	93.2	Very high	30 Å²	30	34.3 Å²	34.3	12%	0.118	19%	0.193	C	C	.	.	H	α-helix	trans	-59.7	-48.2	173.3	178.2	-95.4	0	0	0	112.3	A219 M220 L221 Y225 C226 D227 E228 I229 V248 H250 L251	A219-Y223 PolarHBondContact O-N 2.84Å; A219-Y223 VanDerWaalsContact O-N 3.11Å; M220-Y223 WeakPolarHBondContact O-CB 3.15Å; M220-Y223 PolarHBondContact O-N 2.94Å; L221-Y223 VanDerWaalsContact C-N 3.26Å; L221-Y223 PolarHBondContact O-N 3.41Å; Y223-Y225 PolarHBondContact O-N 2.88Å; Y223-C226 PolarHBondContact O-N 2.89Å; Y223-D227 HydrophobicContact CE2-CB 4.42Å; Y223-D227 VanDerWaalsContact O-CA 3.24Å; Y223-D227 WeakPolarHBondContact O-CA 3.32Å; Y223-D227 PolarHBondContact O-N 3.3Å; Y223-E228 WeakPolarHBondContact CA-O 3.48Å; Y223-I229 HydrophobicContact CD2-CD1 4.03Å; Y223-I229 HydrophobicContact CD2-CG1 3.43Å; Y223-I229 VanDerWaalsContact CD2-CG1 3.43Å; Y223-I229 HydrophobicContact CE2-CD1 3.81Å; Y223-I229 HydrophobicContact CE2-CG1 3.74Å; Y223-V248 HydrophobicContact CD1-CG1 3.52Å; Y223-V248 HydrophobicContact CE1-CG1 3.46Å; Y223-V248 VanDerWaalsContact CE1-CG1 3.46Å; Y223-H250 WeakPolarHBondContact OH-CB 3.43Å; Y223-L251 HydrophobicContact CD1-CB 3.94Å; Y223-L251 HydrophobicContact CD1-CD2 4.38Å; Y223-L251 HydrophobicContact CD2-CD1 4.42Å; Y223-L251 HydrophobicContact CE1-CB 4.18Å; Y223-L251 HydrophobicContact CG-CB 4.15Å; Y223-L251 HydrophobicContact CG-CD1 4.27Å; Y223-L251 HydrophobicContact CG-CD2 4.31Å; Y223-L251 HydrophobicContact CG-CG 4.48Å
224	I	96.4	Very high	92.9	Very high	18 Å²	18	34.2 Å²	34.2	9%	0.092	20%	0.196	C	C	.	.	H	α-helix	trans	-59.7	-36	179.1	-72	168.3	0	0	0	112	V184 L185 F192 M220 L221 V248	V184-I224 HydrophobicContact CG1-CG2 4.2Å; L185-I224 HydrophobicContact CD2-CD1 4.45Å; L185-I224 HydrophobicContact CD2-CG2 4.18Å; F192-I224 HydrophobicContact CD2-CD1 4.37Å; F192-I224 HydrophobicContact CE2-CD1 4.06Å; M220-I224 HydrophobicContact CE-CD1 4.43Å; M220-I224 HydrophobicContact CG-CD1 4.14Å; M220-I224 WeakPolarHBondContact O-CG1 3.44Å; M220-I224 PolarHBondContact O-N 3.04Å; L221-I224 PolarHBondContact O-N 3.34Å; I224-V248 HydrophobicContact CD1-CG2 4.25Å; I224-V248 HydrophobicContact CG1-CG2 4.49Å
225	Y	95.5	Very high	92.7	Very high	6 Å²	6	34.4 Å²	34.4	2%	0.024	20%	0.196	C	C	.	.	H	α-helix	trans	-78.9	-38.2	-177.9	-82.7	-112.5	0	0	0	112.8	N153 M156 F157 H181 V184 L185 L221 K222 Y223	N153-Y225 WeakPolarHBondContact CB-O 3.36Å; N153-Y225 WeakPolarHBondContact O-CD1 3.23Å; M156-Y225 HydrophobicContact CB-CD1 4.28Å; M156-Y225 HydrophobicContact CB-CE1 4.11Å; F157-Y225 HydrophobicContact CB-CD1 4.26Å; F157-Y225 HydrophobicContact CB-CG 4.23Å; H181-Y225 PolarHBondContact N-OH 3.49Å; H181-Y225 VanDerWaalsContact N-OH 3.09Å; H181-Y225 AromaticContact ND1-CE1 3.49Å; H181-Y225 WeakPolarHBondContact ND1-CE1 3.29Å; H181-Y225 AromaticContact ND1-CZ 3.56Å; H181-Y225 PolarHBondContact ND1-OH 3.28Å; V184-Y225 HydrophobicContact CB-CE1 4.46Å; V184-Y225 HydrophobicContact CG1-CD1 4.03Å; V184-Y225 HydrophobicContact CG1-CD2 3.94Å; V184-Y225 HydrophobicContact CG1-CE1 4.1Å; V184-Y225 HydrophobicContact CG1-CE2 4.04Å; V184-Y225 HydrophobicContact CG1-CG 3.99Å; L185-Y225 HydrophobicContact CD2-CE2 4.06Å; L221-Y225 HydrophobicContact CD2-CE2 4.37Å; L221-Y225 WeakPolarHBondContact O-CD2 3.49Å; L221-Y225 PolarHBondContact O-N 3.13Å; K222-Y225 PolarHBondContact O-N 3.41Å; Y223-Y225 PolarHBondContact O-N 2.88Å
226	C	93.9	Very high	92.7	Very high	3 Å²	3	32 Å²	32	2%	0.02	18%	0.176	C	C	.	.	H	α-helix	trans	-141.1	11	-168.5	64.9	0	0	0	0	116.6	R150 A154 K222 Y223 E228	R150-C226 VanDerWaalsContact CD-O 3.22Å; R150-C226 WeakPolarHBondContact CD-O 2.97Å; R150-C226 HydrophobicContact CG-CB 3.97Å; R150-C226 VanDerWaalsContact CG-O 3.29Å; R150-C226 WeakPolarHBondContact CG-O 3.5Å; A154-C226 HydrophobicContact CB-CB 3.67Å; K222-C226 PolarHBondContact O-N 3.21Å; K222-C226 PolarHBondContact O-SG 2.83Å; Y223-C226 PolarHBondContact O-N 2.89Å; C226-E228 PolarHBondContact O-N 3.26Å; C226-E228 VanDerWaalsContact O-N 3.16Å
227	D	93.1	Very high	92.6	Very high	77 Å²	77	33.5 Å²	33.5	41%	0.412	19%	0.185	S	C	.	.			trans	56.5	20.3	-176.5	-57.6	-52	0	0	0	114.4	R150 Y223	R150-D227 IonicContact CZ-OD2 2.88Å; R150-D227 VanDerWaalsContact CZ-OD2 3.3Å; R150-D227 IonicContact NE-OD2 3.15Å; R150-D227 IonicContact NH2-OD2 3.06Å; R150-D227 PolarHBondContact NH2-OD2 3.24Å; Y223-D227 HydrophobicContact CE2-CB 4.42Å; Y223-D227 VanDerWaalsContact O-CA 3.24Å; Y223-D227 WeakPolarHBondContact O-CA 3.32Å; Y223-D227 PolarHBondContact O-N 3.3Å
228	E	92.4	Very high	92.4	Very high	62 Å²	62	34.5 Å²	34.5	29%	0.29	19%	0.193	S	C	.	.			trans	-85.2	131.4	175.2	-71.9	-170.9	-177.2	0	0	111.6	H127 K222 Y223 C226	H127-E228 IonicContact CD2-OE1 3.48Å; H127-E228 IonicContact CD2-OE2 2.83Å; H127-E228 PolarHBondContact CD2-OE2 3.46Å; H127-E228 VanDerWaalsContact CD2-OE2 3.28Å; H127-E228 IonicContact CE1-OE1 3.93Å; H127-E228 PolarHBondContact CE1-OE1 3.43Å; H127-E228 IonicContact CE1-OE2 3.4Å; H127-E228 IonicContact NE2-OE1 2.72Å; H127-E228 PolarHBondContact NE2-OE1 2.93Å; H127-E228 IonicContact NE2-OE2 2.66Å; H127-E228 PolarHBondContact NE2-OE2 3.32Å; K222-E228 WeakPolarHBondContact CE-OE2 3.1Å; K222-E228 HydrophobicContact CG-CB 4.49Å; K222-E228 IonicContact NZ-OE2 3.88Å; K222-E228 PolarHBondContact NZ-OE2 2.98Å; Y223-E228 WeakPolarHBondContact CA-O 3.48Å; C226-E228 PolarHBondContact O-N 3.26Å; C226-E228 VanDerWaalsContact O-N 3.16Å
229	I	91.3	Very high	92.4	Very high	78 Å²	78	33.6 Å²	33.6	40%	0.4	19%	0.188	S	C	.	.			trans	-113.1	106.7	-179.9	-60.6	178	0	0	0	107.6	Y223 L231 L251 A254	Y223-I229 HydrophobicContact CD2-CD1 4.03Å; Y223-I229 HydrophobicContact CD2-CG1 3.43Å; Y223-I229 VanDerWaalsContact CD2-CG1 3.43Å; Y223-I229 HydrophobicContact CE2-CD1 3.81Å; Y223-I229 HydrophobicContact CE2-CG1 3.74Å; I229-L231 HydrophobicContact CG2-CD1 3.7Å; I229-L231 HydrophobicContact CG2-CD2 4.2Å; I229-L231 HydrophobicContact CG2-CG 3.56Å; I229-L251 HydrophobicContact CG1-CD1 4.25Å; I229-L251 HydrophobicContact CG2-CD1 4.26Å; I229-A254 HydrophobicContact CD1-CB 3.64Å; I229-A254 HydrophobicContact CG2-CB 4.1Å
230	D	87	Confident	92.4	Very high	111 Å²	111	32.6 Å²	32.6	59%	0.594	18%	0.179	S	C	*	.			trans	-115.6	97.5	174.5	-168.6	6.4	0	0	0	108.1
231	L	91.2	Very high	92.3	Very high	29 Å²	29	36 Å²	36	15%	0.152	19%	0.193	C	C	.	.			trans	-105.9	122.5	-176.1	-62.5	174.9	0	0	0	109.6	I229 V236 T239 L251 A254 C255 F258	I229-L231 HydrophobicContact CG2-CD1 3.7Å; I229-L231 HydrophobicContact CG2-CD2 4.2Å; I229-L231 HydrophobicContact CG2-CG 3.56Å; L231-V236 HydrophobicContact CD2-CG2 4.44Å; L231-T239 HydrophobicContact CD2-CG2 4.05Å; L231-L251 HydrophobicContact CD2-CD1 4.48Å; L231-A254 HydrophobicContact CD1-CB 4.35Å; L231-C255 VanDerWaalsContact CD2-SG 3.56Å; L231-F258 HydrophobicContact CB-CD2 4.08Å; L231-F258 HydrophobicContact CB-CE2 4.37Å; L231-F258 HydrophobicContact CB-CG 4.31Å; L231-F258 HydrophobicContact CD1-CB 3.86Å; L231-F258 HydrophobicContact CD1-CD2 4.46Å; L231-F258 HydrophobicContact CD1-CG 4.28Å
232	A	89.1	Confident	92.3	Very high	39 Å²	39	36 Å²	36	32%	0.322	19%	0.193	S	C	.	.			trans	-108.1	148.2	170.2	0	0	0	0	0	110.3	D234 T235 V236	A232-D234 WeakPolarHBondContact CB-OD1 3.5Å; A232-D234 PolarHBondContact O-N 3.45Å; A232-T235 PolarHBondContact O-N 3.5Å; A232-T235 VanDerWaalsContact O-N 3.1Å; A232-T235 PolarHBondContact O-OG1 3.24Å; A232-V236 WeakPolarHBondContact O-CB 3.19Å; A232-V236 PolarHBondContact O-N 2.86Å
233	A	85.1	Confident	92.4	Very high	23 Å²	23	34.3 Å²	34.3	19%	0.19	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-24.6	-171.5	0	0	0	0	0	114	F110 F258	F110-A233 HydrophobicContact CB-CB 3.63Å; F110-A233 HydrophobicContact CD1-CB 3.75Å; F110-A233 HydrophobicContact CD2-CB 3.42Å; F110-A233 VanDerWaalsContact CD2-CB 3.42Å; F110-A233 HydrophobicContact CE1-CB 4.2Å; F110-A233 HydrophobicContact CE2-CB 3.91Å; F110-A233 HydrophobicContact CG-CB 3.32Å; F110-A233 HydrophobicContact CZ-CB 4.27Å; A233-F258 HydrophobicContact CB-CE1 4.11Å; A233-F258 HydrophobicContact CB-CZ 4.21Å
234	D	85.5	Confident	92.2	Very high	94 Å²	94	35.7 Å²	35.7	50%	0.503	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-25.4	174.6	55.7	-12.3	0	0	0	113.3	A106 A232	A106-D234 HydrophobicContact CB-CB 4.37Å; A232-D234 WeakPolarHBondContact CB-OD1 3.5Å; A232-D234 PolarHBondContact O-N 3.45Å
235	T	90.5	Very high	92.2	Very high	25 Å²	25	38 Å²	38	15%	0.153	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-12	-175	55.7	0	0	0	0	114.2	A215 A232 L237 A238 T239	A215-T235 HydrophobicContact CB-CG2 4.07Å; A232-T235 PolarHBondContact O-N 3.5Å; A232-T235 VanDerWaalsContact O-N 3.1Å; A232-T235 PolarHBondContact O-OG1 3.24Å; T235-L237 VanDerWaalsContact C-N 3.31Å; T235-L237 PolarHBondContact O-N 2.94Å; T235-A238 PolarHBondContact O-N 3.48Å; T235-T239 WeakPolarHBondContact O-CB 3.49Å; T235-T239 PolarHBondContact O-N 3.39Å; T235-T239 PolarHBondContact O-OG1 2.64Å
236	V	93.4	Very high	92.2	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.6	-37.1	-173	62	0	0	0	0	113.3	L231 A232 T239 L240 C255 F258 L259	L231-V236 HydrophobicContact CD2-CG2 4.44Å; A232-V236 WeakPolarHBondContact O-CB 3.19Å; A232-V236 PolarHBondContact O-N 2.86Å; V236-T239 PolarHBondContact O-N 3.33Å; V236-L240 WeakPolarHBondContact O-CB 3.45Å; V236-L240 PolarHBondContact O-N 2.7Å; V236-C255 HydrophobicContact CG2-CB 3.87Å; V236-F258 HydrophobicContact CB-CD1 4.07Å; V236-F258 HydrophobicContact CB-CE1 4.32Å; V236-F258 HydrophobicContact CG1-CD1 4.03Å; V236-F258 HydrophobicContact CG1-CE1 4.1Å; V236-F258 HydrophobicContact CG2-CB 4.33Å; V236-F258 HydrophobicContact CG2-CD1 3.78Å; V236-F258 HydrophobicContact CG2-CG 4.31Å; V236-L259 HydrophobicContact CG1-CD2 3.57Å; V236-L259 HydrophobicContact CG1-CG 4.31Å; V236-L259 HydrophobicContact CG2-CD2 4.32Å; V236-L259 HydrophobicContact CG2-CG 4.16Å
237	L	91.3	Very high	92.3	Very high	33 Å²	33	41.7 Å²	41.7	17%	0.173	22%	0.22	C	C	.	.	H	α-helix	trans	-70.5	-42.9	178.8	-69.9	154.9	0	0	0	111.8	T235 T239 L240 Y241 L259 L271 Q274 F278	T235-L237 VanDerWaalsContact C-N 3.31Å; T235-L237 PolarHBondContact O-N 2.94Å; L237-T239 VanDerWaalsContact C-N 3.28Å; L237-T239 PolarHBondContact O-N 2.84Å; L237-L240 PolarHBondContact O-N 2.65Å; L237-Y241 PolarHBondContact O-N 3.25Å; L237-L259 HydrophobicContact CD2-CD1 3.83Å; L237-L259 HydrophobicContact CD2-CD2 4.23Å; L237-L259 HydrophobicContact CG-CD2 4.32Å; L237-L271 HydrophobicContact CD1-CD2 4.39Å; L237-L271 HydrophobicContact CD2-CD2 4.08Å; L237-Q274 HydrophobicContact CD2-CB 4.28Å; L237-F278 HydrophobicContact CD2-CE2 3.84Å
238	A	92.4	Very high	92.5	Very high	21 Å²	21	38.2 Å²	38.2	17%	0.174	20%	0.202	C	C	.	.	H	α-helix	trans	-65.6	-35.5	174.1	0	0	0	0	0	111.1	A216 T235 Y241 A242	A216-A238 VanDerWaalsContact CB-C 3.41Å; A216-A238 HydrophobicContact CB-CB 3.59Å; T235-A238 PolarHBondContact O-N 3.48Å; A238-Y241 WeakPolarHBondContact O-CB 3.24Å; A238-Y241 PolarHBondContact O-N 2.97Å; A238-A242 PolarHBondContact O-N 2.97Å
239	T	95.3	Very high	92.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-68.4	-40.2	174.9	-53.4	0	0	0	0	111.3	A219 L231 T235 V236 L237 A242 A243 L251	A219-T239 HydrophobicContact CB-CG2 4Å; L231-T239 HydrophobicContact CD2-CG2 4.05Å; T235-T239 WeakPolarHBondContact O-CB 3.49Å; T235-T239 PolarHBondContact O-N 3.39Å; T235-T239 PolarHBondContact O-OG1 2.64Å; V236-T239 PolarHBondContact O-N 3.33Å; L237-T239 VanDerWaalsContact C-N 3.28Å; L237-T239 PolarHBondContact O-N 2.84Å; T239-A242 PolarHBondContact O-N 2.8Å; T239-A243 VanDerWaalsContact O-CB 3.29Å; T239-A243 WeakPolarHBondContact O-CB 3.46Å; T239-A243 PolarHBondContact O-N 3Å; T239-L251 HydrophobicContact CG2-CD1 4.4Å; T239-L251 HydrophobicContact CG2-CD2 4.16Å; T239-L251 HydrophobicContact CG2-CG 4.4Å
240	L	94.8	Very high	92.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61	-43.8	172.6	177.8	57.7	0	0	0	111.4	V236 L237 A243 K244 A252 C255 V256 L259 F278	V236-L240 WeakPolarHBondContact O-CB 3.45Å; V236-L240 PolarHBondContact O-N 2.7Å; L237-L240 PolarHBondContact O-N 2.65Å; L240-A243 PolarHBondContact O-N 3.4Å; L240-K244 HydrophobicContact CD1-CD 4.22Å; L240-K244 HydrophobicContact CD1-CG 4.24Å; L240-K244 HydrophobicContact CG-CD 4.48Å; L240-K244 PolarHBondContact O-N 3.48Å; L240-A252 HydrophobicContact CD1-CB 3.92Å; L240-C255 HydrophobicContact CB-CB 3.83Å; L240-C255 HydrophobicContact CD1-CB 4.04Å; L240-C255 HydrophobicContact CG-CB 4.4Å; L240-V256 HydrophobicContact CD1-CG2 4.01Å; L240-V256 HydrophobicContact CD2-CG2 4.12Å; L240-L259 HydrophobicContact CD2-CD1 3.99Å; L240-F278 HydrophobicContact CD2-CB 4.35Å; L240-F278 HydrophobicContact CD2-CD1 4.4Å; L240-F278 HydrophobicContact CD2-CD2 3.94Å; L240-F278 HydrophobicContact CD2-CE2 4.34Å; L240-F278 HydrophobicContact CD2-CG 3.97Å; L240-F278 HydrophobicContact CG-CD1 4.3Å; L240-F278 HydrophobicContact CG-CG 4.36Å
241	Y	93.3	Very high	93.3	Very high	72 Å²	72	35.6 Å²	35.6	28%	0.282	19%	0.191	S	C	.	.	H	α-helix	trans	-56.5	-52	173.7	178.1	-103.8	0	0	0	111.4	D211 V212 L237 A238 A243 K244 K245 F278	D211-Y241 WeakPolarHBondContact O-CE1 3.28Å; D211-Y241 PolarHBondContact OD2-OH 3.29Å; V212-Y241 HydrophobicContact CG2-CD1 4.1Å; V212-Y241 HydrophobicContact CG2-CE1 3.83Å; L237-Y241 PolarHBondContact O-N 3.25Å; A238-Y241 WeakPolarHBondContact O-CB 3.24Å; A238-Y241 PolarHBondContact O-N 2.97Å; Y241-A243 PolarHBondContact O-N 2.95Å; Y241-K244 PolarHBondContact O-N 2.83Å; Y241-K245 HydrophobicContact CE1-CD 4.07Å; Y241-K245 VanDerWaalsContact O-CB 3.28Å; Y241-K245 WeakPolarHBondContact O-CB 3.44Å; Y241-K245 PolarHBondContact O-N 2.93Å; Y241-F278 HydrophobicContact CD2-CE1 4.14Å; Y241-F278 HydrophobicContact CG-CE1 4.46Å
242	A	95.4	Very high	93.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-47	178.4	0	0	0	0	0	111.7	V212 M220 A238 T239 K244 K245 Y246	V212-A242 HydrophobicContact CG1-CB 3.99Å; M220-A242 HydrophobicContact CB-CB 4.48Å; M220-A242 HydrophobicContact SD-CB 4.01Å; A238-A242 PolarHBondContact O-N 2.97Å; T239-A242 PolarHBondContact O-N 2.8Å; A242-K244 VanDerWaalsContact C-N 3.32Å; A242-K244 PolarHBondContact O-N 3.32Å; A242-K245 PolarHBondContact O-N 3.38Å; A242-Y246 WeakPolarHBondContact O-CD2 3.46Å; A242-Y246 PolarHBondContact O-N 3.34Å
243	A	96.3	Very high	93.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.8	-40.5	179.3	0	0	0	0	0	112.3	T239 L240 Y241 I247 V248 L251 A252	T239-A243 VanDerWaalsContact O-CB 3.29Å; T239-A243 WeakPolarHBondContact O-CB 3.46Å; T239-A243 PolarHBondContact O-N 3Å; L240-A243 PolarHBondContact O-N 3.4Å; Y241-A243 PolarHBondContact O-N 2.95Å; A243-I247 WeakPolarHBondContact O-CA 3.34Å; A243-I247 PolarHBondContact O-N 3.31Å; A243-V248 HydrophobicContact CB-CB 4.45Å; A243-V248 PolarHBondContact O-N 3.24Å; A243-L251 HydrophobicContact CB-CB 4.12Å; A243-L251 HydrophobicContact CB-CD2 3.94Å; A243-L251 HydrophobicContact CB-CG 3.93Å; A243-A252 HydrophobicContact CB-CB 3.95Å
244	K	94.3	Very high	94.2	Very high	58 Å²	58	40.2 Å²	40.2	25%	0.252	20%	0.2	S	C	.	.	H	α-helix	trans	-69.4	-48.1	174.2	-77.3	-178.2	171.7	-108	0	111.8	L240 Y241 A242 Y246 I247 A252 F278 E280	L240-K244 HydrophobicContact CD1-CD 4.22Å; L240-K244 HydrophobicContact CD1-CG 4.24Å; L240-K244 HydrophobicContact CG-CD 4.48Å; L240-K244 PolarHBondContact O-N 3.48Å; Y241-K244 PolarHBondContact O-N 2.83Å; A242-K244 VanDerWaalsContact C-N 3.32Å; A242-K244 PolarHBondContact O-N 3.32Å; K244-Y246 VanDerWaalsContact C-N 3.26Å; K244-Y246 PolarHBondContact O-N 3.42Å; K244-I247 PolarHBondContact O-N 3.1Å; K244-A252 HydrophobicContact CG-CB 4.32Å; K244-F278 HydrophobicContact CD-CB 4.38Å; K244-F278 HydrophobicContact CD-CD1 4.26Å; K244-F278 WeakPolarHBondContact CE-O 3.38Å; K244-F278 PolarHBondContact NZ-O 3.34Å; K244-E280 WeakPolarHBondContact CE-OE1 3.42Å; K244-E280 IonicContact NZ-OE1 3.71Å; K244-E280 PolarHBondContact NZ-OE1 3.21Å
245	K	94.9	Very high	94.6	Very high	67 Å²	67	35.7 Å²	35.7	29%	0.291	18%	0.176	S	C	.	.	H	α-helix	trans	-55.2	-40.8	179.8	177.7	173	177	170.8	0	112.4	D211 V212 Y241 A242	D211-K245 IonicContact OD1-NZ 2.91Å; D211-K245 PolarHBondContact OD1-NZ 2.82Å; D211-K245 IonicContact OD2-NZ 3.74Å; D211-K245 PolarHBondContact OD2-NZ 2.87Å; V212-K245 HydrophobicContact CG2-CD 4.2Å; Y241-K245 HydrophobicContact CE1-CD 4.07Å; Y241-K245 VanDerWaalsContact O-CB 3.28Å; Y241-K245 WeakPolarHBondContact O-CB 3.44Å; Y241-K245 PolarHBondContact O-N 2.93Å; A242-K245 PolarHBondContact O-N 3.38Å
246	Y	96.3	Very high	94.7	Very high	5 Å²	5	35 Å²	35	2%	0.02	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	8.8	179.3	-67.3	-78.3	0	0	0	113.7	S189 V191 F192 I209 F217 M220 A242 K244	S189-Y246 WeakPolarHBondContact CB-O 3.42Å; S189-Y246 PolarHBondContact OG-O 3.49Å; V191-Y246 HydrophobicContact CB-CD1 4.17Å; V191-Y246 HydrophobicContact CG1-CD1 3.89Å; V191-Y246 HydrophobicContact CG1-CE1 4.3Å; F192-Y246 HydrophobicContact CD1-CD1 4.2Å; F192-Y246 HydrophobicContact CD1-CE1 4.16Å; F192-Y246 HydrophobicContact CD2-CD1 4.25Å; F192-Y246 AromaticContact CE1-CD1 3.68Å; F192-Y246 HydrophobicContact CE1-CD1 3.68Å; F192-Y246 AromaticContact CE1-CE1 3.38Å; F192-Y246 HydrophobicContact CE1-CE1 3.38Å; F192-Y246 AromaticContact CE2-CD1 3.72Å; F192-Y246 HydrophobicContact CE2-CD1 3.72Å; F192-Y246 HydrophobicContact CE2-CE1 4.2Å; F192-Y246 HydrophobicContact CE2-CG 4.11Å; F192-Y246 HydrophobicContact CG-CD1 4.45Å; F192-Y246 AromaticContact CZ-CD1 3.4Å; F192-Y246 HydrophobicContact CZ-CD1 3.4Å; F192-Y246 VanDerWaalsContact CZ-CD1 3.4Å; F192-Y246 AromaticContact CZ-CE1 3.39Å; F192-Y246 HydrophobicContact CZ-CE1 3.39Å; F192-Y246 HydrophobicContact CZ-CG 4.03Å; F192-Y246 AromaticContact CZ-CZ 4Å; I209-Y246 WeakPolarHBondContact CD1-OH 3.44Å; F217-Y246 HydrophobicContact CD2-CE2 4.17Å; F217-Y246 AromaticContact CE2-CE2 3.86Å; F217-Y246 HydrophobicContact CE2-CE2 3.86Å; F217-Y246 AromaticContact CE2-CZ 3.96Å; M220-Y246 HydrophobicContact CE-CD2 3.48Å; M220-Y246 VanDerWaalsContact CE-CD2 3.48Å; M220-Y246 HydrophobicContact CE-CE2 3.97Å; M220-Y246 HydrophobicContact CE-CG 3.88Å; M220-Y246 HydrophobicContact SD-CD2 3.48Å; M220-Y246 WeakPolarHBondContact SD-CD2 3.39Å; M220-Y246 HydrophobicContact SD-CE2 4.43Å; M220-Y246 HydrophobicContact SD-CG 3.85Å; A242-Y246 WeakPolarHBondContact O-CD2 3.46Å; A242-Y246 PolarHBondContact O-N 3.34Å; K244-Y246 VanDerWaalsContact C-N 3.26Å; K244-Y246 PolarHBondContact O-N 3.42Å
247	I	96.4	Very high	94.7	Very high	82 Å²	82	38.9 Å²	38.9	42%	0.421	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	62.3	176.8	-48.3	175.9	0	0	0	111	V191 A243 K244 P249	V191-I247 HydrophobicContact CG2-CB 4.27Å; V191-I247 HydrophobicContact CG2-CD1 3.68Å; V191-I247 HydrophobicContact CG2-CG1 3.72Å; A243-I247 WeakPolarHBondContact O-CA 3.34Å; A243-I247 PolarHBondContact O-N 3.31Å; K244-I247 PolarHBondContact O-N 3.1Å; I247-P249 HydrophobicContact CG2-CG 4.43Å; I247-P249 WeakPolarHBondContact O-CD 3.42Å
248	V	96.9	Very high	94.7	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.024	20%	0.197	C	C	.	.			trans	-113.6	79.3	173.9	-171.5	0	0	0	0	107.9	M220 Y223 I224 A243 H250 L251 A252	M220-V248 HydrophobicContact CG-CG2 4.27Å; M220-V248 HydrophobicContact SD-CG2 4.3Å; Y223-V248 HydrophobicContact CD1-CG1 3.52Å; Y223-V248 HydrophobicContact CE1-CG1 3.46Å; Y223-V248 VanDerWaalsContact CE1-CG1 3.46Å; I224-V248 HydrophobicContact CD1-CG2 4.25Å; I224-V248 HydrophobicContact CG1-CG2 4.49Å; A243-V248 HydrophobicContact CB-CB 4.45Å; A243-V248 PolarHBondContact O-N 3.24Å; V248-H250 VanDerWaalsContact C-N 3.35Å; V248-H250 PolarHBondContact O-N 2.95Å; V248-L251 HydrophobicContact CB-CB 4.35Å; V248-L251 HydrophobicContact CG1-CB 3.72Å; V248-L251 HydrophobicContact CG1-CD2 4.47Å; V248-L251 PolarHBondContact O-N 3.15Å; V248-A252 PolarHBondContact O-N 3.36Å
249	P	94.9	Very high	94.7	Very high	76 Å²	76	39.2 Å²	39.2	49%	0.494	19%	0.188	S	C	.	.	H	α-helix	trans	-67.9	-32.7	-161.7	-21.9	35.1	0	0	0	113.8	I247 A252 R253	I247-P249 HydrophobicContact CG2-CG 4.43Å; I247-P249 WeakPolarHBondContact O-CD 3.42Å; P249-A252 PolarHBondContact O-N 3.2Å; P249-R253 WeakPolarHBondContact O-CB 3.38Å; P249-R253 PolarHBondContact O-N 3.46Å
250	H	95.4	Very high	94.4	Very high	118 Å²	118	41.4 Å²	41.4	55%	0.546	20%	0.199	S	C	.	.	H	α-helix	trans	-68.9	-40.4	179.5	-68.4	-67.5	0	0	0	112.1	Y223 V248 R253 A254	Y223-H250 WeakPolarHBondContact OH-CB 3.43Å; V248-H250 VanDerWaalsContact C-N 3.35Å; V248-H250 PolarHBondContact O-N 2.95Å; H250-R253 PolarHBondContact O-N 3.2Å; H250-A254 PolarHBondContact O-N 3.41Å
251	L	96.4	Very high	94.1	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-66.2	-44.2	172.5	-179.2	61.9	0	0	0	110.9	M220 Y223 I229 L231 T239 A243 V248 R253 A254 C255	M220-L251 HydrophobicContact CB-CD2 3.89Å; M220-L251 HydrophobicContact CG-CD2 3.92Å; Y223-L251 HydrophobicContact CD1-CB 3.94Å; Y223-L251 HydrophobicContact CD1-CD2 4.38Å; Y223-L251 HydrophobicContact CD2-CD1 4.42Å; Y223-L251 HydrophobicContact CE1-CB 4.18Å; Y223-L251 HydrophobicContact CG-CB 4.15Å; Y223-L251 HydrophobicContact CG-CD1 4.27Å; Y223-L251 HydrophobicContact CG-CD2 4.31Å; Y223-L251 HydrophobicContact CG-CG 4.48Å; I229-L251 HydrophobicContact CG1-CD1 4.25Å; I229-L251 HydrophobicContact CG2-CD1 4.26Å; L231-L251 HydrophobicContact CD2-CD1 4.48Å; T239-L251 HydrophobicContact CG2-CD1 4.4Å; T239-L251 HydrophobicContact CG2-CD2 4.16Å; T239-L251 HydrophobicContact CG2-CG 4.4Å; A243-L251 HydrophobicContact CB-CB 4.12Å; A243-L251 HydrophobicContact CB-CD2 3.94Å; A243-L251 HydrophobicContact CB-CG 3.93Å; V248-L251 HydrophobicContact CB-CB 4.35Å; V248-L251 HydrophobicContact CG1-CB 3.72Å; V248-L251 HydrophobicContact CG1-CD2 4.47Å; V248-L251 PolarHBondContact O-N 3.15Å; L251-R253 VanDerWaalsContact C-N 3.32Å; L251-R253 PolarHBondContact O-N 2.93Å; L251-A254 PolarHBondContact O-N 3.42Å; L251-A254 VanDerWaalsContact O-N 3.13Å; L251-C255 PolarHBondContact O-N 2.63Å; L251-C255 PolarHBondContact O-SG 2.7Å
252	A	94.9	Very high	94	Very high	11 Å²	11	44.8 Å²	44.8	9%	0.091	23%	0.228	C	C	.	.	H	α-helix	trans	-57.2	-45.6	176.5	0	0	0	0	0	111.7	L240 A243 K244 V248 P249 A254 C255 V256	L240-A252 HydrophobicContact CD1-CB 3.92Å; A243-A252 HydrophobicContact CB-CB 3.95Å; K244-A252 HydrophobicContact CG-CB 4.32Å; V248-A252 PolarHBondContact O-N 3.36Å; P249-A252 PolarHBondContact O-N 3.2Å; A252-A254 PolarHBondContact O-N 2.84Å; A252-C255 WeakPolarHBondContact O-CB 3.39Å; A252-C255 PolarHBondContact O-N 3.41Å; A252-V256 WeakPolarHBondContact O-CG2 3.41Å; A252-V256 PolarHBondContact O-N 3.05Å
253	R	94.1	Very high	93.8	Very high	154 Å²	154	45.2 Å²	45.2	58%	0.581	23%	0.23	S	C	*	.	H	α-helix	trans	-61.2	-41.9	175.4	-173.5	-179.2	-61.4	161.8	2.9	112.3	P249 H250 L251 C255 V256 N257	P249-R253 WeakPolarHBondContact O-CB 3.38Å; P249-R253 PolarHBondContact O-N 3.46Å; H250-R253 PolarHBondContact O-N 3.2Å; L251-R253 VanDerWaalsContact C-N 3.32Å; L251-R253 PolarHBondContact O-N 2.93Å; R253-C255 VanDerWaalsContact C-N 3.33Å; R253-C255 PolarHBondContact O-N 2.95Å; R253-V256 PolarHBondContact O-N 2.85Å; R253-N257 WeakPolarHBondContact O-CB 3.4Å; R253-N257 VanDerWaalsContact O-CG 3.23Å; R253-N257 PolarHBondContact O-N 3.48Å; R253-N257 PolarHBondContact O-OD1 3.03Å
254	A	95.1	Very high	93.6	Very high	22 Å²	22	47.1 Å²	47.1	18%	0.182	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-39.7	176.8	0	0	0	0	0	112.1	I229 L231 H250 L251 A252 N257 F258	I229-A254 HydrophobicContact CD1-CB 3.64Å; I229-A254 HydrophobicContact CG2-CB 4.1Å; L231-A254 HydrophobicContact CD1-CB 4.35Å; H250-A254 PolarHBondContact O-N 3.41Å; L251-A254 PolarHBondContact O-N 3.42Å; L251-A254 VanDerWaalsContact O-N 3.13Å; A252-A254 PolarHBondContact O-N 2.84Å; A254-N257 PolarHBondContact O-N 3.5Å; A254-F258 WeakPolarHBondContact O-CB 3.49Å; A254-F258 PolarHBondContact O-N 3.46Å
255	C	94.8	Very high	93.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-46.4	172.9	-65	0	0	0	0	111.9	L231 V236 L240 L251 A252 R253 F258 L259	L231-C255 VanDerWaalsContact CD2-SG 3.56Å; V236-C255 HydrophobicContact CG2-CB 3.87Å; L240-C255 HydrophobicContact CB-CB 3.83Å; L240-C255 HydrophobicContact CD1-CB 4.04Å; L240-C255 HydrophobicContact CG-CB 4.4Å; L251-C255 PolarHBondContact O-N 2.63Å; L251-C255 PolarHBondContact O-SG 2.7Å; A252-C255 WeakPolarHBondContact O-CB 3.39Å; A252-C255 PolarHBondContact O-N 3.41Å; R253-C255 VanDerWaalsContact C-N 3.33Å; R253-C255 PolarHBondContact O-N 2.95Å; C255-F258 WeakPolarHBondContact O-CB 3.05Å; C255-F258 PolarHBondContact O-N 3Å; C255-L259 WeakPolarHBondContact O-CG 3.42Å; C255-L259 PolarHBondContact O-N 3.23Å
256	V	93	Very high	93.4	Very high	11 Å²	11	48.6 Å²	48.6	7%	0.067	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-46.5	177.6	174.4	0	0	0	0	110.9	L240 A252 R253 F258 L259 E260 E280	L240-V256 HydrophobicContact CD1-CG2 4.01Å; L240-V256 HydrophobicContact CD2-CG2 4.12Å; A252-V256 WeakPolarHBondContact O-CG2 3.41Å; A252-V256 PolarHBondContact O-N 3.05Å; R253-V256 PolarHBondContact O-N 2.85Å; V256-F258 VanDerWaalsContact C-N 3.28Å; V256-F258 PolarHBondContact O-N 3.31Å; V256-L259 WeakPolarHBondContact O-CA 3.38Å; V256-L259 WeakPolarHBondContact O-CB 3.31Å; V256-L259 PolarHBondContact O-N 3.04Å; V256-E260 HydrophobicContact CG1-CG 4.31Å; V256-E260 WeakPolarHBondContact O-CG 3.42Å; V256-E260 PolarHBondContact O-N 2.83Å; V256-E280 HydrophobicContact CG2-CG 4.01Å
257	N	92	Very high	93.2	Very high	81 Å²	81	48.4 Å²	48.4	43%	0.433	25%	0.251	S	S	.	.	H	α-helix	trans	-59.9	-38.3	176.8	-69.8	-6.6	0	0	0	112.4	R253 A254 E260 T261	R253-N257 WeakPolarHBondContact O-CB 3.4Å; R253-N257 VanDerWaalsContact O-CG 3.23Å; R253-N257 PolarHBondContact O-N 3.48Å; R253-N257 PolarHBondContact O-OD1 3.03Å; A254-N257 PolarHBondContact O-N 3.5Å; N257-E260 PolarHBondContact O-N 3.21Å; N257-T261 WeakPolarHBondContact O-CB 3.49Å; N257-T261 WeakPolarHBondContact O-CG2 3.16Å; N257-T261 PolarHBondContact O-N 3.17Å; N257-T261 PolarHBondContact O-OG1 3.23Å
258	F	92.6	Very high	93.1	Very high	60 Å²	60	44.5 Å²	44.5	26%	0.263	23%	0.231	S	C	.	.	H	α-helix	trans	-64.1	-41.8	174.3	-178.3	-82.8	0	0	0	111.6	L231 A233 V236 A254 C255 V256 T261 S262	L231-F258 HydrophobicContact CB-CD2 4.08Å; L231-F258 HydrophobicContact CB-CE2 4.37Å; L231-F258 HydrophobicContact CB-CG 4.31Å; L231-F258 HydrophobicContact CD1-CB 3.86Å; L231-F258 HydrophobicContact CD1-CD2 4.46Å; L231-F258 HydrophobicContact CD1-CG 4.28Å; A233-F258 HydrophobicContact CB-CE1 4.11Å; A233-F258 HydrophobicContact CB-CZ 4.21Å; V236-F258 HydrophobicContact CB-CD1 4.07Å; V236-F258 HydrophobicContact CB-CE1 4.32Å; V236-F258 HydrophobicContact CG1-CD1 4.03Å; V236-F258 HydrophobicContact CG1-CE1 4.1Å; V236-F258 HydrophobicContact CG2-CB 4.33Å; V236-F258 HydrophobicContact CG2-CD1 3.78Å; V236-F258 HydrophobicContact CG2-CG 4.31Å; A254-F258 WeakPolarHBondContact O-CB 3.49Å; A254-F258 PolarHBondContact O-N 3.46Å; C255-F258 WeakPolarHBondContact O-CB 3.05Å; C255-F258 PolarHBondContact O-N 3Å; V256-F258 VanDerWaalsContact C-N 3.28Å; V256-F258 PolarHBondContact O-N 3.31Å; F258-T261 WeakPolarHBondContact CA-OG1 3.17Å; F258-T261 PolarHBondContact O-N 3.32Å; F258-T261 PolarHBondContact O-OG1 2.86Å; F258-S262 WeakPolarHBondContact O-CB 3.36Å; F258-S262 PolarHBondContact O-N 3.29Å; F258-S262 PolarHBondContact O-OG 3.39Å
259	L	92.2	Very high	93	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.1	-42.2	176.1	-69.6	174.2	0	0	0	111.8	V236 L237 L240 C255 V256 T261 S262 L263 L271 L283	V236-L259 HydrophobicContact CG1-CD2 3.57Å; V236-L259 HydrophobicContact CG1-CG 4.31Å; V236-L259 HydrophobicContact CG2-CD2 4.32Å; V236-L259 HydrophobicContact CG2-CG 4.16Å; L237-L259 HydrophobicContact CD2-CD1 3.83Å; L237-L259 HydrophobicContact CD2-CD2 4.23Å; L237-L259 HydrophobicContact CG-CD2 4.32Å; L240-L259 HydrophobicContact CD2-CD1 3.99Å; C255-L259 WeakPolarHBondContact O-CG 3.42Å; C255-L259 PolarHBondContact O-N 3.23Å; V256-L259 WeakPolarHBondContact O-CA 3.38Å; V256-L259 WeakPolarHBondContact O-CB 3.31Å; V256-L259 PolarHBondContact O-N 3.04Å; L259-T261 PolarHBondContact O-N 2.94Å; L259-S262 PolarHBondContact O-N 2.76Å; L259-S262 PolarHBondContact O-OG 3.06Å; L259-L263 WeakPolarHBondContact O-CB 3.28Å; L259-L263 PolarHBondContact O-N 3.26Å; L259-L271 HydrophobicContact CD2-CD2 3.7Å; L259-L283 HydrophobicContact CB-CD1 4.27Å; L259-L283 HydrophobicContact CB-CD2 4.29Å; L259-L283 HydrophobicContact CD1-CD2 4.05Å
260	E	89.4	Confident	92.8	Very high	46 Å²	46	41.9 Å²	41.9	22%	0.215	21%	0.213	C	C	.	.	H	α-helix	trans	-66	-36.3	178.2	-72	-174.2	162.2	0	0	113.3	V256 N257 L263 L283	V256-E260 HydrophobicContact CG1-CG 4.31Å; V256-E260 WeakPolarHBondContact O-CG 3.42Å; V256-E260 PolarHBondContact O-N 2.83Å; N257-E260 PolarHBondContact O-N 3.21Å; E260-L263 WeakPolarHBondContact O-CB 3.44Å; E260-L283 HydrophobicContact CG-CD1 3.8Å
261	T	87.8	Confident	92.7	Very high	114 Å²	114	36.4 Å²	36.4	70%	0.699	19%	0.188	S	C	*	.	H	α-helix	trans	-78.3	-24.6	178.8	49.8	0	0	0	0	113.1	N257 F258 L259	N257-T261 WeakPolarHBondContact O-CB 3.49Å; N257-T261 WeakPolarHBondContact O-CG2 3.16Å; N257-T261 PolarHBondContact O-N 3.17Å; N257-T261 PolarHBondContact O-OG1 3.23Å; F258-T261 WeakPolarHBondContact CA-OG1 3.17Å; F258-T261 PolarHBondContact O-N 3.32Å; F258-T261 PolarHBondContact O-OG1 2.86Å; L259-T261 PolarHBondContact O-N 2.94Å
262	S	89.9	Confident	92.5	Very high	29 Å²	29	36.4 Å²	36.4	20%	0.203	19%	0.188	C	C	.	.	H	α-helix	trans	-95.1	-0.5	175.1	62.4	0	0	0	0	113.6	F258 L259 S264 N267	F258-S262 WeakPolarHBondContact O-CB 3.36Å; F258-S262 PolarHBondContact O-N 3.29Å; F258-S262 PolarHBondContact O-OG 3.39Å; L259-S262 PolarHBondContact O-N 2.76Å; L259-S262 PolarHBondContact O-OG 3.06Å; S262-S264 PolarHBondContact O-N 2.76Å; S262-N267 PolarHBondContact O-ND2 3.26Å
263	L	91.4	Very high	92.2	Very high	9 Å²	9	37.1 Å²	37.1	5%	0.047	19%	0.192	C	C	.	.			trans	-64.5	128.3	179.5	-177.3	65.8	0	0	0	111	L259 E260 A268 L271 R286 V290	L259-L263 WeakPolarHBondContact O-CB 3.28Å; L259-L263 PolarHBondContact O-N 3.26Å; E260-L263 WeakPolarHBondContact O-CB 3.44Å; L263-A268 HydrophobicContact CD1-CB 3.86Å; L263-L271 HydrophobicContact CD1-CD1 3.7Å; L263-R286 HydrophobicContact CD2-CB 3.73Å; L263-V290 HydrophobicContact CD2-CG2 3.77Å; L263-V290 HydrophobicContact CG-CG2 4.01Å
264	S	92.2	Very high	91.7	Very high	41 Å²	41	32.2 Å²	32.2	29%	0.287	18%	0.176	S	C	.	.			trans	-149.3	166.1	177.5	68.4	0	0	0	0	110.2	S262 K266 N267 A268	S262-S264 PolarHBondContact O-N 2.76Å; S264-K266 PolarHBondContact O-N 2.85Å; S264-N267 PolarHBondContact N-OD1 2.92Å; S264-N267 PolarHBondContact O-N 2.87Å; S264-N267 VanDerWaalsContact O-N 3.11Å; S264-N267 PolarHBondContact O-OD1 3.22Å; S264-N267 PolarHBondContact OG-OD1 3.48Å; S264-A268 VanDerWaalsContact O-CB 3.29Å; S264-A268 WeakPolarHBondContact O-CB 3.19Å; S264-A268 PolarHBondContact O-N 2.81Å
265	A	92.8	Very high	91.2	Very high	6 Å²	6	31.2 Å²	31.2	5%	0.05	17%	0.168	C	C	.	.	H	α-helix	trans	-52.2	-32.3	176.2	0	0	0	0	0	113.2	N267 V290 Q294 L297 A298	A265-N267 PolarHBondContact O-N 2.87Å; A265-V290 HydrophobicContact CB-CG1 4.37Å; A265-Q294 HydrophobicContact CB-CB 3.93Å; A265-L297 HydrophobicContact CB-CB 3.64Å; A265-A298 HydrophobicContact CB-CB 4.26Å; A265-A298 VanDerWaalsContact O-CA 3.29Å; A265-A298 WeakPolarHBondContact O-CA 3.38Å
266	K	92.2	Very high	90.2	Very high	149 Å²	149	35.1 Å²	35.1	65%	0.648	19%	0.194	S	C	*	.	H	α-helix	trans	-67.7	-32	-178	-64.3	-174.2	177.8	-173.2	0	114.3	S264 S301	S264-K266 PolarHBondContact O-N 2.85Å; K266-S301 PolarHBondContact O-OG 3.12Å
267	N	92.6	Very high	89.5	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.011	22%	0.217	C	C	.	.	H	α-helix	trans	-114.8	-9	-175.6	66.3	8.1	0	0	0	113.4	I109 F110 S262 S264 A265 C269 V270 L271	I109-N267 HydrophobicContact CG2-CB 3.48Å; I109-N267 VanDerWaalsContact CG2-CB 3.48Å; F110-N267 WeakPolarHBondContact CE1-ND2 3.48Å; S262-N267 PolarHBondContact O-ND2 3.26Å; S264-N267 PolarHBondContact N-OD1 2.92Å; S264-N267 PolarHBondContact O-N 2.87Å; S264-N267 VanDerWaalsContact O-N 3.11Å; S264-N267 PolarHBondContact O-OD1 3.22Å; S264-N267 PolarHBondContact OG-OD1 3.48Å; A265-N267 PolarHBondContact O-N 2.87Å; N267-C269 VanDerWaalsContact C-N 3.3Å; N267-C269 PolarHBondContact O-N 3.28Å; N267-V270 PolarHBondContact O-N 2.83Å; N267-L271 HydrophobicContact CB-CD1 4.44Å; N267-L271 WeakPolarHBondContact O-CG 3.46Å; N267-L271 PolarHBondContact O-N 3.33Å
268	A	94.6	Very high	89.1	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.1	-38.9	-175.5	0	0	0	0	0	113.2	L263 S264 L272 V290 I291	L263-A268 HydrophobicContact CD1-CB 3.86Å; S264-A268 VanDerWaalsContact O-CB 3.29Å; S264-A268 WeakPolarHBondContact O-CB 3.19Å; S264-A268 PolarHBondContact O-N 2.81Å; A268-L272 WeakPolarHBondContact O-CB 3.48Å; A268-L272 PolarHBondContact O-N 3.43Å; A268-V290 HydrophobicContact CB-CB 4.29Å; A268-V290 HydrophobicContact CB-CG1 3.94Å; A268-I291 HydrophobicContact CB-CD1 4.24Å; A268-I291 HydrophobicContact CB-CG1 3.76Å
269	C	94.3	Very high	88.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.8	-42.7	178.8	-61.7	0	0	0	0	112.4	N267 L272 S273 F304 I307	N267-C269 VanDerWaalsContact C-N 3.3Å; N267-C269 PolarHBondContact O-N 3.28Å; C269-L272 PolarHBondContact O-N 3.07Å; C269-S273 PolarHBondContact O-N 3.17Å; C269-F304 HydrophobicContact CB-CD2 4.42Å; C269-I307 HydrophobicContact CB-CG2 3.76Å; C269-I307 WeakPolarHBondContact O-CG2 3.32Å
270	V	91.3	Very high	88.4	Confident	24 Å²	24	43.7 Å²	43.7	15%	0.145	23%	0.234	C	C	.	.	H	α-helix	trans	-69	-46.7	178.1	-179.3	0	0	0	0	110.3	N267 L272 S273 Q274 G303 D306	N267-V270 PolarHBondContact O-N 2.83Å; V270-L272 VanDerWaalsContact C-N 3.26Å; V270-L272 PolarHBondContact O-N 2.97Å; V270-S273 PolarHBondContact O-N 2.93Å; V270-Q274 WeakPolarHBondContact O-CG 3.29Å; V270-Q274 PolarHBondContact O-N 2.95Å; V270-G303 VanDerWaalsContact CG2-CA 3.45Å; V270-G303 WeakPolarHBondContact CG2-O 3.47Å; V270-D306 HydrophobicContact CG2-CB 4.08Å
271	L	92.2	Very high	88.3	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-34	177.3	-70.9	178.9	0	0	0	112	L237 L259 L263 N267 Q274 S275	L237-L271 HydrophobicContact CD1-CD2 4.39Å; L237-L271 HydrophobicContact CD2-CD2 4.08Å; L259-L271 HydrophobicContact CD2-CD2 3.7Å; L263-L271 HydrophobicContact CD1-CD1 3.7Å; N267-L271 HydrophobicContact CB-CD1 4.44Å; N267-L271 WeakPolarHBondContact O-CG 3.46Å; N267-L271 PolarHBondContact O-N 3.33Å; L271-Q274 PolarHBondContact O-N 2.89Å; L271-S275 WeakPolarHBondContact O-CB 3.35Å; L271-S275 PolarHBondContact O-N 2.79Å; L271-S275 PolarHBondContact O-OG 3.33Å
272	L	92.6	Very high	88.3	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-60.9	-54	174.1	176.1	66.2	0	0	0	111.1	A268 C269 V270 Q274 S275 C276 T284 C287 W288 I291 T311 I315	A268-L272 WeakPolarHBondContact O-CB 3.48Å; A268-L272 PolarHBondContact O-N 3.43Å; C269-L272 PolarHBondContact O-N 3.07Å; V270-L272 VanDerWaalsContact C-N 3.26Å; V270-L272 PolarHBondContact O-N 2.97Å; L272-Q274 PolarHBondContact O-N 3.46Å; L272-S275 PolarHBondContact O-N 3.4Å; L272-S275 PolarHBondContact O-OG 2.91Å; L272-C276 PolarHBondContact O-N 3.2Å; L272-C276 PolarHBondContact O-SG 3.15Å; L272-T284 HydrophobicContact CD1-CG2 3.79Å; L272-C287 HydrophobicContact CB-CB 3.97Å; L272-C287 HydrophobicContact CD1-CB 4.16Å; L272-W288 HydrophobicContact CD1-CD2 4.06Å; L272-W288 HydrophobicContact CD1-CG 4.37Å; L272-W288 HydrophobicContact CD1-CZ2 3.89Å; L272-W288 HydrophobicContact CD2-CD2 4.1Å; L272-W288 HydrophobicContact CD2-CE3 4.01Å; L272-W288 HydrophobicContact CD2-CH2 3.38Å; L272-W288 HydrophobicContact CD2-CZ2 3.47Å; L272-W288 VanDerWaalsContact CD2-CZ2 3.47Å; L272-W288 HydrophobicContact CD2-CZ3 3.66Å; L272-W288 HydrophobicContact CG-CZ2 4.22Å; L272-I291 HydrophobicContact CB-CD1 4.18Å; L272-I291 HydrophobicContact CD2-CD1 3.67Å; L272-I291 HydrophobicContact CG-CD1 4.49Å; L272-T311 HydrophobicContact CD2-CG2 3.86Å; L272-T311 HydrophobicContact CG-CG2 4.23Å; L272-I315 HydrophobicContact CD2-CG1 4.39Å
273	S	88.2	Confident	88.3	Confident	25 Å²	25	44.6 Å²	44.6	18%	0.175	24%	0.238	C	C	.	.	H	α-helix	trans	-54.5	-39.6	177.9	175.1	0	0	0	0	111.5	C269 V270 D308	C269-S273 PolarHBondContact O-N 3.17Å; V270-S273 PolarHBondContact O-N 2.93Å; S273-D308 WeakPolarHBondContact CB-OD1 3.37Å; S273-D308 PolarHBondContact OG-OD1 2.86Å
274	Q	84.2	Confident	88.3	Confident	52 Å²	52	45.3 Å²	45.3	24%	0.243	24%	0.243	C	C	.	.	H	α-helix	trans	-79.5	-34.7	180	-67.6	171.8	-31	0	0	114	L237 V270 L271 L272 C276 L277 F278	L237-Q274 HydrophobicContact CD2-CB 4.28Å; V270-Q274 WeakPolarHBondContact O-CG 3.29Å; V270-Q274 PolarHBondContact O-N 2.95Å; L271-Q274 PolarHBondContact O-N 2.89Å; L272-Q274 PolarHBondContact O-N 3.46Å; Q274-C276 PolarHBondContact O-N 3.34Å; Q274-L277 VanDerWaalsContact O-CB 3.31Å; Q274-L277 WeakPolarHBondContact O-CB 3.49Å; Q274-L277 PolarHBondContact O-N 3.32Å; Q274-F278 HydrophobicContact CB-CE2 4.3Å; Q274-F278 WeakPolarHBondContact O-CD2 3.31Å; Q274-F278 PolarHBondContact O-N 3.39Å
275	S	84	Confident	88.3	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-33.7	-179.7	67.6	0	0	0	0	111.9	L271 L272 L277 F278 E279 E280 T284	L271-S275 WeakPolarHBondContact O-CB 3.35Å; L271-S275 PolarHBondContact O-N 2.79Å; L271-S275 PolarHBondContact O-OG 3.33Å; L272-S275 PolarHBondContact O-N 3.4Å; L272-S275 PolarHBondContact O-OG 2.91Å; S275-L277 PolarHBondContact O-N 3.19Å; S275-F278 PolarHBondContact O-N 2.83Å; S275-F278 VanDerWaalsContact O-N 3.15Å; S275-E279 PolarHBondContact O-N 2.73Å; S275-E279 VanDerWaalsContact O-N 3.17Å; S275-E280 PolarHBondContact O-N 3.3Å; S275-T284 WeakPolarHBondContact CB-OG1 3.12Å; S275-T284 PolarHBondContact OG-OG1 3.31Å
276	C	74.3	Confident	88.2	Confident	81 Å²	81	51.3 Å²	51.3	55%	0.547	26%	0.262	S	S	.	.	H	α-helix	trans	-61	-31.8	172.8	-66	0	0	0	0	112.5	L272 Q274	L272-C276 PolarHBondContact O-N 3.2Å; L272-C276 PolarHBondContact O-SG 3.15Å; Q274-C276 PolarHBondContact O-N 3.34Å
277	L	79.7	Confident	88.3	Confident	105 Å²	105	44.2 Å²	44.2	55%	0.55	23%	0.232	S	C	.	.	H	α-helix	trans	-76.1	-27.7	177	-62.8	171	0	0	0	112.6	Q274 S275	Q274-L277 VanDerWaalsContact O-CB 3.31Å; Q274-L277 WeakPolarHBondContact O-CB 3.49Å; Q274-L277 PolarHBondContact O-N 3.32Å; S275-L277 PolarHBondContact O-N 3.19Å
278	F	81.6	Confident	88.4	Confident	27 Å²	27	45.7 Å²	45.7	12%	0.118	24%	0.237	C	C	.	.	H	α-helix	trans	-93.9	-2.6	-177.9	-63.8	-59.2	0	0	0	113.7	L237 L240 Y241 K244 Q274 S275 E280	L237-F278 HydrophobicContact CD2-CE2 3.84Å; L240-F278 HydrophobicContact CD2-CB 4.35Å; L240-F278 HydrophobicContact CD2-CD1 4.4Å; L240-F278 HydrophobicContact CD2-CD2 3.94Å; L240-F278 HydrophobicContact CD2-CE2 4.34Å; L240-F278 HydrophobicContact CD2-CG 3.97Å; L240-F278 HydrophobicContact CG-CD1 4.3Å; L240-F278 HydrophobicContact CG-CG 4.36Å; Y241-F278 HydrophobicContact CD2-CE1 4.14Å; Y241-F278 HydrophobicContact CG-CE1 4.46Å; K244-F278 HydrophobicContact CD-CB 4.38Å; K244-F278 HydrophobicContact CD-CD1 4.26Å; K244-F278 WeakPolarHBondContact CE-O 3.38Å; K244-F278 PolarHBondContact NZ-O 3.34Å; Q274-F278 HydrophobicContact CB-CE2 4.3Å; Q274-F278 WeakPolarHBondContact O-CD2 3.31Å; Q274-F278 PolarHBondContact O-N 3.39Å; S275-F278 PolarHBondContact O-N 2.83Å; S275-F278 VanDerWaalsContact O-N 3.15Å; F278-E280 VanDerWaalsContact C-N 3.27Å; F278-E280 HydrophobicContact CB-CG 4.12Å; F278-E280 PolarHBondContact O-N 3.21Å
279	E	83.3	Confident	88.3	Confident	160 Å²	160	47.8 Å²	47.8	75%	0.748	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	43.1	-176.4	-57	-179.4	172.6	0	0	112.3	S275 P281	S275-E279 PolarHBondContact O-N 2.73Å; S275-E279 VanDerWaalsContact O-N 3.17Å; E279-P281 WeakPolarHBondContact O-CD 3.42Å
280	E	87.3	Confident	88.3	Confident	41 Å²	41	47.8 Å²	47.8	19%	0.192	25%	0.247	C	C	.	.			trans	-103.9	84.6	177.3	-71.3	-63.2	152.1	0	0	110.1	K244 V256 S275 F278 D282 L283 T284	K244-E280 WeakPolarHBondContact CE-OE1 3.42Å; K244-E280 IonicContact NZ-OE1 3.71Å; K244-E280 PolarHBondContact NZ-OE1 3.21Å; V256-E280 HydrophobicContact CG2-CG 4.01Å; S275-E280 PolarHBondContact O-N 3.3Å; F278-E280 VanDerWaalsContact C-N 3.27Å; F278-E280 HydrophobicContact CB-CG 4.12Å; F278-E280 PolarHBondContact O-N 3.21Å; E280-D282 VanDerWaalsContact C-N 3.31Å; E280-D282 PolarHBondContact O-N 2.87Å; E280-L283 HydrophobicContact CB-CB 3.92Å; E280-L283 PolarHBondContact O-N 2.73Å; E280-T284 PolarHBondContact O-N 3.34Å; E280-T284 PolarHBondContact O-OG1 2.96Å; E280-T284 VanDerWaalsContact O-OG1 3.07Å
281	P	87.8	Confident	88.6	Confident	89 Å²	89	46.7 Å²	46.7	58%	0.578	24%	0.24	S	C	*	.	H	α-helix	trans	-64.8	-34	-171.3	26.5	-35.6	0	0	0	112.9	E279 T284 Q285	E279-P281 WeakPolarHBondContact O-CD 3.42Å; P281-T284 PolarHBondContact O-N 2.95Å; P281-Q285 WeakPolarHBondContact O-CB 3.37Å; P281-Q285 PolarHBondContact O-N 2.89Å
282	D	88.3	Confident	88.7	Confident	115 Å²	115	47 Å²	47	62%	0.615	24%	0.242	S	C	*	.	H	α-helix	trans	-66.5	-46	178.2	-65.9	-38.1	0	0	0	110.4	E280 T284 Q285 R286	E280-D282 VanDerWaalsContact C-N 3.31Å; E280-D282 PolarHBondContact O-N 2.87Å; D282-T284 PolarHBondContact O-N 2.87Å; D282-Q285 PolarHBondContact O-N 2.85Å; D282-R286 WeakPolarHBondContact O-CG 3.35Å; D282-R286 PolarHBondContact O-N 3.01Å
283	L	90.1	Very high	88.7	Confident	3 Å²	3	47 Å²	47	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-61.5	-44.4	174.6	-179.6	62.1	0	0	0	111.4	L259 E260 E280 Q285 R286 C287	L259-L283 HydrophobicContact CB-CD1 4.27Å; L259-L283 HydrophobicContact CB-CD2 4.29Å; L259-L283 HydrophobicContact CD1-CD2 4.05Å; E260-L283 HydrophobicContact CG-CD1 3.8Å; E280-L283 HydrophobicContact CB-CB 3.92Å; E280-L283 PolarHBondContact O-N 2.73Å; L283-Q285 VanDerWaalsContact C-N 3.31Å; L283-Q285 PolarHBondContact O-N 3.45Å; L283-R286 PolarHBondContact O-N 3.38Å; L283-C287 PolarHBondContact O-N 2.95Å; L283-C287 PolarHBondContact O-SG 2.91Å; L283-C287 VanDerWaalsContact O-SG 3.33Å
284	T	92	Very high	89	Confident	25 Å²	25	47.1 Å²	47.1	15%	0.153	24%	0.24	C	C	.	.	H	α-helix	trans	-56.8	-45.3	174.9	-60.5	0	0	0	0	111.4	L272 S275 E280 P281 D282 C287 W288	L272-T284 HydrophobicContact CD1-CG2 3.79Å; S275-T284 WeakPolarHBondContact CB-OG1 3.12Å; S275-T284 PolarHBondContact OG-OG1 3.31Å; E280-T284 PolarHBondContact O-N 3.34Å; E280-T284 PolarHBondContact O-OG1 2.96Å; E280-T284 VanDerWaalsContact O-OG1 3.07Å; P281-T284 PolarHBondContact O-N 2.95Å; D282-T284 PolarHBondContact O-N 2.87Å; T284-C287 WeakPolarHBondContact O-CB 3.08Å; T284-C287 PolarHBondContact O-N 3.19Å; T284-W288 PolarHBondContact O-N 3.23Å
285	Q	91.6	Very high	89.5	Confident	95 Å²	95	44.7 Å²	44.7	44%	0.444	23%	0.229	S	C	.	.	H	α-helix	trans	-63.7	-41.7	177.8	177.9	57.4	27.3	0	0	111.6	P281 D282 L283 W288 E289	P281-Q285 WeakPolarHBondContact O-CB 3.37Å; P281-Q285 PolarHBondContact O-N 2.89Å; D282-Q285 PolarHBondContact O-N 2.85Å; L283-Q285 VanDerWaalsContact C-N 3.31Å; L283-Q285 PolarHBondContact O-N 3.45Å; Q285-W288 WeakPolarHBondContact O-CB 3.34Å; Q285-W288 PolarHBondContact O-N 2.83Å; Q285-E289 PolarHBondContact NE2-OE1 2.86Å; Q285-E289 WeakPolarHBondContact O-CG 3.2Å; Q285-E289 PolarHBondContact O-N 2.88Å
286	R	90.5	Very high	90	Very high	77 Å²	77	46.7 Å²	46.7	29%	0.291	24%	0.238	S	C	.	.	H	α-helix	trans	-62.4	-41.7	174.3	-66.6	-50.2	-168.9	173.4	0.5	112.7	L263 D282 L283 W288 E289 V290	L263-R286 HydrophobicContact CD2-CB 3.73Å; D282-R286 WeakPolarHBondContact O-CG 3.35Å; D282-R286 PolarHBondContact O-N 3.01Å; L283-R286 PolarHBondContact O-N 3.38Å; R286-W288 VanDerWaalsContact C-N 3.28Å; R286-W288 PolarHBondContact O-N 2.87Å; R286-E289 WeakPolarHBondContact CD-OE2 3.36Å; R286-E289 IonicContact CZ-OE2 3.28Å; R286-E289 IonicContact NE-OE2 2.68Å; R286-E289 IonicContact NH1-OE1 3.55Å; R286-E289 IonicContact NH1-OE2 3.04Å; R286-E289 PolarHBondContact NH1-OE2 2.85Å; R286-E289 PolarHBondContact O-N 3.42Å; R286-V290 PolarHBondContact O-N 3.29Å; R286-V290 VanDerWaalsContact O-N 3.15Å
287	C	94.5	Very high	90.9	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-43.9	174.2	-69	0	0	0	0	110.9	L272 L283 T284 V290 I291	L272-C287 HydrophobicContact CB-CB 3.97Å; L272-C287 HydrophobicContact CD1-CB 4.16Å; L283-C287 PolarHBondContact O-N 2.95Å; L283-C287 PolarHBondContact O-SG 2.91Å; L283-C287 VanDerWaalsContact O-SG 3.33Å; T284-C287 WeakPolarHBondContact O-CB 3.08Å; T284-C287 PolarHBondContact O-N 3.19Å; C287-V290 PolarHBondContact O-N 3.29Å; C287-I291 WeakPolarHBondContact O-CB 3.42Å; C287-I291 WeakPolarHBondContact O-CD1 3.46Å; C287-I291 VanDerWaalsContact O-CG1 3.22Å; C287-I291 WeakPolarHBondContact O-CG1 3.05Å; C287-I291 PolarHBondContact O-N 2.91Å
288	W	94.8	Very high	91.7	Very high	34 Å²	34	41 Å²	41	13%	0.129	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-41.1	177.2	-78.2	127.8	0	0	0	113.8	L272 T284 Q285 R286 V290 I291 D292 I315 R318	L272-W288 HydrophobicContact CD1-CD2 4.06Å; L272-W288 HydrophobicContact CD1-CG 4.37Å; L272-W288 HydrophobicContact CD1-CZ2 3.89Å; L272-W288 HydrophobicContact CD2-CD2 4.1Å; L272-W288 HydrophobicContact CD2-CE3 4.01Å; L272-W288 HydrophobicContact CD2-CH2 3.38Å; L272-W288 HydrophobicContact CD2-CZ2 3.47Å; L272-W288 VanDerWaalsContact CD2-CZ2 3.47Å; L272-W288 HydrophobicContact CD2-CZ3 3.66Å; L272-W288 HydrophobicContact CG-CZ2 4.22Å; T284-W288 PolarHBondContact O-N 3.23Å; Q285-W288 WeakPolarHBondContact O-CB 3.34Å; Q285-W288 PolarHBondContact O-N 2.83Å; R286-W288 VanDerWaalsContact C-N 3.28Å; R286-W288 PolarHBondContact O-N 2.87Å; W288-V290 VanDerWaalsContact C-N 3.32Å; W288-V290 PolarHBondContact O-N 2.9Å; W288-I291 HydrophobicContact CE3-CB 4.45Å; W288-I291 HydrophobicContact CE3-CD1 4.24Å; W288-I291 HydrophobicContact CE3-CG2 4.4Å; W288-I291 HydrophobicContact CZ3-CD1 4.44Å; W288-I291 HydrophobicContact CZ3-CG2 4.44Å; W288-I291 PolarHBondContact O-N 2.82Å; W288-D292 WeakPolarHBondContact O-CB 3.22Å; W288-D292 PolarHBondContact O-N 3.47Å; W288-I315 HydrophobicContact CH2-CG1 3.92Å; W288-I315 HydrophobicContact CZ3-CG1 3.83Å; W288-R318 VanDerWaalsContact CD2-CZ 3.49Å; W288-R318 VanDerWaalsContact CE3-CD 3.46Å; W288-R318 VanDerWaalsContact CE3-CZ 3.41Å; W288-R318 VanDerWaalsContact CE3-NH1 3.31Å
289	E	92.9	Very high	92.4	Very high	43 Å²	43	39.9 Å²	39.9	20%	0.201	20%	0.198	C	C	.	.	H	α-helix	trans	-58	-45.7	175.8	-73.3	165.8	-168	0	0	111.4	Q285 R286 A293 F449	Q285-E289 PolarHBondContact NE2-OE1 2.86Å; Q285-E289 WeakPolarHBondContact O-CG 3.2Å; Q285-E289 PolarHBondContact O-N 2.88Å; R286-E289 WeakPolarHBondContact CD-OE2 3.36Å; R286-E289 IonicContact CZ-OE2 3.28Å; R286-E289 IonicContact NE-OE2 2.68Å; R286-E289 IonicContact NH1-OE1 3.55Å; R286-E289 IonicContact NH1-OE2 3.04Å; R286-E289 PolarHBondContact NH1-OE2 2.85Å; R286-E289 PolarHBondContact O-N 3.42Å; E289-A293 VanDerWaalsContact O-CB 3.31Å; E289-A293 WeakPolarHBondContact O-CB 3.31Å; E289-A293 PolarHBondContact O-N 2.87Å; E289-F449 HydrophobicContact CB-CE2 4.17Å
290	V	94.3	Very high	93	Very high	1 Å²	1	38 Å²	38	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-67.5	-45.3	177.9	173.8	0	0	0	0	111.5	L263 A265 A268 R286 C287 W288 D292 A293 Q294 F449	L263-V290 HydrophobicContact CD2-CG2 3.77Å; L263-V290 HydrophobicContact CG-CG2 4.01Å; A265-V290 HydrophobicContact CB-CG1 4.37Å; A268-V290 HydrophobicContact CB-CB 4.29Å; A268-V290 HydrophobicContact CB-CG1 3.94Å; R286-V290 PolarHBondContact O-N 3.29Å; R286-V290 VanDerWaalsContact O-N 3.15Å; C287-V290 PolarHBondContact O-N 3.29Å; W288-V290 VanDerWaalsContact C-N 3.32Å; W288-V290 PolarHBondContact O-N 2.9Å; V290-D292 VanDerWaalsContact C-N 3.32Å; V290-D292 PolarHBondContact O-N 3.37Å; V290-A293 PolarHBondContact O-N 2.81Å; V290-Q294 WeakPolarHBondContact O-CB 3.19Å; V290-Q294 PolarHBondContact O-N 3.01Å; V290-F449 HydrophobicContact CB-CZ 4.43Å; V290-F449 HydrophobicContact CG2-CE1 4.42Å; V290-F449 HydrophobicContact CG2-CZ 3.81Å
291	I	96.1	Very high	93.4	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-62	-40.9	178.1	-69.9	164	0	0	0	110.6	A268 L272 C287 W288 A295 A298 L321	A268-I291 HydrophobicContact CB-CD1 4.24Å; A268-I291 HydrophobicContact CB-CG1 3.76Å; L272-I291 HydrophobicContact CB-CD1 4.18Å; L272-I291 HydrophobicContact CD2-CD1 3.67Å; L272-I291 HydrophobicContact CG-CD1 4.49Å; C287-I291 WeakPolarHBondContact O-CB 3.42Å; C287-I291 WeakPolarHBondContact O-CD1 3.46Å; C287-I291 VanDerWaalsContact O-CG1 3.22Å; C287-I291 WeakPolarHBondContact O-CG1 3.05Å; C287-I291 PolarHBondContact O-N 2.91Å; W288-I291 HydrophobicContact CE3-CB 4.45Å; W288-I291 HydrophobicContact CE3-CD1 4.24Å; W288-I291 HydrophobicContact CE3-CG2 4.4Å; W288-I291 HydrophobicContact CZ3-CD1 4.44Å; W288-I291 HydrophobicContact CZ3-CG2 4.44Å; W288-I291 PolarHBondContact O-N 2.82Å; I291-A295 WeakPolarHBondContact O-CA 3.31Å; I291-A295 WeakPolarHBondContact O-CB 3.09Å; I291-A295 PolarHBondContact O-N 3.47Å; I291-A298 HydrophobicContact CG1-CB 4.44Å; I291-L321 HydrophobicContact CG2-CD1 3.84Å
292	D	95.3	Very high	93.5	Very high	9 Å²	9	39.4 Å²	39.4	5%	0.048	19%	0.187	C	C	.	.	H	α-helix	trans	-70.4	-45.2	179.7	-75.9	-20.8	0	0	0	111.9	W288 V290 R318 T320 N322 L413	W288-D292 WeakPolarHBondContact O-CB 3.22Å; W288-D292 PolarHBondContact O-N 3.47Å; V290-D292 VanDerWaalsContact C-N 3.32Å; V290-D292 PolarHBondContact O-N 3.37Å; D292-R318 WeakPolarHBondContact OD1-CD 3.38Å; D292-R318 IonicContact OD1-CZ 2.64Å; D292-R318 IonicContact OD1-NE 3.39Å; D292-R318 PolarHBondContact OD1-NE 3.33Å; D292-R318 IonicContact OD1-NH2 2.61Å; D292-R318 IonicContact OD2-CZ 3.93Å; D292-R318 IonicContact OD2-NE 2.88Å; D292-R318 PolarHBondContact OD2-NE 3.01Å; D292-R318 IonicContact OD2-NH2 3.97Å; D292-R318 PolarHBondContact OD2-NH2 2.79Å; D292-T320 PolarHBondContact OD1-OG1 3.44Å; D292-T320 WeakPolarHBondContact OD2-CB 3.47Å; D292-T320 PolarHBondContact OD2-OG1 2.93Å; D292-N322 WeakPolarHBondContact O-CB 3.35Å; D292-N322 PolarHBondContact O-N 3.11Å; D292-N322 VanDerWaalsContact O-N 3.14Å; D292-L413 HydrophobicContact CB-CD1 4.16Å; D292-L413 HydrophobicContact CB-CD2 4.03Å; D292-L413 HydrophobicContact CB-CG 4.31Å
293	A	93	Very high	93.7	Very high	2 Å²	2	34 Å²	34	2%	0.017	16%	0.159	C	C	.	.	H	α-helix	trans	-72.8	-38.7	-176.2	0	0	0	0	0	112.8	E289 V290 L413 F449 P501	E289-A293 VanDerWaalsContact O-CB 3.31Å; E289-A293 WeakPolarHBondContact O-CB 3.31Å; E289-A293 PolarHBondContact O-N 2.87Å; V290-A293 PolarHBondContact O-N 2.81Å; A293-L413 HydrophobicContact CB-CD1 4.05Å; A293-F449 HydrophobicContact CB-CB 3.98Å; A293-F449 HydrophobicContact CB-CD1 3.6Å; A293-F449 HydrophobicContact CB-CD2 3.65Å; A293-F449 HydrophobicContact CB-CE1 3.93Å; A293-F449 HydrophobicContact CB-CE2 4Å; A293-F449 HydrophobicContact CB-CG 3.45Å; A293-F449 VanDerWaalsContact CB-CG 3.45Å; A293-F449 HydrophobicContact CB-CZ 4.12Å; A293-P501 WeakPolarHBondContact O-CD 3.37Å; A293-P501 WeakPolarHBondContact O-CG 3.13Å
294	Q	94	Very high	93.9	Very high	29 Å²	29	33.9 Å²	33.9	14%	0.136	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	38.3	-175.8	-61.1	-175.3	-34.5	0	0	111.6	A265 V290 E296 L297 A298 F449 P501	A265-Q294 HydrophobicContact CB-CB 3.93Å; V290-Q294 WeakPolarHBondContact O-CB 3.19Å; V290-Q294 PolarHBondContact O-N 3.01Å; Q294-E296 PolarHBondContact O-N 3.07Å; Q294-L297 HydrophobicContact CB-CB 4.5Å; Q294-L297 HydrophobicContact CB-CD1 4.39Å; Q294-L297 PolarHBondContact O-N 3.45Å; Q294-L297 VanDerWaalsContact O-N 3.1Å; Q294-A298 PolarHBondContact O-N 3.29Å; Q294-F449 HydrophobicContact CG-CD1 4.45Å; Q294-F449 HydrophobicContact CG-CE1 4.4Å; Q294-P501 PolarHBondContact NE2-O 3.34Å
295	A	94.9	Very high	94	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.008	16%	0.158	C	C	.	.	H	α-helix	trans	-52.4	-47.2	-172.3	0	0	0	0	0	113.8	I291 L297 A298 L299 L321 A323	I291-A295 WeakPolarHBondContact O-CA 3.31Å; I291-A295 WeakPolarHBondContact O-CB 3.09Å; I291-A295 PolarHBondContact O-N 3.47Å; A295-L297 VanDerWaalsContact C-N 3.33Å; A295-L297 PolarHBondContact O-N 3.22Å; A295-A298 PolarHBondContact O-N 3.4Å; A295-A298 VanDerWaalsContact O-N 3.16Å; A295-L299 WeakPolarHBondContact O-CB 3.47Å; A295-L299 WeakPolarHBondContact O-CG 3.46Å; A295-L299 PolarHBondContact O-N 2.82Å; A295-L321 HydrophobicContact CB-CD1 3.52Å; A295-L321 HydrophobicContact CB-CG 3.84Å; A295-A323 HydrophobicContact CB-CB 3.75Å
296	E	94	Very high	93.9	Very high	43 Å²	43	32.2 Å²	32.2	20%	0.201	15%	0.153	C	C	.	.	H	α-helix	trans	-61.7	-40.3	-179.5	175.4	159	-170.9	0	0	112.7	Q294 K300 V327 Y500	Q294-E296 PolarHBondContact O-N 3.07Å; E296-K300 HydrophobicContact CG-CD 4.04Å; E296-K300 WeakPolarHBondContact O-CB 3.43Å; E296-K300 VanDerWaalsContact O-CG 3.3Å; E296-K300 WeakPolarHBondContact O-CG 3.14Å; E296-K300 PolarHBondContact O-N 3.01Å; E296-K300 VanDerWaalsContact O-N 3.14Å; E296-K300 IonicContact OE1-NZ 2.76Å; E296-K300 PolarHBondContact OE1-NZ 3.49Å; E296-V327 HydrophobicContact CB-CG1 4.37Å; E296-V327 HydrophobicContact CG-CG1 4.02Å; E296-V327 HydrophobicContact CG-CG2 4.32Å; E296-Y500 HydrophobicContact CB-CE1 4.08Å; E296-Y500 HydrophobicContact CG-CE1 4.03Å
297	L	94.4	Very high	94.1	Very high	66 Å²	66	28.6 Å²	28.6	35%	0.346	14%	0.139	S	C	.	.	H	α-helix	trans	-67.6	-38	175	-63.9	177	0	0	0	111.7	A265 Q294 A295 S301 Y500	A265-L297 HydrophobicContact CB-CB 3.64Å; Q294-L297 HydrophobicContact CB-CB 4.5Å; Q294-L297 HydrophobicContact CB-CD1 4.39Å; Q294-L297 PolarHBondContact O-N 3.45Å; Q294-L297 VanDerWaalsContact O-N 3.1Å; A295-L297 VanDerWaalsContact C-N 3.33Å; A295-L297 PolarHBondContact O-N 3.22Å; L297-S301 PolarHBondContact O-N 2.86Å; L297-Y500 HydrophobicContact CD1-CD1 4.16Å; L297-Y500 HydrophobicContact CD1-CD2 4.12Å; L297-Y500 HydrophobicContact CD1-CG 3.82Å; L297-Y500 HydrophobicContact CD2-CD1 4.34Å; L297-Y500 HydrophobicContact CD2-CD2 4.21Å; L297-Y500 HydrophobicContact CD2-CE1 4.12Å; L297-Y500 HydrophobicContact CD2-CE2 4Å; L297-Y500 HydrophobicContact CD2-CG 4.39Å; L297-Y500 HydrophobicContact CG-CD1 3.87Å; L297-Y500 HydrophobicContact CG-CD2 4.32Å; L297-Y500 HydrophobicContact CG-CE1 4.06Å; L297-Y500 HydrophobicContact CG-CG 4.02Å
298	A	96.3	Very high	94	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-70.2	-43.5	179.9	0	0	0	0	0	112.1	A265 I291 Q294 A295 S301 F304	A265-A298 HydrophobicContact CB-CB 4.26Å; A265-A298 VanDerWaalsContact O-CA 3.29Å; A265-A298 WeakPolarHBondContact O-CA 3.38Å; I291-A298 HydrophobicContact CG1-CB 4.44Å; Q294-A298 PolarHBondContact O-N 3.29Å; A295-A298 PolarHBondContact O-N 3.4Å; A295-A298 VanDerWaalsContact O-N 3.16Å; A298-S301 WeakPolarHBondContact O-CB 3.24Å; A298-S301 PolarHBondContact O-N 2.78Å; A298-S301 PolarHBondContact O-OG 3.09Å; A298-F304 WeakPolarHBondContact O-CB 3.17Å
299	L	96.4	Very high	94	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-67.9	-32.9	179	-69.8	173.9	0	0	0	113	A295 S301 F304 I315 L321 A323 V327 V328 A331	A295-L299 WeakPolarHBondContact O-CB 3.47Å; A295-L299 WeakPolarHBondContact O-CG 3.46Å; A295-L299 PolarHBondContact O-N 2.82Å; L299-S301 VanDerWaalsContact C-N 3.3Å; L299-F304 HydrophobicContact CD2-CD2 3.84Å; L299-F304 HydrophobicContact CD2-CE1 4.43Å; L299-F304 HydrophobicContact CD2-CE2 3.41Å; L299-F304 VanDerWaalsContact CD2-CE2 3.41Å; L299-F304 HydrophobicContact CD2-CG 4.49Å; L299-F304 HydrophobicContact CD2-CZ 3.73Å; L299-I315 HydrophobicContact CD2-CG2 4.07Å; L299-L321 HydrophobicContact CD1-CD2 4.3Å; L299-A323 HydrophobicContact CD1-CB 4Å; L299-V327 HydrophobicContact CB-CG1 4.33Å; L299-V327 HydrophobicContact CD1-CG1 4.23Å; L299-V328 HydrophobicContact CD1-CG2 3.88Å; L299-A331 HydrophobicContact CB-CB 3.78Å; L299-A331 HydrophobicContact CD2-CB 4.22Å; L299-A331 HydrophobicContact CG-CB 4.46Å; L299-A331 WeakPolarHBondContact O-CB 3.21Å
300	K	94.9	Very high	94	Very high	120 Å²	120	38.5 Å²	38.5	52%	0.522	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.3	175.9	-71.3	175.3	173.5	175.5	0	113.6	E296 V327	E296-K300 HydrophobicContact CG-CD 4.04Å; E296-K300 WeakPolarHBondContact O-CB 3.43Å; E296-K300 VanDerWaalsContact O-CG 3.3Å; E296-K300 WeakPolarHBondContact O-CG 3.14Å; E296-K300 PolarHBondContact O-N 3.01Å; E296-K300 VanDerWaalsContact O-N 3.14Å; E296-K300 IonicContact OE1-NZ 2.76Å; E296-K300 PolarHBondContact OE1-NZ 3.49Å; K300-V327 HydrophobicContact CG-CG1 4.43Å
301	S	95.3	Very high	94	Very high	13 Å²	13	39 Å²	39	9%	0.091	19%	0.19	C	C	.	.	S	Bend	trans	-73.9	149	-179.2	75	0	0	0	0	112.1	K266 L297 A298 L299 G303 F304	K266-S301 PolarHBondContact O-OG 3.12Å; L297-S301 PolarHBondContact O-N 2.86Å; A298-S301 WeakPolarHBondContact O-CB 3.24Å; A298-S301 PolarHBondContact O-N 2.78Å; A298-S301 PolarHBondContact O-OG 3.09Å; L299-S301 VanDerWaalsContact C-N 3.3Å; S301-G303 PolarHBondContact O-N 2.83Å; S301-F304 WeakPolarHBondContact O-CB 3.19Å; S301-F304 PolarHBondContact O-N 2.88Å; S301-F304 VanDerWaalsContact O-N 3.09Å; S301-F304 PolarHBondContact OG-N 3.3Å
302	E	91.1	Very high	94	Very high	147 Å²	147	38.9 Å²	38.9	69%	0.687	19%	0.19	S	C	*	.	H	α-helix	trans	-59.1	-33.1	171.6	-63.3	-178.6	179.1	0	0	111.6	F304 C305	E302-F304 PolarHBondContact O-N 2.98Å; E302-C305 WeakPolarHBondContact O-CB 3.31Å; E302-C305 PolarHBondContact O-N 3.2Å; E302-C305 VanDerWaalsContact O-N 3.1Å
303	G	90.6	Very high	94	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-61.1	-27.2	176.5	0	0	0	0	0	113.8	V270 S301 D306	V270-G303 VanDerWaalsContact CG2-CA 3.45Å; V270-G303 WeakPolarHBondContact CG2-O 3.47Å; S301-G303 PolarHBondContact O-N 2.83Å; G303-D306 PolarHBondContact O-N 3.05Å
304	F	95.4	Very high	94.1	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-65.8	-40.3	174.2	-178.6	-99.1	0	0	0	111.9	C269 A298 L299 S301 E302 D306 I307 L312 I315 A331 W335	C269-F304 HydrophobicContact CB-CD2 4.42Å; A298-F304 WeakPolarHBondContact O-CB 3.17Å; L299-F304 HydrophobicContact CD2-CD2 3.84Å; L299-F304 HydrophobicContact CD2-CE1 4.43Å; L299-F304 HydrophobicContact CD2-CE2 3.41Å; L299-F304 VanDerWaalsContact CD2-CE2 3.41Å; L299-F304 HydrophobicContact CD2-CG 4.49Å; L299-F304 HydrophobicContact CD2-CZ 3.73Å; S301-F304 WeakPolarHBondContact O-CB 3.19Å; S301-F304 PolarHBondContact O-N 2.88Å; S301-F304 VanDerWaalsContact O-N 3.09Å; S301-F304 PolarHBondContact OG-N 3.3Å; E302-F304 PolarHBondContact O-N 2.98Å; F304-D306 PolarHBondContact O-N 3.32Å; F304-D306 VanDerWaalsContact O-N 3.16Å; F304-I307 HydrophobicContact CD2-CD1 3.81Å; F304-I307 HydrophobicContact CE2-CD1 3.68Å; F304-I307 HydrophobicContact CG-CD1 4.47Å; F304-I307 HydrophobicContact CZ-CD1 4.25Å; F304-I307 VanDerWaalsContact O-CG1 3.23Å; F304-I307 WeakPolarHBondContact O-CG1 3.29Å; F304-I307 PolarHBondContact O-N 3.42Å; F304-L312 HydrophobicContact CE1-CD1 4.02Å; F304-L312 HydrophobicContact CE2-CD1 4.22Å; F304-L312 HydrophobicContact CZ-CD1 3.43Å; F304-L312 VanDerWaalsContact CZ-CD1 3.43Å; F304-I315 HydrophobicContact CD2-CD1 4.2Å; F304-I315 HydrophobicContact CE2-CD1 3.84Å; F304-I315 HydrophobicContact CE2-CG2 4.24Å; F304-A331 HydrophobicContact CD1-CB 4.12Å; F304-A331 HydrophobicContact CE1-CB 3.78Å; F304-A331 WeakPolarHBondContact CE1-O 3.39Å; F304-A331 HydrophobicContact CZ-CB 4.36Å; F304-W335 HydrophobicContact CD1-CB 4.31Å; F304-W335 HydrophobicContact CE1-CB 3.91Å
305	C	93.5	Very high	94.2	Very high	22 Å²	22	42.8 Å²	42.8	15%	0.149	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-18.5	175.6	-63.8	0	0	0	0	112.2	E302 V338 R342	E302-C305 WeakPolarHBondContact O-CB 3.31Å; E302-C305 PolarHBondContact O-N 3.2Å; E302-C305 VanDerWaalsContact O-N 3.1Å; C305-V338 HydrophobicContact CB-CB 4.16Å; C305-V338 HydrophobicContact CB-CG1 4.35Å; C305-V338 HydrophobicContact CB-CG2 3.84Å; C305-R342 PolarHBondContact O-NH1 3.24Å; C305-R342 PolarHBondContact O-NH2 2.96Å
306	D	90.6	Very high	94.3	Very high	63 Å²	63	42.8 Å²	42.8	34%	0.337	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-8.9	-179	-90.5	-43.4	0	0	0	117	K103 V270 G303 F304 R342	K103-D306 IonicContact NZ-OD1 3.39Å; K103-D306 PolarHBondContact NZ-OD1 3.45Å; V270-D306 HydrophobicContact CG2-CB 4.08Å; G303-D306 PolarHBondContact O-N 3.05Å; F304-D306 PolarHBondContact O-N 3.32Å; F304-D306 VanDerWaalsContact O-N 3.16Å; D306-R342 VanDerWaalsContact CA-NH2 3.27Å; D306-R342 IonicContact OD1-NH2 2.78Å; D306-R342 PolarHBondContact OD1-NH2 3.15Å
307	I	94.1	Very high	94.4	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	23%	0.233	C	C	.	.	S	Bend	trans	-78.2	157.4	-177.5	74.7	-168.8	0	0	0	112.9	C269 F304 T311 L312 I315 W335	C269-I307 HydrophobicContact CB-CG2 3.76Å; C269-I307 WeakPolarHBondContact O-CG2 3.32Å; F304-I307 HydrophobicContact CD2-CD1 3.81Å; F304-I307 HydrophobicContact CE2-CD1 3.68Å; F304-I307 HydrophobicContact CG-CD1 4.47Å; F304-I307 HydrophobicContact CZ-CD1 4.25Å; F304-I307 VanDerWaalsContact O-CG1 3.23Å; F304-I307 WeakPolarHBondContact O-CG1 3.29Å; F304-I307 PolarHBondContact O-N 3.42Å; I307-T311 HydrophobicContact CB-CG2 4.1Å; I307-T311 HydrophobicContact CD1-CG2 4.19Å; I307-T311 HydrophobicContact CG2-CG2 4.26Å; I307-L312 HydrophobicContact CD1-CB 4.04Å; I307-L312 HydrophobicContact CD1-CD1 4.38Å; I307-L312 HydrophobicContact CG1-CB 4.35Å; I307-I315 HydrophobicContact CD1-CD1 3.83Å; I307-W335 PolarHBondContact O-NE1 3.45Å
308	D	92.7	Very high	94.4	Very high	60 Å²	60	48.2 Å²	48.2	32%	0.321	23%	0.227	S	C	.	.			trans	-76.4	163.7	171	68.1	-78.8	0	0	0	112.4	S273 Q310 T311 L312	S273-D308 WeakPolarHBondContact CB-OD1 3.37Å; S273-D308 PolarHBondContact OG-OD1 2.86Å; D308-Q310 VanDerWaalsContact C-N 3.3Å; D308-Q310 PolarHBondContact O-N 2.8Å; D308-Q310 WeakPolarHBondContact OD2-CA 3.21Å; D308-Q310 VanDerWaalsContact OD2-CB 3.27Å; D308-Q310 WeakPolarHBondContact OD2-CB 3.34Å; D308-Q310 PolarHBondContact OD2-N 3.29Å; D308-T311 PolarHBondContact O-N 2.95Å; D308-T311 WeakPolarHBondContact OD1-CB 3.14Å; D308-T311 PolarHBondContact OD1-OG1 3Å; D308-T311 PolarHBondContact OD2-N 3.36Å; D308-T311 PolarHBondContact OD2-OG1 2.89Å; D308-L312 PolarHBondContact O-N 3.37Å
309	F	93.8	Very high	94.3	Very high	79 Å²	79	51.9 Å²	51.9	35%	0.346	24%	0.244	S	C	.	.	H	α-helix	trans	-60.9	-34.3	-177.4	-176.2	-92.5	0	0	0	113.6	L312 E313 W335 L356 A359	F309-L312 HydrophobicContact CD2-CD2 4.42Å; F309-L312 WeakPolarHBondContact O-CB 3.37Å; F309-L312 PolarHBondContact O-N 2.53Å; F309-E313 WeakPolarHBondContact O-CB 3.39Å; F309-E313 PolarHBondContact O-N 3.19Å; F309-W335 HydrophobicContact CB-CH2 4.35Å; F309-W335 HydrophobicContact CB-CZ2 4.33Å; F309-W335 AromaticContact CD2-CH2 3.71Å; F309-W335 HydrophobicContact CD2-CH2 3.71Å; F309-W335 HydrophobicContact CD2-CZ2 4.41Å; F309-W335 HydrophobicContact CD2-CZ3 4.33Å; F309-L356 WeakPolarHBondContact CE2-O 3.39Å; F309-A359 HydrophobicContact CE2-CB 3.92Å; F309-A359 HydrophobicContact CZ-CB 3.93Å
310	Q	93.3	Very high	94.3	Very high	145 Å²	145	53.9 Å²	53.9	68%	0.678	26%	0.257	S	S	*	.	H	α-helix	trans	-70.8	-39.3	-179.2	-178.7	-178.5	-10.1	0	0	111	D308 E313 S314	D308-Q310 VanDerWaalsContact C-N 3.3Å; D308-Q310 PolarHBondContact O-N 2.8Å; D308-Q310 WeakPolarHBondContact OD2-CA 3.21Å; D308-Q310 VanDerWaalsContact OD2-CB 3.27Å; D308-Q310 WeakPolarHBondContact OD2-CB 3.34Å; D308-Q310 PolarHBondContact OD2-N 3.29Å; Q310-E313 PolarHBondContact O-N 3.23Å; Q310-S314 WeakPolarHBondContact O-CB 3.44Å; Q310-S314 PolarHBondContact O-N 3.37Å; Q310-S314 PolarHBondContact O-OG 3.48Å
311	T	93.9	Very high	94.3	Very high	11 Å²	11	48.2 Å²	48.2	7%	0.067	23%	0.233	C	C	.	.	H	α-helix	trans	-64.6	-43.6	172.7	-59	0	0	0	0	111.1	L272 I307 D308 E313 S314 I315	L272-T311 HydrophobicContact CD2-CG2 3.86Å; L272-T311 HydrophobicContact CG-CG2 4.23Å; I307-T311 HydrophobicContact CB-CG2 4.1Å; I307-T311 HydrophobicContact CD1-CG2 4.19Å; I307-T311 HydrophobicContact CG2-CG2 4.26Å; D308-T311 PolarHBondContact O-N 2.95Å; D308-T311 WeakPolarHBondContact OD1-CB 3.14Å; D308-T311 PolarHBondContact OD1-OG1 3Å; D308-T311 PolarHBondContact OD2-N 3.36Å; D308-T311 PolarHBondContact OD2-OG1 2.89Å; T311-E313 PolarHBondContact O-N 2.85Å; T311-S314 WeakPolarHBondContact O-CB 3.49Å; T311-S314 PolarHBondContact O-N 2.91Å; T311-I315 HydrophobicContact CG2-CD1 4.12Å; T311-I315 WeakPolarHBondContact O-CG1 3.47Å; T311-I315 PolarHBondContact O-N 3.26Å
312	L	96.3	Very high	94.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-55	-51.2	173.2	176.4	74.6	0	0	0	111.4	F304 I307 D308 F309 S314 I315 L316 W335 L356 A359	F304-L312 HydrophobicContact CE1-CD1 4.02Å; F304-L312 HydrophobicContact CE2-CD1 4.22Å; F304-L312 HydrophobicContact CZ-CD1 3.43Å; F304-L312 VanDerWaalsContact CZ-CD1 3.43Å; I307-L312 HydrophobicContact CD1-CB 4.04Å; I307-L312 HydrophobicContact CD1-CD1 4.38Å; I307-L312 HydrophobicContact CG1-CB 4.35Å; D308-L312 PolarHBondContact O-N 3.37Å; F309-L312 HydrophobicContact CD2-CD2 4.42Å; F309-L312 WeakPolarHBondContact O-CB 3.37Å; F309-L312 PolarHBondContact O-N 2.53Å; L312-S314 VanDerWaalsContact C-N 3.25Å; L312-S314 PolarHBondContact O-N 2.83Å; L312-I315 PolarHBondContact O-N 3.06Å; L312-L316 HydrophobicContact CD1-CD1 4.1Å; L312-L316 HydrophobicContact CD1-CG 4.23Å; L312-L316 HydrophobicContact CD2-CD1 4.43Å; L312-L316 HydrophobicContact CG-CD1 3.95Å; L312-L316 HydrophobicContact CG-CG 4.34Å; L312-L316 WeakPolarHBondContact O-CG 3.41Å; L312-L316 PolarHBondContact O-N 2.94Å; L312-W335 HydrophobicContact CD1-CD2 4.33Å; L312-W335 HydrophobicContact CD1-CG 4.19Å; L312-W335 HydrophobicContact CD2-CD2 3.62Å; L312-W335 HydrophobicContact CD2-CE3 3.45Å; L312-W335 VanDerWaalsContact CD2-CE3 3.45Å; L312-W335 HydrophobicContact CD2-CG 4.34Å; L312-W335 HydrophobicContact CD2-CH2 3.96Å; L312-W335 HydrophobicContact CD2-CZ2 4.06Å; L312-W335 HydrophobicContact CD2-CZ3 3.64Å; L312-W335 HydrophobicContact CG-CD2 4.44Å; L312-L356 HydrophobicContact CD2-CD2 4.27Å; L312-A359 HydrophobicContact CD2-CB 4.29Å
313	E	95.9	Very high	94.2	Very high	69 Å²	69	44.5 Å²	44.5	32%	0.322	22%	0.22	S	C	.	.	H	α-helix	trans	-57.7	-41.7	179.9	-164.1	-175.7	172.8	0	0	111.5	F309 Q310 T311 L316 R317 L362	F309-E313 WeakPolarHBondContact O-CB 3.39Å; F309-E313 PolarHBondContact O-N 3.19Å; Q310-E313 PolarHBondContact O-N 3.23Å; T311-E313 PolarHBondContact O-N 2.85Å; E313-L316 PolarHBondContact O-N 2.85Å; E313-R317 VanDerWaalsContact O-CB 3.31Å; E313-R317 WeakPolarHBondContact O-CB 3.43Å; E313-R317 PolarHBondContact O-N 2.84Å; E313-L362 HydrophobicContact CB-CD1 4.46Å; E313-L362 HydrophobicContact CG-CD1 3.41Å; E313-L362 VanDerWaalsContact CG-CD1 3.41Å
314	S	95.3	Very high	94.3	Very high	53 Å²	53	51.4 Å²	51.4	37%	0.371	25%	0.249	S	C	.	.	H	α-helix	trans	-63.5	-41.9	178.6	-59.7	0	0	0	0	112.2	Q310 T311 L312 R318	Q310-S314 WeakPolarHBondContact O-CB 3.44Å; Q310-S314 PolarHBondContact O-N 3.37Å; Q310-S314 PolarHBondContact O-OG 3.48Å; T311-S314 WeakPolarHBondContact O-CB 3.49Å; T311-S314 PolarHBondContact O-N 2.91Å; L312-S314 VanDerWaalsContact C-N 3.25Å; L312-S314 PolarHBondContact O-N 2.83Å; S314-R318 PolarHBondContact O-N 3.36Å
315	I	96.3	Very high	94.3	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.4	-47.8	176	-65.9	168.6	0	0	0	110.4	L272 W288 L299 F304 I307 T311 L312 R317 R318 L321	L272-I315 HydrophobicContact CD2-CG1 4.39Å; W288-I315 HydrophobicContact CH2-CG1 3.92Å; W288-I315 HydrophobicContact CZ3-CG1 3.83Å; L299-I315 HydrophobicContact CD2-CG2 4.07Å; F304-I315 HydrophobicContact CD2-CD1 4.2Å; F304-I315 HydrophobicContact CE2-CD1 3.84Å; F304-I315 HydrophobicContact CE2-CG2 4.24Å; I307-I315 HydrophobicContact CD1-CD1 3.83Å; T311-I315 HydrophobicContact CG2-CD1 4.12Å; T311-I315 WeakPolarHBondContact O-CG1 3.47Å; T311-I315 PolarHBondContact O-N 3.26Å; L312-I315 PolarHBondContact O-N 3.06Å; I315-R317 VanDerWaalsContact C-N 3.3Å; I315-R317 PolarHBondContact O-N 3.27Å; I315-R318 WeakPolarHBondContact O-CB 3.5Å; I315-R318 PolarHBondContact O-N 3.23Å; I315-R318 VanDerWaalsContact O-N 3.12Å; I315-L321 HydrophobicContact CG2-CD1 4.28Å; I315-L321 HydrophobicContact CG2-CD2 4.3Å
316	L	96.3	Very high	94.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.8	-30.8	-177.6	-66.4	-179.5	0	0	0	113.2	L312 E313 R318 V328 A359 L362 I363 R410	L312-L316 HydrophobicContact CD1-CD1 4.1Å; L312-L316 HydrophobicContact CD1-CG 4.23Å; L312-L316 HydrophobicContact CD2-CD1 4.43Å; L312-L316 HydrophobicContact CG-CD1 3.95Å; L312-L316 HydrophobicContact CG-CG 4.34Å; L312-L316 WeakPolarHBondContact O-CG 3.41Å; L312-L316 PolarHBondContact O-N 2.94Å; E313-L316 PolarHBondContact O-N 2.85Å; L316-R318 VanDerWaalsContact C-N 3.29Å; L316-R318 PolarHBondContact O-N 3.24Å; L316-V328 HydrophobicContact CD2-CG1 3.36Å; L316-A359 HydrophobicContact CD1-CB 3.97Å; L316-L362 HydrophobicContact CB-CB 3.89Å; L316-L362 HydrophobicContact CB-CD1 4.28Å; L316-I363 HydrophobicContact CD1-CG1 4.3Å; L316-I363 HydrophobicContact CD2-CG1 4.25Å; L316-R410 PolarHBondContact O-NH1 3.17Å; L316-R410 PolarHBondContact O-NH2 2.64Å
317	R	95.5	Very high	94.6	Very high	166 Å²	166	49.1 Å²	49.1	63%	0.626	24%	0.235	S	C	*	.	H	α-helix	trans	-74.4	-19.1	176.4	-175.8	177.5	-93.1	-112	3.1	113.1	E313 I315 E319	E313-R317 VanDerWaalsContact O-CB 3.31Å; E313-R317 WeakPolarHBondContact O-CB 3.43Å; E313-R317 PolarHBondContact O-N 2.84Å; I315-R317 VanDerWaalsContact C-N 3.3Å; I315-R317 PolarHBondContact O-N 3.27Å; R317-E319 PolarHBondContact O-N 2.86Å
318	R	95.1	Very high	94.7	Very high	57 Å²	57	49.1 Å²	49.1	22%	0.215	24%	0.235	C	C	.	.			trans	-67.8	128.4	-167.1	-161.7	163.8	178.5	93.4	9.3	113.4	W288 D292 S314 I315 L316 T320 L321 R410	W288-R318 VanDerWaalsContact CD2-CZ 3.49Å; W288-R318 VanDerWaalsContact CE3-CD 3.46Å; W288-R318 VanDerWaalsContact CE3-CZ 3.41Å; W288-R318 VanDerWaalsContact CE3-NH1 3.31Å; D292-R318 WeakPolarHBondContact OD1-CD 3.38Å; D292-R318 IonicContact OD1-CZ 2.64Å; D292-R318 IonicContact OD1-NE 3.39Å; D292-R318 PolarHBondContact OD1-NE 3.33Å; D292-R318 IonicContact OD1-NH2 2.61Å; D292-R318 IonicContact OD2-CZ 3.93Å; D292-R318 IonicContact OD2-NE 2.88Å; D292-R318 PolarHBondContact OD2-NE 3.01Å; D292-R318 IonicContact OD2-NH2 3.97Å; D292-R318 PolarHBondContact OD2-NH2 2.79Å; S314-R318 PolarHBondContact O-N 3.36Å; I315-R318 WeakPolarHBondContact O-CB 3.5Å; I315-R318 PolarHBondContact O-N 3.23Å; I315-R318 VanDerWaalsContact O-N 3.12Å; L316-R318 VanDerWaalsContact C-N 3.29Å; L316-R318 PolarHBondContact O-N 3.24Å; R318-T320 WeakPolarHBondContact CG-OG1 3.4Å; R318-T320 PolarHBondContact NE-OG1 2.91Å; R318-L321 HydrophobicContact CB-CB 4.5Å; R318-R410 PolarHBondContact O-NH1 3.35Å
319	E	94.9	Very high	94.9	Very high	77 Å²	77	46.4 Å²	46.4	36%	0.36	22%	0.221	S	C	.	.	S	Bend	trans	-78	-25.9	-179.5	-71.7	-64.9	153.7	0	0	113.8	R317 R364 K411 G412	R317-E319 PolarHBondContact O-N 2.86Å; E319-R364 IonicContact OE1-CZ 2.75Å; E319-R364 IonicContact OE1-NH1 3.05Å; E319-R364 PolarHBondContact OE1-NH1 2.87Å; E319-R364 IonicContact OE1-NH2 3.35Å; E319-R364 PolarHBondContact OE1-NH2 2.93Å; E319-R364 IonicContact OE2-CZ 3.38Å; E319-R364 IonicContact OE2-NH1 3.27Å; E319-R364 PolarHBondContact OE2-NH1 2.86Å; E319-R364 IonicContact OE2-NH2 2.7Å; E319-R364 PolarHBondContact OE2-NH2 2.87Å; E319-K411 PolarHBondContact O-N 2.89Å; E319-K411 VanDerWaalsContact O-N 3.14Å; E319-G412 PolarHBondContact O-N 3.14Å
320	T	95.3	Very high	95	Very high	47 Å²	47	47 Å²	47	29%	0.288	23%	0.225	S	C	.	.	S	Bend	trans	-89.6	-3.5	-173.4	45.2	0	0	0	0	113.8	D292 R318 N322 L413	D292-T320 PolarHBondContact OD1-OG1 3.44Å; D292-T320 WeakPolarHBondContact OD2-CB 3.47Å; D292-T320 PolarHBondContact OD2-OG1 2.93Å; R318-T320 WeakPolarHBondContact CG-OG1 3.4Å; R318-T320 PolarHBondContact NE-OG1 2.91Å; T320-N322 PolarHBondContact O-N 3.03Å; T320-N322 VanDerWaalsContact O-N 3.11Å; T320-L413 HydrophobicContact CG2-CD2 4.45Å
321	L	94.4	Very high	95.2	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	19%	0.194	C	C	.	.			trans	-62.5	110.2	-178.7	-169.6	72.6	0	0	0	110.8	I291 A295 L299 I315 R318 A323 V328	I291-L321 HydrophobicContact CG2-CD1 3.84Å; A295-L321 HydrophobicContact CB-CD1 3.52Å; A295-L321 HydrophobicContact CB-CG 3.84Å; L299-L321 HydrophobicContact CD1-CD2 4.3Å; I315-L321 HydrophobicContact CG2-CD1 4.28Å; I315-L321 HydrophobicContact CG2-CD2 4.3Å; R318-L321 HydrophobicContact CB-CB 4.5Å; L321-A323 VanDerWaalsContact C-N 3.3Å; L321-A323 PolarHBondContact O-N 3.18Å; L321-V328 HydrophobicContact CD2-CG2 3.96Å
322	N	91.8	Very high	95.3	Very high	59 Å²	59	39.8 Å²	39.8	32%	0.316	19%	0.191	S	C	.	.			trans	-85.2	64.1	-175.4	-170.1	38.7	0	0	0	112.2	D292 T320 L413	D292-N322 WeakPolarHBondContact O-CB 3.35Å; D292-N322 PolarHBondContact O-N 3.11Å; D292-N322 VanDerWaalsContact O-N 3.14Å; T320-N322 PolarHBondContact O-N 3.03Å; T320-N322 VanDerWaalsContact O-N 3.11Å; N322-L413 HydrophobicContact CB-CD1 4.41Å
323	A	93.3	Very high	95.3	Very high	23 Å²	23	41 Å²	41	19%	0.19	20%	0.197	C	C	.	.	S	Bend	trans	-135.6	152.7	177.7	0	0	0	0	0	111.6	A295 L299 L321 V328	A295-A323 HydrophobicContact CB-CB 3.75Å; L299-A323 HydrophobicContact CD1-CB 4Å; L321-A323 VanDerWaalsContact C-N 3.3Å; L321-A323 PolarHBondContact O-N 3.18Å; A323-V328 HydrophobicContact CB-CG2 4.2Å
324	K	93	Very high	95.3	Very high	145 Å²	145	41.6 Å²	41.6	63%	0.63	20%	0.202	S	C	*	.			trans	-66.4	142.5	166.9	-62.8	-179.6	-177.3	176.5	0	109.3	I326 V327 V328	K324-I326 HydrophobicContact CB-CG2 3.99Å; K324-I326 PolarHBondContact O-N 3.46Å; K324-V327 HydrophobicContact CB-CG2 4.37Å; K324-V327 WeakPolarHBondContact O-CB 3.36Å; K324-V327 PolarHBondContact O-N 3.07Å; K324-V328 PolarHBondContact O-N 2.95Å
325	E	94.8	Very high	95.4	Very high	13 Å²	13	39.1 Å²	39.1	6%	0.061	19%	0.185	C	C	.	.	H	α-helix	trans	-66.6	-25.9	-174.7	-159.9	68.2	-162.8	0	0	112.8	V327 V328 F329 I363 R364 M368 R410	E325-V327 VanDerWaalsContact C-N 3.3Å; E325-V327 PolarHBondContact O-N 3.47Å; E325-V328 WeakPolarHBondContact O-CB 3.33Å; E325-V328 PolarHBondContact O-N 3.43Å; E325-F329 PolarHBondContact O-N 2.69Å; E325-I363 HydrophobicContact CG-CG2 4.07Å; E325-I363 WeakPolarHBondContact OE1-CA 3.32Å; E325-I363 WeakPolarHBondContact OE1-CG2 3.28Å; E325-R364 HydrophobicContact CG-CB 4.02Å; E325-R364 PolarHBondContact OE1-N 3.18Å; E325-M368 HydrophobicContact CB-CE 4.23Å; E325-M368 HydrophobicContact CB-CG 3.79Å; E325-M368 HydrophobicContact CG-CE 3.93Å; E325-M368 HydrophobicContact CG-CG 4.24Å; E325-M368 WeakPolarHBondContact O-CE 3.17Å; E325-R410 IonicContact OE1-CZ 2.79Å; E325-R410 IonicContact OE1-NE 3.75Å; E325-R410 IonicContact OE1-NH2 2.83Å; E325-R410 PolarHBondContact OE1-NH2 3.33Å; E325-R410 IonicContact OE2-CZ 3.4Å; E325-R410 IonicContact OE2-NE 3.19Å; E325-R410 PolarHBondContact OE2-NE 3.41Å; E325-R410 IonicContact OE2-NH2 3.9Å; E325-R410 PolarHBondContact OE2-NH2 3.43Å
326	I	94.9	Very high	95.3	Very high	19 Å²	19	39.1 Å²	39.1	10%	0.097	19%	0.185	C	C	.	.	H	α-helix	trans	-58.5	-41	171.9	-173.7	58.8	0	0	0	112.1	K324 V328 F329 E330 D372	K324-I326 HydrophobicContact CB-CG2 3.99Å; K324-I326 PolarHBondContact O-N 3.46Å; I326-V328 VanDerWaalsContact C-N 3.34Å; I326-V328 PolarHBondContact O-N 2.8Å; I326-F329 HydrophobicContact CD1-CD1 4.43Å; I326-F329 WeakPolarHBondContact O-CB 3.46Å; I326-F329 PolarHBondContact O-N 2.72Å; I326-E330 WeakPolarHBondContact O-CG 3.29Å; I326-E330 PolarHBondContact O-N 3.03Å; I326-D372 HydrophobicContact CB-CB 4.11Å; I326-D372 HydrophobicContact CD1-CB 4.34Å; I326-D372 HydrophobicContact CG1-CB 4.19Å
327	V	95.6	Very high	95.3	Very high	7 Å²	7	42.1 Å²	42.1	4%	0.042	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-40	176.7	178.4	0	0	0	0	110.7	E296 L299 K300 K324 E325 F329 E330 A331	E296-V327 HydrophobicContact CB-CG1 4.37Å; E296-V327 HydrophobicContact CG-CG1 4.02Å; E296-V327 HydrophobicContact CG-CG2 4.32Å; L299-V327 HydrophobicContact CB-CG1 4.33Å; L299-V327 HydrophobicContact CD1-CG1 4.23Å; K300-V327 HydrophobicContact CG-CG1 4.43Å; K324-V327 HydrophobicContact CB-CG2 4.37Å; K324-V327 WeakPolarHBondContact O-CB 3.36Å; K324-V327 PolarHBondContact O-N 3.07Å; E325-V327 VanDerWaalsContact C-N 3.3Å; E325-V327 PolarHBondContact O-N 3.47Å; V327-F329 VanDerWaalsContact C-N 3.31Å; V327-F329 PolarHBondContact O-N 2.92Å; V327-E330 PolarHBondContact O-N 2.83Å; V327-A331 VanDerWaalsContact O-CB 3.25Å; V327-A331 WeakPolarHBondContact O-CB 3.44Å; V327-A331 PolarHBondContact O-N 2.78Å
328	V	96.8	Very high	95.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-41.9	176.1	-178.6	0	0	0	0	110.8	L299 L316 L321 A323 K324 E325 I326 A332	L299-V328 HydrophobicContact CD1-CG2 3.88Å; L316-V328 HydrophobicContact CD2-CG1 3.36Å; L321-V328 HydrophobicContact CD2-CG2 3.96Å; A323-V328 HydrophobicContact CB-CG2 4.2Å; K324-V328 PolarHBondContact O-N 2.95Å; E325-V328 WeakPolarHBondContact O-CB 3.33Å; E325-V328 PolarHBondContact O-N 3.43Å; I326-V328 VanDerWaalsContact C-N 3.34Å; I326-V328 PolarHBondContact O-N 2.8Å; V328-A332 WeakPolarHBondContact O-CB 3.45Å; V328-A332 PolarHBondContact O-N 2.9Å
329	F	96.6	Very high	95.2	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.018	18%	0.178	C	C	.	.	H	α-helix	trans	-64.3	-51.4	177.1	177.4	-102	0	0	0	112.4	E325 I326 V327 A331 A332 L333 I363 I365 M368 A377	E325-F329 PolarHBondContact O-N 2.69Å; I326-F329 HydrophobicContact CD1-CD1 4.43Å; I326-F329 WeakPolarHBondContact O-CB 3.46Å; I326-F329 PolarHBondContact O-N 2.72Å; V327-F329 VanDerWaalsContact C-N 3.31Å; V327-F329 PolarHBondContact O-N 2.92Å; F329-A331 VanDerWaalsContact C-N 3.32Å; F329-A331 PolarHBondContact O-N 3.42Å; F329-A332 PolarHBondContact O-N 3.29Å; F329-L333 HydrophobicContact CD1-CD1 4.2Å; F329-L333 HydrophobicContact CE1-CD1 3.54Å; F329-L333 HydrophobicContact CE1-CG 4.22Å; F329-L333 HydrophobicContact CE2-CD1 4.47Å; F329-L333 HydrophobicContact CE2-CD2 4.4Å; F329-L333 HydrophobicContact CE2-CG 4.48Å; F329-L333 HydrophobicContact CZ-CD1 3.7Å; F329-L333 HydrophobicContact CZ-CD2 4.32Å; F329-L333 HydrophobicContact CZ-CG 4.18Å; F329-L333 WeakPolarHBondContact O-CG 3.22Å; F329-L333 PolarHBondContact O-N 2.9Å; F329-I363 HydrophobicContact CB-CG2 4.11Å; F329-I363 HydrophobicContact CD2-CD1 4.25Å; F329-I363 HydrophobicContact CD2-CG2 4.4Å; F329-I365 HydrophobicContact CD2-CD1 4.27Å; F329-I365 HydrophobicContact CE2-CD1 4.28Å; F329-M368 HydrophobicContact CB-CE 3.42Å; F329-M368 VanDerWaalsContact CB-CE 3.42Å; F329-M368 HydrophobicContact CD2-CE 4.45Å; F329-M368 HydrophobicContact CG-CE 3.97Å; F329-A377 HydrophobicContact CD1-CB 4.34Å; F329-A377 HydrophobicContact CE1-CB 3.97Å; F329-A377 HydrophobicContact CE2-CB 4.35Å; F329-A377 HydrophobicContact CZ-CB 3.98Å
330	E	95.9	Very high	95.2	Very high	92 Å²	92	31.4 Å²	31.4	43%	0.43	16%	0.161	S	C	.	.	H	α-helix	trans	-57.8	-44.7	177.1	-71.7	174.5	176.2	0	0	111.9	I326 V327 A332 L333 N334	I326-E330 WeakPolarHBondContact O-CG 3.29Å; I326-E330 PolarHBondContact O-N 3.03Å; V327-E330 PolarHBondContact O-N 2.83Å; E330-A332 PolarHBondContact O-N 2.88Å; E330-L333 PolarHBondContact O-N 2.89Å; E330-N334 VanDerWaalsContact O-CG 3.3Å; E330-N334 PolarHBondContact O-N 2.96Å; E330-N334 PolarHBondContact O-ND2 2.88Å
331	A	96.8	Very high	95.1	Very high	4 Å²	4	34.1 Å²	34.1	3%	0.033	17%	0.171	C	C	.	.	H	α-helix	trans	-61.3	-42.6	177.6	0	0	0	0	0	112.1	L299 F304 V327 F329 L333 N334 W335	L299-A331 HydrophobicContact CB-CB 3.78Å; L299-A331 HydrophobicContact CD2-CB 4.22Å; L299-A331 HydrophobicContact CG-CB 4.46Å; L299-A331 WeakPolarHBondContact O-CB 3.21Å; F304-A331 HydrophobicContact CD1-CB 4.12Å; F304-A331 HydrophobicContact CE1-CB 3.78Å; F304-A331 WeakPolarHBondContact CE1-O 3.39Å; F304-A331 HydrophobicContact CZ-CB 4.36Å; V327-A331 VanDerWaalsContact O-CB 3.25Å; V327-A331 WeakPolarHBondContact O-CB 3.44Å; V327-A331 PolarHBondContact O-N 2.78Å; F329-A331 VanDerWaalsContact C-N 3.32Å; F329-A331 PolarHBondContact O-N 3.42Å; A331-L333 VanDerWaalsContact C-N 3.32Å; A331-L333 PolarHBondContact O-N 3.13Å; A331-N334 PolarHBondContact O-N 2.98Å; A331-W335 PolarHBondContact O-N 2.84Å
332	A	96.9	Very high	95	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-38.1	175.8	0	0	0	0	0	112.1	V328 F329 E330 W335 A336 L356 I363	V328-A332 WeakPolarHBondContact O-CB 3.45Å; V328-A332 PolarHBondContact O-N 2.9Å; F329-A332 PolarHBondContact O-N 3.29Å; E330-A332 PolarHBondContact O-N 2.88Å; A332-W335 PolarHBondContact O-N 2.7Å; A332-A336 WeakPolarHBondContact O-CB 3.36Å; A332-A336 PolarHBondContact O-N 2.97Å; A332-L356 HydrophobicContact CB-CD2 4.14Å; A332-I363 HydrophobicContact CB-CD1 3.6Å
333	L	95.7	Very high	95.1	Very high	25 Å²	25	40.2 Å²	40.2	13%	0.131	19%	0.193	C	C	.	.	H	α-helix	trans	-66.6	-39.8	175.4	-64.3	-170	0	0	0	112.6	F329 E330 A331 A336 E337 L356 V382	F329-L333 HydrophobicContact CD1-CD1 4.2Å; F329-L333 HydrophobicContact CE1-CD1 3.54Å; F329-L333 HydrophobicContact CE1-CG 4.22Å; F329-L333 HydrophobicContact CE2-CD1 4.47Å; F329-L333 HydrophobicContact CE2-CD2 4.4Å; F329-L333 HydrophobicContact CE2-CG 4.48Å; F329-L333 HydrophobicContact CZ-CD1 3.7Å; F329-L333 HydrophobicContact CZ-CD2 4.32Å; F329-L333 HydrophobicContact CZ-CG 4.18Å; F329-L333 WeakPolarHBondContact O-CG 3.22Å; F329-L333 PolarHBondContact O-N 2.9Å; E330-L333 PolarHBondContact O-N 2.89Å; A331-L333 VanDerWaalsContact C-N 3.32Å; A331-L333 PolarHBondContact O-N 3.13Å; L333-A336 PolarHBondContact O-N 3.49Å; L333-E337 PolarHBondContact O-N 3.1Å; L333-L356 HydrophobicContact CD2-CD1 4.02Å; L333-V382 HydrophobicContact CD1-CG2 4.41Å; L333-V382 HydrophobicContact CD2-CB 4.39Å; L333-V382 HydrophobicContact CD2-CG1 4.18Å; L333-V382 HydrophobicContact CD2-CG2 3.72Å
334	N	95.6	Very high	95.1	Very high	81 Å²	81	46.3 Å²	46.3	43%	0.433	22%	0.223	S	C	.	.	H	α-helix	trans	-65	-43.2	175.9	-68	-19.8	0	0	0	111.2	E330 A331 A336 E337 V338	E330-N334 VanDerWaalsContact O-CG 3.3Å; E330-N334 PolarHBondContact O-N 2.96Å; E330-N334 PolarHBondContact O-ND2 2.88Å; A331-N334 PolarHBondContact O-N 2.98Å; N334-A336 VanDerWaalsContact C-N 3.34Å; N334-A336 PolarHBondContact O-N 2.85Å; N334-E337 WeakPolarHBondContact O-CB 3.22Å; N334-E337 PolarHBondContact O-N 3Å; N334-V338 PolarHBondContact O-N 2.65Å
335	W	97.1	Very high	95.1	Very high	2 Å²	2	42 Å²	42	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-45.2	172.8	178.2	93.3	0	0	0	111.4	F304 I307 F309 L312 A331 A332 E337 V338 E339 V355 L356	F304-W335 HydrophobicContact CD1-CB 4.31Å; F304-W335 HydrophobicContact CE1-CB 3.91Å; I307-W335 PolarHBondContact O-NE1 3.45Å; F309-W335 HydrophobicContact CB-CH2 4.35Å; F309-W335 HydrophobicContact CB-CZ2 4.33Å; F309-W335 AromaticContact CD2-CH2 3.71Å; F309-W335 HydrophobicContact CD2-CH2 3.71Å; F309-W335 HydrophobicContact CD2-CZ2 4.41Å; F309-W335 HydrophobicContact CD2-CZ3 4.33Å; L312-W335 HydrophobicContact CD1-CD2 4.33Å; L312-W335 HydrophobicContact CD1-CG 4.19Å; L312-W335 HydrophobicContact CD2-CD2 3.62Å; L312-W335 HydrophobicContact CD2-CE3 3.45Å; L312-W335 VanDerWaalsContact CD2-CE3 3.45Å; L312-W335 HydrophobicContact CD2-CG 4.34Å; L312-W335 HydrophobicContact CD2-CH2 3.96Å; L312-W335 HydrophobicContact CD2-CZ2 4.06Å; L312-W335 HydrophobicContact CD2-CZ3 3.64Å; L312-W335 HydrophobicContact CG-CD2 4.44Å; A331-W335 PolarHBondContact O-N 2.84Å; A332-W335 PolarHBondContact O-N 2.7Å; W335-E337 VanDerWaalsContact C-N 3.29Å; W335-E337 PolarHBondContact O-N 3.38Å; W335-V338 PolarHBondContact O-N 3.37Å; W335-E339 HydrophobicContact CD2-CB 4.49Å; W335-E339 HydrophobicContact CE3-CB 4.34Å; W335-E339 HydrophobicContact CH2-CB 3.92Å; W335-E339 HydrophobicContact CH2-CG 3.67Å; W335-E339 HydrophobicContact CZ2-CB 4.13Å; W335-E339 HydrophobicContact CZ2-CG 3.99Å; W335-E339 HydrophobicContact CZ3-CB 4.06Å; W335-E339 HydrophobicContact CZ3-CG 4.21Å; W335-E339 WeakPolarHBondContact O-CB 3.15Å; W335-E339 PolarHBondContact O-N 2.93Å; W335-V355 HydrophobicContact CH2-CG1 4.23Å; W335-V355 HydrophobicContact CZ3-CG1 4.1Å; W335-L356 HydrophobicContact CE3-CD2 3.95Å; W335-L356 HydrophobicContact CZ3-CD2 4.17Å
336	A	96.2	Very high	94.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-36.1	-180	0	0	0	0	0	112.5	A332 L333 N334 E339 C340 K352 L356	A332-A336 WeakPolarHBondContact O-CB 3.36Å; A332-A336 PolarHBondContact O-N 2.97Å; L333-A336 PolarHBondContact O-N 3.49Å; N334-A336 VanDerWaalsContact C-N 3.34Å; N334-A336 PolarHBondContact O-N 2.85Å; A336-E339 PolarHBondContact O-N 2.87Å; A336-C340 PolarHBondContact O-N 3.22Å; A336-C340 PolarHBondContact O-SG 3.46Å; A336-K352 HydrophobicContact CB-CB 4.09Å; A336-K352 HydrophobicContact CB-CG 4.28Å; A336-L356 HydrophobicContact CB-CD1 3.91Å; A336-L356 HydrophobicContact CB-CD2 4.05Å; A336-L356 HydrophobicContact CB-CG 3.66Å
337	E	94.9	Very high	94.8	Very high	62 Å²	62	48.4 Å²	48.4	29%	0.29	25%	0.251	S	S	.	.	H	α-helix	trans	-62	-48.6	175	-173.3	165.6	160.6	0	0	112.2	L333 N334 W335 E339 C340 Q341 L347 K352	L333-E337 PolarHBondContact O-N 3.1Å; N334-E337 WeakPolarHBondContact O-CB 3.22Å; N334-E337 PolarHBondContact O-N 3Å; W335-E337 VanDerWaalsContact C-N 3.29Å; W335-E337 PolarHBondContact O-N 3.38Å; E337-E339 VanDerWaalsContact C-N 3.31Å; E337-E339 PolarHBondContact O-N 3.22Å; E337-C340 WeakPolarHBondContact O-CB 3.38Å; E337-C340 PolarHBondContact O-N 2.97Å; E337-Q341 WeakPolarHBondContact O-CG 3.5Å; E337-Q341 PolarHBondContact O-N 3.28Å; E337-L347 HydrophobicContact CG-CD1 4.28Å; E337-L347 HydrophobicContact CG-CD2 3.81Å; E337-K352 IonicContact OE2-NZ 3.95Å; E337-K352 PolarHBondContact OE2-NZ 3.09Å
338	V	94.6	Very high	94.7	Very high	41 Å²	41	49.7 Å²	49.7	25%	0.248	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-37.7	178.1	175.5	0	0	0	0	110.9	C305 N334 W335 Q341 R342	C305-V338 HydrophobicContact CB-CB 4.16Å; C305-V338 HydrophobicContact CB-CG1 4.35Å; C305-V338 HydrophobicContact CB-CG2 3.84Å; N334-V338 PolarHBondContact O-N 2.65Å; W335-V338 PolarHBondContact O-N 3.37Å; V338-Q341 WeakPolarHBondContact O-CB 3.29Å; V338-Q341 PolarHBondContact O-N 3.45Å; V338-R342 WeakPolarHBondContact O-CG 2.81Å; V338-R342 PolarHBondContact O-N 3.45Å
339	E	94.6	Very high	94.4	Very high	35 Å²	35	53.2 Å²	53.2	16%	0.164	28%	0.278	C	S	.	.	H	α-helix	trans	-69.7	-34.2	177.4	-170.3	62.6	-156.2	0	0	112.3	W335 A336 E337 Q341 R342 Q343 V355	W335-E339 HydrophobicContact CD2-CB 4.49Å; W335-E339 HydrophobicContact CE3-CB 4.34Å; W335-E339 HydrophobicContact CH2-CB 3.92Å; W335-E339 HydrophobicContact CH2-CG 3.67Å; W335-E339 HydrophobicContact CZ2-CB 4.13Å; W335-E339 HydrophobicContact CZ2-CG 3.99Å; W335-E339 HydrophobicContact CZ3-CB 4.06Å; W335-E339 HydrophobicContact CZ3-CG 4.21Å; W335-E339 WeakPolarHBondContact O-CB 3.15Å; W335-E339 PolarHBondContact O-N 2.93Å; A336-E339 PolarHBondContact O-N 2.87Å; E337-E339 VanDerWaalsContact C-N 3.31Å; E337-E339 PolarHBondContact O-N 3.22Å; E339-Q341 VanDerWaalsContact C-N 3.3Å; E339-Q341 PolarHBondContact O-N 3.06Å; E339-R342 PolarHBondContact O-N 2.64Å; E339-R342 VanDerWaalsContact OE2-CD 3.24Å; E339-R342 WeakPolarHBondContact OE2-CD 3.49Å; E339-R342 IonicContact OE2-CZ 2.7Å; E339-R342 IonicContact OE2-NH1 2.7Å; E339-R342 PolarHBondContact OE2-NH1 3.16Å; E339-Q343 WeakPolarHBondContact O-CG 3.44Å; E339-Q343 PolarHBondContact O-N 2.82Å; E339-Q343 PolarHBondContact OE1-NE2 2.81Å; E339-V355 HydrophobicContact CB-CG1 3.81Å; E339-V355 HydrophobicContact CG-CG1 3.27Å
340	C	94.6	Very high	94.2	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-57.4	-44.8	168.5	-72.9	0	0	0	0	111.3	A336 E337 R342 Q343 D344 L345 L347 V355	A336-C340 PolarHBondContact O-N 3.22Å; A336-C340 PolarHBondContact O-SG 3.46Å; E337-C340 WeakPolarHBondContact O-CB 3.38Å; E337-C340 PolarHBondContact O-N 2.97Å; C340-R342 VanDerWaalsContact C-N 3.33Å; C340-R342 PolarHBondContact O-N 3.02Å; C340-Q343 CarbonylContact O-C 3.52Å; C340-Q343 PolarHBondContact O-N 2.88Å; C340-D344 PolarHBondContact O-N 2.88Å; C340-L345 HydrophobicContact CB-CB 4.26Å; C340-L345 PolarHBondContact O-N 3.46Å; C340-L347 HydrophobicContact CB-CD2 3.87Å; C340-V355 VanDerWaalsContact SG-CG2 3.5Å
341	Q	93.6	Very high	94.1	Very high	104 Å²	104	56.6 Å²	56.6	49%	0.486	30%	0.295	S	S	.	.	H	α-helix	trans	-63.3	-39	177.6	-63.6	173.9	7	0	0	111.8	E337 V338 E339 Q343 D344 L347	E337-Q341 WeakPolarHBondContact O-CG 3.5Å; E337-Q341 PolarHBondContact O-N 3.28Å; V338-Q341 WeakPolarHBondContact O-CB 3.29Å; V338-Q341 PolarHBondContact O-N 3.45Å; E339-Q341 VanDerWaalsContact C-N 3.3Å; E339-Q341 PolarHBondContact O-N 3.06Å; Q341-Q343 VanDerWaalsContact C-N 3.29Å; Q341-Q343 PolarHBondContact O-N 3.4Å; Q341-D344 PolarHBondContact O-N 3.48Å; Q341-L347 HydrophobicContact CG-CD2 3.92Å
342	R	92.5	Very high	94	Very high	87 Å²	87	58.3 Å²	58.3	33%	0.328	30%	0.302	S	S	.	.	H	α-helix	trans	-66	-30.3	177	-74	177.1	-177.5	146.3	13.2	114	C305 D306 V338 E339 C340 D344	C305-R342 PolarHBondContact O-NH1 3.24Å; C305-R342 PolarHBondContact O-NH2 2.96Å; D306-R342 VanDerWaalsContact CA-NH2 3.27Å; D306-R342 IonicContact OD1-NH2 2.78Å; D306-R342 PolarHBondContact OD1-NH2 3.15Å; V338-R342 WeakPolarHBondContact O-CG 2.81Å; V338-R342 PolarHBondContact O-N 3.45Å; E339-R342 PolarHBondContact O-N 2.64Å; E339-R342 VanDerWaalsContact OE2-CD 3.24Å; E339-R342 WeakPolarHBondContact OE2-CD 3.49Å; E339-R342 IonicContact OE2-CZ 2.7Å; E339-R342 IonicContact OE2-NH1 2.7Å; E339-R342 PolarHBondContact OE2-NH1 3.16Å; C340-R342 VanDerWaalsContact C-N 3.33Å; C340-R342 PolarHBondContact O-N 3.02Å; R342-D344 VanDerWaalsContact C-N 3.29Å
343	Q	93.3	Very high	93.9	Very high	100 Å²	100	61 Å²	61	47%	0.467	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	8.7	177.3	-63.6	-175.6	23.2	0	0	112.6	E339 C340 Q341 L345	E339-Q343 WeakPolarHBondContact O-CG 3.44Å; E339-Q343 PolarHBondContact O-N 2.82Å; E339-Q343 PolarHBondContact OE1-NE2 2.81Å; C340-Q343 CarbonylContact O-C 3.52Å; C340-Q343 PolarHBondContact O-N 2.88Å; Q341-Q343 VanDerWaalsContact C-N 3.29Å; Q341-Q343 PolarHBondContact O-N 3.4Å; Q343-L345 HydrophobicContact CB-CD1 3.98Å; Q343-L345 HydrophobicContact CB-CG 3.9Å; Q343-L345 PolarHBondContact O-N 3.25Å
344	D	93	Very high	93.8	Very high	151 Å²	151	67.2 Å²	67.2	81%	0.807	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	36.3	-176.4	-63.7	-53.8	0	0	0	112.7	C340 Q341 R342	C340-D344 PolarHBondContact O-N 2.88Å; Q341-D344 PolarHBondContact O-N 3.48Å; R342-D344 VanDerWaalsContact C-N 3.29Å
345	L	92.6	Very high	93.8	Very high	55 Å²	55	64.1 Å²	64.1	29%	0.288	32%	0.322	S	S	.	.			trans	-95.7	146.2	177.4	-61	176.1	0	0	0	111	C340 Q343 V355	C340-L345 HydrophobicContact CB-CB 4.26Å; C340-L345 PolarHBondContact O-N 3.46Å; Q343-L345 HydrophobicContact CB-CD1 3.98Å; Q343-L345 HydrophobicContact CB-CG 3.9Å; Q343-L345 PolarHBondContact O-N 3.25Å; L345-V355 HydrophobicContact CD1-CG2 4.29Å
346	A	92.2	Very high	93.7	Very high	73 Å²	73	64 Å²	64	60%	0.603	32%	0.322	S	S	*	.			trans	-61.7	141.7	172	0	0	0	0	0	110.9	S348 N351	A346-S348 VanDerWaalsContact C-N 3.31Å; A346-S348 PolarHBondContact O-N 2.99Å; A346-N351 PolarHBondContact O-ND2 3.17Å
347	L	91.6	Very high	93.6	Very high	93 Å²	93	65.6 Å²	65.6	49%	0.487	34%	0.338	S	S	.	.			trans	-73	84.5	177	-62.8	-176.5	0	0	0	110.4	E337 C340 Q341	E337-L347 HydrophobicContact CG-CD1 4.28Å; E337-L347 HydrophobicContact CG-CD2 3.81Å; C340-L347 HydrophobicContact CB-CD2 3.87Å; Q341-L347 HydrophobicContact CG-CD2 3.92Å
348	S	93.2	Very high	93.5	Very high	35 Å²	35	70.9 Å²	70.9	25%	0.245	36%	0.36	C	S	.	.			trans	-122.9	157.7	173.8	95.5	0	0	0	0	110.9	A346 E350 N351 K352	A346-S348 VanDerWaalsContact C-N 3.31Å; A346-S348 PolarHBondContact O-N 2.99Å; S348-E350 VanDerWaalsContact C-N 3.3Å; S348-E350 VanDerWaalsContact CB-OE2 3.27Å; S348-E350 WeakPolarHBondContact CB-OE2 3.06Å; S348-E350 PolarHBondContact O-N 3.1Å; S348-E350 PolarHBondContact OG-N 3.27Å; S348-E350 PolarHBondContact OG-OE2 3.16Å; S348-N351 PolarHBondContact O-N 2.66Å; S348-N351 PolarHBondContact OG-N 3.24Å; S348-K352 WeakPolarHBondContact O-CG 3.43Å; S348-K352 PolarHBondContact O-N 3.37Å
349	I	91.9	Very high	93.6	Very high	74 Å²	74	68.9 Å²	68.9	38%	0.379	35%	0.348	S	S	.	.	H	α-helix	trans	-63.9	-39	-179.8	-63	174.3	0	0	0	110.5	N351 K352 R353 G381 V382	I349-N351 VanDerWaalsContact C-N 3.34Å; I349-N351 PolarHBondContact O-N 3.16Å; I349-K352 PolarHBondContact O-N 3.24Å; I349-R353 WeakPolarHBondContact O-CB 3.45Å; I349-R353 PolarHBondContact O-N 3.19Å; I349-G381 VanDerWaalsContact CG2-O 3.23Å; I349-G381 WeakPolarHBondContact CG2-O 3.39Å; I349-V382 HydrophobicContact CG2-CB 4.48Å; I349-V382 HydrophobicContact CG2-CG2 3.9Å
350	E	92.4	Very high	93.6	Very high	133 Å²	133	67.3 Å²	67.3	62%	0.621	34%	0.34	S	S	*	.	H	α-helix	trans	-63.2	-41.9	177.1	-56	75.3	-164.2	0	0	111	S348 R353 K354	S348-E350 VanDerWaalsContact C-N 3.3Å; S348-E350 VanDerWaalsContact CB-OE2 3.27Å; S348-E350 WeakPolarHBondContact CB-OE2 3.06Å; S348-E350 PolarHBondContact O-N 3.1Å; S348-E350 PolarHBondContact OG-N 3.27Å; S348-E350 PolarHBondContact OG-OE2 3.16Å; E350-R353 PolarHBondContact O-N 3.06Å; E350-K354 VanDerWaalsContact O-CB 3.28Å; E350-K354 WeakPolarHBondContact O-CB 3.39Å; E350-K354 PolarHBondContact O-N 2.99Å
351	N	93.8	Very high	93.7	Very high	34 Å²	34	70.3 Å²	70.3	18%	0.182	35%	0.352	C	S	.	.	H	α-helix	trans	-66	-48.1	175.9	-74.4	-23.6	0	0	0	110.5	A346 S348 I349 R353 K354 V355	A346-N351 PolarHBondContact O-ND2 3.17Å; S348-N351 PolarHBondContact O-N 2.66Å; S348-N351 PolarHBondContact OG-N 3.24Å; I349-N351 VanDerWaalsContact C-N 3.34Å; I349-N351 PolarHBondContact O-N 3.16Å; N351-R353 VanDerWaalsContact C-N 3.3Å; N351-R353 PolarHBondContact O-N 2.94Å; N351-K354 WeakPolarHBondContact O-CA 3.46Å; N351-K354 WeakPolarHBondContact O-CB 3.4Å; N351-K354 PolarHBondContact O-N 2.87Å; N351-V355 WeakPolarHBondContact O-CG2 3.24Å; N351-V355 PolarHBondContact O-N 3.33Å
352	K	94.3	Very high	93.8	Very high	40 Å²	40	66.7 Å²	66.7	17%	0.174	34%	0.336	C	S	.	.	H	α-helix	trans	-53.5	-46.8	175.6	-72.1	-175.1	179.4	-164.3	0	111.6	A336 E337 S348 I349 K354 V355 L356	A336-K352 HydrophobicContact CB-CB 4.09Å; A336-K352 HydrophobicContact CB-CG 4.28Å; E337-K352 IonicContact OE2-NZ 3.95Å; E337-K352 PolarHBondContact OE2-NZ 3.09Å; S348-K352 WeakPolarHBondContact O-CG 3.43Å; S348-K352 PolarHBondContact O-N 3.37Å; I349-K352 PolarHBondContact O-N 3.24Å; K352-K354 PolarHBondContact O-N 3.25Å; K352-V355 PolarHBondContact O-N 3.27Å; K352-L356 WeakPolarHBondContact O-CG 3.37Å; K352-L356 PolarHBondContact O-N 3.1Å
353	R	94.9	Very high	94	Very high	56 Å²	56	62.6 Å²	62.6	21%	0.211	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-42.6	175.7	-172.3	-178.3	175	104.8	1	112	I349 E350 N351 L356 G357 L360 Y361 V382 E387	I349-R353 WeakPolarHBondContact O-CB 3.45Å; I349-R353 PolarHBondContact O-N 3.19Å; E350-R353 PolarHBondContact O-N 3.06Å; N351-R353 VanDerWaalsContact C-N 3.3Å; N351-R353 PolarHBondContact O-N 2.94Å; R353-L356 PolarHBondContact O-N 2.75Å; R353-G357 PolarHBondContact O-N 3.4Å; R353-L360 HydrophobicContact CG-CD2 4.09Å; R353-Y361 PolarHBondContact NH2-OH 3.28Å; R353-V382 HydrophobicContact CB-CG1 4.39Å; R353-V382 WeakPolarHBondContact CD-O 3.49Å; R353-V382 PolarHBondContact NH1-O 3.39Å; R353-E387 IonicContact CZ-OE1 3.74Å; R353-E387 IonicContact CZ-OE2 2.9Å; R353-E387 IonicContact NH1-OE1 3.79Å; R353-E387 IonicContact NH1-OE2 2.69Å; R353-E387 PolarHBondContact NH1-OE2 3.34Å; R353-E387 VanDerWaalsContact NH2-CD 3.29Å; R353-E387 IonicContact NH2-OE1 2.95Å; R353-E387 PolarHBondContact NH2-OE1 3.23Å; R353-E387 IonicContact NH2-OE2 2.78Å; R353-E387 PolarHBondContact NH2-OE2 2.87Å
354	K	94.1	Very high	94.1	Very high	155 Å²	155	58.2 Å²	58.2	67%	0.674	30%	0.3	S	S	*	.	H	α-helix	trans	-62.2	-42.4	178.9	-177.1	-176.4	177.6	-174	0	111.9	E350 N351 K352 G357	E350-K354 VanDerWaalsContact O-CB 3.28Å; E350-K354 WeakPolarHBondContact O-CB 3.39Å; E350-K354 PolarHBondContact O-N 2.99Å; N351-K354 WeakPolarHBondContact O-CA 3.46Å; N351-K354 WeakPolarHBondContact O-CB 3.4Å; N351-K354 PolarHBondContact O-N 2.87Å; K352-K354 PolarHBondContact O-N 3.25Å; K354-G357 PolarHBondContact O-N 2.81Å
355	V	95.2	Very high	94.1	Very high	16 Å²	16	51 Å²	51	10%	0.097	26%	0.261	C	S	.	.	H	α-helix	trans	-71.4	-39.2	-179.2	-161.7	0	0	0	0	111.4	W335 E339 C340 L345 N351 K352 G357	W335-V355 HydrophobicContact CH2-CG1 4.23Å; W335-V355 HydrophobicContact CZ3-CG1 4.1Å; E339-V355 HydrophobicContact CB-CG1 3.81Å; E339-V355 HydrophobicContact CG-CG1 3.27Å; C340-V355 VanDerWaalsContact SG-CG2 3.5Å; L345-V355 HydrophobicContact CD1-CG2 4.29Å; N351-V355 WeakPolarHBondContact O-CG2 3.24Å; N351-V355 PolarHBondContact O-N 3.33Å; K352-V355 PolarHBondContact O-N 3.27Å; V355-G357 VanDerWaalsContact C-N 3.32Å; V355-G357 PolarHBondContact O-N 3.31Å
356	L	94.6	Very high	94.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-64.1	-37.6	172.7	-73.7	169.9	0	0	0	112.1	F309 L312 A332 L333 W335 A336 K352 R353 K358 A359 L360	F309-L356 WeakPolarHBondContact CE2-O 3.39Å; L312-L356 HydrophobicContact CD2-CD2 4.27Å; A332-L356 HydrophobicContact CB-CD2 4.14Å; L333-L356 HydrophobicContact CD2-CD1 4.02Å; W335-L356 HydrophobicContact CE3-CD2 3.95Å; W335-L356 HydrophobicContact CZ3-CD2 4.17Å; A336-L356 HydrophobicContact CB-CD1 3.91Å; A336-L356 HydrophobicContact CB-CD2 4.05Å; A336-L356 HydrophobicContact CB-CG 3.66Å; K352-L356 WeakPolarHBondContact O-CG 3.37Å; K352-L356 PolarHBondContact O-N 3.1Å; R353-L356 PolarHBondContact O-N 2.75Å; L356-K358 PolarHBondContact O-N 3.15Å; L356-K358 VanDerWaalsContact O-N 3.13Å; L356-A359 WeakPolarHBondContact O-CB 3.33Å; L356-A359 PolarHBondContact O-N 2.66Å; L356-L360 HydrophobicContact CB-CB 4.26Å; L356-L360 HydrophobicContact CD1-CD1 4.49Å
357	G	94.1	Very high	94.3	Very high	33 Å²	33	47.1 Å²	47.1	34%	0.34	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	50.2	-120.1	175.2	0	0	0	0	0	112.4	R353 K354 V355 A359	R353-G357 PolarHBondContact O-N 3.4Å; K354-G357 PolarHBondContact O-N 2.81Å; V355-G357 VanDerWaalsContact C-N 3.32Å; V355-G357 PolarHBondContact O-N 3.31Å; G357-A359 VanDerWaalsContact C-N 3.31Å; G357-A359 PolarHBondContact O-N 2.83Å
358	K	93.5	Very high	94.5	Very high	173 Å²	173	43.3 Å²	43.3	75%	0.752	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-70.7	-24.6	-179.8	-65.6	-179.2	-177.8	175.8	0	113.7	L356 L360 Y361	L356-K358 PolarHBondContact O-N 3.15Å; L356-K358 VanDerWaalsContact O-N 3.13Å; K358-L360 PolarHBondContact O-N 2.93Å; K358-Y361 PolarHBondContact O-N 2.48Å
359	A	95.4	Very high	94.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-65.3	-28.1	-177.5	0	0	0	0	0	111.9	F309 L312 L316 L356 G357 Y361 L362	F309-A359 HydrophobicContact CE2-CB 3.92Å; F309-A359 HydrophobicContact CZ-CB 3.93Å; L312-A359 HydrophobicContact CD2-CB 4.29Å; L316-A359 HydrophobicContact CD1-CB 3.97Å; L356-A359 WeakPolarHBondContact O-CB 3.33Å; L356-A359 PolarHBondContact O-N 2.66Å; G357-A359 VanDerWaalsContact C-N 3.31Å; G357-A359 PolarHBondContact O-N 2.83Å; A359-Y361 PolarHBondContact O-N 3.11Å; A359-L362 WeakPolarHBondContact O-CB 3.31Å; A359-L362 PolarHBondContact O-N 2.72Å
360	L	95.7	Very high	94.6	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-55	-39.9	174.6	-179.9	62.7	0	0	0	112.3	R353 L356 K358 L362 I363 V382 F405	R353-L360 HydrophobicContact CG-CD2 4.09Å; L356-L360 HydrophobicContact CB-CB 4.26Å; L356-L360 HydrophobicContact CD1-CD1 4.49Å; K358-L360 PolarHBondContact O-N 2.93Å; L360-L362 PolarHBondContact O-N 3.12Å; L360-I363 HydrophobicContact CD1-CD1 4.27Å; L360-I363 WeakPolarHBondContact O-CB 3.35Å; L360-I363 PolarHBondContact O-N 3.33Å; L360-V382 HydrophobicContact CD1-CG1 4.11Å; L360-V382 HydrophobicContact CD2-CG1 4.21Å; L360-F405 HydrophobicContact CG-CE1 4.25Å
361	Y	95.3	Very high	94.7	Very high	63 Å²	63	43.2 Å²	43.2	25%	0.247	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-76.9	-9.3	-177.9	-59.8	-74.5	0	0	0	113.7	R353 K358 A359 I363 E387 Q404 F405	R353-Y361 PolarHBondContact NH2-OH 3.28Å; K358-Y361 PolarHBondContact O-N 2.48Å; A359-Y361 PolarHBondContact O-N 3.11Å; Y361-I363 VanDerWaalsContact C-N 3.31Å; Y361-E387 WeakPolarHBondContact CE1-OE1 3.14Å; Y361-E387 PolarHBondContact OH-OE1 3.2Å; Y361-E387 VanDerWaalsContact OH-OE1 3.06Å; Y361-Q404 HydrophobicContact CD1-CB 3.97Å; Y361-Q404 HydrophobicContact CE1-CB 4.03Å; Y361-Q404 VanDerWaalsContact CE1-OE1 3.28Å; Y361-F405 HydrophobicContact CD1-CD1 4.26Å; Y361-F405 AromaticContact CD1-CE1 3.93Å; Y361-F405 HydrophobicContact CD1-CE1 3.93Å; Y361-F405 HydrophobicContact CD1-CE2 4.23Å; Y361-F405 AromaticContact CD1-CZ 3.91Å; Y361-F405 HydrophobicContact CD1-CZ 3.91Å; Y361-F405 HydrophobicContact CE1-CE1 4.44Å; Y361-F405 HydrophobicContact CE1-CE2 4.21Å; Y361-F405 AromaticContact CE1-CZ 3.98Å; Y361-F405 HydrophobicContact CE1-CZ 3.98Å
362	L	96.1	Very high	94.7	Very high	29 Å²	29	44.4 Å²	44.4	15%	0.152	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-80.3	-17.3	171.7	-59.2	177.9	0	0	0	112.3	E313 L316 A359 L360	E313-L362 HydrophobicContact CB-CD1 4.46Å; E313-L362 HydrophobicContact CG-CD1 3.41Å; E313-L362 VanDerWaalsContact CG-CD1 3.41Å; L316-L362 HydrophobicContact CB-CB 3.89Å; L316-L362 HydrophobicContact CB-CD1 4.28Å; A359-L362 WeakPolarHBondContact O-CB 3.31Å; A359-L362 PolarHBondContact O-N 2.72Å; L360-L362 PolarHBondContact O-N 3.12Å
363	I	96	Very high	94.7	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.22	C	C	.	.	S	Bend	trans	-75.5	128.5	174.2	-51	176.7	0	0	0	108.2	L316 E325 F329 A332 L360 Y361 I365 M368 F405	L316-I363 HydrophobicContact CD1-CG1 4.3Å; L316-I363 HydrophobicContact CD2-CG1 4.25Å; E325-I363 HydrophobicContact CG-CG2 4.07Å; E325-I363 WeakPolarHBondContact OE1-CA 3.32Å; E325-I363 WeakPolarHBondContact OE1-CG2 3.28Å; F329-I363 HydrophobicContact CB-CG2 4.11Å; F329-I363 HydrophobicContact CD2-CD1 4.25Å; F329-I363 HydrophobicContact CD2-CG2 4.4Å; A332-I363 HydrophobicContact CB-CD1 3.6Å; L360-I363 HydrophobicContact CD1-CD1 4.27Å; L360-I363 WeakPolarHBondContact O-CB 3.35Å; L360-I363 PolarHBondContact O-N 3.33Å; Y361-I363 VanDerWaalsContact C-N 3.31Å; I363-I365 HydrophobicContact CB-CG1 4.28Å; I363-I365 HydrophobicContact CG2-CG1 3.88Å; I363-I365 PolarHBondContact O-N 3.47Å; I363-M368 HydrophobicContact CG2-CE 4.28Å; I363-F405 WeakPolarHBondContact O-CD1 3.27Å
364	R	95.5	Very high	94.6	Very high	7 Å²	7	42 Å²	42	3%	0.026	23%	0.226	C	C	.	.			trans	-89.1	50.9	-172.2	-43.6	-164.1	-170.5	-172.3	-3.6	111.5	E319 E325 P366 T367 V406 K408 A409 R410	E319-R364 IonicContact OE1-CZ 2.75Å; E319-R364 IonicContact OE1-NH1 3.05Å; E319-R364 PolarHBondContact OE1-NH1 2.87Å; E319-R364 IonicContact OE1-NH2 3.35Å; E319-R364 PolarHBondContact OE1-NH2 2.93Å; E319-R364 IonicContact OE2-CZ 3.38Å; E319-R364 IonicContact OE2-NH1 3.27Å; E319-R364 PolarHBondContact OE2-NH1 2.86Å; E319-R364 IonicContact OE2-NH2 2.7Å; E319-R364 PolarHBondContact OE2-NH2 2.87Å; E325-R364 HydrophobicContact CG-CB 4.02Å; E325-R364 PolarHBondContact OE1-N 3.18Å; R364-P366 WeakPolarHBondContact O-CD 3.12Å; R364-T367 HydrophobicContact CB-CG2 3.92Å; R364-T367 WeakPolarHBondContact CB-OG1 3.31Å; R364-T367 WeakPolarHBondContact O-CA 3.27Å; R364-T367 WeakPolarHBondContact O-CB 3.35Å; R364-T367 PolarHBondContact O-N 2.83Å; R364-T367 PolarHBondContact O-OG1 3.22Å; R364-V406 WeakPolarHBondContact CA-O 3.46Å; R364-V406 WeakPolarHBondContact CB-O 3.47Å; R364-V406 HydrophobicContact CG-CB 4.13Å; R364-V406 HydrophobicContact CG-CG1 4.27Å; R364-K408 WeakPolarHBondContact CD-O 3.49Å; R364-K408 PolarHBondContact NH1-O 3.19Å; R364-A409 PolarHBondContact NH1-O 3.48Å; R364-R410 VanDerWaalsContact CZ-CG 3.45Å; R364-R410 VanDerWaalsContact NH1-CA 3.29Å
365	I	94.7	Very high	94.5	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-45.3	-39.5	-176.4	-55.3	-179.6	0	0	0	113.7	F329 I363 T367 M368 F373 A377 L383 I391 Y395 F405	F329-I365 HydrophobicContact CD2-CD1 4.27Å; F329-I365 HydrophobicContact CE2-CD1 4.28Å; I363-I365 HydrophobicContact CB-CG1 4.28Å; I363-I365 HydrophobicContact CG2-CG1 3.88Å; I363-I365 PolarHBondContact O-N 3.47Å; I365-T367 PolarHBondContact O-N 3.31Å; I365-M368 HydrophobicContact CB-CE 4.33Å; I365-M368 HydrophobicContact CB-SD 4.46Å; I365-M368 HydrophobicContact CG1-CE 4.06Å; I365-M368 HydrophobicContact CG2-CE 4.37Å; I365-M368 HydrophobicContact CG2-SD 3.99Å; I365-M368 WeakPolarHBondContact O-CB 3.07Å; I365-M368 WeakPolarHBondContact O-CG 3.3Å; I365-M368 PolarHBondContact O-N 3.03Å; I365-F373 HydrophobicContact CG2-CD2 3.76Å; I365-F373 HydrophobicContact CG2-CE2 4.09Å; I365-A377 HydrophobicContact CG2-CB 4.12Å; I365-L383 HydrophobicContact CD1-CD1 4.13Å; I365-L383 HydrophobicContact CD1-CD2 3.66Å; I365-L383 HydrophobicContact CD1-CG 4.4Å; I365-L383 HydrophobicContact CG2-CD1 4.41Å; I365-I391 HydrophobicContact CB-CD1 4.38Å; I365-I391 HydrophobicContact CG2-CD1 4.01Å; I365-I391 HydrophobicContact CG2-CG2 4.41Å; I365-Y395 PolarHBondContact O-OH 3Å; I365-Y395 VanDerWaalsContact O-OH 3.08Å; I365-F405 HydrophobicContact CB-CD1 4.49Å; I365-F405 HydrophobicContact CD1-CD1 3.97Å; I365-F405 HydrophobicContact CD1-CE1 3.54Å; I365-F405 HydrophobicContact CD1-CZ 4.05Å; I365-F405 HydrophobicContact CG1-CD1 4.17Å; I365-F405 HydrophobicContact CG1-CE1 4.24Å
366	P	94.8	Very high	94.3	Very high	6 Å²	6	40.4 Å²	40.4	4%	0.039	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-67.7	-3.6	178.2	-19.5	33.6	0	0	0	115.4	R364 I391 W394 L403 F405	R364-P366 WeakPolarHBondContact O-CD 3.12Å; P366-I391 HydrophobicContact CG-CG1 4.49Å; P366-W394 HydrophobicContact CB-CG 4.24Å; P366-W394 PolarHBondContact O-NE1 3.27Å; P366-L403 HydrophobicContact CB-CD1 3.76Å; P366-L403 HydrophobicContact CG-CD1 3.36Å; P366-F405 HydrophobicContact CG-CB 3.83Å
367	T	94	Very high	94.2	Very high	41 Å²	41	40.4 Å²	40.4	25%	0.252	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-105.3	-2.2	-179.9	72.8	0	0	0	0	112.7	R364 I365 S407 A409	R364-T367 HydrophobicContact CB-CG2 3.92Å; R364-T367 WeakPolarHBondContact CB-OG1 3.31Å; R364-T367 WeakPolarHBondContact O-CA 3.27Å; R364-T367 WeakPolarHBondContact O-CB 3.35Å; R364-T367 PolarHBondContact O-N 2.83Å; R364-T367 PolarHBondContact O-OG1 3.22Å; I365-T367 PolarHBondContact O-N 3.31Å; T367-S407 WeakPolarHBondContact CG2-O 3.31Å; T367-A409 HydrophobicContact CG2-CB 4.3Å
368	M	94.6	Very high	94.1	Very high	12 Å²	12	40.3 Å²	40.3	6%	0.059	23%	0.227	C	C	.	.	S	Bend	trans	-65.8	163.8	171.6	-66.1	173.1	-179.4	0	0	110.8	E325 F329 I363 I365 D372 A377 Y395	E325-M368 HydrophobicContact CB-CE 4.23Å; E325-M368 HydrophobicContact CB-CG 3.79Å; E325-M368 HydrophobicContact CG-CE 3.93Å; E325-M368 HydrophobicContact CG-CG 4.24Å; E325-M368 WeakPolarHBondContact O-CE 3.17Å; F329-M368 HydrophobicContact CB-CE 3.42Å; F329-M368 VanDerWaalsContact CB-CE 3.42Å; F329-M368 HydrophobicContact CD2-CE 4.45Å; F329-M368 HydrophobicContact CG-CE 3.97Å; I363-M368 HydrophobicContact CG2-CE 4.28Å; I365-M368 HydrophobicContact CB-CE 4.33Å; I365-M368 HydrophobicContact CB-SD 4.46Å; I365-M368 HydrophobicContact CG1-CE 4.06Å; I365-M368 HydrophobicContact CG2-CE 4.37Å; I365-M368 HydrophobicContact CG2-SD 3.99Å; I365-M368 WeakPolarHBondContact O-CB 3.07Å; I365-M368 WeakPolarHBondContact O-CG 3.3Å; I365-M368 PolarHBondContact O-N 3.03Å; M368-D372 HydrophobicContact CB-CB 4.34Å; M368-A377 HydrophobicContact SD-CB 4.29Å; M368-Y395 PolarHBondContact N-OH 2.98Å; M368-Y395 WeakPolarHBondContact O-CE1 3.35Å; M368-Y395 PolarHBondContact O-OH 3.41Å
369	A	93.8	Very high	94	Very high	53 Å²	53	38.7 Å²	38.7	44%	0.438	22%	0.221	S	C	.	.			trans	-65.4	148.1	164.2	0	0	0	0	0	109.2	D371 D372 F373	A369-D371 PolarHBondContact O-N 3.44Å; A369-D372 HydrophobicContact CB-CB 4.29Å; A369-D372 WeakPolarHBondContact O-CB 2.95Å; A369-D372 PolarHBondContact O-N 2.97Å; A369-D372 VanDerWaalsContact O-N 3.1Å; A369-F373 PolarHBondContact O-N 3.3Å
370	L	93.6	Very high	93.7	Very high	74 Å²	74	40 Å²	40	39%	0.387	23%	0.23	S	C	.	.	H	α-helix	trans	-57.2	-39.2	179.1	178.4	59.5	0	0	0	111.4	F373 A374 Y395	L370-F373 HydrophobicContact CD1-CD1 4.43Å; L370-F373 PolarHBondContact O-N 3.42Å; L370-A374 VanDerWaalsContact O-CB 3.31Å; L370-A374 WeakPolarHBondContact O-CB 3.42Å; L370-A374 PolarHBondContact O-N 2.82Å; L370-Y395 HydrophobicContact CB-CD1 4.33Å; L370-Y395 HydrophobicContact CD1-CD1 4.22Å; L370-Y395 HydrophobicContact CD1-CD2 3.82Å; L370-Y395 HydrophobicContact CD1-CE2 4.41Å; L370-Y395 HydrophobicContact CD1-CG 3.73Å
371	D	93.8	Very high	93.4	Very high	114 Å²	114	42 Å²	42	61%	0.61	25%	0.252	S	S	*	.	H	α-helix	trans	-66.1	-39.7	178	-62.7	-23	0	0	0	112.1	A369 F373 A374 N375	A369-D371 PolarHBondContact O-N 3.44Å; D371-F373 VanDerWaalsContact C-N 3.35Å; D371-A374 PolarHBondContact O-N 2.87Å; D371-N375 WeakPolarHBondContact O-CB 3.46Å; D371-N375 PolarHBondContact O-N 2.79Å; D371-N375 PolarHBondContact O-ND2 3.06Å
372	D	94.3	Very high	93.3	Very high	58 Å²	58	39.2 Å²	39.2	31%	0.31	24%	0.241	S	C	.	.	H	α-helix	trans	-65.5	-39.8	175.7	-67.7	-21.9	0	0	0	111	I326 M368 A369 G376	I326-D372 HydrophobicContact CB-CB 4.11Å; I326-D372 HydrophobicContact CD1-CB 4.34Å; I326-D372 HydrophobicContact CG1-CB 4.19Å; M368-D372 HydrophobicContact CB-CB 4.34Å; A369-D372 HydrophobicContact CB-CB 4.29Å; A369-D372 WeakPolarHBondContact O-CB 2.95Å; A369-D372 PolarHBondContact O-N 2.97Å; A369-D372 VanDerWaalsContact O-N 3.1Å; D372-G376 VanDerWaalsContact O-CA 3.3Å; D372-G376 WeakPolarHBondContact O-CA 3.32Å; D372-G376 PolarHBondContact O-N 3.11Å
373	F	95.4	Very high	93.2	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.018	24%	0.237	C	C	.	.	I	π-helix	trans	-65.8	-49.6	175.5	170.2	-106	0	0	0	111.5	I365 A369 L370 D371 A377 A378 L383 T388 I391 F392 Y395	I365-F373 HydrophobicContact CG2-CD2 3.76Å; I365-F373 HydrophobicContact CG2-CE2 4.09Å; A369-F373 PolarHBondContact O-N 3.3Å; L370-F373 HydrophobicContact CD1-CD1 4.43Å; L370-F373 PolarHBondContact O-N 3.42Å; D371-F373 VanDerWaalsContact C-N 3.35Å; F373-A377 HydrophobicContact CD2-CB 3.97Å; F373-A377 HydrophobicContact CE2-CB 4.47Å; F373-A377 PolarHBondContact O-N 3.14Å; F373-A378 HydrophobicContact CE1-CB 4.12Å; F373-A378 HydrophobicContact CE2-CB 4.16Å; F373-A378 HydrophobicContact CZ-CB 3.93Å; F373-A378 VanDerWaalsContact O-CB 3.26Å; F373-A378 WeakPolarHBondContact O-CB 3.31Å; F373-A378 PolarHBondContact O-N 2.93Å; F373-L383 HydrophobicContact CE2-CD1 4.03Å; F373-T388 HydrophobicContact CZ-CG2 4.04Å; F373-I391 HydrophobicContact CD1-CG2 4.5Å; F373-I391 HydrophobicContact CD2-CG2 3.88Å; F373-I391 HydrophobicContact CE1-CG2 4.12Å; F373-I391 HydrophobicContact CE2-CB 4Å; F373-I391 HydrophobicContact CE2-CD1 4.33Å; F373-I391 HydrophobicContact CE2-CG2 3.46Å; F373-I391 VanDerWaalsContact CE2-CG2 3.46Å; F373-I391 HydrophobicContact CG-CG2 4.39Å; F373-I391 HydrophobicContact CZ-CB 3.87Å; F373-I391 HydrophobicContact CZ-CG2 3.58Å; F373-F392 HydrophobicContact CE1-CB 4.31Å; F373-Y395 HydrophobicContact CB-CE2 4Å; F373-Y395 HydrophobicContact CD1-CD2 4.15Å; F373-Y395 AromaticContact CD1-CE2 3.83Å; F373-Y395 HydrophobicContact CD1-CE2 3.83Å; F373-Y395 HydrophobicContact CD2-CE2 4.48Å; F373-Y395 HydrophobicContact CE1-CE2 4.46Å; F373-Y395 AromaticContact CG-CE2 3.84Å; F373-Y395 HydrophobicContact CG-CE2 3.84Å
374	A	92.3	Very high	93	Very high	41 Å²	41	41.2 Å²	41.2	34%	0.339	25%	0.254	S	S	.	.	I	π-helix	trans	-66.8	-38.8	-175.2	0	0	0	0	0	112.8	L370 D371 Q379	L370-A374 VanDerWaalsContact O-CB 3.31Å; L370-A374 WeakPolarHBondContact O-CB 3.42Å; L370-A374 PolarHBondContact O-N 2.82Å; D371-A374 PolarHBondContact O-N 2.87Å; A374-Q379 WeakPolarHBondContact O-CG 3.49Å; A374-Q379 PolarHBondContact O-NE2 3.41Å
375	N	91.6	Very high	92.9	Very high	115 Å²	115	48.1 Å²	48.1	62%	0.615	29%	0.291	S	S	*	.	I	π-helix	trans	-93	-15	-178.6	-61.6	-53.6	0	0	0	113.7	D371	D371-N375 WeakPolarHBondContact O-CB 3.46Å; D371-N375 PolarHBondContact O-N 2.79Å; D371-N375 PolarHBondContact O-ND2 3.06Å
376	G	91.8	Very high	92.8	Very high	24 Å²	24	53.9 Å²	53.9	25%	0.247	32%	0.322	C	S	.	.	I	π-helix	trans	-114.3	-88.2	180	0	0	0	0	0	112.3	D372 A378 Q379 S380	D372-G376 VanDerWaalsContact O-CA 3.3Å; D372-G376 WeakPolarHBondContact O-CA 3.32Å; D372-G376 PolarHBondContact O-N 3.11Å; G376-A378 VanDerWaalsContact C-N 3.35Å; G376-A378 PolarHBondContact O-N 2.92Å; G376-Q379 PolarHBondContact O-N 2.81Å; G376-Q379 VanDerWaalsContact O-N 3.11Å; G376-S380 PolarHBondContact O-N 2.87Å
377	A	92.1	Very high	92.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.324	C	S	.	.	I	π-helix	trans	-58.8	-39.8	-167.9	0	0	0	0	0	114	F329 I365 M368 F373 Q379 S380 L383	F329-A377 HydrophobicContact CD1-CB 4.34Å; F329-A377 HydrophobicContact CE1-CB 3.97Å; F329-A377 HydrophobicContact CE2-CB 4.35Å; F329-A377 HydrophobicContact CZ-CB 3.98Å; I365-A377 HydrophobicContact CG2-CB 4.12Å; M368-A377 HydrophobicContact SD-CB 4.29Å; F373-A377 HydrophobicContact CD2-CB 3.97Å; F373-A377 HydrophobicContact CE2-CB 4.47Å; F373-A377 PolarHBondContact O-N 3.14Å; A377-Q379 VanDerWaalsContact C-N 3.35Å; A377-Q379 PolarHBondContact O-N 2.93Å; A377-S380 WeakPolarHBondContact O-CB 3.46Å; A377-S380 PolarHBondContact O-N 3.45Å; A377-S380 PolarHBondContact O-OG 3.15Å; A377-L383 HydrophobicContact CB-CD1 4.23Å
378	A	91.6	Very high	92.8	Very high	31 Å²	31	53.8 Å²	53.8	26%	0.256	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-32.9	179.2	0	0	0	0	0	113.1	F373 G376 T388	F373-A378 HydrophobicContact CE1-CB 4.12Å; F373-A378 HydrophobicContact CE2-CB 4.16Å; F373-A378 HydrophobicContact CZ-CB 3.93Å; F373-A378 VanDerWaalsContact O-CB 3.26Å; F373-A378 WeakPolarHBondContact O-CB 3.31Å; F373-A378 PolarHBondContact O-N 2.93Å; G376-A378 VanDerWaalsContact C-N 3.35Å; G376-A378 PolarHBondContact O-N 2.92Å; A378-T388 HydrophobicContact CB-CG2 3.88Å
379	Q	91.1	Very high	92.8	Very high	138 Å²	138	57.4 Å²	57.4	65%	0.645	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-12.6	-179.5	-65.3	-177.8	33.9	0	0	113.2	A374 G376 A377 G381	A374-Q379 WeakPolarHBondContact O-CG 3.49Å; A374-Q379 PolarHBondContact O-NE2 3.41Å; G376-Q379 PolarHBondContact O-N 2.81Å; G376-Q379 VanDerWaalsContact O-N 3.11Å; A377-Q379 VanDerWaalsContact C-N 3.35Å; A377-Q379 PolarHBondContact O-N 2.93Å; Q379-G381 PolarHBondContact O-N 2.78Å; Q379-G381 VanDerWaalsContact O-N 3.12Å
380	S	90.4	Very high	92.9	Very high	27 Å²	27	57.9 Å²	57.9	19%	0.189	34%	0.335	C	S	.	.	S	Bend	trans	-62.4	-19.2	-178.5	72.1	0	0	0	0	114.6	G376 A377 V382	G376-S380 PolarHBondContact O-N 2.87Å; A377-S380 WeakPolarHBondContact O-CB 3.46Å; A377-S380 PolarHBondContact O-N 3.45Å; A377-S380 PolarHBondContact O-OG 3.15Å; S380-V382 PolarHBondContact O-N 2.83Å; S380-V382 VanDerWaalsContact O-N 3.08Å; S380-V382 PolarHBondContact OG-N 2.66Å
381	G	89.1	Confident	92.9	Very high	44 Å²	44	54.3 Å²	54.3	45%	0.454	32%	0.316	S	S	.	.	S	Bend	trans	69.4	-6.3	-171.9	0	0	0	0	0	114.5	I349 Q379 L383	I349-G381 VanDerWaalsContact CG2-O 3.23Å; I349-G381 WeakPolarHBondContact CG2-O 3.39Å; Q379-G381 PolarHBondContact O-N 2.78Å; Q379-G381 VanDerWaalsContact O-N 3.12Å; G381-L383 VanDerWaalsContact C-N 3.33Å
382	V	93.1	Very high	92.9	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.024	31%	0.309	C	S	.	.			trans	-71.8	-31.2	-178.7	175.4	0	0	0	0	110.8	L333 I349 R353 L360 S380	L333-V382 HydrophobicContact CD1-CG2 4.41Å; L333-V382 HydrophobicContact CD2-CB 4.39Å; L333-V382 HydrophobicContact CD2-CG1 4.18Å; L333-V382 HydrophobicContact CD2-CG2 3.72Å; I349-V382 HydrophobicContact CG2-CB 4.48Å; I349-V382 HydrophobicContact CG2-CG2 3.9Å; R353-V382 HydrophobicContact CB-CG1 4.39Å; R353-V382 WeakPolarHBondContact CD-O 3.49Å; R353-V382 PolarHBondContact NH1-O 3.39Å; L360-V382 HydrophobicContact CD1-CG1 4.11Å; L360-V382 HydrophobicContact CD2-CG1 4.21Å; S380-V382 PolarHBondContact O-N 2.83Å; S380-V382 VanDerWaalsContact O-N 3.08Å; S380-V382 PolarHBondContact OG-N 2.66Å
383	L	93.5	Very high	92.9	Very high	11 Å²	11	54.1 Å²	54.1	6%	0.058	31%	0.31	C	S	.	.	S	Bend	trans	-82.2	142.6	173.8	-59.2	179.4	0	0	0	110.9	I365 F373 A377 G381 T388 I391 F405	I365-L383 HydrophobicContact CD1-CD1 4.13Å; I365-L383 HydrophobicContact CD1-CD2 3.66Å; I365-L383 HydrophobicContact CD1-CG 4.4Å; I365-L383 HydrophobicContact CG2-CD1 4.41Å; F373-L383 HydrophobicContact CE2-CD1 4.03Å; A377-L383 HydrophobicContact CB-CD1 4.23Å; G381-L383 VanDerWaalsContact C-N 3.33Å; L383-T388 WeakPolarHBondContact CB-OG1 3.41Å; L383-I391 HydrophobicContact CD1-CD1 4.09Å; L383-F405 HydrophobicContact CD2-CE1 4.33Å; L383-F405 HydrophobicContact CD2-CE2 4.31Å; L383-F405 HydrophobicContact CD2-CZ 3.63Å
384	T	93.1	Very high	92.8	Very high	61 Å²	61	56.2 Å²	56.2	37%	0.374	32%	0.318	S	S	.	.			trans	-69.1	159.2	170.7	63.8	0	0	0	0	110.4	N386 E387 T388	T384-N386 VanDerWaalsContact C-N 3.25Å; T384-N386 PolarHBondContact O-N 2.93Å; T384-E387 PolarHBondContact N-OE2 3Å; T384-E387 PolarHBondContact O-N 2.84Å; T384-E387 WeakPolarHBondContact OG1-CB 3.41Å; T384-E387 WeakPolarHBondContact OG1-CG 3.36Å; T384-E387 PolarHBondContact OG1-N 2.88Å; T384-E387 PolarHBondContact OG1-OE2 2.83Å; T384-T388 WeakPolarHBondContact O-CB 3.23Å; T384-T388 PolarHBondContact O-N 3.14Å; T384-T388 PolarHBondContact O-OG1 3.47Å
385	L	92.4	Very high	92.8	Very high	153 Å²	153	57.1 Å²	57.1	80%	0.801	31%	0.313	S	S	*	.	H	α-helix	trans	-58.8	-38.5	176.9	-66.5	174.7	0	0	0	112.1	T388 N389	L385-T388 PolarHBondContact O-N 2.91Å; L385-N389 WeakPolarHBondContact O-CB 3.46Å; L385-N389 PolarHBondContact O-N 3.21Å
386	N	93.1	Very high	92.9	Very high	121 Å²	121	55.3 Å²	55.3	65%	0.647	31%	0.306	S	S	*	.	H	α-helix	trans	-65.3	-49.1	176.1	-71	-4.2	0	0	0	111.3	T384 T388 N389 D390	T384-N386 VanDerWaalsContact C-N 3.25Å; T384-N386 PolarHBondContact O-N 2.93Å; N386-T388 VanDerWaalsContact C-N 3.29Å; N386-T388 PolarHBondContact O-N 3.32Å; N386-N389 PolarHBondContact O-N 3.48Å; N386-D390 WeakPolarHBondContact O-CB 3.15Å; N386-D390 VanDerWaalsContact O-CG 3.26Å; N386-D390 PolarHBondContact O-N 2.89Å
387	E	94.6	Very high	93	Very high	17 Å²	17	55.8 Å²	55.8	8%	0.079	31%	0.307	C	S	.	.	H	α-helix	trans	-59	-41.8	177	-73.1	164.2	158.5	0	0	111.6	R353 Y361 T384 D390 I391 F405	R353-E387 IonicContact CZ-OE1 3.74Å; R353-E387 IonicContact CZ-OE2 2.9Å; R353-E387 IonicContact NH1-OE1 3.79Å; R353-E387 IonicContact NH1-OE2 2.69Å; R353-E387 PolarHBondContact NH1-OE2 3.34Å; R353-E387 VanDerWaalsContact NH2-CD 3.29Å; R353-E387 IonicContact NH2-OE1 2.95Å; R353-E387 PolarHBondContact NH2-OE1 3.23Å; R353-E387 IonicContact NH2-OE2 2.78Å; R353-E387 PolarHBondContact NH2-OE2 2.87Å; Y361-E387 WeakPolarHBondContact CE1-OE1 3.14Å; Y361-E387 PolarHBondContact OH-OE1 3.2Å; Y361-E387 VanDerWaalsContact OH-OE1 3.06Å; T384-E387 PolarHBondContact N-OE2 3Å; T384-E387 PolarHBondContact O-N 2.84Å; T384-E387 WeakPolarHBondContact OG1-CB 3.41Å; T384-E387 WeakPolarHBondContact OG1-CG 3.36Å; T384-E387 PolarHBondContact OG1-N 2.88Å; T384-E387 PolarHBondContact OG1-OE2 2.83Å; E387-D390 PolarHBondContact O-N 3.45Å; E387-I391 WeakPolarHBondContact O-CB 3.47Å; E387-I391 WeakPolarHBondContact O-CD1 3.38Å; E387-I391 WeakPolarHBondContact O-CG1 3.49Å; E387-I391 PolarHBondContact O-N 3.24Å; E387-F405 HydrophobicContact CB-CE2 4.2Å; E387-F405 HydrophobicContact CG-CE2 4.05Å
388	T	94.6	Very high	92.9	Very high	28 Å²	28	61.2 Å²	61.2	17%	0.172	35%	0.353	C	S	.	.	H	α-helix	trans	-63.3	-44.5	178.4	-55.2	0	0	0	0	111.1	F373 A378 L383 T384 L385 N386 F392	F373-T388 HydrophobicContact CZ-CG2 4.04Å; A378-T388 HydrophobicContact CB-CG2 3.88Å; L383-T388 WeakPolarHBondContact CB-OG1 3.41Å; T384-T388 WeakPolarHBondContact O-CB 3.23Å; T384-T388 PolarHBondContact O-N 3.14Å; T384-T388 PolarHBondContact O-OG1 3.47Å; L385-T388 PolarHBondContact O-N 2.91Å; N386-T388 VanDerWaalsContact C-N 3.29Å; N386-T388 PolarHBondContact O-N 3.32Å; T388-F392 WeakPolarHBondContact O-CB 3.22Å; T388-F392 PolarHBondContact O-N 3.32Å
389	N	93.9	Very high	92.9	Very high	87 Å²	87	68.9 Å²	68.9	47%	0.465	38%	0.38	S	S	.	.	H	α-helix	trans	-64.9	-45.8	176.9	-172.4	20.3	0	0	0	111.8	L385 N386 I391 F392 L393	L385-N389 WeakPolarHBondContact O-CB 3.46Å; L385-N389 PolarHBondContact O-N 3.21Å; N386-N389 PolarHBondContact O-N 3.48Å; N389-I391 VanDerWaalsContact C-N 3.33Å; N389-I391 PolarHBondContact O-N 3.19Å; N389-F392 WeakPolarHBondContact O-CB 3.28Å; N389-F392 PolarHBondContact O-N 3.35Å; N389-F392 VanDerWaalsContact O-N 3.17Å; N389-L393 WeakPolarHBondContact O-CG 3.47Å; N389-L393 PolarHBondContact O-N 3.23Å
390	D	94.9	Very high	92.9	Very high	63 Å²	63	68 Å²	68	34%	0.337	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-41	179.3	-68.8	-24.7	0	0	0	111.6	N386 E387 L393 W394 P401 L403	N386-D390 WeakPolarHBondContact O-CB 3.15Å; N386-D390 VanDerWaalsContact O-CG 3.26Å; N386-D390 PolarHBondContact O-N 2.89Å; E387-D390 PolarHBondContact O-N 3.45Å; D390-L393 PolarHBondContact O-N 2.99Å; D390-W394 PolarHBondContact O-N 3.2Å; D390-P401 VanDerWaalsContact O-CG 3.27Å; D390-P401 WeakPolarHBondContact O-CG 3.2Å; D390-L403 HydrophobicContact CB-CD2 3.72Å
391	I	94.9	Very high	93	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-68.3	-38.7	175	-65	165	0	0	0	111	I365 P366 F373 L383 E387 N389 W394 Y395 L403 F405	I365-I391 HydrophobicContact CB-CD1 4.38Å; I365-I391 HydrophobicContact CG2-CD1 4.01Å; I365-I391 HydrophobicContact CG2-CG2 4.41Å; P366-I391 HydrophobicContact CG-CG1 4.49Å; F373-I391 HydrophobicContact CD1-CG2 4.5Å; F373-I391 HydrophobicContact CD2-CG2 3.88Å; F373-I391 HydrophobicContact CE1-CG2 4.12Å; F373-I391 HydrophobicContact CE2-CB 4Å; F373-I391 HydrophobicContact CE2-CD1 4.33Å; F373-I391 HydrophobicContact CE2-CG2 3.46Å; F373-I391 VanDerWaalsContact CE2-CG2 3.46Å; F373-I391 HydrophobicContact CG-CG2 4.39Å; F373-I391 HydrophobicContact CZ-CB 3.87Å; F373-I391 HydrophobicContact CZ-CG2 3.58Å; L383-I391 HydrophobicContact CD1-CD1 4.09Å; E387-I391 WeakPolarHBondContact O-CB 3.47Å; E387-I391 WeakPolarHBondContact O-CD1 3.38Å; E387-I391 WeakPolarHBondContact O-CG1 3.49Å; E387-I391 PolarHBondContact O-N 3.24Å; N389-I391 VanDerWaalsContact C-N 3.33Å; N389-I391 PolarHBondContact O-N 3.19Å; I391-W394 VanDerWaalsContact O-CB 3.27Å; I391-W394 WeakPolarHBondContact O-CB 3.18Å; I391-W394 PolarHBondContact O-N 2.88Å; I391-W394 VanDerWaalsContact O-N 3.14Å; I391-Y395 HydrophobicContact CG2-CD2 4.19Å; I391-Y395 HydrophobicContact CG2-CE2 3.73Å; I391-Y395 WeakPolarHBondContact O-CD2 3.46Å; I391-Y395 PolarHBondContact O-N 2.89Å; I391-L403 HydrophobicContact CG1-CD1 4.43Å; I391-L403 HydrophobicContact CG1-CD2 4.37Å; I391-F405 HydrophobicContact CD1-CD2 3.84Å; I391-F405 HydrophobicContact CD1-CE2 3.92Å; I391-F405 HydrophobicContact CG1-CD2 4.41Å
392	F	93.9	Very high	93.1	Very high	103 Å²	103	75.3 Å²	75.3	45%	0.452	40%	0.396	S	S	.	.	H	α-helix	trans	-63.1	-42.8	174.8	180	-98.2	0	0	0	112	F373 T388 N389 W394 Y395 T396	F373-F392 HydrophobicContact CE1-CB 4.31Å; T388-F392 WeakPolarHBondContact O-CB 3.22Å; T388-F392 PolarHBondContact O-N 3.32Å; N389-F392 WeakPolarHBondContact O-CB 3.28Å; N389-F392 PolarHBondContact O-N 3.35Å; N389-F392 VanDerWaalsContact O-N 3.17Å; F392-W394 VanDerWaalsContact C-N 3.26Å; F392-W394 PolarHBondContact O-N 3.24Å; F392-Y395 PolarHBondContact O-N 3.05Å; F392-T396 HydrophobicContact CE1-CG2 4.15Å; F392-T396 HydrophobicContact CE2-CG2 4.1Å; F392-T396 HydrophobicContact CZ-CG2 3.85Å; F392-T396 PolarHBondContact O-N 3.27Å; F392-T396 VanDerWaalsContact O-N 3.15Å; F392-T396 PolarHBondContact O-OG1 3.46Å
393	L	93.6	Very high	93	Very high	64 Å²	64	76.8 Å²	76.8	34%	0.335	40%	0.404	S	S	.	.	H	α-helix	trans	-63.8	-32.6	172.6	-70.1	176	0	0	0	111.6	N389 D390 Y395 T396 A397 P401	N389-L393 WeakPolarHBondContact O-CG 3.47Å; N389-L393 PolarHBondContact O-N 3.23Å; D390-L393 PolarHBondContact O-N 2.99Å; L393-Y395 VanDerWaalsContact C-N 3.27Å; L393-Y395 PolarHBondContact O-N 3.17Å; L393-T396 PolarHBondContact O-N 3.41Å; L393-A397 HydrophobicContact CB-CB 4.3Å; L393-A397 HydrophobicContact CD2-CB 4.35Å; L393-A397 WeakPolarHBondContact O-CA 3.44Å; L393-A397 WeakPolarHBondContact O-CB 3.38Å; L393-A397 PolarHBondContact O-N 3.43Å; L393-P401 HydrophobicContact CB-CG 4.14Å
394	W	93.9	Very high	92.9	Very high	49 Å²	49	83 Å²	83	19%	0.186	43%	0.433	C	S	.	.	H	α-helix	trans	-60.8	-34.6	173.1	174.1	-90.7	0	0	0	113.5	P366 D390 I391 F392 K400 L403	P366-W394 HydrophobicContact CB-CG 4.24Å; P366-W394 PolarHBondContact O-NE1 3.27Å; D390-W394 PolarHBondContact O-N 3.2Å; I391-W394 VanDerWaalsContact O-CB 3.27Å; I391-W394 WeakPolarHBondContact O-CB 3.18Å; I391-W394 PolarHBondContact O-N 2.88Å; I391-W394 VanDerWaalsContact O-N 3.14Å; F392-W394 VanDerWaalsContact C-N 3.26Å; F392-W394 PolarHBondContact O-N 3.24Å; W394-K400 HydrophobicContact CD2-CD 4.02Å; W394-K400 HydrophobicContact CE3-CB 3.63Å; W394-K400 HydrophobicContact CE3-CD 3.71Å; W394-K400 HydrophobicContact CE3-CG 4.12Å; W394-K400 HydrophobicContact CH2-CD 3.58Å; W394-K400 HydrophobicContact CZ2-CD 3.91Å; W394-K400 HydrophobicContact CZ3-CB 3.6Å; W394-K400 HydrophobicContact CZ3-CD 3.49Å; W394-K400 VanDerWaalsContact CZ3-CD 3.49Å; W394-K400 HydrophobicContact CZ3-CG 4.14Å; W394-L403 HydrophobicContact CB-CD1 3.82Å; W394-L403 HydrophobicContact CD2-CD1 3.73Å; W394-L403 HydrophobicContact CE3-CD1 3.85Å; W394-L403 HydrophobicContact CE3-CG 4.16Å; W394-L403 HydrophobicContact CG-CD1 3.69Å
395	Y	92.3	Very high	92.9	Very high	60 Å²	60	80.5 Å²	80.5	24%	0.235	42%	0.417	C	S	.	.	H	α-helix	trans	-76.7	-37.5	175.5	-74.7	-72.7	0	0	0	113.4	I365 M368 L370 F373 I391 F392 L393	I365-Y395 PolarHBondContact O-OH 3Å; I365-Y395 VanDerWaalsContact O-OH 3.08Å; M368-Y395 PolarHBondContact N-OH 2.98Å; M368-Y395 WeakPolarHBondContact O-CE1 3.35Å; M368-Y395 PolarHBondContact O-OH 3.41Å; L370-Y395 HydrophobicContact CB-CD1 4.33Å; L370-Y395 HydrophobicContact CD1-CD1 4.22Å; L370-Y395 HydrophobicContact CD1-CD2 3.82Å; L370-Y395 HydrophobicContact CD1-CE2 4.41Å; L370-Y395 HydrophobicContact CD1-CG 3.73Å; F373-Y395 HydrophobicContact CB-CE2 4Å; F373-Y395 HydrophobicContact CD1-CD2 4.15Å; F373-Y395 AromaticContact CD1-CE2 3.83Å; F373-Y395 HydrophobicContact CD1-CE2 3.83Å; F373-Y395 HydrophobicContact CD2-CE2 4.48Å; F373-Y395 HydrophobicContact CE1-CE2 4.46Å; F373-Y395 AromaticContact CG-CE2 3.84Å; F373-Y395 HydrophobicContact CG-CE2 3.84Å; I391-Y395 HydrophobicContact CG2-CD2 4.19Å; I391-Y395 HydrophobicContact CG2-CE2 3.73Å; I391-Y395 WeakPolarHBondContact O-CD2 3.46Å; I391-Y395 PolarHBondContact O-N 2.89Å; F392-Y395 PolarHBondContact O-N 3.05Å; L393-Y395 VanDerWaalsContact C-N 3.27Å; L393-Y395 PolarHBondContact O-N 3.17Å
396	T	93.6	Very high	92.9	Very high	77 Å²	77	76 Å²	76	47%	0.472	40%	0.395	S	S	.	.	H	α-helix	trans	-109	-27.5	-164.4	56.6	0	0	0	0	114.6	F392 L393	F392-T396 HydrophobicContact CE1-CG2 4.15Å; F392-T396 HydrophobicContact CE2-CG2 4.1Å; F392-T396 HydrophobicContact CZ-CG2 3.85Å; F392-T396 PolarHBondContact O-N 3.27Å; F392-T396 VanDerWaalsContact O-N 3.15Å; F392-T396 PolarHBondContact O-OG1 3.46Å; L393-T396 PolarHBondContact O-N 3.41Å
397	A	92.4	Very high	92.8	Very high	33 Å²	33	72.6 Å²	72.6	27%	0.273	38%	0.381	S	S	.	.			trans	-83.4	141.9	-173	0	0	0	0	0	112.5	L393 K399	L393-A397 HydrophobicContact CB-CB 4.3Å; L393-A397 HydrophobicContact CD2-CB 4.35Å; L393-A397 WeakPolarHBondContact O-CA 3.44Å; L393-A397 WeakPolarHBondContact O-CB 3.38Å; L393-A397 PolarHBondContact O-N 3.43Å; A397-K399 VanDerWaalsContact C-N 3.33Å; A397-K399 PolarHBondContact O-N 3.43Å
398	A	90.9	Very high	92.7	Very high	115 Å²	115	79.4 Å²	79.4	95%	0.95	41%	0.41	S	S	*	.	S	Bend	trans	-65.7	-36.1	173.6	0	0	0	0	0	112.4
399	K	91.9	Very high	92.6	Very high	192 Å²	192	81.3 Å²	81.3	84%	0.835	43%	0.429	S	S	*	.	S	Bend	trans	-102.9	110.1	173.2	-173.5	179.8	179.4	-176.9	0	108.9	A397	A397-K399 VanDerWaalsContact C-N 3.33Å; A397-K399 PolarHBondContact O-N 3.43Å
400	K	90.9	Very high	92.6	Very high	119 Å²	119	78.6 Å²	78.6	52%	0.517	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-75.5	134.8	-175	-60.1	-167.4	177.4	-163.6	0	111.8	W394	W394-K400 HydrophobicContact CD2-CD 4.02Å; W394-K400 HydrophobicContact CE3-CB 3.63Å; W394-K400 HydrophobicContact CE3-CD 3.71Å; W394-K400 HydrophobicContact CE3-CG 4.12Å; W394-K400 HydrophobicContact CH2-CD 3.58Å; W394-K400 HydrophobicContact CZ2-CD 3.91Å; W394-K400 HydrophobicContact CZ3-CB 3.6Å; W394-K400 HydrophobicContact CZ3-CD 3.49Å; W394-K400 VanDerWaalsContact CZ3-CD 3.49Å; W394-K400 HydrophobicContact CZ3-CG 4.14Å
401	P	92.3	Very high	92.5	Very high	33 Å²	33	84 Å²	84	21%	0.214	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-72.1	161.7	172.9	30.8	-34	0	0	0	111.4	D390 L393 L403	D390-P401 VanDerWaalsContact O-CG 3.27Å; D390-P401 WeakPolarHBondContact O-CG 3.2Å; L393-P401 HydrophobicContact CB-CG 4.14Å; P401-L403 HydrophobicContact CG-CD2 4.09Å
402	E	90.2	Very high	92.2	Very high	192 Å²	192	84.7 Å²	84.7	90%	0.897	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-79.9	123.5	168.5	-69.7	-172.3	174	0	0	109.5
403	L	92.2	Very high	92.1	Very high	35 Å²	35	81.7 Å²	81.7	18%	0.183	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-103	146.8	-178	-58.5	-178.4	0	0	0	110.9	P366 D390 I391 W394 P401	P366-L403 HydrophobicContact CB-CD1 3.76Å; P366-L403 HydrophobicContact CG-CD1 3.36Å; D390-L403 HydrophobicContact CB-CD2 3.72Å; I391-L403 HydrophobicContact CG1-CD1 4.43Å; I391-L403 HydrophobicContact CG1-CD2 4.37Å; W394-L403 HydrophobicContact CB-CD1 3.82Å; W394-L403 HydrophobicContact CD2-CD1 3.73Å; W394-L403 HydrophobicContact CE3-CD1 3.85Å; W394-L403 HydrophobicContact CE3-CG 4.16Å; W394-L403 HydrophobicContact CG-CD1 3.69Å; P401-L403 HydrophobicContact CG-CD2 4.09Å
404	Q	90.9	Very high	92	Very high	141 Å²	141	84.5 Å²	84.5	66%	0.659	45%	0.447	S	S	*	.	S	Bend	trans	-72.3	-21.3	167.3	-62.1	-172.1	3.9	0	0	112.3	Y361	Y361-Q404 HydrophobicContact CD1-CB 3.97Å; Y361-Q404 HydrophobicContact CE1-CB 4.03Å; Y361-Q404 VanDerWaalsContact CE1-OE1 3.28Å
405	F	93	Very high	91.9	Very high	9 Å²	9	84.3 Å²	84.3	4%	0.039	45%	0.453	C	S	.	.	S	Bend	trans	-85	148.8	178.6	-65.6	-87.7	0	0	0	111.8	L360 Y361 I363 I365 P366 L383 E387 I391 S407	L360-F405 HydrophobicContact CG-CE1 4.25Å; Y361-F405 HydrophobicContact CD1-CD1 4.26Å; Y361-F405 AromaticContact CD1-CE1 3.93Å; Y361-F405 HydrophobicContact CD1-CE1 3.93Å; Y361-F405 HydrophobicContact CD1-CE2 4.23Å; Y361-F405 AromaticContact CD1-CZ 3.91Å; Y361-F405 HydrophobicContact CD1-CZ 3.91Å; Y361-F405 HydrophobicContact CE1-CE1 4.44Å; Y361-F405 HydrophobicContact CE1-CE2 4.21Å; Y361-F405 AromaticContact CE1-CZ 3.98Å; Y361-F405 HydrophobicContact CE1-CZ 3.98Å; I363-F405 WeakPolarHBondContact O-CD1 3.27Å; I365-F405 HydrophobicContact CB-CD1 4.49Å; I365-F405 HydrophobicContact CD1-CD1 3.97Å; I365-F405 HydrophobicContact CD1-CE1 3.54Å; I365-F405 HydrophobicContact CD1-CZ 4.05Å; I365-F405 HydrophobicContact CG1-CD1 4.17Å; I365-F405 HydrophobicContact CG1-CE1 4.24Å; P366-F405 HydrophobicContact CG-CB 3.83Å; L383-F405 HydrophobicContact CD2-CE1 4.33Å; L383-F405 HydrophobicContact CD2-CE2 4.31Å; L383-F405 HydrophobicContact CD2-CZ 3.63Å; E387-F405 HydrophobicContact CB-CE2 4.2Å; E387-F405 HydrophobicContact CG-CE2 4.05Å; I391-F405 HydrophobicContact CD1-CD2 3.84Å; I391-F405 HydrophobicContact CD1-CE2 3.92Å; I391-F405 HydrophobicContact CG1-CD2 4.41Å; F405-S407 PolarHBondContact O-N 2.87Å
406	V	92.7	Very high	92.1	Very high	58 Å²	58	84.1 Å²	84.1	35%	0.352	45%	0.454	S	S	.	.			trans	-66.7	120.9	173.6	-178.2	0	0	0	0	109.7	R364	R364-V406 WeakPolarHBondContact CA-O 3.46Å; R364-V406 WeakPolarHBondContact CB-O 3.47Å; R364-V406 HydrophobicContact CG-CB 4.13Å; R364-V406 HydrophobicContact CG-CG1 4.27Å
407	S	91.1	Very high	92.2	Very high	49 Å²	49	84.5 Å²	84.5	34%	0.343	45%	0.447	S	S	.	.			trans	-96.1	-2.4	-175.3	58.5	0	0	0	0	115	T367 F405	T367-S407 WeakPolarHBondContact CG2-O 3.31Å; F405-S407 PolarHBondContact O-N 2.87Å
408	K	92.5	Very high	92.4	Very high	161 Å²	161	83 Å²	83	70%	0.7	43%	0.434	S	S	*	.	S	Bend	trans	-96.7	124.7	178.4	-68.8	-176.8	178.8	178.6	0	110.6	R364	R364-K408 WeakPolarHBondContact CD-O 3.49Å; R364-K408 PolarHBondContact NH1-O 3.19Å
409	A	93.2	Very high	92.6	Very high	68 Å²	68	81.7 Å²	81.7	56%	0.562	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-55.4	151.1	175.6	0	0	0	0	0	111.6	R364 T367	R364-A409 PolarHBondContact NH1-O 3.48Å; T367-A409 HydrophobicContact CG2-CB 4.3Å
410	R	93.9	Very high	92.7	Very high	30 Å²	30	72.6 Å²	72.6	11%	0.113	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-59.4	141.6	173.1	-66.8	179.1	-166.2	-81.7	-5.4	109.4	L316 R318 E325 R364 G412	L316-R410 PolarHBondContact O-NH1 3.17Å; L316-R410 PolarHBondContact O-NH2 2.64Å; R318-R410 PolarHBondContact O-NH1 3.35Å; E325-R410 IonicContact OE1-CZ 2.79Å; E325-R410 IonicContact OE1-NE 3.75Å; E325-R410 IonicContact OE1-NH2 2.83Å; E325-R410 PolarHBondContact OE1-NH2 3.33Å; E325-R410 IonicContact OE2-CZ 3.4Å; E325-R410 IonicContact OE2-NE 3.19Å; E325-R410 PolarHBondContact OE2-NE 3.41Å; E325-R410 IonicContact OE2-NH2 3.9Å; E325-R410 PolarHBondContact OE2-NH2 3.43Å; R364-R410 VanDerWaalsContact CZ-CG 3.45Å; R364-R410 VanDerWaalsContact NH1-CA 3.29Å; R410-G412 PolarHBondContact O-N 2.75Å
411	K	91.9	Very high	92.9	Very high	176 Å²	176	67.8 Å²	67.8	77%	0.765	35%	0.348	S	S	*	.			trans	-64.6	-32.3	176.1	-67.9	-177.2	-178.9	179	0	111.7	E319	E319-K411 PolarHBondContact O-N 2.89Å; E319-K411 VanDerWaalsContact O-N 3.14Å
412	G	89.6	Confident	92.9	Very high	14 Å²	14	72.8 Å²	72.8	14%	0.144	37%	0.368	C	S	.	.			trans	68.1	-170.3	-173.3	0	0	0	0	0	112.1	E319 R410	E319-G412 PolarHBondContact O-N 3.14Å; R410-G412 PolarHBondContact O-N 2.75Å
413	L	91.1	Very high	92.9	Very high	40 Å²	40	65.4 Å²	65.4	21%	0.209	34%	0.338	C	S	.	.			trans	-83.8	140.7	174.1	-67.2	172.8	0	0	0	110.5	D292 A293 T320 N322 P415 Y564	D292-L413 HydrophobicContact CB-CD1 4.16Å; D292-L413 HydrophobicContact CB-CD2 4.03Å; D292-L413 HydrophobicContact CB-CG 4.31Å; A293-L413 HydrophobicContact CB-CD1 4.05Å; T320-L413 HydrophobicContact CG2-CD2 4.45Å; N322-L413 HydrophobicContact CB-CD1 4.41Å; L413-P415 WeakPolarHBondContact O-CD 3.43Å; L413-Y564 HydrophobicContact CB-CD1 3.42Å; L413-Y564 VanDerWaalsContact CB-CD1 3.42Å; L413-Y564 HydrophobicContact CB-CD2 4.39Å; L413-Y564 HydrophobicContact CB-CE1 3.53Å; L413-Y564 HydrophobicContact CB-CE2 4.47Å; L413-Y564 HydrophobicContact CB-CG 3.88Å; L413-Y564 HydrophobicContact CD1-CD1 4.14Å; L413-Y564 HydrophobicContact CD1-CD2 3.71Å; L413-Y564 HydrophobicContact CD1-CE2 4.19Å; L413-Y564 HydrophobicContact CD1-CG 3.68Å; L413-Y564 HydrophobicContact CG-CD1 4.4Å; L413-Y564 HydrophobicContact CG-CG 4.4Å
414	V	91.1	Very high	92.6	Very high	123 Å²	123	66 Å²	66	75%	0.745	35%	0.345	S	S	*	.			trans	-88.1	115.4	175.1	-179.1	0	0	0	0	108.5
415	P	92.8	Very high	92.1	Very high	46 Å²	46	60.2 Å²	60.2	30%	0.299	32%	0.321	S	S	.	.			trans	-71	134.3	-179.9	27.8	-32.8	0	0	0	111	L413 W497 I562 Y564	L413-P415 WeakPolarHBondContact O-CD 3.43Å; P415-W497 HydrophobicContact CB-CH2 4.25Å; P415-W497 HydrophobicContact CB-CZ3 4.49Å; P415-W497 HydrophobicContact CG-CH2 4.3Å; P415-I562 HydrophobicContact CB-CG2 3.7Å; P415-Y564 HydrophobicContact CB-CD1 4.37Å; P415-Y564 HydrophobicContact CB-CE1 3.81Å
416	Q	95.1	Very high	91.1	Very high	56 Å²	56	65.4 Å²	65.4	26%	0.262	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	146.8	167.4	-61.8	-174.3	24	0	0	109.6	C534 I562 F563	Q416-C534 PolarHBondContact OE1-O 2.97Å; Q416-I562 WeakPolarHBondContact O-CA 3.49Å; Q416-F563 HydrophobicContact CB-CD1 4.42Å; Q416-F563 HydrophobicContact CB-CD2 4.2Å; Q416-F563 HydrophobicContact CB-CE1 3.98Å; Q416-F563 HydrophobicContact CB-CE2 3.73Å; Q416-F563 HydrophobicContact CB-CZ 3.61Å; Q416-F563 HydrophobicContact CG-CE2 4.35Å; Q416-F563 PolarHBondContact N-O 2.74Å; Q416-F563 PolarHBondContact O-N 2.97Å
417	R	95.9	Very high	89.5	Confident	84 Å²	84	72.4 Å²	72.4	32%	0.317	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	111.6	-177.1	-64.8	179.5	-179.4	-88.6	-3.2	109.9	C534 E560 L561 I562	R417-C534 PolarHBondContact O-SG 3.47Å; R417-E560 IonicContact CZ-OE2 2.66Å; R417-E560 IonicContact NH1-OE2 3.48Å; R417-E560 PolarHBondContact NH1-OE2 2.9Å; R417-L561 WeakPolarHBondContact CA-O 3.08Å; R417-I562 HydrophobicContact CG-CG1 4.47Å; R417-I562 HydrophobicContact CG-CG2 4.49Å; R417-I562 VanDerWaalsContact NH1-CD1 3.33Å
418	C	96.4	Very high	87.7	Confident	1 Å²	1	75.3 Å²	75.3	1%	0.007	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	102.6	174.4	174.1	0	0	0	0	109.5	C534 V539 E560 L561 F563	C418-C534 HydrophobicContact CB-CB 4.02Å; C418-V539 HydrophobicContact CB-CG2 4.16Å; C418-E560 WeakPolarHBondContact O-CB 3.27Å; C418-L561 HydrophobicContact CB-CB 4.32Å; C418-L561 PolarHBondContact N-O 3.49Å; C418-L561 PolarHBondContact O-N 3Å; C418-L561 VanDerWaalsContact O-N 3.1Å; C418-F563 HydrophobicContact CB-CE1 3.86Å
419	H	95.6	Very high	85.9	Confident	88 Å²	88	74.1 Å²	74.1	41%	0.407	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	123.4	174	-67.6	-105.3	0	0	0	110.8	M529 P559 E560	H419-M529 VanDerWaalsContact O-CE 3.31Å; H419-M529 WeakPolarHBondContact O-CE 3.34Å; H419-P559 WeakPolarHBondContact CA-O 3.44Å; H419-E560 IonicContact CE1-OE1 3.61Å; H419-E560 PolarHBondContact CE1-OE1 3.02Å; H419-E560 IonicContact ND1-OE1 3.41Å; H419-E560 PolarHBondContact ND1-OE1 2.9Å; H419-E560 IonicContact NE2-OE1 2.63Å; H419-E560 PolarHBondContact NE2-OE1 2.78Å; H419-E560 VanDerWaalsContact NE2-OE1 3.15Å
420	R	95.4	Very high	84.7	Confident	1 Å²	1	75.3 Å²	75.3	0%	0.004	38%	0.377	C	S	.	.			trans	-98.4	-3.7	-176.9	76.2	-174.6	-169.7	88.7	-7.7	116	G528 M529 V532 F541 G552 V553 Q557 I558 P559	R420-G528 CarbonylContact O-C 3.55Å; R420-G528 VanDerWaalsContact O-CA 3.29Å; R420-G528 WeakPolarHBondContact O-CA 3.49Å; R420-M529 PolarHBondContact O-N 2.89Å; R420-V532 HydrophobicContact CB-CG2 4.43Å; R420-F541 HydrophobicContact CB-CD2 4.16Å; R420-F541 HydrophobicContact CB-CE1 4.37Å; R420-F541 HydrophobicContact CB-CE2 3.71Å; R420-F541 HydrophobicContact CB-CZ 3.82Å; R420-G552 PolarHBondContact NH1-O 3.05Å; R420-G552 PolarHBondContact NH2-O 2.91Å; R420-V553 PolarHBondContact NH1-O 3.42Å; R420-V553 VanDerWaalsContact NH1-O 3.09Å; R420-Q557 PolarHBondContact NH2-O 2.78Å; R420-I558 WeakPolarHBondContact CD-O 3Å; R420-I558 PolarHBondContact NE-O 2.94Å; R420-P559 PolarHBondContact N-O 3.4Å
421	F	94.9	Very high	83.7	Confident	18 Å²	18	75.3 Å²	75.3	8%	0.079	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	141.8	-178.3	-63.8	-63.5	0	0	0	111.5	Y456 Q526 G528 G555 G556 P559	F421-Y456 HydrophobicContact CD2-CE2 4.24Å; F421-Y456 HydrophobicContact CE2-CE2 4.5Å; F421-Q526 WeakPolarHBondContact CB-O 3.4Å; F421-Q526 WeakPolarHBondContact CD1-O 3.27Å; F421-G528 VanDerWaalsContact CD1-CA 3.48Å; F421-G555 VanDerWaalsContact CE1-CA 3.46Å; F421-G556 VanDerWaalsContact CE2-O 3.24Å; F421-G556 WeakPolarHBondContact CE2-O 3.4Å; F421-G556 WeakPolarHBondContact CZ-O 3.36Å; F421-P559 HydrophobicContact CD2-CB 3.79Å; F421-P559 HydrophobicContact CE2-CB 4.2Å
422	Q	91.5	Very high	82.9	Confident	138 Å²	138	71.9 Å²	71.9	65%	0.645	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	-28.6	177.1	-61.4	179.1	15	0	0	112.1	Q526 E527 M529	Q422-Q526 PolarHBondContact N-O 3.06Å; Q422-E527 HydrophobicContact CB-CB 3.99Å; Q422-E527 HydrophobicContact CG-CB 4.43Å; Q422-E527 PolarHBondContact N-O 3.05Å; Q422-M529 HydrophobicContact CG-CE 4.45Å; Q422-M529 HydrophobicContact CG-CG 4.35Å; Q422-M529 HydrophobicContact CG-SD 4.18Å
423	S	89.7	Confident	82.3	Confident	38 Å²	38	71.8 Å²	71.8	27%	0.266	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	163	-179.8	56.9	0	0	0	0	111.2	Q526 E527	S423-Q526 PolarHBondContact O-N 2.88Å; S423-E527 WeakPolarHBondContact CB-OE2 3.41Å; S423-E527 VanDerWaalsContact OG-CD 3.32Å; S423-E527 PolarHBondContact OG-OE2 2.96Å
424	C	86.6	Confident	81.4	Confident	48 Å²	48	78.5 Å²	78.5	32%	0.324	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149.4	172.2	59.3	0	0	0	0	109.3	Y456 S491 F524	C424-Y456 HydrophobicContact CB-CE1 3.99Å; C424-S491 VanDerWaalsContact SG-CB 3.52Å; C424-F524 WeakPolarHBondContact CA-O 3.46Å
425	A	80.5	Confident	80.6	Confident	18 Å²	18	75.1 Å²	75.1	15%	0.149	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	154.8	-176.9	0	0	0	0	0	112.1	F524 Q526	A425-F524 HydrophobicContact CB-CE1 4.25Å; A425-F524 HydrophobicContact CB-CZ 4.12Å; A425-F524 PolarHBondContact N-O 2.83Å; A425-F524 PolarHBondContact O-N 3.48Å; A425-Q526 HydrophobicContact CB-CG 4Å
426	Y	72.1	Confident	80.4	Confident	118 Å²	118	79.6 Å²	79.6	46%	0.463	38%	0.378	S	S	.	.			trans	-147.3	95	173.2	72.8	-67.4	0	0	0	109.1	Y523	Y426-Y523 HydrophobicContact CD1-CD1 4.26Å; Y426-Y523 AromaticContact CD1-CE1 3.56Å; Y426-Y523 HydrophobicContact CD1-CE1 3.56Å; Y426-Y523 HydrophobicContact CD2-CE1 4.45Å; Y426-Y523 HydrophobicContact CE1-CE1 4.41Å; Y426-Y523 HydrophobicContact CG-CD1 4.22Å; Y426-Y523 AromaticContact CG-CE1 3.6Å; Y426-Y523 HydrophobicContact CG-CE1 3.6Å
427	R	58.5	Low	80.3	Confident	205 Å²	205	77.9 Å²	77.9	77%	0.774	37%	0.372	S	S	*	.	S	Bend	trans	167.8	160.3	157.6	-93.2	159.7	-170	-152.9	3.4	114.8	N429	R427-N429 VanDerWaalsContact C-N 3.26Å; R427-N429 PolarHBondContact O-N 2.89Å
428	S	54	Low	80.2	Confident	111 Å²	111	73.9 Å²	73.9	78%	0.776	36%	0.357	S	S	*	.	S	Bend	trans	47.3	-36	-176.8	66.2	0	0	0	0	120.3
429	N	54.7	Low	80.2	Confident	136 Å²	136	73.8 Å²	73.8	73%	0.727	36%	0.357	S	S	*	.	S	Bend	trans	-105.8	88.7	169.6	-79.8	-12.2	0	0	0	109	R427 W431	R427-N429 VanDerWaalsContact C-N 3.26Å; R427-N429 PolarHBondContact O-N 2.89Å; N429-W431 PolarHBondContact O-N 3.13Å
430	Q	66.4	Low	80.3	Confident	93 Å²	93	69.6 Å²	69.6	44%	0.435	34%	0.337	S	S	.	.			trans	-68.6	120.6	-169.3	-58.6	-178.1	-7.6	0	0	111	R432 L521	Q430-R432 HydrophobicContact CB-CG 4.12Å; Q430-R432 PolarHBondContact O-N 3.04Å; Q430-R432 VanDerWaalsContact O-N 3.15Å; Q430-R432 VanDerWaalsContact OE1-CZ 3.24Å; Q430-L521 HydrophobicContact CB-CD1 3.94Å; Q430-L521 HydrophobicContact CB-CD2 3.73Å; Q430-L521 HydrophobicContact CB-CG 4.39Å; Q430-L521 HydrophobicContact CG-CD1 3.57Å; Q430-L521 HydrophobicContact CG-CD2 4.28Å
431	W	72.8	Confident	80.5	Confident	29 Å²	29	71.9 Å²	71.9	11%	0.11	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-73.3	106.1	169.5	-146.6	-79	0	0	0	107.9	N429 Y433 D438 F524 N549 G550 T551 G556	N429-W431 PolarHBondContact O-N 3.13Å; W431-Y433 AromaticContact CD1-CE1 3.54Å; W431-D438 VanDerWaalsContact CZ2-OD1 3.31Å; W431-D438 WeakPolarHBondContact CZ2-OD1 3.47Å; W431-D438 PolarHBondContact NE1-OD1 3.11Å; W431-D438 PolarHBondContact NE1-OD2 2.93Å; W431-F524 HydrophobicContact CB-CB 4.29Å; W431-F524 HydrophobicContact CB-CD1 4.24Å; W431-F524 HydrophobicContact CD2-CB 3.75Å; W431-F524 HydrophobicContact CD2-CG 4.15Å; W431-F524 HydrophobicContact CE3-CB 3.42Å; W431-F524 VanDerWaalsContact CE3-CB 3.42Å; W431-F524 AromaticContact CE3-CD1 3.87Å; W431-F524 HydrophobicContact CE3-CD1 3.87Å; W431-F524 AromaticContact CE3-CD2 3.62Å; W431-F524 HydrophobicContact CE3-CD2 3.62Å; W431-F524 HydrophobicContact CE3-CE2 4.32Å; W431-F524 AromaticContact CE3-CG 3.35Å; W431-F524 HydrophobicContact CE3-CG 3.35Å; W431-F524 HydrophobicContact CG-CB 4.14Å; W431-F524 HydrophobicContact CZ3-CB 4.04Å; W431-F524 AromaticContact CZ3-CD2 3.67Å; W431-F524 HydrophobicContact CZ3-CD2 3.67Å; W431-F524 HydrophobicContact CZ3-CE2 4.3Å; W431-F524 AromaticContact CZ3-CG 3.91Å; W431-F524 HydrophobicContact CZ3-CG 3.91Å; W431-N549 VanDerWaalsContact CZ2-O 3.28Å; W431-N549 WeakPolarHBondContact CZ2-O 3.27Å; W431-N549 PolarHBondContact NE1-ND2 2.88Å; W431-G550 WeakPolarHBondContact CH2-O 3.42Å; W431-T551 WeakPolarHBondContact CZ2-OG1 3.31Å; W431-G556 VanDerWaalsContact CZ2-CA 3.46Å
432	R	76.3	Confident	80.6	Confident	105 Å²	105	71 Å²	71	40%	0.396	34%	0.344	S	S	.	.			trans	-107.6	144.2	-175.3	-70.2	-179.4	179	-168.3	0.6	109.9	Q430 R434 L521 N549	Q430-R432 HydrophobicContact CB-CG 4.12Å; Q430-R432 PolarHBondContact O-N 3.04Å; Q430-R432 VanDerWaalsContact O-N 3.15Å; Q430-R432 VanDerWaalsContact OE1-CZ 3.24Å; R432-R434 VanDerWaalsContact NH1-NH2 3.14Å; R432-L521 HydrophobicContact CG-CD2 3.69Å; R432-N549 PolarHBondContact O-ND2 2.89Å; R432-N549 VanDerWaalsContact O-ND2 3.16Å; R432-N549 PolarHBondContact O-OD1 3.15Å
433	Y	77.8	Confident	80.9	Confident	12 Å²	12	64.7 Å²	64.7	5%	0.047	32%	0.315	C	S	.	.			trans	-108.5	96.5	178.6	-58.5	-50.4	0	0	0	108.5	W431 Y456 Y465 L516 S522 Q557	W431-Y433 AromaticContact CD1-CE1 3.54Å; Y433-Y456 PolarHBondContact OH-O 3.44Å; Y433-Y465 AromaticContact CD2-CD1 3.96Å; Y433-Y465 HydrophobicContact CD2-CD1 3.96Å; Y433-Y465 AromaticContact CD2-CE1 3.55Å; Y433-Y465 HydrophobicContact CD2-CE1 3.55Å; Y433-Y465 AromaticContact CE2-CD1 3.94Å; Y433-Y465 HydrophobicContact CE2-CD1 3.94Å; Y433-Y465 AromaticContact CE2-CE1 3.47Å; Y433-Y465 HydrophobicContact CE2-CE1 3.47Å; Y433-Y465 VanDerWaalsContact CE2-CE1 3.47Å; Y433-L516 WeakPolarHBondContact CB-O 3.08Å; Y433-L516 HydrophobicContact CD1-CB 3.41Å; Y433-L516 VanDerWaalsContact CD1-CB 3.41Å; Y433-L516 HydrophobicContact CD1-CD1 4.12Å; Y433-L516 HydrophobicContact CD1-CG 4.36Å; Y433-L516 HydrophobicContact CD2-CB 4.06Å; Y433-L516 HydrophobicContact CE1-CB 3.65Å; Y433-L516 HydrophobicContact CE1-CD1 3.4Å; Y433-L516 HydrophobicContact CE1-CG 4.12Å; Y433-L516 HydrophobicContact CE2-CB 4.2Å; Y433-L516 HydrophobicContact CE2-CD1 4.1Å; Y433-L516 HydrophobicContact CG-CB 3.61Å; Y433-L516 VanDerWaalsContact OH-CD1 3.26Å; Y433-L516 WeakPolarHBondContact OH-CD1 3.4Å; Y433-S522 VanDerWaalsContact CE2-CB 3.44Å; Y433-S522 VanDerWaalsContact CE2-OG 3.27Å; Y433-S522 WeakPolarHBondContact CE2-OG 3.37Å; Y433-S522 WeakPolarHBondContact OH-CB 3.48Å; Y433-S522 PolarHBondContact OH-OG 3.45Å; Y433-Q557 HydrophobicContact CE1-CG 4.11Å; Y433-Q557 PolarHBondContact OH-NE2 2.84Å
434	R	71.9	Confident	81.3	Confident	180 Å²	180	63.1 Å²	63.1	68%	0.679	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122	44.6	-179.9	-67.7	-175.5	172.7	-171.4	-5.7	110.7	R432 R436	R432-R434 VanDerWaalsContact NH1-NH2 3.14Å; R434-R436 PolarHBondContact O-N 3.41Å
435	G	73.8	Confident	81.7	Confident	53 Å²	53	63.8 Å²	63.8	55%	0.546	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	68.3	13.3	-175.3	0	0	0	0	0	114.8
436	R	87.8	Confident	82.3	Confident	139 Å²	139	67.5 Å²	67.5	53%	0.525	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	152.7	173.8	-65.4	-177.5	177	-176.8	-2.3	110.2	R434 N549	R434-R436 PolarHBondContact O-N 3.41Å; R436-N549 HydrophobicContact CB-CB 3.65Å; R436-N549 WeakPolarHBondContact CD-OD1 3.17Å
437	C	92.7	Very high	83.3	Confident	20 Å²	20	63.2 Å²	63.2	14%	0.135	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	126.1	-178.2	-173.2	0	0	0	0	111.3	V514 I515 S547 T548 N549	C437-V514 WeakPolarHBondContact CA-O 3.26Å; C437-I515 HydrophobicContact CB-CG1 4.17Å; C437-S547 WeakPolarHBondContact O-CA 3.17Å; C437-S547 PolarHBondContact O-OG 2.96Å; C437-T548 PolarHBondContact N-OG1 3.25Å; C437-T548 PolarHBondContact O-N 3.2Å; C437-T548 PolarHBondContact O-OG1 3.32Å; C437-N549 PolarHBondContact O-N 2.87Å; C437-N549 VanDerWaalsContact O-N 3.07Å
438	D	95.2	Very high	85.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	125.5	164.2	-75.7	-66.3	0	0	0	108.2	W431 S513 V514 N549 T551 Q557	W431-D438 VanDerWaalsContact CZ2-OD1 3.31Å; W431-D438 WeakPolarHBondContact CZ2-OD1 3.47Å; W431-D438 PolarHBondContact NE1-OD1 3.11Å; W431-D438 PolarHBondContact NE1-OD2 2.93Å; D438-S513 CarbonylContact O-C 3.56Å; D438-S513 WeakPolarHBondContact O-CA 3.23Å; D438-V514 PolarHBondContact N-O 3.21Å; D438-V514 PolarHBondContact O-N 3.36Å; D438-N549 WeakPolarHBondContact OD1-CB 3.4Å; D438-N549 PolarHBondContact OD2-ND2 3.34Å; D438-T551 WeakPolarHBondContact CB-OG1 3.26Å; D438-T551 WeakPolarHBondContact OD1-CB 3.45Å; D438-T551 PolarHBondContact OD1-OG1 3.25Å; D438-Q557 HydrophobicContact CB-CB 3.75Å; D438-Q557 HydrophobicContact CB-CG 4.42Å
439	S	96.9	Very high	87.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	140.6	-174.9	-172.2	0	0	0	0	112.3	T511 A512 S513 S544 S547	S439-T511 WeakPolarHBondContact OG-CG2 3.3Å; S439-A512 CarbonylContact C-O 3.56Å; S439-A512 VanDerWaalsContact CA-O 3.22Å; S439-A512 WeakPolarHBondContact CA-O 3.18Å; S439-A512 PolarHBondContact OG-O 3.04Å; S439-S513 PolarHBondContact OG-OG 3.18Å; S439-S544 VanDerWaalsContact OG-CB 3.24Å; S439-S544 WeakPolarHBondContact OG-CB 3.49Å; S439-S544 PolarHBondContact OG-OG 3.46Å; S439-S547 PolarHBondContact N-OG 2.85Å; S439-S547 WeakPolarHBondContact O-CB 3.41Å
440	I	97.6	Very high	89.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	141.2	177.9	-168.2	73	0	0	0	109.4	A512 F541 Q542 T551 V553 I558	I440-A512 HydrophobicContact CG2-CB 4.05Å; I440-A512 PolarHBondContact N-O 3.48Å; I440-A512 PolarHBondContact O-N 3.48Å; I440-F541 HydrophobicContact CG1-CB 4.48Å; I440-F541 HydrophobicContact CG1-CD1 3.97Å; I440-Q542 WeakPolarHBondContact CD1-O 3.33Å; I440-T551 HydrophobicContact CB-CG2 4.39Å; I440-V553 HydrophobicContact CD1-CG2 4.22Å; I440-I558 HydrophobicContact CG2-CB 4.29Å; I440-I558 HydrophobicContact CG2-CD1 3.98Å; I440-I558 HydrophobicContact CG2-CG2 4.17Å
441	Q	97.8	Very high	90.6	Very high	49 Å²	49	38 Å²	38	23%	0.229	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	143.5	170.9	-69.9	-172.5	-16.2	0	0	110.3	F509 Y510 T511 F541 Q542	Q441-F509 HydrophobicContact CB-CD1 4.24Å; Q441-Y510 CarbonylContact C-O 3.47Å; Q441-Y510 WeakPolarHBondContact CA-O 3.25Å; Q441-T511 HydrophobicContact CG-CG2 4.44Å; Q441-F541 CarbonylContact O-C 3.55Å; Q441-F541 WeakPolarHBondContact O-CA 3.33Å; Q441-Q542 HydrophobicContact CB-CB 4.16Å; Q441-Q542 PolarHBondContact N-O 3.43Å; Q441-Q542 PolarHBondContact O-N 3.48Å
442	F	98	Very high	91.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	153.7	174.1	72.1	-82.7	0	0	0	112.3	V444 I450 L471 I504 F509 Y510 A512 V539 Q540 F541 L561	F442-V444 HydrophobicContact CD2-CG1 4.2Å; F442-V444 HydrophobicContact CE2-CG1 4.37Å; F442-I450 HydrophobicContact CE2-CD1 4.08Å; F442-I450 HydrophobicContact CE2-CG1 4.27Å; F442-I450 HydrophobicContact CZ-CD1 4.11Å; F442-I450 HydrophobicContact CZ-CG1 3.97Å; F442-L471 HydrophobicContact CE1-CD1 3.57Å; F442-L471 HydrophobicContact CZ-CD1 3.76Å; F442-I504 HydrophobicContact CE2-CG2 4.28Å; F442-I504 HydrophobicContact CZ-CD1 4.47Å; F442-F509 WeakPolarHBondContact O-CA 3.39Å; F442-Y510 PolarHBondContact N-O 2.92Å; F442-Y510 PolarHBondContact O-N 3.48Å; F442-A512 HydrophobicContact CD1-CB 4.25Å; F442-A512 HydrophobicContact CE1-CB 4.04Å; F442-V539 HydrophobicContact CB-CG1 4.08Å; F442-V539 HydrophobicContact CD2-CG1 4.28Å; F442-Q540 CarbonylContact C-O 3.5Å; F442-Q540 WeakPolarHBondContact CA-O 3.35Å; F442-Q540 WeakPolarHBondContact CB-O 3.3Å; F442-F541 HydrophobicContact CB-CD1 3.95Å; F442-F541 HydrophobicContact CB-CE1 4.08Å; F442-L561 HydrophobicContact CB-CD1 4.17Å; F442-L561 HydrophobicContact CD1-CD1 4Å; F442-L561 HydrophobicContact CD2-CD1 3.73Å; F442-L561 HydrophobicContact CE1-CD1 4.34Å; F442-L561 HydrophobicContact CE2-CD1 4.1Å; F442-L561 HydrophobicContact CG-CD1 3.68Å; F442-L561 HydrophobicContact CZ-CD1 4.4Å
443	A	97.9	Very high	92.8	Very high	5 Å²	5	31.6 Å²	31.6	4%	0.041	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	155.7	168.7	0	0	0	0	0	109.2	F509 V539 Q540	A443-F509 HydrophobicContact CB-CD1 3.88Å; A443-F509 HydrophobicContact CB-CD2 4.22Å; A443-F509 HydrophobicContact CB-CE1 3.73Å; A443-F509 HydrophobicContact CB-CE2 4.09Å; A443-F509 HydrophobicContact CB-CG 4.11Å; A443-F509 HydrophobicContact CB-CZ 3.82Å; A443-V539 WeakPolarHBondContact O-CA 3.49Å; A443-Q540 PolarHBondContact N-O 3.19Å; A443-Q540 PolarHBondContact O-N 2.68Å
444	V	97.4	Very high	93.7	Very high	5 Å²	5	31 Å²	31	3%	0.03	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147	-178.7	-66.3	0	0	0	0	110	F442 K446 V448 I504 P506 D507 V537 T538 V539	F442-V444 HydrophobicContact CD2-CG1 4.2Å; F442-V444 HydrophobicContact CE2-CG1 4.37Å; V444-K446 VanDerWaalsContact C-N 3.28Å; V444-K446 WeakPolarHBondContact CG2-O 3.5Å; V444-V448 HydrophobicContact CG1-CG2 4.2Å; V444-V448 HydrophobicContact CG2-CG2 4.2Å; V444-I504 HydrophobicContact CG2-CB 4.36Å; V444-I504 HydrophobicContact CG2-CG2 3.52Å; V444-P506 CarbonylContact O-C 3.55Å; V444-P506 VanDerWaalsContact O-CA 3.28Å; V444-P506 WeakPolarHBondContact O-CA 3.35Å; V444-D507 PolarHBondContact O-N 2.76Å; V444-V537 HydrophobicContact CB-CG1 4.2Å; V444-V537 HydrophobicContact CG1-CG1 4.28Å; V444-T538 WeakPolarHBondContact CA-O 3.42Å; V444-V539 HydrophobicContact CG1-CG1 4.36Å; V444-V539 HydrophobicContact CG1-CG2 4.17Å
445	D	96.3	Very high	94.8	Very high	61 Å²	61	22.5 Å²	22.5	33%	0.326	12%	0.116	S	C	.	.	S	Bend	trans	-77.3	-14.4	177.1	65.7	-11.7	0	0	0	113.4	V537 T538	D445-V537 WeakPolarHBondContact OD1-CA 3.41Å; D445-T538 VanDerWaalsContact CG-N 3.26Å; D445-T538 PolarHBondContact N-O 3.11Å; D445-T538 VanDerWaalsContact N-O 3.12Å; D445-T538 PolarHBondContact OD1-N 3.26Å; D445-T538 VanDerWaalsContact OD2-CB 3.29Å; D445-T538 WeakPolarHBondContact OD2-CB 3.43Å; D445-T538 PolarHBondContact OD2-N 3.48Å; D445-T538 PolarHBondContact OD2-OG1 3.03Å
446	K	93.4	Very high	95.7	Very high	97 Å²	97	20.6 Å²	20.6	42%	0.422	9%	0.093	S	C	.	.	S	Bend	trans	-136.6	150.8	-177.7	-69.5	178.4	-174.4	167.8	0	110.9	V444 V448 K536 V537	V444-K446 VanDerWaalsContact C-N 3.28Å; V444-K446 WeakPolarHBondContact CG2-O 3.5Å; K446-V448 PolarHBondContact O-N 2.95Å; K446-K536 WeakPolarHBondContact CD-O 3.42Å; K446-K536 WeakPolarHBondContact CE-O 3.24Å; K446-K536 PolarHBondContact NZ-O 3.5Å; K446-V537 HydrophobicContact CB-CG2 4.37Å
447	R	92.6	Very high	95.9	Very high	28 Å²	28	14 Å²	14	11%	0.106	7%	0.068	C	C	.	.			trans	-59.4	127.5	171.5	-177.1	177.9	-69.5	176.5	-0.3	109.7	Q503 I504 E505	R447-Q503 HydrophobicContact CG-CG 4.3Å; R447-I504 VanDerWaalsContact CA-O 3.31Å; R447-I504 WeakPolarHBondContact CA-O 3.3Å; R447-I504 WeakPolarHBondContact CG-O 3.02Å; R447-E505 IonicContact CZ-OE1 3.98Å; R447-E505 IonicContact CZ-OE2 3.3Å; R447-E505 IonicContact NE-OE1 2.75Å; R447-E505 PolarHBondContact NE-OE1 3.47Å; R447-E505 IonicContact NE-OE2 3.94Å; R447-E505 PolarHBondContact NE-OE2 2.92Å; R447-E505 IonicContact NH2-OE1 2.68Å; R447-E505 PolarHBondContact NH2-OE1 3.2Å; R447-E505 IonicContact NH2-OE2 3.61Å; R447-E505 PolarHBondContact NH2-OE2 3.44Å
448	V	95.2	Very high	95.7	Very high	1 Å²	1	13 Å²	13	1%	0.006	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	165.6	176.8	-60.1	0	0	0	0	110.4	V444 K446 I450 I504 V537 F563 Y564 A565	V444-V448 HydrophobicContact CG1-CG2 4.2Å; V444-V448 HydrophobicContact CG2-CG2 4.2Å; K446-V448 PolarHBondContact O-N 2.95Å; V448-I450 HydrophobicContact CG2-CD1 4.36Å; V448-I504 HydrophobicContact CG2-CB 3.97Å; V448-I504 HydrophobicContact CG2-CG1 4.24Å; V448-I504 PolarHBondContact N-O 3.49Å; V448-I504 PolarHBondContact O-N 3.26Å; V448-V537 HydrophobicContact CG1-CG1 3.95Å; V448-V537 HydrophobicContact CG1-CG2 3.8Å; V448-F563 HydrophobicContact CB-CB 4.43Å; V448-F563 HydrophobicContact CB-CD2 3.94Å; V448-F563 HydrophobicContact CB-CG 4.48Å; V448-F563 HydrophobicContact CG1-CD2 3.8Å; V448-F563 HydrophobicContact CG1-CE2 4.12Å; V448-F563 HydrophobicContact CG2-CB 4.46Å; V448-F563 HydrophobicContact CG2-CD2 4.45Å; V448-Y564 WeakPolarHBondContact CA-O 3.44Å; V448-Y564 WeakPolarHBondContact CB-O 3.44Å; V448-A565 HydrophobicContact CG1-CB 3.78Å
449	F	96.2	Very high	95.3	Very high	9 Å²	9	14.2 Å²	14.2	4%	0.039	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	110.7	170.6	-64.2	-95.3	0	0	0	109.7	E289 V290 A293 Q294 A451 P501 V502 Q503 F563 Y564	E289-F449 HydrophobicContact CB-CE2 4.17Å; V290-F449 HydrophobicContact CB-CZ 4.43Å; V290-F449 HydrophobicContact CG2-CE1 4.42Å; V290-F449 HydrophobicContact CG2-CZ 3.81Å; A293-F449 HydrophobicContact CB-CB 3.98Å; A293-F449 HydrophobicContact CB-CD1 3.6Å; A293-F449 HydrophobicContact CB-CD2 3.65Å; A293-F449 HydrophobicContact CB-CE1 3.93Å; A293-F449 HydrophobicContact CB-CE2 4Å; A293-F449 HydrophobicContact CB-CG 3.45Å; A293-F449 VanDerWaalsContact CB-CG 3.45Å; A293-F449 HydrophobicContact CB-CZ 4.12Å; Q294-F449 HydrophobicContact CG-CD1 4.45Å; Q294-F449 HydrophobicContact CG-CE1 4.4Å; F449-A451 PolarHBondContact O-N 3.47Å; F449-P501 HydrophobicContact CB-CB 3.78Å; F449-V502 CarbonylContact C-O 3.57Å; F449-V502 WeakPolarHBondContact CA-O 3.5Å; F449-Q503 HydrophobicContact CD1-CB 3.95Å; F449-Q503 HydrophobicContact CE1-CB 3.7Å; F449-Q503 HydrophobicContact CE1-CG 4Å; F449-Q503 HydrophobicContact CZ-CB 4.45Å; F449-Q503 HydrophobicContact CZ-CG 4.26Å; F449-F563 CarbonylContact O-C 3.56Å; F449-F563 WeakPolarHBondContact O-CA 3.38Å; F449-F563 WeakPolarHBondContact O-CB 3.38Å; F449-Y564 HydrophobicContact CB-CD2 4.35Å; F449-Y564 PolarHBondContact N-O 3.05Å; F449-Y564 PolarHBondContact O-N 3.49Å
450	I	97.6	Very high	94.6	Very high	2 Å²	2	18.2 Å²	18.2	1%	0.01	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	114.7	174.8	-63.8	-62.7	0	0	0	108.3	F442 V448 F453 L471 F498 P501 V502 I504 F563	F442-I450 HydrophobicContact CE2-CD1 4.08Å; F442-I450 HydrophobicContact CE2-CG1 4.27Å; F442-I450 HydrophobicContact CZ-CD1 4.11Å; F442-I450 HydrophobicContact CZ-CG1 3.97Å; V448-I450 HydrophobicContact CG2-CD1 4.36Å; I450-F453 HydrophobicContact CG2-CE1 3.96Å; I450-L471 HydrophobicContact CB-CD2 3.94Å; I450-L471 HydrophobicContact CG1-CD2 4.18Å; I450-L471 HydrophobicContact CG2-CD2 4.11Å; I450-F498 HydrophobicContact CG2-CD2 4.21Å; I450-F498 HydrophobicContact CG2-CE2 3.79Å; I450-P501 CarbonylContact O-C 3.55Å; I450-P501 VanDerWaalsContact O-CA 3.27Å; I450-P501 WeakPolarHBondContact O-CA 3.39Å; I450-V502 PolarHBondContact N-O 3.4Å; I450-V502 PolarHBondContact O-N 3.07Å; I450-I504 HydrophobicContact CB-CG1 4.41Å; I450-I504 HydrophobicContact CD1-CG1 4.46Å; I450-I504 HydrophobicContact CG1-CD1 4.02Å; I450-I504 HydrophobicContact CG1-CG1 3.5Å; I450-F563 HydrophobicContact CD1-CB 3.82Å
451	A	96.7	Very high	93.9	Very high	3 Å²	3	19.7 Å²	19.7	3%	0.025	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-26.6	179.1	0	0	0	0	0	112	F449 W497 F498 P501 I562 Y564	F449-A451 PolarHBondContact O-N 3.47Å; A451-W497 HydrophobicContact CB-CE3 3.81Å; A451-W497 HydrophobicContact CB-CZ3 3.72Å; A451-W497 WeakPolarHBondContact O-CA 3.44Å; A451-F498 PolarHBondContact O-N 2.89Å; A451-P501 HydrophobicContact CB-CG 4.47Å; A451-I562 PolarHBondContact N-O 2.91Å; A451-Y564 HydrophobicContact CB-CD2 4.16Å; A451-Y564 HydrophobicContact CB-CE2 3.59Å
452	G	97.4	Very high	93.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.5	-173.5	-178.4	0	0	0	0	0	113.5	V496 I562	G452-V496 CarbonylContact C-O 3.58Å; G452-V496 WeakPolarHBondContact CA-O 3.38Å; G452-I562 PolarHBondContact N-O 3.22Å; G452-I562 WeakPolarHBondContact O-CB 3.34Å; G452-I562 PolarHBondContact O-N 3.17Å
453	F	97.9	Very high	93.2	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	141.7	175.7	-54.7	-38.7	0	0	0	110.5	I450 L455 I469 L471 V496 F498 A512 V514 I558 E560 L561	I450-F453 HydrophobicContact CG2-CE1 3.96Å; F453-L455 HydrophobicContact CB-CD2 3.9Å; F453-L455 HydrophobicContact CB-CG 4.5Å; F453-I469 HydrophobicContact CD2-CB 3.84Å; F453-I469 HydrophobicContact CD2-CD1 4.47Å; F453-I469 HydrophobicContact CD2-CG2 3.86Å; F453-I469 HydrophobicContact CE2-CB 3.99Å; F453-I469 HydrophobicContact CE2-CG2 4.49Å; F453-L471 HydrophobicContact CZ-CD1 4.2Å; F453-V496 PolarHBondContact N-O 3.4Å; F453-V496 PolarHBondContact O-N 2.88Å; F453-F498 HydrophobicContact CE1-CE2 4.15Å; F453-F498 HydrophobicContact CE1-CZ 4.4Å; F453-F498 HydrophobicContact CE2-CE2 4.25Å; F453-F498 AromaticContact CE2-CZ 3.79Å; F453-F498 HydrophobicContact CE2-CZ 3.79Å; F453-F498 AromaticContact CZ-CE2 3.91Å; F453-F498 HydrophobicContact CZ-CE2 3.91Å; F453-F498 AromaticContact CZ-CZ 3.7Å; F453-F498 HydrophobicContact CZ-CZ 3.7Å; F453-A512 HydrophobicContact CE1-CB 3.7Å; F453-A512 HydrophobicContact CE2-CB 3.99Å; F453-A512 HydrophobicContact CZ-CB 3.38Å; F453-V514 HydrophobicContact CD2-CG2 3.67Å; F453-V514 HydrophobicContact CE2-CG2 4.15Å; F453-I558 HydrophobicContact CB-CG2 4.44Å; F453-I558 HydrophobicContact CD1-CG2 4.43Å; F453-I558 HydrophobicContact CG-CG2 4.33Å; F453-E560 CarbonylContact C-O 3.55Å; F453-E560 VanDerWaalsContact CA-O 3.3Å; F453-E560 WeakPolarHBondContact CA-O 3.19Å; F453-L561 HydrophobicContact CD1-CD2 3.71Å; F453-L561 HydrophobicContact CE1-CD2 3.81Å
454	G	96.8	Very high	92.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	125.5	164.6	0	0	0	0	0	108.7	P559 E560	G454-P559 WeakPolarHBondContact O-CD 3.45Å; G454-P559 VanDerWaalsContact O-CG 3.22Å; G454-P559 WeakPolarHBondContact O-CG 3.06Å; G454-E560 PolarHBondContact N-O 2.86Å; G454-E560 PolarHBondContact O-N 3.41Å; G454-E560 VanDerWaalsContact O-N 3.13Å
455	L	95.4	Very high	92.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	148.4	-176.2	-53.2	-178.1	0	0	0	110.7	F453 A467 I469 Y485 T493 F494 V496 V514 L516 I558	F453-L455 HydrophobicContact CB-CD2 3.9Å; F453-L455 HydrophobicContact CB-CG 4.5Å; L455-A467 HydrophobicContact CD1-CB 3.86Å; L455-I469 HydrophobicContact CD1-CG2 4.42Å; L455-Y485 HydrophobicContact CD1-CE1 4.16Å; L455-T493 CarbonylContact O-C 3.55Å; L455-T493 WeakPolarHBondContact O-CA 3.44Å; L455-F494 PolarHBondContact N-O 2.84Å; L455-F494 PolarHBondContact O-N 2.66Å; L455-V496 HydrophobicContact CD1-CB 4.15Å; L455-V496 HydrophobicContact CD1-CG2 3.58Å; L455-V496 HydrophobicContact CG-CG2 4.11Å; L455-V514 HydrophobicContact CD1-CG1 3.88Å; L455-V514 HydrophobicContact CD2-CG1 4.27Å; L455-V514 HydrophobicContact CD2-CG2 3.98Å; L455-L516 HydrophobicContact CD1-CD2 3.88Å; L455-L516 HydrophobicContact CD1-CG 4.49Å; L455-I558 HydrophobicContact CD2-CG1 4.41Å
456	Y	93.7	Very high	92.4	Very high	14 Å²	14	25.1 Å²	25.1	6%	0.055	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	140	171.3	-73.5	-61.3	0	0	0	110.8	F421 C424 Y433 Y485 T493 Y523 G525 Q557 P559	F421-Y456 HydrophobicContact CD2-CE2 4.24Å; F421-Y456 HydrophobicContact CE2-CE2 4.5Å; C424-Y456 HydrophobicContact CB-CE1 3.99Å; Y433-Y456 PolarHBondContact OH-O 3.44Å; Y456-Y485 PolarHBondContact O-OH 2.94Å; Y456-Y485 VanDerWaalsContact O-OH 3.11Å; Y456-T493 HydrophobicContact CD1-CG2 4.2Å; Y456-T493 HydrophobicContact CE1-CG2 3.93Å; Y456-Y523 WeakPolarHBondContact CB-O 3.28Å; Y456-G525 VanDerWaalsContact CE2-N 3.25Å; Y456-Q557 VanDerWaalsContact N-OE1 3.17Å; Y456-P559 HydrophobicContact CD1-CG 4.37Å; Y456-P559 HydrophobicContact CD2-CB 4.15Å; Y456-P559 HydrophobicContact CD2-CG 3.66Å; Y456-P559 HydrophobicContact CE1-CB 4.43Å; Y456-P559 HydrophobicContact CE1-CG 4.27Å; Y456-P559 HydrophobicContact CE2-CB 3.5Å; Y456-P559 HydrophobicContact CE2-CG 3.55Å; Y456-P559 HydrophobicContact CG-CG 4.07Å
457	G	90.8	Very high	92.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.128	C	C	.	.			trans	-102.1	-158.3	176.6	0	0	0	0	0	113.5	S487 S522 Y523	G457-S487 WeakPolarHBondContact CA-OG 3.45Å; G457-S522 CarbonylContact O-C 3.59Å; G457-S522 WeakPolarHBondContact O-CA 3.33Å; G457-S522 WeakPolarHBondContact O-CB 3.3Å; G457-Y523 PolarHBondContact O-N 3.19Å
458	S	90	Very high	92.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-64	144.7	-173.4	177	0	0	0	0	113.1	C460 G461 Y465 S487 G489 E520 L521 Y523	S458-C460 PolarHBondContact OG-N 3.43Å; S458-G461 WeakPolarHBondContact CB-O 3.47Å; S458-G461 PolarHBondContact OG-O 3.18Å; S458-Y465 WeakPolarHBondContact CA-OH 3.36Å; S458-Y465 WeakPolarHBondContact CB-OH 3.21Å; S458-Y465 PolarHBondContact N-OH 3.27Å; S458-S487 PolarHBondContact N-OG 2.97Å; S458-G489 CarbonylContact O-C 3.58Å; S458-G489 VanDerWaalsContact O-CA 3.3Å; S458-G489 WeakPolarHBondContact O-CA 3.44Å; S458-E520 WeakPolarHBondContact OG-CB 3.47Å; S458-L521 CarbonylContact C-O 3.54Å; S458-L521 WeakPolarHBondContact CA-O 3.46Å; S458-Y523 WeakPolarHBondContact O-CD2 3.47Å; S458-Y523 WeakPolarHBondContact O-CE2 3.47Å
459	S	85.8	Confident	92.7	Very high	24 Å²	24	22.8 Å²	22.8	17%	0.168	14%	0.139	C	C	.	.	S	Bend	trans	-104.3	-6.3	174.5	61	0	0	0	0	114	L521 Y523	S459-L521 PolarHBondContact N-O 2.99Å; S459-L521 PolarHBondContact OG-O 3.32Å; S459-Y523 VanDerWaalsContact CA-CE2 3.43Å
460	C	81.6	Confident	92.8	Very high	85 Å²	85	23.5 Å²	23.5	57%	0.574	14%	0.143	S	C	*	.	S	Bend	trans	-110.7	3.6	-174.8	-65.5	0	0	0	0	113.7	S458	S458-C460 PolarHBondContact OG-N 3.43Å
461	G	84.4	Confident	92.8	Very high	31 Å²	31	23.4 Å²	23.4	32%	0.32	14%	0.142	S	C	.	.	S	Bend	trans	136	-175.8	-175.6	0	0	0	0	0	111.6	S458 G489	S458-G461 WeakPolarHBondContact CB-O 3.47Å; S458-G461 PolarHBondContact OG-O 3.18Å; G461-G489 WeakPolarHBondContact O-CA 3.32Å
462	S	89.3	Confident	92.8	Very high	78 Å²	78	24.9 Å²	24.9	55%	0.545	15%	0.148	S	C	.	.			trans	-71.1	132.7	-179.2	62.6	0	0	0	0	112	S487	S462-S487 CarbonylContact C-O 3.52Å; S462-S487 WeakPolarHBondContact CA-O 3.35Å; S462-S487 WeakPolarHBondContact CB-O 3.2Å
463	A	90.2	Very high	92.7	Very high	13 Å²	13	29.3 Å²	29.3	11%	0.107	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	150.2	179.2	0	0	0	0	0	111.8	Y465 S487 E520	A463-Y465 HydrophobicContact CB-CE2 3.95Å; A463-S487 PolarHBondContact N-O 2.75Å; A463-S487 PolarHBondContact O-N 2.98Å; A463-E520 HydrophobicContact CB-CB 4.14Å; A463-E520 HydrophobicContact CB-CG 3.82Å
464	E	92	Very high	92.3	Very high	109 Å²	109	37.9 Å²	37.9	51%	0.509	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	135.2	169.5	-174.4	178.7	-102.5	0	0	109.8	K484	E464-K484 HydrophobicContact CG-CB 4.28Å; E464-K484 HydrophobicContact CG-CD 4.46Å; E464-K484 WeakPolarHBondContact OE2-CD 3.31Å; E464-K484 WeakPolarHBondContact OE2-CE 3.43Å; E464-K484 IonicContact OE2-NZ 2.75Å; E464-K484 PolarHBondContact OE2-NZ 3.22Å
465	Y	90.7	Very high	91.9	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146	172.9	-71.9	-93	0	0	0	110	Y433 S458 A463 K484 Y485 D517 E520	Y433-Y465 AromaticContact CD2-CD1 3.96Å; Y433-Y465 HydrophobicContact CD2-CD1 3.96Å; Y433-Y465 AromaticContact CD2-CE1 3.55Å; Y433-Y465 HydrophobicContact CD2-CE1 3.55Å; Y433-Y465 AromaticContact CE2-CD1 3.94Å; Y433-Y465 HydrophobicContact CE2-CD1 3.94Å; Y433-Y465 AromaticContact CE2-CE1 3.47Å; Y433-Y465 HydrophobicContact CE2-CE1 3.47Å; Y433-Y465 VanDerWaalsContact CE2-CE1 3.47Å; S458-Y465 WeakPolarHBondContact CA-OH 3.36Å; S458-Y465 WeakPolarHBondContact CB-OH 3.21Å; S458-Y465 PolarHBondContact N-OH 3.27Å; A463-Y465 HydrophobicContact CB-CE2 3.95Å; Y465-K484 CarbonylContact O-C 3.49Å; Y465-K484 WeakPolarHBondContact O-CA 3.12Å; Y465-Y485 VanDerWaalsContact CB-CE1 3.43Å; Y465-Y485 HydrophobicContact CD2-CE2 4.2Å; Y465-Y485 HydrophobicContact CG-CE1 4.29Å; Y465-Y485 HydrophobicContact CG-CE2 4.43Å; Y465-Y485 AromaticContact CG-CZ 3.92Å; Y465-Y485 PolarHBondContact N-O 3.42Å; Y465-Y485 PolarHBondContact O-N 2.71Å; Y465-D517 WeakPolarHBondContact CA-O 3.43Å; Y465-E520 PolarHBondContact OH-O 3.27Å; Y465-E520 VanDerWaalsContact OH-O 3.11Å
466	S	93.1	Very high	91.9	Very high	32 Å²	32	45.3 Å²	45.3	22%	0.224	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	132.9	164	-173.7	0	0	0	0	109.1	L516 D517	S466-L516 CarbonylContact O-C 3.44Å; S466-L516 WeakPolarHBondContact O-CA 3.46Å; S466-D517 PolarHBondContact N-O 2.72Å; S466-D517 PolarHBondContact O-N 2.82Å
467	A	94.5	Very high	92	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	119.6	179.9	0	0	0	0	0	110.1	L455 I469 L482 S483 Y485 V496 L516	L455-A467 HydrophobicContact CD1-CB 3.86Å; A467-I469 HydrophobicContact CB-CG2 4.48Å; A467-L482 WeakPolarHBondContact O-CA 3.32Å; A467-S483 PolarHBondContact N-O 2.7Å; A467-S483 PolarHBondContact O-N 2.87Å; A467-Y485 HydrophobicContact CB-CD1 4.12Å; A467-Y485 HydrophobicContact CB-CE1 3.98Å; A467-V496 HydrophobicContact CB-CG1 4.2Å; A467-V496 HydrophobicContact CB-CG2 4.19Å; A467-L516 HydrophobicContact CB-CD2 3.65Å
468	K	95.9	Very high	92.2	Very high	78 Å²	78	51.4 Å²	51.4	34%	0.339	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	108.8	163	-167.6	-174.6	178.1	-159.5	0	108.5	E470 N481 L482 V514 I515	K468-E470 WeakPolarHBondContact CE-OE1 3.08Å; K468-E470 IonicContact NZ-OE1 3.69Å; K468-E470 PolarHBondContact NZ-OE1 3.09Å; K468-N481 CarbonylContact C-O 3.59Å; K468-N481 WeakPolarHBondContact CA-O 3.25Å; K468-L482 HydrophobicContact CB-CD1 3.94Å; K468-V514 CarbonylContact O-C 3.57Å; K468-V514 VanDerWaalsContact O-CA 3.31Å; K468-V514 WeakPolarHBondContact O-CA 3.37Å; K468-I515 HydrophobicContact CB-CB 4.3Å; K468-I515 PolarHBondContact N-O 3.46Å; K468-I515 PolarHBondContact O-N 3.45Å
469	I	97.3	Very high	92.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	140.4	175.3	65.1	167.6	0	0	0	109.9	F453 L455 A467 Q480 N481 V496 F498 S513 V514	F453-I469 HydrophobicContact CD2-CB 3.84Å; F453-I469 HydrophobicContact CD2-CD1 4.47Å; F453-I469 HydrophobicContact CD2-CG2 3.86Å; F453-I469 HydrophobicContact CE2-CB 3.99Å; F453-I469 HydrophobicContact CE2-CG2 4.49Å; L455-I469 HydrophobicContact CD1-CG2 4.42Å; A467-I469 HydrophobicContact CB-CG2 4.48Å; I469-Q480 CarbonylContact O-C 3.5Å; I469-Q480 WeakPolarHBondContact O-CA 3.31Å; I469-Q480 WeakPolarHBondContact O-CB 3.39Å; I469-N481 HydrophobicContact CD1-CB 4.32Å; I469-N481 HydrophobicContact CG1-CB 3.96Å; I469-N481 PolarHBondContact N-O 3.27Å; I469-N481 PolarHBondContact O-N 2.7Å; I469-V496 HydrophobicContact CD1-CG1 3.98Å; I469-V496 HydrophobicContact CG1-CG1 4.3Å; I469-V496 HydrophobicContact CG2-CB 4.26Å; I469-V496 HydrophobicContact CG2-CG1 3.79Å; I469-F498 HydrophobicContact CB-CE1 4.34Å; I469-F498 HydrophobicContact CB-CZ 4.4Å; I469-F498 HydrophobicContact CD1-CD1 3.72Å; I469-F498 HydrophobicContact CD1-CD2 4.07Å; I469-F498 HydrophobicContact CD1-CE1 3.58Å; I469-F498 HydrophobicContact CD1-CE2 3.93Å; I469-F498 HydrophobicContact CD1-CG 3.96Å; I469-F498 HydrophobicContact CD1-CZ 3.68Å; I469-F498 HydrophobicContact CG1-CD1 4.06Å; I469-F498 HydrophobicContact CG1-CE1 3.67Å; I469-F498 HydrophobicContact CG1-CZ 4.06Å; I469-S513 CarbonylContact C-O 3.59Å; I469-S513 WeakPolarHBondContact CA-O 3.4Å; I469-V514 HydrophobicContact CG2-CG1 4.19Å; I469-V514 HydrophobicContact CG2-CG2 3.96Å
470	E	97.7	Very high	92.9	Very high	24 Å²	24	56.2 Å²	56.2	11%	0.112	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	137.7	176.2	-67.6	178.6	172.1	0	0	109.2	K468 K472 G479 Q480 S513	K468-E470 WeakPolarHBondContact CE-OE1 3.08Å; K468-E470 IonicContact NZ-OE1 3.69Å; K468-E470 PolarHBondContact NZ-OE1 3.09Å; E470-K472 WeakPolarHBondContact OE2-CE 3.4Å; E470-K472 IonicContact OE2-NZ 3.79Å; E470-K472 PolarHBondContact OE2-NZ 2.86Å; E470-G479 WeakPolarHBondContact CA-O 3.43Å; E470-Q480 HydrophobicContact CG-CB 3.99Å; E470-S513 PolarHBondContact N-O 3.2Å; E470-S513 PolarHBondContact O-N 3.27Å
471	L	97.8	Very high	93.6	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124	169.6	-172.1	63.2	0	0	0	109.1	F442 I450 F453 L478 G479 F498 V502 I504 A512	F442-L471 HydrophobicContact CE1-CD1 3.57Å; F442-L471 HydrophobicContact CZ-CD1 3.76Å; I450-L471 HydrophobicContact CB-CD2 3.94Å; I450-L471 HydrophobicContact CG1-CD2 4.18Å; I450-L471 HydrophobicContact CG2-CD2 4.11Å; F453-L471 HydrophobicContact CZ-CD1 4.2Å; L471-L478 PolarHBondContact O-N 3.21Å; L471-G479 PolarHBondContact N-O 3.35Å; L471-G479 PolarHBondContact O-N 3.24Å; L471-F498 HydrophobicContact CB-CE1 4.27Å; L471-F498 HydrophobicContact CB-CE2 4.35Å; L471-F498 HydrophobicContact CB-CZ 3.73Å; L471-V502 HydrophobicContact CD2-CB 3.76Å; L471-V502 HydrophobicContact CD2-CG1 3.83Å; L471-V502 HydrophobicContact CD2-CG2 4.26Å; L471-I504 HydrophobicContact CD2-CD1 3.62Å; L471-A512 HydrophobicContact CD1-CB 4.47Å
472	K	96.7	Very high	94.2	Very high	34 Å²	34	58.7 Å²	58.7	15%	0.148	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	152.5	-172.2	-54.3	177.2	-173.1	176.2	0	112.4	E470 V476 V477 Y510 T511	E470-K472 WeakPolarHBondContact OE2-CE 3.4Å; E470-K472 IonicContact OE2-NZ 3.79Å; E470-K472 PolarHBondContact OE2-NZ 2.86Å; K472-V476 CarbonylContact C-O 3.48Å; K472-V476 WeakPolarHBondContact CA-O 3.3Å; K472-V477 HydrophobicContact CD-CG2 4.35Å; K472-V477 HydrophobicContact CG-CG2 4.06Å; K472-Y510 CarbonylContact O-C 3.6Å; K472-Y510 WeakPolarHBondContact O-CA 3.11Å; K472-T511 PolarHBondContact N-O 2.57Å; K472-T511 PolarHBondContact O-N 2.95Å
473	R	95	Very high	94.4	Very high	93 Å²	93	56.5 Å²	56.5	35%	0.351	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	122	166.8	-178.5	180	179.2	-179.6	5	108.7	G475 V476 L478 Y510	R473-G475 PolarHBondContact O-N 3.06Å; R473-V476 PolarHBondContact N-O 3.26Å; R473-V476 WeakPolarHBondContact O-CB 3.17Å; R473-V476 PolarHBondContact O-N 3.06Å; R473-L478 HydrophobicContact CB-CD1 3.77Å; R473-L478 HydrophobicContact CB-CG 4.28Å; R473-Y510 HydrophobicContact CB-CD1 3.95Å; R473-Y510 HydrophobicContact CB-CE1 3.99Å; R473-Y510 HydrophobicContact CG-CD1 4.47Å; R473-Y510 HydrophobicContact CG-CE1 4.27Å
474	Q	90	Very high	94.6	Very high	180 Å²	180	62.4 Å²	62.4	84%	0.841	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	41	-179.2	-61.1	176.8	-16.3	0	0	112.7	V476	Q474-V476 VanDerWaalsContact C-N 3.27Å; Q474-V476 PolarHBondContact O-N 3.34Å
475	G	87.9	Confident	94.7	Very high	62 Å²	62	58 Å²	58	64%	0.639	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-12.9	-178.5	0	0	0	0	0	115.8	R473	R473-G475 PolarHBondContact O-N 3.06Å
476	V	94.8	Very high	94.8	Very high	94 Å²	94	64.1 Å²	64.1	57%	0.57	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	127.1	177.3	-177.5	0	0	0	0	110.1	K472 R473 Q474 L478	K472-V476 CarbonylContact C-O 3.48Å; K472-V476 WeakPolarHBondContact CA-O 3.3Å; R473-V476 PolarHBondContact N-O 3.26Å; R473-V476 WeakPolarHBondContact O-CB 3.17Å; R473-V476 PolarHBondContact O-N 3.06Å; Q474-V476 VanDerWaalsContact C-N 3.27Å; Q474-V476 PolarHBondContact O-N 3.34Å; V476-L478 PolarHBondContact O-N 3.31Å
477	V	95.9	Very high	94.7	Very high	62 Å²	62	62.6 Å²	62.6	38%	0.376	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	122.7	175.2	-179.1	0	0	0	0	109.6	K472 Q480	K472-V477 HydrophobicContact CD-CG2 4.35Å; K472-V477 HydrophobicContact CG-CG2 4.06Å; V477-Q480 HydrophobicContact CG1-CB 4.11Å; V477-Q480 HydrophobicContact CG1-CG 4.47Å
478	L	95.1	Very high	94.6	Very high	79 Å²	79	66.7 Å²	66.7	41%	0.414	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-31.3	177.7	-58.9	-179	0	0	0	112.4	L471 R473 V476 V502 Y510	L471-L478 PolarHBondContact O-N 3.21Å; R473-L478 HydrophobicContact CB-CD1 3.77Å; R473-L478 HydrophobicContact CB-CG 4.28Å; V476-L478 PolarHBondContact O-N 3.31Å; L478-V502 HydrophobicContact CB-CG1 3.77Å; L478-V502 HydrophobicContact CD1-CG1 4.32Å; L478-Y510 HydrophobicContact CD1-CD1 3.78Å; L478-Y510 HydrophobicContact CD1-CE1 3.47Å; L478-Y510 VanDerWaalsContact CD1-CE1 3.47Å
479	G	94.8	Very high	94.2	Very high	15 Å²	15	63.8 Å²	63.8	16%	0.155	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	145.7	175.5	0	0	0	0	0	110	E470 L471 F498	E470-G479 WeakPolarHBondContact CA-O 3.43Å; L471-G479 PolarHBondContact N-O 3.35Å; L471-G479 PolarHBondContact O-N 3.24Å; G479-F498 WeakPolarHBondContact O-CE1 3.47Å
480	Q	96.7	Very high	93.8	Very high	111 Å²	111	65.2 Å²	65.2	52%	0.519	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	154	174.9	65.3	178.9	8.3	0	0	110	I469 E470 V477	I469-Q480 CarbonylContact O-C 3.5Å; I469-Q480 WeakPolarHBondContact O-CA 3.31Å; I469-Q480 WeakPolarHBondContact O-CB 3.39Å; E470-Q480 HydrophobicContact CG-CB 3.99Å; V477-Q480 HydrophobicContact CG1-CB 4.11Å; V477-Q480 HydrophobicContact CG1-CG 4.47Å
481	N	96.6	Very high	93.4	Very high	50 Å²	50	66.6 Å²	66.6	27%	0.267	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	147.4	167.5	-167.1	14.2	0	0	0	109.7	K468 I469 W497	K468-N481 CarbonylContact C-O 3.59Å; K468-N481 WeakPolarHBondContact CA-O 3.25Å; I469-N481 HydrophobicContact CD1-CB 4.32Å; I469-N481 HydrophobicContact CG1-CB 3.96Å; I469-N481 PolarHBondContact N-O 3.27Å; I469-N481 PolarHBondContact O-N 2.7Å; N481-W497 PolarHBondContact ND2-O 2.95Å
482	L	95.8	Very high	93.2	Very high	117 Å²	117	71.1 Å²	71.1	61%	0.613	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	110.7	169.8	176.1	64.9	0	0	0	107.6	A467 K468	A467-L482 WeakPolarHBondContact O-CA 3.32Å; K468-L482 HydrophobicContact CB-CD1 3.94Å
483	S	94.8	Very high	93	Very high	33 Å²	33	70.9 Å²	70.9	23%	0.231	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	157	-176.9	63.6	0	0	0	0	111.6	A467 V496	A467-S483 PolarHBondContact N-O 2.7Å; A467-S483 PolarHBondContact O-N 2.87Å; S483-V496 VanDerWaalsContact OG-CG1 3.23Å; S483-V496 WeakPolarHBondContact OG-CG1 3.42Å
484	K	94.1	Very high	93.1	Very high	136 Å²	136	67.7 Å²	67.7	59%	0.591	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	145.5	173.4	-67.3	172.7	162.7	-150.3	0	110.2	E464 Y465	E464-K484 HydrophobicContact CG-CB 4.28Å; E464-K484 HydrophobicContact CG-CD 4.46Å; E464-K484 WeakPolarHBondContact OE2-CD 3.31Å; E464-K484 WeakPolarHBondContact OE2-CE 3.43Å; E464-K484 IonicContact OE2-NZ 2.75Å; E464-K484 PolarHBondContact OE2-NZ 3.22Å; Y465-K484 CarbonylContact O-C 3.49Å; Y465-K484 WeakPolarHBondContact O-CA 3.12Å
485	Y	93.4	Very high	93.3	Very high	17 Å²	17	61.4 Å²	61.4	7%	0.067	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	150.3	170	72.2	-84.3	0	0	0	110.3	L455 Y456 Y465 A467 F494 V496 L516	L455-Y485 HydrophobicContact CD1-CE1 4.16Å; Y456-Y485 PolarHBondContact O-OH 2.94Å; Y456-Y485 VanDerWaalsContact O-OH 3.11Å; Y465-Y485 VanDerWaalsContact CB-CE1 3.43Å; Y465-Y485 HydrophobicContact CD2-CE2 4.2Å; Y465-Y485 HydrophobicContact CG-CE1 4.29Å; Y465-Y485 HydrophobicContact CG-CE2 4.43Å; Y465-Y485 AromaticContact CG-CZ 3.92Å; Y465-Y485 PolarHBondContact N-O 3.42Å; Y465-Y485 PolarHBondContact O-N 2.71Å; A467-Y485 HydrophobicContact CB-CD1 4.12Å; A467-Y485 HydrophobicContact CB-CE1 3.98Å; Y485-F494 HydrophobicContact CD2-CB 3.36Å; Y485-F494 HydrophobicContact CD2-CD2 4.29Å; Y485-F494 AromaticContact CD2-CG 3.87Å; Y485-F494 HydrophobicContact CD2-CG 3.87Å; Y485-F494 HydrophobicContact CE2-CB 3.68Å; Y485-F494 AromaticContact CE2-CD2 3.96Å; Y485-F494 HydrophobicContact CE2-CD2 3.96Å; Y485-F494 HydrophobicContact CE2-CG 4.01Å; Y485-F494 HydrophobicContact CG-CB 4.28Å; Y485-V496 HydrophobicContact CD1-CG2 3.65Å; Y485-V496 HydrophobicContact CE1-CG2 4.19Å; Y485-V496 HydrophobicContact CG-CG2 4.09Å; Y485-L516 HydrophobicContact CE1-CD2 3.62Å
486	F	93.4	Very high	93.8	Very high	129 Å²	129	58.6 Å²	58.6	57%	0.566	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	125.5	179.8	-174	-97.3	0	0	0	109.8	F494	F486-F494 VanDerWaalsContact O-CD1 3.3Å; F486-F494 WeakPolarHBondContact O-CD1 3.41Å
487	S	91.6	Very high	93.8	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	135.8	170.8	177.5	0	0	0	0	109.6	G457 S458 S462 A463 G489 F494	G457-S487 WeakPolarHBondContact CA-OG 3.45Å; S458-S487 PolarHBondContact N-OG 2.97Å; S462-S487 CarbonylContact C-O 3.52Å; S462-S487 WeakPolarHBondContact CA-O 3.35Å; S462-S487 WeakPolarHBondContact CB-O 3.2Å; A463-S487 PolarHBondContact N-O 2.75Å; A463-S487 PolarHBondContact O-N 2.98Å; S487-G489 VanDerWaalsContact C-N 3.32Å; S487-G489 PolarHBondContact OG-N 3.04Å; S487-F494 VanDerWaalsContact OG-CE2 3.31Å; S487-F494 WeakPolarHBondContact OG-CE2 3.04Å
488	D	91.5	Very high	93.8	Very high	87 Å²	87	56.4 Å²	56.4	47%	0.465	30%	0.295	S	S	.	.			trans	-87.1	2.9	177.9	64.5	1.6	0	0	0	113.7	S490 F494	D488-S490 VanDerWaalsContact C-N 3.31Å; D488-S490 WeakPolarHBondContact OD1-CA 3.41Å; D488-S490 WeakPolarHBondContact OD1-CB 3.46Å; D488-S490 PolarHBondContact OD1-N 3.22Å; D488-S490 PolarHBondContact OD1-OG 3.27Å; D488-S490 PolarHBondContact OD2-OG 3.46Å; D488-F494 VanDerWaalsContact OD1-CZ 3.3Å; D488-F494 WeakPolarHBondContact OD1-CZ 3.49Å
489	G	86.7	Confident	93.6	Very high	16 Å²	16	59.1 Å²	59.1	17%	0.165	31%	0.305	C	S	.	.	S	Bend	trans	84.7	-1.3	-175.5	0	0	0	0	0	114.6	S458 G461 S487 Y523	S458-G489 CarbonylContact O-C 3.58Å; S458-G489 VanDerWaalsContact O-CA 3.3Å; S458-G489 WeakPolarHBondContact O-CA 3.44Å; G461-G489 WeakPolarHBondContact O-CA 3.32Å; S487-G489 VanDerWaalsContact C-N 3.32Å; S487-G489 PolarHBondContact OG-N 3.04Å; G489-Y523 PolarHBondContact O-OH 3.03Å
490	S	90.4	Very high	93.5	Very high	31 Å²	31	61.3 Å²	61.3	22%	0.217	31%	0.31	C	S	.	.	S	Bend	trans	-80.7	164.2	174.4	74.6	0	0	0	0	111.8	D488 N492 Y523	D488-S490 VanDerWaalsContact C-N 3.31Å; D488-S490 WeakPolarHBondContact OD1-CA 3.41Å; D488-S490 WeakPolarHBondContact OD1-CB 3.46Å; D488-S490 PolarHBondContact OD1-N 3.22Å; D488-S490 PolarHBondContact OD1-OG 3.27Å; D488-S490 PolarHBondContact OD2-OG 3.46Å; S490-N492 PolarHBondContact O-N 3.4Å; S490-N492 VanDerWaalsContact O-N 3.17Å; S490-N492 VanDerWaalsContact OG-CB 3.31Å; S490-N492 WeakPolarHBondContact OG-CB 3.43Å; S490-N492 PolarHBondContact OG-N 2.93Å; S490-N492 PolarHBondContact OG-ND2 3.5Å; S490-N492 VanDerWaalsContact OG-ND2 3.09Å; S490-Y523 VanDerWaalsContact C-CE2 3.48Å; S490-Y523 WeakPolarHBondContact O-CE2 3.45Å
491	S	89.3	Confident	93.4	Very high	53 Å²	53	56.5 Å²	56.5	37%	0.371	29%	0.288	S	S	.	.	S	Bend	trans	-76.3	10.8	173.8	63.8	0	0	0	0	113.9	C424	C424-S491 VanDerWaalsContact SG-CB 3.52Å
492	N	92.3	Very high	93.3	Very high	94 Å²	94	54.9 Å²	54.9	50%	0.503	28%	0.28	S	S	.	.			trans	-71.2	166.3	176.6	-67.4	-29.8	0	0	0	111.1	S490 F494	S490-N492 PolarHBondContact O-N 3.4Å; S490-N492 VanDerWaalsContact O-N 3.17Å; S490-N492 VanDerWaalsContact OG-CB 3.31Å; S490-N492 WeakPolarHBondContact OG-CB 3.43Å; S490-N492 PolarHBondContact OG-N 2.93Å; S490-N492 PolarHBondContact OG-ND2 3.5Å; S490-N492 VanDerWaalsContact OG-ND2 3.09Å; N492-F494 HydrophobicContact CB-CZ 4.43Å; N492-F494 VanDerWaalsContact O-CE2 3.25Å; N492-F494 WeakPolarHBondContact O-CE2 3.36Å
493	T	93.8	Very high	93.2	Very high	30 Å²	30	51 Å²	51	18%	0.184	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	139	175.5	49.3	0	0	0	0	109.6	L455 Y456 P559 E560	L455-T493 CarbonylContact O-C 3.55Å; L455-T493 WeakPolarHBondContact O-CA 3.44Å; Y456-T493 HydrophobicContact CD1-CG2 4.2Å; Y456-T493 HydrophobicContact CE1-CG2 3.93Å; T493-P559 HydrophobicContact CG2-CB 3.97Å; T493-P559 HydrophobicContact CG2-CG 3.5Å; T493-P559 VanDerWaalsContact CG2-CG 3.5Å; T493-E560 VanDerWaalsContact CB-OE1 3.28Å; T493-E560 WeakPolarHBondContact CB-OE1 3.47Å; T493-E560 HydrophobicContact CG2-CG 3.83Å; T493-E560 VanDerWaalsContact OG1-CD 3.27Å; T493-E560 PolarHBondContact OG1-OE1 3.44Å
494	F	95.4	Very high	93.3	Very high	25 Å²	25	49.4 Å²	49.4	11%	0.11	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.4	-178.2	-56.4	-83.1	0	0	0	108.6	L455 Y485 F486 S487 D488 N492	L455-F494 PolarHBondContact N-O 2.84Å; L455-F494 PolarHBondContact O-N 2.66Å; Y485-F494 HydrophobicContact CD2-CB 3.36Å; Y485-F494 HydrophobicContact CD2-CD2 4.29Å; Y485-F494 AromaticContact CD2-CG 3.87Å; Y485-F494 HydrophobicContact CD2-CG 3.87Å; Y485-F494 HydrophobicContact CE2-CB 3.68Å; Y485-F494 AromaticContact CE2-CD2 3.96Å; Y485-F494 HydrophobicContact CE2-CD2 3.96Å; Y485-F494 HydrophobicContact CE2-CG 4.01Å; Y485-F494 HydrophobicContact CG-CB 4.28Å; F486-F494 VanDerWaalsContact O-CD1 3.3Å; F486-F494 WeakPolarHBondContact O-CD1 3.41Å; S487-F494 VanDerWaalsContact OG-CE2 3.31Å; S487-F494 WeakPolarHBondContact OG-CE2 3.04Å; D488-F494 VanDerWaalsContact OD1-CZ 3.3Å; D488-F494 WeakPolarHBondContact OD1-CZ 3.49Å; N492-F494 HydrophobicContact CB-CZ 4.43Å; N492-F494 VanDerWaalsContact O-CE2 3.25Å; N492-F494 WeakPolarHBondContact O-CE2 3.36Å
495	P	96.1	Very high	93.2	Very high	49 Å²	49	45.1 Å²	45.1	32%	0.318	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	132.4	-176.3	30.6	-34.5	0	0	0	111	W497 I562	P495-W497 HydrophobicContact CB-CZ2 3.73Å; P495-W497 HydrophobicContact CG-CZ2 4.21Å; P495-I562 HydrophobicContact CB-CD1 3.54Å
496	V	96.6	Very high	93.2	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	119.4	169.8	-176.2	0	0	0	0	108	G452 F453 L455 A467 I469 S483 Y485	G452-V496 CarbonylContact C-O 3.58Å; G452-V496 WeakPolarHBondContact CA-O 3.38Å; F453-V496 PolarHBondContact N-O 3.4Å; F453-V496 PolarHBondContact O-N 2.88Å; L455-V496 HydrophobicContact CD1-CB 4.15Å; L455-V496 HydrophobicContact CD1-CG2 3.58Å; L455-V496 HydrophobicContact CG-CG2 4.11Å; A467-V496 HydrophobicContact CB-CG1 4.2Å; A467-V496 HydrophobicContact CB-CG2 4.19Å; I469-V496 HydrophobicContact CD1-CG1 3.98Å; I469-V496 HydrophobicContact CG1-CG1 4.3Å; I469-V496 HydrophobicContact CG2-CB 4.26Å; I469-V496 HydrophobicContact CG2-CG1 3.79Å; S483-V496 VanDerWaalsContact OG-CG1 3.23Å; S483-V496 WeakPolarHBondContact OG-CG1 3.42Å; Y485-V496 HydrophobicContact CD1-CG2 3.65Å; Y485-V496 HydrophobicContact CE1-CG2 4.19Å; Y485-V496 HydrophobicContact CG-CG2 4.09Å
497	W	96.1	Very high	93.3	Very high	96 Å²	96	46.6 Å²	46.6	36%	0.364	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	147.6	-169.6	-54.1	97.6	0	0	0	111.8	P415 A451 N481 P495 I562	P415-W497 HydrophobicContact CB-CH2 4.25Å; P415-W497 HydrophobicContact CB-CZ3 4.49Å; P415-W497 HydrophobicContact CG-CH2 4.3Å; A451-W497 HydrophobicContact CB-CE3 3.81Å; A451-W497 HydrophobicContact CB-CZ3 3.72Å; A451-W497 WeakPolarHBondContact O-CA 3.44Å; N481-W497 PolarHBondContact ND2-O 2.95Å; P495-W497 HydrophobicContact CB-CZ2 3.73Å; P495-W497 HydrophobicContact CG-CZ2 4.21Å; W497-I562 HydrophobicContact CH2-CD1 4.28Å; W497-I562 HydrophobicContact CH2-CG2 3.66Å; W497-I562 HydrophobicContact CZ3-CB 4.27Å; W497-I562 HydrophobicContact CZ3-CD1 4.39Å; W497-I562 HydrophobicContact CZ3-CG2 3.48Å; W497-I562 VanDerWaalsContact CZ3-CG2 3.48Å
498	F	95.9	Very high	93.5	Very high	13 Å²	13	48.2 Å²	48.2	6%	0.057	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	158.8	161.4	-67.9	-73.6	0	0	0	110	I450 A451 F453 I469 L471 G479 Y500 V502	I450-F498 HydrophobicContact CG2-CD2 4.21Å; I450-F498 HydrophobicContact CG2-CE2 3.79Å; A451-F498 PolarHBondContact O-N 2.89Å; F453-F498 HydrophobicContact CE1-CE2 4.15Å; F453-F498 HydrophobicContact CE1-CZ 4.4Å; F453-F498 HydrophobicContact CE2-CE2 4.25Å; F453-F498 AromaticContact CE2-CZ 3.79Å; F453-F498 HydrophobicContact CE2-CZ 3.79Å; F453-F498 AromaticContact CZ-CE2 3.91Å; F453-F498 HydrophobicContact CZ-CE2 3.91Å; F453-F498 AromaticContact CZ-CZ 3.7Å; F453-F498 HydrophobicContact CZ-CZ 3.7Å; I469-F498 HydrophobicContact CB-CE1 4.34Å; I469-F498 HydrophobicContact CB-CZ 4.4Å; I469-F498 HydrophobicContact CD1-CD1 3.72Å; I469-F498 HydrophobicContact CD1-CD2 4.07Å; I469-F498 HydrophobicContact CD1-CE1 3.58Å; I469-F498 HydrophobicContact CD1-CE2 3.93Å; I469-F498 HydrophobicContact CD1-CG 3.96Å; I469-F498 HydrophobicContact CD1-CZ 3.68Å; I469-F498 HydrophobicContact CG1-CD1 4.06Å; I469-F498 HydrophobicContact CG1-CE1 3.67Å; I469-F498 HydrophobicContact CG1-CZ 4.06Å; L471-F498 HydrophobicContact CB-CE1 4.27Å; L471-F498 HydrophobicContact CB-CE2 4.35Å; L471-F498 HydrophobicContact CB-CZ 3.73Å; G479-F498 WeakPolarHBondContact O-CE1 3.47Å; F498-Y500 VanDerWaalsContact C-N 3.31Å; F498-Y500 WeakPolarHBondContact CB-O 3.18Å; F498-V502 HydrophobicContact CG-CG2 4.5Å
499	E	90.8	Very high	93.7	Very high	136 Å²	136	47.5 Å²	47.5	64%	0.636	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-61.2	-43.5	173.5	-168.7	-175.3	160.3	0	0	111
500	Y	91.6	Very high	94.3	Very high	62 Å²	62	47 Å²	47	24%	0.243	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.9	172.6	-52.3	-74.1	0	0	0	109.9	E296 L297 F498 V502	E296-Y500 HydrophobicContact CB-CE1 4.08Å; E296-Y500 HydrophobicContact CG-CE1 4.03Å; L297-Y500 HydrophobicContact CD1-CD1 4.16Å; L297-Y500 HydrophobicContact CD1-CD2 4.12Å; L297-Y500 HydrophobicContact CD1-CG 3.82Å; L297-Y500 HydrophobicContact CD2-CD1 4.34Å; L297-Y500 HydrophobicContact CD2-CD2 4.21Å; L297-Y500 HydrophobicContact CD2-CE1 4.12Å; L297-Y500 HydrophobicContact CD2-CE2 4Å; L297-Y500 HydrophobicContact CD2-CG 4.39Å; L297-Y500 HydrophobicContact CG-CD1 3.87Å; L297-Y500 HydrophobicContact CG-CD2 4.32Å; L297-Y500 HydrophobicContact CG-CE1 4.06Å; L297-Y500 HydrophobicContact CG-CG 4.02Å; F498-Y500 VanDerWaalsContact C-N 3.31Å; F498-Y500 WeakPolarHBondContact CB-O 3.18Å; Y500-V502 PolarHBondContact O-N 2.92Å
501	P	95.2	Very high	94.6	Very high	10 Å²	10	46 Å²	46	7%	0.065	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	137.6	174.3	-25	35.7	0	0	0	112	A293 Q294 F449 I450 A451 Y564	A293-P501 WeakPolarHBondContact O-CD 3.37Å; A293-P501 WeakPolarHBondContact O-CG 3.13Å; Q294-P501 PolarHBondContact NE2-O 3.34Å; F449-P501 HydrophobicContact CB-CB 3.78Å; I450-P501 CarbonylContact O-C 3.55Å; I450-P501 VanDerWaalsContact O-CA 3.27Å; I450-P501 WeakPolarHBondContact O-CA 3.39Å; A451-P501 HydrophobicContact CB-CG 4.47Å; P501-Y564 HydrophobicContact CB-CD2 4.18Å; P501-Y564 HydrophobicContact CB-CE2 4.22Å; P501-Y564 HydrophobicContact CG-CD2 4.02Å; P501-Y564 HydrophobicContact CG-CE2 3.61Å
502	V	95.2	Very high	95	Very high	15 Å²	15	43.5 Å²	43.5	9%	0.091	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.6	-176.1	-175.6	0	0	0	0	110.1	F449 I450 L471 L478 F498 Y500 I504	F449-V502 CarbonylContact C-O 3.57Å; F449-V502 WeakPolarHBondContact CA-O 3.5Å; I450-V502 PolarHBondContact N-O 3.4Å; I450-V502 PolarHBondContact O-N 3.07Å; L471-V502 HydrophobicContact CD2-CB 3.76Å; L471-V502 HydrophobicContact CD2-CG1 3.83Å; L471-V502 HydrophobicContact CD2-CG2 4.26Å; L478-V502 HydrophobicContact CB-CG1 3.77Å; L478-V502 HydrophobicContact CD1-CG1 4.32Å; F498-V502 HydrophobicContact CG-CG2 4.5Å; Y500-V502 PolarHBondContact O-N 2.92Å; V502-I504 HydrophobicContact CG1-CD1 4.42Å
503	Q	94.1	Very high	95.3	Very high	35 Å²	35	39.2 Å²	39.2	16%	0.164	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	131.9	178.2	-174.9	173.7	-42.5	0	0	111.7	R447 F449 E505	R447-Q503 HydrophobicContact CG-CG 4.3Å; F449-Q503 HydrophobicContact CD1-CB 3.95Å; F449-Q503 HydrophobicContact CE1-CB 3.7Å; F449-Q503 HydrophobicContact CE1-CG 4Å; F449-Q503 HydrophobicContact CZ-CB 4.45Å; F449-Q503 HydrophobicContact CZ-CG 4.26Å; Q503-E505 PolarHBondContact NE2-OE1 3Å
504	I	94.9	Very high	95.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.6	178.5	-54.2	-53.4	0	0	0	109	F442 V444 R447 V448 I450 L471 V502 Y510	F442-I504 HydrophobicContact CE2-CG2 4.28Å; F442-I504 HydrophobicContact CZ-CD1 4.47Å; V444-I504 HydrophobicContact CG2-CB 4.36Å; V444-I504 HydrophobicContact CG2-CG2 3.52Å; R447-I504 VanDerWaalsContact CA-O 3.31Å; R447-I504 WeakPolarHBondContact CA-O 3.3Å; R447-I504 WeakPolarHBondContact CG-O 3.02Å; V448-I504 HydrophobicContact CG2-CB 3.97Å; V448-I504 HydrophobicContact CG2-CG1 4.24Å; V448-I504 PolarHBondContact N-O 3.49Å; V448-I504 PolarHBondContact O-N 3.26Å; I450-I504 HydrophobicContact CB-CG1 4.41Å; I450-I504 HydrophobicContact CD1-CG1 4.46Å; I450-I504 HydrophobicContact CG1-CD1 4.02Å; I450-I504 HydrophobicContact CG1-CG1 3.5Å; L471-I504 HydrophobicContact CD2-CD1 3.62Å; V502-I504 HydrophobicContact CG1-CD1 4.42Å; I504-Y510 HydrophobicContact CB-CE2 4.3Å; I504-Y510 HydrophobicContact CD1-CD1 3.63Å; I504-Y510 HydrophobicContact CD1-CD2 4.28Å; I504-Y510 HydrophobicContact CD1-CE1 3.66Å; I504-Y510 HydrophobicContact CD1-CE2 4.35Å; I504-Y510 HydrophobicContact CD1-CG 3.95Å; I504-Y510 HydrophobicContact CG2-CD2 3.58Å; I504-Y510 HydrophobicContact CG2-CE2 3.41Å; I504-Y510 VanDerWaalsContact CG2-CE2 3.41Å; I504-Y510 HydrophobicContact CG2-CG 4.3Å
505	E	92.9	Very high	95.3	Very high	47 Å²	47	39.4 Å²	39.4	22%	0.22	20%	0.196	C	C	.	.			trans	-80.6	145.2	174.2	-65.4	-53.2	139.7	0	0	110.8	R447 Q503 Y510	R447-E505 IonicContact CZ-OE1 3.98Å; R447-E505 IonicContact CZ-OE2 3.3Å; R447-E505 IonicContact NE-OE1 2.75Å; R447-E505 PolarHBondContact NE-OE1 3.47Å; R447-E505 IonicContact NE-OE2 3.94Å; R447-E505 PolarHBondContact NE-OE2 2.92Å; R447-E505 IonicContact NH2-OE1 2.68Å; R447-E505 PolarHBondContact NH2-OE1 3.2Å; R447-E505 IonicContact NH2-OE2 3.61Å; R447-E505 PolarHBondContact NH2-OE2 3.44Å; Q503-E505 PolarHBondContact NE2-OE1 3Å; E505-Y510 PolarHBondContact N-OH 3.34Å
506	P	94.1	Very high	95.1	Very high	45 Å²	45	37 Å²	37	29%	0.292	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	152.9	177.3	27.4	-34.5	0	0	0	111.5	V444 T508	V444-P506 CarbonylContact O-C 3.55Å; V444-P506 VanDerWaalsContact O-CA 3.28Å; V444-P506 WeakPolarHBondContact O-CA 3.35Å; P506-T508 PolarHBondContact O-N 3.3Å; P506-T508 PolarHBondContact O-OG1 2.88Å
507	D	95	Very high	94.7	Very high	132 Å²	132	41.5 Å²	41.5	71%	0.706	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	20.3	173.1	-52.5	-49.3	0	0	0	114.8	V444	V444-D507 PolarHBondContact O-N 2.76Å
508	T	95.1	Very high	94.2	Very high	34 Å²	34	37.7 Å²	37.7	21%	0.209	19%	0.194	C	C	.	.			trans	-116.4	134.1	179	-60.9	0	0	0	0	109.4	P506 Y510	P506-T508 PolarHBondContact O-N 3.3Å; P506-T508 PolarHBondContact O-OG1 2.88Å; T508-Y510 HydrophobicContact CG2-CD2 4.3Å; T508-Y510 HydrophobicContact CG2-CE2 3.68Å; T508-Y510 WeakPolarHBondContact O-CD2 3.37Å; T508-Y510 WeakPolarHBondContact O-CE2 3Å
509	F	96.6	Very high	93.4	Very high	72 Å²	72	44.8 Å²	44.8	32%	0.316	23%	0.233	S	C	.	.			trans	-80.9	130.4	176.7	-79.5	-82.9	0	0	0	112.4	Q441 F442 A443 Q542	Q441-F509 HydrophobicContact CB-CD1 4.24Å; F442-F509 WeakPolarHBondContact O-CA 3.39Å; A443-F509 HydrophobicContact CB-CD1 3.88Å; A443-F509 HydrophobicContact CB-CD2 4.22Å; A443-F509 HydrophobicContact CB-CE1 3.73Å; A443-F509 HydrophobicContact CB-CE2 4.09Å; A443-F509 HydrophobicContact CB-CG 4.11Å; A443-F509 HydrophobicContact CB-CZ 3.82Å; F509-Q542 HydrophobicContact CE1-CB 4.28Å; F509-Q542 VanDerWaalsContact CE1-CD 3.49Å; F509-Q542 HydrophobicContact CE1-CG 3.75Å; F509-Q542 VanDerWaalsContact CZ-CD 3.48Å; F509-Q542 HydrophobicContact CZ-CG 4.12Å
510	Y	98	Very high	93.1	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.016	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	154.3	172.9	-67.4	-104.6	0	0	0	109.2	Q441 F442 K472 R473 L478 I504 E505 T508	Q441-Y510 CarbonylContact C-O 3.47Å; Q441-Y510 WeakPolarHBondContact CA-O 3.25Å; F442-Y510 PolarHBondContact N-O 2.92Å; F442-Y510 PolarHBondContact O-N 3.48Å; K472-Y510 CarbonylContact O-C 3.6Å; K472-Y510 WeakPolarHBondContact O-CA 3.11Å; R473-Y510 HydrophobicContact CB-CD1 3.95Å; R473-Y510 HydrophobicContact CB-CE1 3.99Å; R473-Y510 HydrophobicContact CG-CD1 4.47Å; R473-Y510 HydrophobicContact CG-CE1 4.27Å; L478-Y510 HydrophobicContact CD1-CD1 3.78Å; L478-Y510 HydrophobicContact CD1-CE1 3.47Å; L478-Y510 VanDerWaalsContact CD1-CE1 3.47Å; I504-Y510 HydrophobicContact CB-CE2 4.3Å; I504-Y510 HydrophobicContact CD1-CD1 3.63Å; I504-Y510 HydrophobicContact CD1-CD2 4.28Å; I504-Y510 HydrophobicContact CD1-CE1 3.66Å; I504-Y510 HydrophobicContact CD1-CE2 4.35Å; I504-Y510 HydrophobicContact CD1-CG 3.95Å; I504-Y510 HydrophobicContact CG2-CD2 3.58Å; I504-Y510 HydrophobicContact CG2-CE2 3.41Å; I504-Y510 VanDerWaalsContact CG2-CE2 3.41Å; I504-Y510 HydrophobicContact CG2-CG 4.3Å; E505-Y510 PolarHBondContact N-OH 3.34Å; T508-Y510 HydrophobicContact CG2-CD2 4.3Å; T508-Y510 HydrophobicContact CG2-CE2 3.68Å; T508-Y510 WeakPolarHBondContact O-CD2 3.37Å; T508-Y510 WeakPolarHBondContact O-CE2 3Å
511	T	98.1	Very high	92.8	Very high	12 Å²	12	41.3 Å²	41.3	7%	0.074	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	114.8	179	-53.8	0	0	0	0	109.2	S439 Q441 K472 S544	S439-T511 WeakPolarHBondContact OG-CG2 3.3Å; Q441-T511 HydrophobicContact CG-CG2 4.44Å; K472-T511 PolarHBondContact N-O 2.57Å; K472-T511 PolarHBondContact O-N 2.95Å; T511-S544 WeakPolarHBondContact CG2-OG 3.23Å
512	A	98	Very high	92.5	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	123.3	169	0	0	0	0	0	108.4	S439 I440 F442 F453 L471 I558	S439-A512 CarbonylContact C-O 3.56Å; S439-A512 VanDerWaalsContact CA-O 3.22Å; S439-A512 WeakPolarHBondContact CA-O 3.18Å; S439-A512 PolarHBondContact OG-O 3.04Å; I440-A512 HydrophobicContact CG2-CB 4.05Å; I440-A512 PolarHBondContact N-O 3.48Å; I440-A512 PolarHBondContact O-N 3.48Å; F442-A512 HydrophobicContact CD1-CB 4.25Å; F442-A512 HydrophobicContact CE1-CB 4.04Å; F453-A512 HydrophobicContact CE1-CB 3.7Å; F453-A512 HydrophobicContact CE2-CB 3.99Å; F453-A512 HydrophobicContact CZ-CB 3.38Å; L471-A512 HydrophobicContact CD1-CB 4.47Å; A512-I558 HydrophobicContact CB-CD1 4.27Å; A512-I558 WeakPolarHBondContact O-CD1 3.27Å
513	S	97.3	Very high	92.3	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	139.8	-178.5	-66.9	0	0	0	0	110.6	D438 S439 I469 E470	D438-S513 CarbonylContact O-C 3.56Å; D438-S513 WeakPolarHBondContact O-CA 3.23Å; S439-S513 PolarHBondContact OG-OG 3.18Å; I469-S513 CarbonylContact C-O 3.59Å; I469-S513 WeakPolarHBondContact CA-O 3.4Å; E470-S513 PolarHBondContact N-O 3.2Å; E470-S513 PolarHBondContact O-N 3.27Å
514	V	96	Very high	92.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	134.9	179.9	-175.2	0	0	0	0	109.3	C437 D438 F453 L455 K468 I469 L516 I558	C437-V514 WeakPolarHBondContact CA-O 3.26Å; D438-V514 PolarHBondContact N-O 3.21Å; D438-V514 PolarHBondContact O-N 3.36Å; F453-V514 HydrophobicContact CD2-CG2 3.67Å; F453-V514 HydrophobicContact CE2-CG2 4.15Å; L455-V514 HydrophobicContact CD1-CG1 3.88Å; L455-V514 HydrophobicContact CD2-CG1 4.27Å; L455-V514 HydrophobicContact CD2-CG2 3.98Å; K468-V514 CarbonylContact O-C 3.57Å; K468-V514 VanDerWaalsContact O-CA 3.31Å; K468-V514 WeakPolarHBondContact O-CA 3.37Å; I469-V514 HydrophobicContact CG2-CG1 4.19Å; I469-V514 HydrophobicContact CG2-CG2 3.96Å; V514-L516 HydrophobicContact CG1-CD1 4.37Å; V514-L516 HydrophobicContact CG1-CD2 4.29Å; V514-L516 HydrophobicContact CG1-CG 3.79Å; V514-I558 HydrophobicContact CB-CD1 4.44Å; V514-I558 HydrophobicContact CB-CG1 4.41Å; V514-I558 HydrophobicContact CG2-CD1 3.81Å; V514-I558 HydrophobicContact CG2-CG1 3.77Å
515	I	94.5	Very high	92	Very high	59 Å²	59	40.9 Å²	40.9	30%	0.303	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	110.6	165.1	-57.6	172.2	0	0	0	106.2	C437 K468	C437-I515 HydrophobicContact CB-CG1 4.17Å; K468-I515 HydrophobicContact CB-CB 4.3Å; K468-I515 PolarHBondContact N-O 3.46Å; K468-I515 PolarHBondContact O-N 3.45Å
516	L	90.9	Very high	92	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	148.2	174.6	-76.8	167.4	0	0	0	109.7	Y433 L455 S466 A467 Y485 V514 Q557	Y433-L516 WeakPolarHBondContact CB-O 3.08Å; Y433-L516 HydrophobicContact CD1-CB 3.41Å; Y433-L516 VanDerWaalsContact CD1-CB 3.41Å; Y433-L516 HydrophobicContact CD1-CD1 4.12Å; Y433-L516 HydrophobicContact CD1-CG 4.36Å; Y433-L516 HydrophobicContact CD2-CB 4.06Å; Y433-L516 HydrophobicContact CE1-CB 3.65Å; Y433-L516 HydrophobicContact CE1-CD1 3.4Å; Y433-L516 HydrophobicContact CE1-CG 4.12Å; Y433-L516 HydrophobicContact CE2-CB 4.2Å; Y433-L516 HydrophobicContact CE2-CD1 4.1Å; Y433-L516 HydrophobicContact CG-CB 3.61Å; Y433-L516 VanDerWaalsContact OH-CD1 3.26Å; Y433-L516 WeakPolarHBondContact OH-CD1 3.4Å; L455-L516 HydrophobicContact CD1-CD2 3.88Å; L455-L516 HydrophobicContact CD1-CG 4.49Å; S466-L516 CarbonylContact O-C 3.44Å; S466-L516 WeakPolarHBondContact O-CA 3.46Å; A467-L516 HydrophobicContact CB-CD2 3.65Å; Y485-L516 HydrophobicContact CE1-CD2 3.62Å; V514-L516 HydrophobicContact CG1-CD1 4.37Å; V514-L516 HydrophobicContact CG1-CD2 4.29Å; V514-L516 HydrophobicContact CG1-CG 3.79Å; L516-Q557 HydrophobicContact CD1-CG 4.29Å
517	D	88.9	Confident	91.9	Very high	97 Å²	97	45.4 Å²	45.4	52%	0.519	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	129.4	171.8	-173.6	24.3	0	0	0	109.2	Y465 S466	Y465-D517 WeakPolarHBondContact CA-O 3.43Å; S466-D517 PolarHBondContact N-O 2.72Å; S466-D517 PolarHBondContact O-N 2.82Å
518	G	84.5	Confident	91.8	Very high	15 Å²	15	39.5 Å²	39.5	16%	0.155	20%	0.203	C	C	.	.			trans	-178.8	150	-174.7	0	0	0	0	0	111.6
519	N	80.4	Confident	91.8	Very high	163 Å²	163	40.3 Å²	40.3	87%	0.872	21%	0.205	S	C	*	.	S	Bend	trans	-78.6	-25.9	-174.3	-67.7	-15.9	0	0	0	113
520	E	82.8	Confident	91.8	Very high	84 Å²	84	41.2 Å²	41.2	39%	0.393	22%	0.217	S	C	.	.	S	Bend	trans	-96.4	159.1	-175.1	-64.9	-58.7	151.9	0	0	112.5	S458 A463 Y465	S458-E520 WeakPolarHBondContact OG-CB 3.47Å; A463-E520 HydrophobicContact CB-CB 4.14Å; A463-E520 HydrophobicContact CB-CG 3.82Å; Y465-E520 PolarHBondContact OH-O 3.27Å; Y465-E520 VanDerWaalsContact OH-O 3.11Å
521	L	85.8	Confident	91.7	Very high	40 Å²	40	45.9 Å²	45.9	21%	0.209	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-77.2	141.8	174.1	-59.1	178.5	0	0	0	110.5	Q430 R432 S458 S459	Q430-L521 HydrophobicContact CB-CD1 3.94Å; Q430-L521 HydrophobicContact CB-CD2 3.73Å; Q430-L521 HydrophobicContact CB-CG 4.39Å; Q430-L521 HydrophobicContact CG-CD1 3.57Å; Q430-L521 HydrophobicContact CG-CD2 4.28Å; R432-L521 HydrophobicContact CG-CD2 3.69Å; S458-L521 CarbonylContact C-O 3.54Å; S458-L521 WeakPolarHBondContact CA-O 3.46Å; S459-L521 PolarHBondContact N-O 2.99Å; S459-L521 PolarHBondContact OG-O 3.32Å
522	S	88.9	Confident	91.6	Very high	4 Å²	4	46.1 Å²	46.1	3%	0.028	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-102.6	160.7	178.9	60.7	0	0	0	0	115.1	Y433 G457	Y433-S522 VanDerWaalsContact CE2-CB 3.44Å; Y433-S522 VanDerWaalsContact CE2-OG 3.27Å; Y433-S522 WeakPolarHBondContact CE2-OG 3.37Å; Y433-S522 WeakPolarHBondContact OH-CB 3.48Å; Y433-S522 PolarHBondContact OH-OG 3.45Å; G457-S522 CarbonylContact O-C 3.59Å; G457-S522 WeakPolarHBondContact O-CA 3.33Å; G457-S522 WeakPolarHBondContact O-CB 3.3Å
523	Y	90.8	Very high	91.5	Very high	24 Å²	24	53.3 Å²	53.3	9%	0.094	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-63.4	152.6	157.7	-68.6	-89.3	0	0	0	110.4	Y426 Y456 G457 S458 S459 G489 S490 Q557	Y426-Y523 HydrophobicContact CD1-CD1 4.26Å; Y426-Y523 AromaticContact CD1-CE1 3.56Å; Y426-Y523 HydrophobicContact CD1-CE1 3.56Å; Y426-Y523 HydrophobicContact CD2-CE1 4.45Å; Y426-Y523 HydrophobicContact CE1-CE1 4.41Å; Y426-Y523 HydrophobicContact CG-CD1 4.22Å; Y426-Y523 AromaticContact CG-CE1 3.6Å; Y426-Y523 HydrophobicContact CG-CE1 3.6Å; Y456-Y523 WeakPolarHBondContact CB-O 3.28Å; G457-Y523 PolarHBondContact O-N 3.19Å; S458-Y523 WeakPolarHBondContact O-CD2 3.47Å; S458-Y523 WeakPolarHBondContact O-CE2 3.47Å; S459-Y523 VanDerWaalsContact CA-CE2 3.43Å; G489-Y523 PolarHBondContact O-OH 3.03Å; S490-Y523 VanDerWaalsContact C-CE2 3.48Å; S490-Y523 WeakPolarHBondContact O-CE2 3.45Å; Y523-Q557 PolarHBondContact O-NE2 2.65Å
524	F	91.2	Very high	91.3	Very high	24 Å²	24	54 Å²	54	11%	0.105	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	156.3	168.3	68.3	-82.4	0	0	0	110.2	C424 A425 W431 Q526	C424-F524 WeakPolarHBondContact CA-O 3.46Å; A425-F524 HydrophobicContact CB-CE1 4.25Å; A425-F524 HydrophobicContact CB-CZ 4.12Å; A425-F524 PolarHBondContact N-O 2.83Å; A425-F524 PolarHBondContact O-N 3.48Å; W431-F524 HydrophobicContact CB-CB 4.29Å; W431-F524 HydrophobicContact CB-CD1 4.24Å; W431-F524 HydrophobicContact CD2-CB 3.75Å; W431-F524 HydrophobicContact CD2-CG 4.15Å; W431-F524 HydrophobicContact CE3-CB 3.42Å; W431-F524 VanDerWaalsContact CE3-CB 3.42Å; W431-F524 AromaticContact CE3-CD1 3.87Å; W431-F524 HydrophobicContact CE3-CD1 3.87Å; W431-F524 AromaticContact CE3-CD2 3.62Å; W431-F524 HydrophobicContact CE3-CD2 3.62Å; W431-F524 HydrophobicContact CE3-CE2 4.32Å; W431-F524 AromaticContact CE3-CG 3.35Å; W431-F524 HydrophobicContact CE3-CG 3.35Å; W431-F524 HydrophobicContact CG-CB 4.14Å; W431-F524 HydrophobicContact CZ3-CB 4.04Å; W431-F524 AromaticContact CZ3-CD2 3.67Å; W431-F524 HydrophobicContact CZ3-CD2 3.67Å; W431-F524 HydrophobicContact CZ3-CE2 4.3Å; W431-F524 AromaticContact CZ3-CG 3.91Å; W431-F524 HydrophobicContact CZ3-CG 3.91Å; F524-Q526 HydrophobicContact CD2-CG 4.27Å; F524-Q526 HydrophobicContact CE2-CG 3.81Å
525	G	92.5	Very high	91.1	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	150.8	-178.2	0	0	0	0	0	112.7	Y456 G555 G556	Y456-G525 VanDerWaalsContact CE2-N 3.25Å; G525-G555 CarbonylContact O-C 3.53Å; G525-G555 WeakPolarHBondContact O-CA 3.42Å; G525-G556 PolarHBondContact N-O 3.08Å; G525-G556 PolarHBondContact O-N 2.99Å
526	Q	92.1	Very high	90.9	Very high	77 Å²	77	62 Å²	62	36%	0.36	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	168.1	174.3	-65.3	-171.4	-13.9	0	0	110.1	F421 Q422 S423 A425 F524 G528 Q554	F421-Q526 WeakPolarHBondContact CB-O 3.4Å; F421-Q526 WeakPolarHBondContact CD1-O 3.27Å; Q422-Q526 PolarHBondContact N-O 3.06Å; S423-Q526 PolarHBondContact O-N 2.88Å; A425-Q526 HydrophobicContact CB-CG 4Å; F524-Q526 HydrophobicContact CD2-CG 4.27Å; F524-Q526 HydrophobicContact CE2-CG 3.81Å; Q526-G528 VanDerWaalsContact C-N 3.28Å; Q526-G528 PolarHBondContact O-N 3.1Å; Q526-Q554 CarbonylContact C-O 3.58Å
527	E	92.6	Very high	91.2	Very high	109 Å²	109	62.1 Å²	62.1	51%	0.509	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.7	47	178.2	-59.9	169.2	158.2	0	0	111.1	Q422 S423 Q554	Q422-E527 HydrophobicContact CB-CB 3.99Å; Q422-E527 HydrophobicContact CG-CB 4.43Å; Q422-E527 PolarHBondContact N-O 3.05Å; S423-E527 WeakPolarHBondContact CB-OE2 3.41Å; S423-E527 VanDerWaalsContact OG-CD 3.32Å; S423-E527 PolarHBondContact OG-OE2 2.96Å; E527-Q554 PolarHBondContact N-O 2.75Å
528	G	93.1	Very high	91.6	Very high	8 Å²	8	58.8 Å²	58.8	8%	0.082	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	144	-174.5	0	0	0	0	0	113.6	R420 F421 Q526 V553 Q554	R420-G528 CarbonylContact O-C 3.55Å; R420-G528 VanDerWaalsContact O-CA 3.29Å; R420-G528 WeakPolarHBondContact O-CA 3.49Å; F421-G528 VanDerWaalsContact CD1-CA 3.48Å; Q526-G528 VanDerWaalsContact C-N 3.28Å; Q526-G528 PolarHBondContact O-N 3.1Å; G528-V553 CarbonylContact C-O 3.59Å; G528-V553 WeakPolarHBondContact CA-O 3.41Å; G528-Q554 PolarHBondContact N-O 3.26Å
529	M	95.3	Very high	92.2	Very high	51 Å²	51	58.1 Å²	58.1	25%	0.251	31%	0.305	S	S	.	.			trans	-97.1	135.4	-174.2	-62.4	175.6	-75.7	0	0	110.6	H419 R420 Q422 E531 V532	H419-M529 VanDerWaalsContact O-CE 3.31Å; H419-M529 WeakPolarHBondContact O-CE 3.34Å; R420-M529 PolarHBondContact O-N 2.89Å; Q422-M529 HydrophobicContact CG-CE 4.45Å; Q422-M529 HydrophobicContact CG-CG 4.35Å; Q422-M529 HydrophobicContact CG-SD 4.18Å; M529-E531 VanDerWaalsContact C-N 3.3Å; M529-V532 HydrophobicContact CB-CG2 3.73Å; M529-V532 HydrophobicContact CE-CG2 3.75Å; M529-V532 HydrophobicContact SD-CG2 4.22Å
530	T	95.7	Very high	93	Very high	92 Å²	92	54.6 Å²	54.6	56%	0.564	28%	0.283	S	S	*	.	S	Bend	trans	-73.1	-24.7	174	48.8	0	0	0	0	112.4	Q540 F541 V553	T530-Q540 CarbonylContact O-C 3.48Å; T530-Q540 WeakPolarHBondContact O-CA 3.45Å; T530-F541 PolarHBondContact O-N 2.68Å; T530-V553 HydrophobicContact CG2-CG1 3.68Å
531	E	96.8	Very high	93.8	Very high	102 Å²	102	50.9 Å²	50.9	48%	0.477	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	136.1	-179.6	-174.8	170.1	-120.9	0	0	109.6	M529 T538 V539 Q540	M529-E531 VanDerWaalsContact C-N 3.3Å; E531-T538 HydrophobicContact CG-CG2 3.56Å; E531-T538 WeakPolarHBondContact OE1-CG2 3.46Å; E531-V539 CarbonylContact C-O 3.6Å; E531-V539 VanDerWaalsContact CA-O 3.31Å; E531-V539 WeakPolarHBondContact CA-O 3.5Å; E531-Q540 HydrophobicContact CB-CG 4.48Å; E531-Q540 HydrophobicContact CG-CG 4.11Å; E531-Q540 PolarHBondContact OE1-NE2 2.75Å
532	V	96.6	Very high	94.3	Very high	17 Å²	17	53.3 Å²	53.3	10%	0.103	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	127.8	-179.3	-176.6	0	0	0	0	109.5	R420 M529 V539 F541	R420-V532 HydrophobicContact CB-CG2 4.43Å; M529-V532 HydrophobicContact CB-CG2 3.73Å; M529-V532 HydrophobicContact CE-CG2 3.75Å; M529-V532 HydrophobicContact SD-CG2 4.22Å; V532-V539 PolarHBondContact N-O 3.34Å; V532-V539 PolarHBondContact O-N 3.12Å; V532-F541 HydrophobicContact CB-CE2 4.34Å; V532-F541 HydrophobicContact CG2-CD2 4.43Å; V532-F541 HydrophobicContact CG2-CE2 3.94Å
533	Q	95.4	Very high	94.6	Very high	150 Å²	150	57.1 Å²	57.1	70%	0.701	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.9	172.1	-168.8	176.6	19.5	0	0	109.9
534	C	92.9	Very high	94.8	Very high	19 Å²	19	56.5 Å²	56.5	13%	0.128	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	104.1	176.3	-173.4	0	0	0	0	109.4	Q416 R417 C418 K536 V537 F563	Q416-C534 PolarHBondContact OE1-O 2.97Å; R417-C534 PolarHBondContact O-SG 3.47Å; C418-C534 HydrophobicContact CB-CB 4.02Å; C534-K536 PolarHBondContact O-N 2.97Å; C534-V537 PolarHBondContact N-O 2.93Å; C534-V537 PolarHBondContact O-N 3.25Å; C534-V537 VanDerWaalsContact O-O 3.14Å; C534-F563 HydrophobicContact CB-CE1 4.38Å; C534-F563 HydrophobicContact CB-CZ 4.06Å
535	G	90.6	Very high	94.9	Very high	61 Å²	61	60.5 Å²	60.5	63%	0.629	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	-111.8	-175.4	0	0	0	0	0	111.7
536	K	91.5	Very high	94.9	Very high	166 Å²	166	63.7 Å²	63.7	72%	0.722	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-1.4	179	-68.1	-176.9	-177.2	175.7	0	113.5	K446 C534	K446-K536 WeakPolarHBondContact CD-O 3.42Å; K446-K536 WeakPolarHBondContact CE-O 3.24Å; K446-K536 PolarHBondContact NZ-O 3.5Å; C534-K536 PolarHBondContact O-N 2.97Å
537	V	96.2	Very high	95	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.006	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	135.1	-175.1	-178.1	0	0	0	0	109.1	V444 D445 K446 V448 C534 V539 F563 A565	V444-V537 HydrophobicContact CB-CG1 4.2Å; V444-V537 HydrophobicContact CG1-CG1 4.28Å; D445-V537 WeakPolarHBondContact OD1-CA 3.41Å; K446-V537 HydrophobicContact CB-CG2 4.37Å; V448-V537 HydrophobicContact CG1-CG1 3.95Å; V448-V537 HydrophobicContact CG1-CG2 3.8Å; C534-V537 PolarHBondContact N-O 2.93Å; C534-V537 PolarHBondContact O-N 3.25Å; C534-V537 VanDerWaalsContact O-O 3.14Å; V537-V539 HydrophobicContact CG1-CG2 4.37Å; V537-F563 HydrophobicContact CB-CE2 4.07Å; V537-F563 HydrophobicContact CB-CZ 4.2Å; V537-F563 HydrophobicContact CG1-CE2 4.39Å; V537-F563 HydrophobicContact CG2-CE2 3.92Å; V537-A565 HydrophobicContact CG2-CB 3.59Å
538	T	97.4	Very high	95	Very high	28 Å²	28	60.3 Å²	60.3	17%	0.172	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128	173.8	-46	0	0	0	0	108.4	V444 D445 E531	V444-T538 WeakPolarHBondContact CA-O 3.42Å; D445-T538 VanDerWaalsContact CG-N 3.26Å; D445-T538 PolarHBondContact N-O 3.11Å; D445-T538 VanDerWaalsContact N-O 3.12Å; D445-T538 PolarHBondContact OD1-N 3.26Å; D445-T538 VanDerWaalsContact OD2-CB 3.29Å; D445-T538 WeakPolarHBondContact OD2-CB 3.43Å; D445-T538 PolarHBondContact OD2-N 3.48Å; D445-T538 PolarHBondContact OD2-OG1 3.03Å; E531-T538 HydrophobicContact CG-CG2 3.56Å; E531-T538 WeakPolarHBondContact OE1-CG2 3.46Å
539	V	97.9	Very high	94.8	Very high	1 Å²	1	61 Å²	61	1%	0.006	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.2	-179.9	-169.8	0	0	0	0	109.1	C418 F442 A443 V444 E531 V532 V537 F541 L561	C418-V539 HydrophobicContact CB-CG2 4.16Å; F442-V539 HydrophobicContact CB-CG1 4.08Å; F442-V539 HydrophobicContact CD2-CG1 4.28Å; A443-V539 WeakPolarHBondContact O-CA 3.49Å; V444-V539 HydrophobicContact CG1-CG1 4.36Å; V444-V539 HydrophobicContact CG1-CG2 4.17Å; E531-V539 CarbonylContact C-O 3.6Å; E531-V539 VanDerWaalsContact CA-O 3.31Å; E531-V539 WeakPolarHBondContact CA-O 3.5Å; V532-V539 PolarHBondContact N-O 3.34Å; V532-V539 PolarHBondContact O-N 3.12Å; V537-V539 HydrophobicContact CG1-CG2 4.37Å; V539-F541 HydrophobicContact CB-CE2 4.03Å; V539-F541 HydrophobicContact CB-CZ 4.2Å; V539-F541 HydrophobicContact CG1-CD2 4.37Å; V539-F541 HydrophobicContact CG1-CE1 4.03Å; V539-F541 HydrophobicContact CG1-CE2 3.72Å; V539-F541 HydrophobicContact CG1-CZ 3.53Å; V539-L561 HydrophobicContact CG1-CD1 3.95Å
540	Q	97.9	Very high	94.4	Very high	88 Å²	88	61.3 Å²	61.3	41%	0.411	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	138.6	174.9	-66.5	-179.7	-2.7	0	0	109.9	F442 A443 T530 E531	F442-Q540 CarbonylContact C-O 3.5Å; F442-Q540 WeakPolarHBondContact CA-O 3.35Å; F442-Q540 WeakPolarHBondContact CB-O 3.3Å; A443-Q540 PolarHBondContact N-O 3.19Å; A443-Q540 PolarHBondContact O-N 2.68Å; T530-Q540 CarbonylContact O-C 3.48Å; T530-Q540 WeakPolarHBondContact O-CA 3.45Å; E531-Q540 HydrophobicContact CB-CG 4.48Å; E531-Q540 HydrophobicContact CG-CG 4.11Å; E531-Q540 PolarHBondContact OE1-NE2 2.75Å
541	F	97.9	Very high	94.3	Very high	7 Å²	7	57.3 Å²	57.3	3%	0.031	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.3	-176.2	-65.2	-82.9	0	0	0	112	R420 I440 Q441 F442 T530 V532 V539 L561	R420-F541 HydrophobicContact CB-CD2 4.16Å; R420-F541 HydrophobicContact CB-CE1 4.37Å; R420-F541 HydrophobicContact CB-CE2 3.71Å; R420-F541 HydrophobicContact CB-CZ 3.82Å; I440-F541 HydrophobicContact CG1-CB 4.48Å; I440-F541 HydrophobicContact CG1-CD1 3.97Å; Q441-F541 CarbonylContact O-C 3.55Å; Q441-F541 WeakPolarHBondContact O-CA 3.33Å; F442-F541 HydrophobicContact CB-CD1 3.95Å; F442-F541 HydrophobicContact CB-CE1 4.08Å; T530-F541 PolarHBondContact O-N 2.68Å; V532-F541 HydrophobicContact CB-CE2 4.34Å; V532-F541 HydrophobicContact CG2-CD2 4.43Å; V532-F541 HydrophobicContact CG2-CE2 3.94Å; V539-F541 HydrophobicContact CB-CE2 4.03Å; V539-F541 HydrophobicContact CB-CZ 4.2Å; V539-F541 HydrophobicContact CG1-CD2 4.37Å; V539-F541 HydrophobicContact CG1-CE1 4.03Å; V539-F541 HydrophobicContact CG1-CE2 3.72Å; V539-F541 HydrophobicContact CG1-CZ 3.53Å; F541-L561 HydrophobicContact CE1-CD1 3.76Å; F541-L561 HydrophobicContact CE1-CG 4.15Å; F541-L561 HydrophobicContact CZ-CD1 3.98Å; F541-L561 HydrophobicContact CZ-CG 4.33Å
542	Q	96.8	Very high	94.2	Very high	90 Å²	90	53 Å²	53	42%	0.421	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	155.3	175	-66.9	-173.9	6.8	0	0	111	I440 Q441 F509	I440-Q542 WeakPolarHBondContact CD1-O 3.33Å; Q441-Q542 HydrophobicContact CB-CB 4.16Å; Q441-Q542 PolarHBondContact N-O 3.43Å; Q441-Q542 PolarHBondContact O-N 3.48Å; F509-Q542 HydrophobicContact CE1-CB 4.28Å; F509-Q542 VanDerWaalsContact CE1-CD 3.49Å; F509-Q542 HydrophobicContact CE1-CG 3.75Å; F509-Q542 VanDerWaalsContact CZ-CD 3.48Å; F509-Q542 HydrophobicContact CZ-CG 4.12Å
543	C	95.8	Very high	94.1	Very high	84 Å²	84	52.9 Å²	52.9	57%	0.568	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.6	139.7	175	-73.7	0	0	0	0	110.9
544	S	95.4	Very high	93.9	Very high	11 Å²	11	52 Å²	52	8%	0.077	32%	0.315	C	S	.	.			trans	-99.4	135.8	173.5	-178.8	0	0	0	0	110.4	S439 T511 D546 S547	S439-S544 VanDerWaalsContact OG-CB 3.24Å; S439-S544 WeakPolarHBondContact OG-CB 3.49Å; S439-S544 PolarHBondContact OG-OG 3.46Å; T511-S544 WeakPolarHBondContact CG2-OG 3.23Å; S544-D546 PolarHBondContact O-N 3.08Å; S544-D546 PolarHBondContact OG-N 2.85Å; S544-S547 PolarHBondContact O-N 3.48Å
545	S	92.9	Very high	93.9	Very high	109 Å²	109	52 Å²	52	76%	0.762	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.2	170.1	51.7	0	0	0	0	113	S547	S545-S547 VanDerWaalsContact C-N 3.26Å; S545-S547 PolarHBondContact O-N 2.89Å
546	D	92.7	Very high	94	Very high	67 Å²	67	49 Å²	49	36%	0.358	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-10.9	-178.6	-64.7	2	0	0	0	112.1	S544 T548	S544-D546 PolarHBondContact O-N 3.08Å; S544-D546 PolarHBondContact OG-N 2.85Å; D546-T548 PolarHBondContact O-N 3.35Å
547	S	93.5	Very high	94.1	Very high	27 Å²	27	41.1 Å²	41.1	19%	0.189	25%	0.253	C	S	.	.			trans	-76.6	117.7	-179.7	-164.1	0	0	0	0	111.3	C437 S439 S544 S545 T551	C437-S547 WeakPolarHBondContact O-CA 3.17Å; C437-S547 PolarHBondContact O-OG 2.96Å; S439-S547 PolarHBondContact N-OG 2.85Å; S439-S547 WeakPolarHBondContact O-CB 3.41Å; S544-S547 PolarHBondContact O-N 3.48Å; S545-S547 VanDerWaalsContact C-N 3.26Å; S545-S547 PolarHBondContact O-N 2.89Å; S547-T551 WeakPolarHBondContact CB-O 3.38Å; S547-T551 PolarHBondContact OG-N 3.37Å; S547-T551 PolarHBondContact OG-O 3.17Å
548	T	92.1	Very high	94.1	Very high	88 Å²	88	41.1 Å²	41.1	54%	0.54	25%	0.253	S	S	.	.			trans	-112.1	-5.1	178.8	50.9	0	0	0	0	112.6	C437 D546	C437-T548 PolarHBondContact N-OG1 3.25Å; C437-T548 PolarHBondContact O-N 3.2Å; C437-T548 PolarHBondContact O-OG1 3.32Å; D546-T548 PolarHBondContact O-N 3.35Å
549	N	89.1	Confident	94.1	Very high	21 Å²	21	39.9 Å²	39.9	11%	0.112	25%	0.246	C	C	.	.	S	Bend	trans	-107.7	6.2	-179.8	-151.8	29.5	0	0	0	114.1	W431 R432 R436 C437 D438	W431-N549 VanDerWaalsContact CZ2-O 3.28Å; W431-N549 WeakPolarHBondContact CZ2-O 3.27Å; W431-N549 PolarHBondContact NE1-ND2 2.88Å; R432-N549 PolarHBondContact O-ND2 2.89Å; R432-N549 VanDerWaalsContact O-ND2 3.16Å; R432-N549 PolarHBondContact O-OD1 3.15Å; R436-N549 HydrophobicContact CB-CB 3.65Å; R436-N549 WeakPolarHBondContact CD-OD1 3.17Å; C437-N549 PolarHBondContact O-N 2.87Å; C437-N549 VanDerWaalsContact O-N 3.07Å; D438-N549 WeakPolarHBondContact OD1-CB 3.4Å; D438-N549 PolarHBondContact OD2-ND2 3.34Å
550	G	87.9	Confident	94	Very high	59 Å²	59	40 Å²	40	61%	0.608	25%	0.246	S	C	*	.			trans	92.6	5.4	174.4	0	0	0	0	0	115.1	W431 G552	W431-G550 WeakPolarHBondContact CH2-O 3.42Å; G550-G552 PolarHBondContact O-N 3.14Å
551	T	93.5	Very high	94	Very high	7 Å²	7	36 Å²	36	4%	0.043	23%	0.227	C	C	.	.			trans	-65.4	126.5	172.2	-77	0	0	0	0	110.3	W431 D438 I440 S547 Q557	W431-T551 WeakPolarHBondContact CZ2-OG1 3.31Å; D438-T551 WeakPolarHBondContact CB-OG1 3.26Å; D438-T551 WeakPolarHBondContact OD1-CB 3.45Å; D438-T551 PolarHBondContact OD1-OG1 3.25Å; I440-T551 HydrophobicContact CB-CG2 4.39Å; S547-T551 WeakPolarHBondContact CB-O 3.38Å; S547-T551 PolarHBondContact OG-N 3.37Å; S547-T551 PolarHBondContact OG-O 3.17Å; T551-Q557 PolarHBondContact OG1-N 2.82Å
552	G	94.2	Very high	94	Very high	12 Å²	12	35.6 Å²	35.6	12%	0.124	23%	0.226	C	C	.	.			trans	-147.1	-166.9	174.3	0	0	0	0	0	110.9	R420 G550 G555	R420-G552 PolarHBondContact NH1-O 3.05Å; R420-G552 PolarHBondContact NH2-O 2.91Å; G550-G552 PolarHBondContact O-N 3.14Å; G552-G555 PolarHBondContact N-O 3.44Å
553	V	93.9	Very high	94	Very high	15 Å²	15	31.4 Å²	31.4	9%	0.091	21%	0.206	C	C	.	.	S	Bend	trans	-64.6	-45.4	179.9	179.8	0	0	0	0	111	R420 I440 G528 T530	R420-V553 PolarHBondContact NH1-O 3.42Å; R420-V553 VanDerWaalsContact NH1-O 3.09Å; I440-V553 HydrophobicContact CD1-CG2 4.22Å; G528-V553 CarbonylContact C-O 3.59Å; G528-V553 WeakPolarHBondContact CA-O 3.41Å; T530-V553 HydrophobicContact CG2-CG1 3.68Å
554	Q	92.6	Very high	93.9	Very high	131 Å²	131	28.6 Å²	28.6	61%	0.612	18%	0.183	S	C	*	.	S	Bend	trans	-75	-26.6	-173.2	-64.9	-59.3	-41.2	0	0	114.9	Q526 E527 G528	Q526-Q554 CarbonylContact C-O 3.58Å; E527-Q554 PolarHBondContact N-O 2.75Å; G528-Q554 PolarHBondContact N-O 3.26Å
555	G	92.5	Very high	93.4	Very high	18 Å²	18	32.1 Å²	32.1	19%	0.186	21%	0.213	C	C	.	.	S	Bend	trans	-163.7	158.3	-175.8	0	0	0	0	0	113.6	F421 G525 G552	F421-G555 VanDerWaalsContact CE1-CA 3.46Å; G525-G555 CarbonylContact O-C 3.53Å; G525-G555 WeakPolarHBondContact O-CA 3.42Å; G552-G555 PolarHBondContact N-O 3.44Å
556	G	92.9	Very high	93.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	128.2	-149.6	168.9	0	0	0	0	0	116.6	F421 W431 G525	F421-G556 VanDerWaalsContact CE2-O 3.24Å; F421-G556 WeakPolarHBondContact CE2-O 3.4Å; F421-G556 WeakPolarHBondContact CZ-O 3.36Å; W431-G556 VanDerWaalsContact CZ2-CA 3.46Å; G525-G556 PolarHBondContact N-O 3.08Å; G525-G556 PolarHBondContact O-N 2.99Å
557	Q	93.5	Very high	93.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	-87.4	179.8	179.1	-77.5	-55.6	-45	0	0	112.5	R420 Y433 D438 Y456 L516 Y523 T551	R420-Q557 PolarHBondContact NH2-O 2.78Å; Y433-Q557 HydrophobicContact CE1-CG 4.11Å; Y433-Q557 PolarHBondContact OH-NE2 2.84Å; D438-Q557 HydrophobicContact CB-CB 3.75Å; D438-Q557 HydrophobicContact CB-CG 4.42Å; Y456-Q557 VanDerWaalsContact N-OE1 3.17Å; L516-Q557 HydrophobicContact CD1-CG 4.29Å; Y523-Q557 PolarHBondContact O-NE2 2.65Å; T551-Q557 PolarHBondContact OG1-N 2.82Å
558	I	96.2	Very high	93.5	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	18%	0.176	C	C	.	.			trans	59	57.9	-173	-45	171.2	0	0	0	109.7	R420 I440 F453 L455 A512 V514 E560 L561	R420-I558 WeakPolarHBondContact CD-O 3Å; R420-I558 PolarHBondContact NE-O 2.94Å; I440-I558 HydrophobicContact CG2-CB 4.29Å; I440-I558 HydrophobicContact CG2-CD1 3.98Å; I440-I558 HydrophobicContact CG2-CG2 4.17Å; F453-I558 HydrophobicContact CB-CG2 4.44Å; F453-I558 HydrophobicContact CD1-CG2 4.43Å; F453-I558 HydrophobicContact CG-CG2 4.33Å; L455-I558 HydrophobicContact CD2-CG1 4.41Å; A512-I558 HydrophobicContact CB-CD1 4.27Å; A512-I558 WeakPolarHBondContact O-CD1 3.27Å; V514-I558 HydrophobicContact CB-CD1 4.44Å; V514-I558 HydrophobicContact CB-CG1 4.41Å; V514-I558 HydrophobicContact CG2-CD1 3.81Å; V514-I558 HydrophobicContact CG2-CG1 3.77Å; I558-E560 PolarHBondContact O-N 2.95Å; I558-L561 HydrophobicContact CG2-CD2 4.13Å
559	P	96	Very high	93.5	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.013	16%	0.155	C	C	.	.			trans	-62.7	-35.7	173.4	25	-35.2	0	0	0	112.5	H419 R420 F421 G454 Y456 T493	H419-P559 WeakPolarHBondContact CA-O 3.44Å; R420-P559 PolarHBondContact N-O 3.4Å; F421-P559 HydrophobicContact CD2-CB 3.79Å; F421-P559 HydrophobicContact CE2-CB 4.2Å; G454-P559 WeakPolarHBondContact O-CD 3.45Å; G454-P559 VanDerWaalsContact O-CG 3.22Å; G454-P559 WeakPolarHBondContact O-CG 3.06Å; Y456-P559 HydrophobicContact CD1-CG 4.37Å; Y456-P559 HydrophobicContact CD2-CB 4.15Å; Y456-P559 HydrophobicContact CD2-CG 3.66Å; Y456-P559 HydrophobicContact CE1-CB 4.43Å; Y456-P559 HydrophobicContact CE1-CG 4.27Å; Y456-P559 HydrophobicContact CE2-CB 3.5Å; Y456-P559 HydrophobicContact CE2-CG 3.55Å; Y456-P559 HydrophobicContact CG-CG 4.07Å; T493-P559 HydrophobicContact CG2-CB 3.97Å; T493-P559 HydrophobicContact CG2-CG 3.5Å; T493-P559 VanDerWaalsContact CG2-CG 3.5Å
560	E	96.8	Very high	93.8	Very high	3 Å²	3	22.6 Å²	22.6	1%	0.014	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	114.3	-173.7	52.6	126.1	149.7	0	0	117.7	R417 C418 H419 F453 G454 T493 I558	R417-E560 IonicContact CZ-OE2 2.66Å; R417-E560 IonicContact NH1-OE2 3.48Å; R417-E560 PolarHBondContact NH1-OE2 2.9Å; C418-E560 WeakPolarHBondContact O-CB 3.27Å; H419-E560 IonicContact CE1-OE1 3.61Å; H419-E560 PolarHBondContact CE1-OE1 3.02Å; H419-E560 IonicContact ND1-OE1 3.41Å; H419-E560 PolarHBondContact ND1-OE1 2.9Å; H419-E560 IonicContact NE2-OE1 2.63Å; H419-E560 PolarHBondContact NE2-OE1 2.78Å; H419-E560 VanDerWaalsContact NE2-OE1 3.15Å; F453-E560 CarbonylContact C-O 3.55Å; F453-E560 VanDerWaalsContact CA-O 3.3Å; F453-E560 WeakPolarHBondContact CA-O 3.19Å; G454-E560 PolarHBondContact N-O 2.86Å; G454-E560 PolarHBondContact O-N 3.41Å; G454-E560 VanDerWaalsContact O-N 3.13Å; T493-E560 VanDerWaalsContact CB-OE1 3.28Å; T493-E560 WeakPolarHBondContact CB-OE1 3.47Å; T493-E560 HydrophobicContact CG2-CG 3.83Å; T493-E560 VanDerWaalsContact OG1-CD 3.27Å; T493-E560 PolarHBondContact OG1-OE1 3.44Å; I558-E560 PolarHBondContact O-N 2.95Å
561	L	97.9	Very high	94.2	Very high	3 Å²	3	20.2 Å²	20.2	2%	0.016	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.2	151.2	-60.9	-173	0	0	0	109.8	R417 C418 F442 F453 V539 F541 I558	R417-L561 WeakPolarHBondContact CA-O 3.08Å; C418-L561 HydrophobicContact CB-CB 4.32Å; C418-L561 PolarHBondContact N-O 3.49Å; C418-L561 PolarHBondContact O-N 3Å; C418-L561 VanDerWaalsContact O-N 3.1Å; F442-L561 HydrophobicContact CB-CD1 4.17Å; F442-L561 HydrophobicContact CD1-CD1 4Å; F442-L561 HydrophobicContact CD2-CD1 3.73Å; F442-L561 HydrophobicContact CE1-CD1 4.34Å; F442-L561 HydrophobicContact CE2-CD1 4.1Å; F442-L561 HydrophobicContact CG-CD1 3.68Å; F442-L561 HydrophobicContact CZ-CD1 4.4Å; F453-L561 HydrophobicContact CD1-CD2 3.71Å; F453-L561 HydrophobicContact CE1-CD2 3.81Å; V539-L561 HydrophobicContact CG1-CD1 3.95Å; F541-L561 HydrophobicContact CE1-CD1 3.76Å; F541-L561 HydrophobicContact CE1-CG 4.15Å; F541-L561 HydrophobicContact CZ-CD1 3.98Å; F541-L561 HydrophobicContact CZ-CG 4.33Å; I558-L561 HydrophobicContact CG2-CD2 4.13Å
562	I	97.5	Very high	94.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.4	179.6	-47.4	170.7	0	0	0	108.8	P415 Q416 R417 A451 G452 P495 W497	P415-I562 HydrophobicContact CB-CG2 3.7Å; Q416-I562 WeakPolarHBondContact O-CA 3.49Å; R417-I562 HydrophobicContact CG-CG1 4.47Å; R417-I562 HydrophobicContact CG-CG2 4.49Å; R417-I562 VanDerWaalsContact NH1-CD1 3.33Å; A451-I562 PolarHBondContact N-O 2.91Å; G452-I562 PolarHBondContact N-O 3.22Å; G452-I562 WeakPolarHBondContact O-CB 3.34Å; G452-I562 PolarHBondContact O-N 3.17Å; P495-I562 HydrophobicContact CB-CD1 3.54Å; W497-I562 HydrophobicContact CH2-CD1 4.28Å; W497-I562 HydrophobicContact CH2-CG2 3.66Å; W497-I562 HydrophobicContact CZ3-CB 4.27Å; W497-I562 HydrophobicContact CZ3-CD1 4.39Å; W497-I562 HydrophobicContact CZ3-CG2 3.48Å; W497-I562 VanDerWaalsContact CZ3-CG2 3.48Å
563	F	96.8	Very high	94.3	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.009	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	163.6	-171.9	65.4	-86.1	0	0	0	114.2	Q416 C418 V448 F449 I450 C534 V537 A565	Q416-F563 HydrophobicContact CB-CD1 4.42Å; Q416-F563 HydrophobicContact CB-CD2 4.2Å; Q416-F563 HydrophobicContact CB-CE1 3.98Å; Q416-F563 HydrophobicContact CB-CE2 3.73Å; Q416-F563 HydrophobicContact CB-CZ 3.61Å; Q416-F563 HydrophobicContact CG-CE2 4.35Å; Q416-F563 PolarHBondContact N-O 2.74Å; Q416-F563 PolarHBondContact O-N 2.97Å; C418-F563 HydrophobicContact CB-CE1 3.86Å; V448-F563 HydrophobicContact CB-CB 4.43Å; V448-F563 HydrophobicContact CB-CD2 3.94Å; V448-F563 HydrophobicContact CB-CG 4.48Å; V448-F563 HydrophobicContact CG1-CD2 3.8Å; V448-F563 HydrophobicContact CG1-CE2 4.12Å; V448-F563 HydrophobicContact CG2-CB 4.46Å; V448-F563 HydrophobicContact CG2-CD2 4.45Å; F449-F563 CarbonylContact O-C 3.56Å; F449-F563 WeakPolarHBondContact O-CA 3.38Å; F449-F563 WeakPolarHBondContact O-CB 3.38Å; I450-F563 HydrophobicContact CD1-CB 3.82Å; C534-F563 HydrophobicContact CB-CE1 4.38Å; C534-F563 HydrophobicContact CB-CZ 4.06Å; V537-F563 HydrophobicContact CB-CE2 4.07Å; V537-F563 HydrophobicContact CB-CZ 4.2Å; V537-F563 HydrophobicContact CG1-CE2 4.39Å; V537-F563 HydrophobicContact CG2-CE2 3.92Å; F563-A565 HydrophobicContact CD2-CB 3.82Å; F563-A565 HydrophobicContact CE2-CB 3.65Å
564	Y	94.6	Very high	94.3	Very high	24 Å²	24	22.4 Å²	22.4	9%	0.094	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	136.3	168.3	-50.9	-58.1	0	0	0	109.4	L413 P415 V448 F449 A451 P501	L413-Y564 HydrophobicContact CB-CD1 3.42Å; L413-Y564 VanDerWaalsContact CB-CD1 3.42Å; L413-Y564 HydrophobicContact CB-CD2 4.39Å; L413-Y564 HydrophobicContact CB-CE1 3.53Å; L413-Y564 HydrophobicContact CB-CE2 4.47Å; L413-Y564 HydrophobicContact CB-CG 3.88Å; L413-Y564 HydrophobicContact CD1-CD1 4.14Å; L413-Y564 HydrophobicContact CD1-CD2 3.71Å; L413-Y564 HydrophobicContact CD1-CE2 4.19Å; L413-Y564 HydrophobicContact CD1-CG 3.68Å; L413-Y564 HydrophobicContact CG-CD1 4.4Å; L413-Y564 HydrophobicContact CG-CG 4.4Å; P415-Y564 HydrophobicContact CB-CD1 4.37Å; P415-Y564 HydrophobicContact CB-CE1 3.81Å; V448-Y564 WeakPolarHBondContact CA-O 3.44Å; V448-Y564 WeakPolarHBondContact CB-O 3.44Å; F449-Y564 HydrophobicContact CB-CD2 4.35Å; F449-Y564 PolarHBondContact N-O 3.05Å; F449-Y564 PolarHBondContact O-N 3.49Å; A451-Y564 HydrophobicContact CB-CD2 4.16Å; A451-Y564 HydrophobicContact CB-CE2 3.59Å; P501-Y564 HydrophobicContact CB-CD2 4.18Å; P501-Y564 HydrophobicContact CB-CE2 4.22Å; P501-Y564 HydrophobicContact CG-CD2 4.02Å; P501-Y564 HydrophobicContact CG-CE2 3.61Å
565	A	84.4	Confident	94.5	Very high	85 Å²	85	12.5 Å²	12.5	70%	0.702	9%	0.094	S	C	*	.			trans	-142.5	0	-174.3	0	0	0	0	0	112.5	V448 V537 F563	V448-A565 HydrophobicContact CG1-CB 3.78Å; V537-A565 HydrophobicContact CG2-CB 3.59Å; F563-A565 HydrophobicContact CD2-CB 3.82Å; F563-A565 HydrophobicContact CE2-CB 3.65Å

Retrieved 565 of 565 residues in 594.5 ms (Link to these results)

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