A0A087YNB7_POEFO Loading...

F-box and leucine rich repeat protein 7

AlphaFold DB , UniProt , Accession A0A087YNB7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 493 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.2	Very low	36.7	Very low	255 Å²	255	145.1 Å²	145.1	100%	1.256	85%	0.847	S	S	*	*				0	106.5	0	-52.5	166.4	-172.8	0	0	104.8
2	G	34.1	Very low	36.4	Very low	72 Å²	72	145.4 Å²	145.4	74%	0.742	84%	0.835	S	S	*	*			cis	123.8	101.8	33.1	0	0	0	0	0	105
3	A	38.6	Very low	36.1	Very low	106 Å²	106	140.4 Å²	140.4	88%	0.876	83%	0.834	S	S	*	*				67	132.2	66.5	0	0	0	0	0	112.7
4	N	42.6	Very low	36.1	Very low	139 Å²	139	142.6 Å²	142.6	74%	0.743	83%	0.828	S	S	*	*			cis	-166.6	176.8	-12.7	-163.2	8.2	0	0	0	109.6
5	N	40.3	Very low	35.8	Very low	144 Å²	144	138.7 Å²	138.7	77%	0.77	83%	0.83	S	S	*	*			trans	72.3	154.9	168.7	-41.1	-38.4	0	0	0	116.7
6	G	36.6	Very low	35.6	Very low	69 Å²	69	137.2 Å²	137.2	71%	0.711	83%	0.828	S	S	*	*			cis	120.2	111.9	-19.6	0	0	0	0	0	117.5
7	K	34.3	Very low	35.5	Very low	215 Å²	215	136.5 Å²	136.5	94%	0.935	83%	0.831	S	S	*	*			trans	-177.3	176.3	146.3	-107.8	171.9	-176.3	-178	0	114.8
8	Q	37.1	Very low	35.4	Very low	168 Å²	168	134.9 Å²	134.9	79%	0.785	83%	0.827	S	S	*	*			trans	-111.1	-170.4	-168.1	-57	166.3	-77	0	0	113.7
9	Y	34	Very low	35.3	Very low	233 Å²	233	136.3 Å²	136.3	91%	0.914	83%	0.827	S	S	*	*			trans	78.3	143.7	177.5	-61	-94.5	0	0	0	115.3
10	G	32.2	Very low	35.1	Very low	68 Å²	68	134.7 Å²	134.7	70%	0.701	82%	0.822	S	S	*	*			cis	159.9	171.2	-9	0	0	0	0	0	113.7
11	S	34.3	Very low	35	Very low	127 Å²	127	133 Å²	133	89%	0.888	82%	0.816	S	S	*	*			trans	86.4	151.5	165.7	-152.5	0	0	0	0	120.8
12	E	32.4	Very low	34.8	Very low	149 Å²	149	128 Å²	128	70%	0.696	79%	0.794	S	S	*	*			trans	-53.8	161.5	-166.3	-52.3	-173.1	116.6	0	0	120.5	K14	E12-K14 WeakPolarHBondContact OE1-CE 3.21Å; E12-K14 IonicContact OE1-NZ 3.47Å; E12-K14 PolarHBondContact OE1-NZ 3.38Å; E12-K14 IonicContact OE2-NZ 3.74Å; E12-K14 PolarHBondContact OE2-NZ 2.86Å
13	G	33.3	Very low	34.8	Very low	80 Å²	80	132.7 Å²	132.7	83%	0.825	80%	0.801	S	S	*	*			trans	-157.2	99.2	157.6	0	0	0	0	0	111.4
14	K	34.9	Very low	34.6	Very low	172 Å²	172	132.9 Å²	132.9	75%	0.748	80%	0.795	S	S	*	*			trans	-85.8	140.4	179.9	-67.4	169.4	-177.4	123.9	0	110.6	E12	E12-K14 WeakPolarHBondContact OE1-CE 3.21Å; E12-K14 IonicContact OE1-NZ 3.47Å; E12-K14 PolarHBondContact OE1-NZ 3.38Å; E12-K14 IonicContact OE2-NZ 3.74Å; E12-K14 PolarHBondContact OE2-NZ 2.86Å
15	G	31.9	Very low	34.1	Very low	84 Å²	84	132.3 Å²	132.3	87%	0.866	80%	0.803	S	S	*	*			trans	-157	77	-179.6	0	0	0	0	0	112.4
16	S	33.3	Very low	33.8	Very low	114 Å²	114	130.7 Å²	130.7	80%	0.797	80%	0.802	S	S	*	*			trans	-110	124.1	-174.1	55.4	0	0	0	0	112.9
17	S	33.6	Very low	33.7	Very low	125 Å²	125	134.4 Å²	134.4	87%	0.874	81%	0.811	S	S	*	*			trans	-158.9	125.6	148.2	43.1	0	0	0	0	111.7
18	S	33.6	Very low	33.6	Very low	108 Å²	108	130.5 Å²	130.5	76%	0.755	80%	0.801	S	S	*	*			trans	-85	162.5	163.1	49	0	0	0	0	110.2
19	I	33.3	Very low	33.5	Very low	162 Å²	162	131.2 Å²	131.2	83%	0.831	80%	0.804	S	S	*	*				-172.9	161.8	126.6	-99.5	159.1	0	0	0	111.5
20	S	31.3	Very low	33.5	Very low	103 Å²	103	126 Å²	126	72%	0.72	80%	0.797	S	S	*	*			trans	-60.5	177.8	179.5	57.9	0	0	0	0	114.3
21	S	32.8	Very low	34.2	Very low	101 Å²	101	128.5 Å²	128.5	71%	0.706	80%	0.8	S	S	*	*			cis	-157.5	172	24.7	59.8	0	0	0	0	114.6
22	D	36	Very low	34.1	Very low	149 Å²	149	129.4 Å²	129.4	80%	0.797	80%	0.801	S	S	*	*			trans	-57.5	159.1	164.8	-46.1	-96.5	0	0	0	113.2
23	I	34.2	Very low	34.1	Very low	170 Å²	170	132 Å²	132	87%	0.872	81%	0.81	S	S	*	*				-161.6	143.4	129.5	-103.7	157	0	0	0	109.8
24	S	34.3	Very low	34	Very low	110 Å²	110	133 Å²	133	77%	0.769	81%	0.809	S	S	*	*			trans	-90.8	148	-179.5	56	0	0	0	0	113.3
25	S	33.2	Very low	33.7	Very low	128 Å²	128	133 Å²	133	90%	0.895	82%	0.817	S	S	*	*			trans	-152.5	149.1	145.9	57.3	0	0	0	0	112.1
26	S	32.3	Very low	33.7	Very low	109 Å²	109	137.7 Å²	137.7	76%	0.762	81%	0.814	S	S	*	*			trans	-128.5	143.2	-176.8	55.3	0	0	0	0	110.1
27	T	34.9	Very low	33.5	Very low	147 Å²	147	140.4 Å²	140.4	90%	0.902	82%	0.819	S	S	*	*			trans	-159.1	139.5	151.1	16.3	0	0	0	0	111.3
28	D	33.3	Very low	33.3	Very low	134 Å²	134	140.6 Å²	140.6	72%	0.717	82%	0.815	S	S	*	*			trans	-74.6	155.5	165.9	-65.4	-81.8	0	0	0	111.7
29	H	33.5	Very low	33.1	Very low	183 Å²	183	139.6 Å²	139.6	85%	0.847	81%	0.813	S	S	*	*				-175.1	171.1	106	-95.9	-57.9	0	0	0	112.8
30	T	34.9	Very low	32.9	Very low	124 Å²	124	137.4 Å²	137.4	76%	0.761	81%	0.807	S	S	*	*			trans	-116.6	-161.6	-163.1	63	0	0	0	0	111.4
31	P	47	Very low	32.7	Very low	120 Å²	120	138.7 Å²	138.7	78%	0.779	81%	0.811	S	S	*	*				-116.7	166.9	-121.2	27.2	-4.7	0	0	0	115.5
32	T	32	Very low	32.5	Very low	146 Å²	146	142.7 Å²	142.7	90%	0.896	82%	0.818	S	S	*	*			trans	-118.3	155.7	-178.2	-23	0	0	0	0	113.1
33	K	33.3	Very low	32	Very low	204 Å²	204	139.1 Å²	139.1	89%	0.887	82%	0.817	S	S	*	*			trans	-85.7	161.4	-167.8	-70.8	175.7	178.5	172.2	0	114.8
34	A	30.7	Very low	31.7	Very low	99 Å²	99	139.4 Å²	139.4	82%	0.818	82%	0.819	S	S	*	*			trans	-48.6	160.5	171.1	0	0	0	0	0	116.4
35	L	28.2	Very low	31.3	Very low	174 Å²	174	142.2 Å²	142.2	91%	0.911	82%	0.82	S	S	*	*			trans	-132.4	152.7	158.3	-106.9	169.8	0	0	0	110.9
36	K	31.4	Very low	31	Very low	182 Å²	182	143.1 Å²	143.1	79%	0.791	82%	0.821	S	S	*	*			trans	-87.4	167	173.2	-61.5	176	178.6	178.5	0	110
37	N	29.9	Very low	30.6	Very low	171 Å²	171	143.2 Å²	143.2	91%	0.914	82%	0.821	S	S	*	*			trans	-139.8	156.8	147	-107.1	-20.7	0	0	0	110.9
38	V	29.5	Very low	30.2	Very low	129 Å²	129	143 Å²	143	78%	0.782	82%	0.82	S	S	*	*			trans	-144	130.9	-170.5	171.8	0	0	0	0	109.4
39	A	28.9	Very low	29.8	Very low	87 Å²	87	147.5 Å²	147.5	72%	0.719	83%	0.827	S	S	*	*			trans	-175.1	149.9	159.8	0	0	0	0	0	110.4
40	T	28.2	Very low	29.4	Very low	115 Å²	115	144.7 Å²	144.7	71%	0.706	82%	0.823	S	S	*	*			cis	-169.6	138.6	-26.3	30.1	0	0	0	0	108.4
41	T	29.1	Very low	28.9	Very low	131 Å²	131	146.2 Å²	146.2	80%	0.804	83%	0.825	S	S	*	*			trans	57.7	164.5	149.5	58.9	0	0	0	0	119
42	E	27.2	Very low	27.9	Very low	184 Å²	184	145.8 Å²	145.8	86%	0.86	83%	0.825	S	S	*	*			cis	-125.9	157.8	1.8	-66.1	176.5	147.2	0	0	110
43	G	26	Very low	27.6	Very low	74 Å²	74	145.2 Å²	145.2	76%	0.763	82%	0.822	S	S	*	*				96	140.8	100.9	0	0	0	0	0	112.2
44	L	27.1	Very low	27.5	Very low	176 Å²	176	141.1 Å²	141.1	92%	0.921	82%	0.816	S	S	*	*			cis	-144.1	-170.3	2.2	-149.3	78.2	0	0	0	110.5
45	E	26.1	Very low	27.5	Very low	169 Å²	169	142.3 Å²	142.3	79%	0.79	82%	0.818	S	S	*	*			trans	-85.5	160.3	-165.9	-50	176.4	136.6	0	0	116.1
46	T	26.4	Very low	27.6	Very low	148 Å²	148	140 Å²	140	91%	0.908	81%	0.814	S	S	*	*				-165	152.9	125.1	9.9	0	0	0	0	111.8
47	S	24.6	Very low	27.4	Very low	110 Å²	110	134.6 Å²	134.6	77%	0.769	81%	0.809	S	S	*	*			trans	-115.3	148	178.2	-70.7	0	0	0	0	111.4
48	T	26.1	Very low	27.2	Very low	143 Å²	143	135.2 Å²	135.2	88%	0.877	81%	0.812	S	S	*	*				-174.2	157.5	121.8	21.3	0	0	0	0	115.1
49	R	25.3	Very low	27.2	Very low	228 Å²	228	136.9 Å²	136.9	86%	0.86	82%	0.815	S	S	*	*			trans	-48.5	152.4	174.2	-52.7	156.2	175.5	164.2	-3.4	114.3
50	T	24.8	Very low	27.2	Very low	125 Å²	125	140.4 Å²	140.4	77%	0.767	82%	0.82	S	S	*	*				-169.9	135	106.9	25.8	0	0	0	0	116
51	L	24.1	Very low	27.4	Very low	155 Å²	155	140.8 Å²	140.8	81%	0.812	83%	0.825	S	S	*	*			trans	44	122.9	134.5	-63	168.8	0	0	0	122.9
52	S	26.8	Very low	27.2	Very low	111 Å²	111	140.2 Å²	140.2	78%	0.776	83%	0.827	S	S	*	*			trans	-62.2	148.2	154.8	52.4	0	0	0	0	114.4
53	T	26.2	Very low	27.2	Very low	135 Å²	135	141.2 Å²	141.2	83%	0.828	83%	0.828	S	S	*	*			trans	-135.7	155.6	162.7	49	0	0	0	0	111.5
54	P	30.3	Very low	27.2	Very low	118 Å²	118	143.3 Å²	143.3	77%	0.766	83%	0.831	S	S	*	*			trans	-105.5	167.5	-167.8	40.2	-35.7	0	0	0	115
55	S	30.4	Very low	27.2	Very low	123 Å²	123	141 Å²	141	86%	0.86	83%	0.83	S	S	*	*			trans	-77.6	138.7	173.2	-43	0	0	0	0	113.8
56	P	31.4	Very low	27.3	Very low	127 Å²	127	137.7 Å²	137.7	83%	0.825	83%	0.825	S	S	*	*			trans	-119.8	163.8	141.2	37	-28.5	0	0	0	110.2
57	G	27.7	Very low	27.3	Very low	67 Å²	67	138.7 Å²	138.7	69%	0.691	82%	0.824	S	S	*	*			cis	165.3	117.2	-2.3	0	0	0	0	0	108.2
58	L	26.1	Very low	27.5	Very low	184 Å²	184	138.6 Å²	138.6	96%	0.963	82%	0.823	S	S	*	*			trans	-73.7	130.1	-173.6	-72.2	166.2	0	0	0	111.7
59	I	28.2	Very low	27.5	Very low	164 Å²	164	137.1 Å²	137.1	84%	0.841	82%	0.819	S	S	*	*			trans	-126.6	123.7	169.6	-60.9	-178.9	0	0	0	108.8
60	L	30.1	Very low	28.1	Very low	161 Å²	161	132.6 Å²	132.6	84%	0.843	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-89.7	149.9	177.1	-79.3	158	0	0	0	111.1
61	P	30.8	Very low	28.2	Very low	124 Å²	124	131.1 Å²	131.1	81%	0.805	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-78.1	139.1	-179.9	31.8	-34.6	0	0	0	112.2
62	S	25.1	Very low	28.3	Very low	119 Å²	119	131.4 Å²	131.4	83%	0.832	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-84.9	140.2	175.1	50.6	0	0	0	0	112.5
63	K	27	Very low	28.3	Very low	204 Å²	204	131.1 Å²	131.1	89%	0.887	82%	0.819	S	S	*	*			trans	-150.1	166.2	167.4	-96.9	-166.7	178.3	-179.1	0	111.6
64	S	26.9	Very low	28.4	Very low	119 Å²	119	130 Å²	130	83%	0.832	82%	0.816	S	S	*	*			trans	61.1	99.2	174.5	60.6	0	0	0	0	118
65	S	27.6	Very low	28.3	Very low	128 Å²	128	132.3 Å²	132.3	90%	0.895	82%	0.822	S	S	*	*				-111.2	166.3	124.1	58.7	0	0	0	0	108.4
66	S	26.7	Very low	28.1	Very low	98 Å²	98	129.6 Å²	129.6	69%	0.685	81%	0.814	S	S	*	*			trans	-146.1	163.8	-167	56.6	0	0	0	0	112.1
67	L	27.3	Very low	28	Very low	170 Å²	170	130.6 Å²	130.6	89%	0.89	81%	0.813	S	S	*	*			trans	72.8	153.1	178.2	-53.9	150.2	0	0	0	112.5
68	S	28	Very low	28	Very low	108 Å²	108	135.1 Å²	135.1	76%	0.755	82%	0.816	S	S	*	*			cis	-146.6	158.2	1.9	46.8	0	0	0	0	111.5
69	S	27.8	Very low	28.3	Very low	112 Å²	112	133.6 Å²	133.6	78%	0.783	81%	0.814	S	S	*	*			trans	-71.1	161.5	160.9	-49.9	0	0	0	0	111.3
70	P	36.8	Very low	28.3	Very low	133 Å²	133	132.4 Å²	132.4	86%	0.864	81%	0.809	S	S	*	*				-133.9	-176.3	97.6	38.5	-28.9	0	0	0	113.1
71	A	27.2	Very low	28.4	Very low	93 Å²	93	129.5 Å²	129.5	77%	0.769	80%	0.802	S	S	*	*			trans	-121	159.7	-176.3	0	0	0	0	0	112.1
72	L	27.1	Very low	28.4	Very low	161 Å²	161	128.9 Å²	128.9	84%	0.843	80%	0.801	S	S	*	*			trans	178.2	152.8	137.3	-98.2	158	0	0	0	111.9
73	S	26.1	Very low	28.7	Very low	106 Å²	106	128 Å²	128	74%	0.741	80%	0.795	S	S	*	*			trans	26.6	141.1	151.5	64.6	0	0	0	0	121
74	S	27.9	Very low	28.9	Very low	110 Å²	110	124 Å²	124	77%	0.769	79%	0.793	S	S	*	*			cis	-170	168.9	36.3	53.3	0	0	0	0	114.2
75	N	27.8	Very low	29	Very low	167 Å²	167	123.4 Å²	123.4	89%	0.893	79%	0.789	S	S	*	*			trans	-39.4	158.6	170.8	-47.6	-12.2	0	0	0	117.8
76	G	26.6	Very low	29.1	Very low	67 Å²	67	122.5 Å²	122.5	69%	0.691	78%	0.782	S	S	*	*			trans	170	110	153.8	0	0	0	0	0	116.5
77	N	30.2	Very low	29.3	Very low	148 Å²	148	121.9 Å²	121.9	79%	0.791	78%	0.783	S	S	*	*			trans	50.9	119.2	156.1	-61.2	20.6	0	0	0	119.5
78	E	26.9	Very low	29.4	Very low	162 Å²	162	122 Å²	122	76%	0.757	78%	0.779	S	S	*	*				73.4	113.2	65.7	-72	-169.1	166.4	0	0	115.9
79	T	31.8	Very low	29.4	Very low	151 Å²	151	122 Å²	122	93%	0.926	77%	0.774	S	S	*	*			trans	-142.8	152.7	139.4	39.2	0	0	0	0	108.8
80	N	28.6	Very low	29.4	Very low	139 Å²	139	124 Å²	124	74%	0.743	77%	0.771	S	S	*	*			trans	-110.4	147.6	-156.4	-104.2	-43.2	0	0	0	115.9
81	S	31.6	Very low	29	Very low	100 Å²	100	123.1 Å²	123.1	70%	0.699	76%	0.764	S	S	*	*			trans	40	135.6	145.5	67.6	0	0	0	0	120.8
82	S	31.4	Very low	28.9	Very low	112 Å²	112	125.1 Å²	125.1	78%	0.783	77%	0.766	S	S	*	*				173.1	163	78.3	40.1	0	0	0	0	109.8
83	S	31.3	Very low	28.8	Very low	100 Å²	100	121.9 Å²	121.9	70%	0.699	76%	0.762	S	S	*	*			cis	-167.6	165.6	-11.1	47	0	0	0	0	111.2
84	S	30.9	Very low	29.1	Very low	119 Å²	119	123.1 Å²	123.1	83%	0.832	77%	0.765	S	S	*	*			trans	72.3	152.6	164.5	84.6	0	0	0	0	117.7
85	S	29.8	Very low	29.1	Very low	107 Å²	107	125.8 Å²	125.8	75%	0.748	77%	0.769	S	S	*	*			cis	-148.4	169.8	5.3	58.9	0	0	0	0	114.8
86	S	29.8	Very low	29.3	Very low	109 Å²	109	125.5 Å²	125.5	76%	0.762	76%	0.762	S	S	*	*			trans	-36.2	162	167.1	45	0	0	0	0	119.5
87	A	29.8	Very low	29.6	Very low	85 Å²	85	128.1 Å²	128.1	70%	0.702	77%	0.767	S	S	*	*			cis	-169.6	166.9	-5.4	0	0	0	0	0	113.7
88	H	29.7	Very low	29.7	Very low	174 Å²	174	128.7 Å²	128.7	81%	0.806	77%	0.765	S	S	*	*			trans	-0.5	152.2	145	-54.8	-73.4	0	0	0	120.8
89	T	28	Very low	30.4	Very low	106 Å²	106	126.9 Å²	126.9	65%	0.65	77%	0.767	S	S	*	*			cis	-156.6	-163.7	-2.9	12.7	0	0	0	0	108.9
90	E	28.4	Very low	30.3	Very low	155 Å²	155	122.9 Å²	122.9	72%	0.724	76%	0.756	S	S	*	*			cis	-150.6	159.9	7.1	-127.3	137.7	-80.4	0	0	107.3
91	T	27.2	Very low	30.9	Very low	115 Å²	115	122.6 Å²	122.6	71%	0.706	76%	0.759	S	S	*	*				64.7	137.9	58	-3.1	0	0	0	0	114.7
92	V	26.2	Very low	31	Very low	134 Å²	134	127 Å²	127	81%	0.812	77%	0.768	S	S	*	*			cis	-147.5	152	12.5	-159.2	0	0	0	0	110.8
93	A	25.4	Very low	31.5	Very low	93 Å²	93	126.9 Å²	126.9	77%	0.769	77%	0.767	S	S	*	*			trans	173.8	132.7	134.5	0	0	0	0	0	113.1
94	V	32.3	Very low	31.7	Very low	132 Å²	132	133.9 Å²	133.9	80%	0.8	78%	0.778	S	S	*	*			trans	-142.2	123	167.7	176.4	0	0	0	0	109.8
95	I	26.4	Very low	32	Very low	166 Å²	166	132.3 Å²	132.3	85%	0.851	77%	0.768	S	S	*	*			trans	-139.9	139.9	165.2	-60.4	-176.9	0	0	0	108.9
96	H	32	Very low	32.5	Very low	161 Å²	161	139.2 Å²	139.2	75%	0.745	78%	0.777	S	S	*	*			trans	-117.2	157.6	168.5	-91	62.5	0	0	0	107.3
97	P	33.8	Very low	33	Very low	123 Å²	123	142.2 Å²	142.2	80%	0.799	78%	0.779	S	S	*	*			cis	-147.1	-173.8	44.2	40.7	-18.9	0	0	0	118.2
98	Q	32.6	Very low	33.5	Very low	160 Å²	160	143.3 Å²	143.3	75%	0.748	78%	0.781	S	S	*	*			trans	-60.2	170.9	165.1	-74.9	-83.8	-27.2	0	0	112.7
99	P	42.1	Very low	34.2	Very low	123 Å²	123	144 Å²	144	80%	0.799	78%	0.782	S	S	*	*			cis	-143.1	174.4	25.7	42.8	-23.7	0	0	0	118.9
100	G	29.7	Very low	35	Very low	67 Å²	67	142.7 Å²	142.7	69%	0.691	78%	0.777	S	S	*	*			trans	-174.7	107.9	164	0	0	0	0	0	112.8
101	V	39.8	Very low	36.4	Very low	134 Å²	134	142.5 Å²	142.5	81%	0.812	78%	0.776	S	S	*	*			trans	-97.1	122.3	-170.6	178.6	0	0	0	0	112.5
102	H	34	Very low	37.8	Very low	191 Å²	191	145.2 Å²	145.2	88%	0.884	78%	0.781	S	S	*	*			trans	-136.7	131.1	151.1	-84.3	-60.5	0	0	0	111.8	R104	H102-R104 PolarHBondContact O-N 2.98Å
103	S	42.7	Very low	39.3	Very low	110 Å²	110	146.6 Å²	146.6	77%	0.769	77%	0.772	S	S	*	*			trans	-63.7	123.6	178.9	178.7	0	0	0	0	111.7
104	R	34.3	Very low	41.5	Very low	247 Å²	247	144.7 Å²	144.7	93%	0.932	76%	0.756	S	S	*	*			trans	-105.8	113.8	152.6	-78	-172.7	170.2	-175.4	-2.5	107.6	H102	H102-R104 PolarHBondContact O-N 2.98Å
105	S	37.3	Very low	43.6	Very low	87 Å²	87	143.4 Å²	143.4	61%	0.608	75%	0.751	S	S	*	*			trans	-61.7	145.7	178.7	56.4	0	0	0	0	110.8	Q107	S105-Q107 PolarHBondContact O-N 3.17Å
106	R	42.1	Very low	46.1	Very low	251 Å²	251	138.6 Å²	138.6	95%	0.947	73%	0.726	S	S	*	*			trans	-67.6	87.5	162.1	-84.5	-178.2	166.9	175.3	-4	108	S108	R106-S108 PolarHBondContact O-N 2.9Å
107	Q	40	Very low	48.5	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.804	71%	0.706	S	S	*	*			trans	-58.8	108.1	162.6	-78.1	-172.9	-20.5	0	0	107.8	S105 K109	S105-Q107 PolarHBondContact O-N 3.17Å; Q107-K109 PolarHBondContact O-N 3.45Å; Q107-K109 VanDerWaalsContact O-N 3.17Å
108	S	40.4	Very low	51	Low	108 Å²	108	134.3 Å²	134.3	76%	0.755	70%	0.701	S	S	*	*			trans	-57.2	120.1	167.7	-176.8	0	0	0	0	107.6	R106 S110	R106-S108 PolarHBondContact O-N 2.9Å; S108-S110 PolarHBondContact O-N 2.86Å
109	K	44.5	Very low	53.8	Low	189 Å²	189	129.4 Å²	129.4	82%	0.822	68%	0.68	S	S	*	*			trans	-71.7	86.5	172.1	-72.5	-174.5	178.2	-179	0	107.8	Q107 H111	Q107-K109 PolarHBondContact O-N 3.45Å; Q107-K109 VanDerWaalsContact O-N 3.17Å; K109-H111 PolarHBondContact O-N 2.8Å
110	S	44.9	Very low	56.3	Low	78 Å²	78	126.6 Å²	126.6	55%	0.545	66%	0.662	S	S	.	*			trans	-57.8	102.8	165.7	49.2	0	0	0	0	107.8	S108 H112	S108-S110 PolarHBondContact O-N 2.86Å; S110-H112 VanDerWaalsContact C-N 3.3Å; S110-H112 PolarHBondContact O-CD2 2.95Å; S110-H112 PolarHBondContact O-N 2.83Å
111	H	56.5	Low	59.3	Low	152 Å²	152	127 Å²	127	70%	0.704	65%	0.648	S	S	*	*			trans	-62.6	97.1	171.3	-83.8	-85.3	0	0	0	107.6	K109 Y113	K109-H111 PolarHBondContact O-N 2.8Å; H111-Y113 HydrophobicContact CB-CD2 4.31Å; H111-Y113 HydrophobicContact CB-CE2 4.02Å; H111-Y113 WeakPolarHBondContact O-CD2 3.39Å; H111-Y113 PolarHBondContact O-N 2.85Å
112	H	57.2	Low	62	Low	172 Å²	172	126.8 Å²	126.8	80%	0.796	64%	0.638	S	S	*	*			trans	-66.5	84.7	167.5	-71.3	-75.5	0	0	0	107.8	S110 A114	S110-H112 VanDerWaalsContact C-N 3.3Å; S110-H112 PolarHBondContact O-CD2 2.95Å; S110-H112 PolarHBondContact O-N 2.83Å; H112-A114 PolarHBondContact O-N 3.01Å; H112-A114 VanDerWaalsContact O-N 3.1Å
113	Y	58.6	Low	64.9	Low	163 Å²	163	119.6 Å²	119.6	64%	0.639	61%	0.608	S	S	*	*			trans	-54.2	117.3	168.3	-74.9	-88.3	0	0	0	107.7	H111 N117	H111-Y113 HydrophobicContact CB-CD2 4.31Å; H111-Y113 HydrophobicContact CB-CE2 4.02Å; H111-Y113 WeakPolarHBondContact O-CD2 3.39Å; H111-Y113 PolarHBondContact O-N 2.85Å; Y113-N117 HydrophobicContact CD1-CB 4.32Å
114	A	70.7	Confident	67.3	Low	52 Å²	52	114.4 Å²	114.4	43%	0.43	57%	0.571	S	S	.	*			trans	-53.6	133.8	174.4	0	0	0	0	0	108.4	H112 I116 N117	H112-A114 PolarHBondContact O-N 3.01Å; H112-A114 VanDerWaalsContact O-N 3.1Å; A114-I116 HydrophobicContact CB-CG2 4.35Å; A114-I116 PolarHBondContact O-N 2.92Å; A114-N117 WeakPolarHBondContact O-CB 3.43Å; A114-N117 PolarHBondContact O-N 3.1Å; A114-N117 PolarHBondContact O-ND2 2.73Å
115	P	76.1	Confident	70.3	Confident	105 Å²	105	103.7 Å²	103.7	68%	0.682	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-53	-30.3	-164.6	-31.7	35.8	0	0	0	115.2	N117 L118	P115-N117 PolarHBondContact O-N 3.12Å; P115-N117 VanDerWaalsContact O-N 3.12Å; P115-L118 WeakPolarHBondContact O-CB 3.44Å; P115-L118 PolarHBondContact O-N 2.67Å
116	I	79.8	Confident	73	Confident	66 Å²	66	105.8 Å²	105.8	34%	0.338	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-56.5	-24.1	174.8	-162.8	161.3	0	0	0	114.3	A114 L118 L119 L124 W146	A114-I116 HydrophobicContact CB-CG2 4.35Å; A114-I116 PolarHBondContact O-N 2.92Å; I116-L118 VanDerWaalsContact C-N 3.35Å; I116-L119 HydrophobicContact CG1-CD1 4.16Å; I116-L124 HydrophobicContact CG1-CD2 3.86Å; I116-W146 HydrophobicContact CD1-CH2 3.81Å; I116-W146 HydrophobicContact CD1-CZ2 3.61Å; I116-W146 HydrophobicContact CG1-CZ2 3.94Å; I116-W146 HydrophobicContact CG2-CZ2 4.3Å
117	N	81.1	Confident	75.6	Confident	60 Å²	60	97.2 Å²	97.2	32%	0.321	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-76.8	-20.9	175.5	-64	-72.6	0	0	0	113.1	Y113 A114 P115 L119 R145	Y113-N117 HydrophobicContact CD1-CB 4.32Å; A114-N117 WeakPolarHBondContact O-CB 3.43Å; A114-N117 PolarHBondContact O-N 3.1Å; A114-N117 PolarHBondContact O-ND2 2.73Å; P115-N117 PolarHBondContact O-N 3.12Å; P115-N117 VanDerWaalsContact O-N 3.12Å; N117-L119 VanDerWaalsContact C-N 3.35Å; N117-R145 PolarHBondContact O-NH1 2.85Å
118	L	86.8	Confident	78.3	Confident	133 Å²	133	89.1 Å²	89.1	70%	0.696	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-14.5	177.6	-56.8	174.7	0	0	0	112.3	P115 I116	P115-L118 WeakPolarHBondContact O-CB 3.44Å; P115-L118 PolarHBondContact O-N 2.67Å; I116-L118 VanDerWaalsContact C-N 3.35Å
119	L	91.1	Very high	80.9	Confident	57 Å²	57	87.1 Å²	87.1	30%	0.298	45%	0.453	S	S	.	.	S	Bend	trans	-65.8	138.7	175.4	-61.1	-178.6	0	0	0	110.8	I116 N117 L124 I127 R145	I116-L119 HydrophobicContact CG1-CD1 4.16Å; N117-L119 VanDerWaalsContact C-N 3.35Å; L119-L124 HydrophobicContact CB-CD2 4.18Å; L119-L124 HydrophobicContact CB-CG 4.14Å; L119-L124 HydrophobicContact CD1-CD2 4.06Å; L119-I127 HydrophobicContact CD1-CD1 3.67Å; L119-R145 PolarHBondContact O-NH2 2.81Å
120	P	94	Very high	83.4	Confident	65 Å²	65	85.6 Å²	85.6	42%	0.422	45%	0.448	S	S	.	.			trans	-60.4	156.8	170.1	-25.5	34.5	0	0	0	113.7	H122 T123 L124	P120-H122 VanDerWaalsContact C-N 3.33Å; P120-H122 PolarHBondContact O-N 3.44Å; P120-T123 WeakPolarHBondContact CD-OG1 3.41Å; P120-T123 WeakPolarHBondContact O-CB 3.05Å; P120-T123 PolarHBondContact O-N 3.24Å; P120-L124 PolarHBondContact O-N 3.05Å
121	D	94.6	Very high	85.8	Confident	75 Å²	75	83.9 Å²	83.9	40%	0.401	43%	0.433	S	S	.	.	H	α-helix	trans	-58.8	-40.7	179.1	-75.1	-8.5	0	0	0	112.8	T123 L124 L125 R145 L149	D121-T123 PolarHBondContact O-N 3.03Å; D121-L124 PolarHBondContact O-N 3.35Å; D121-L125 WeakPolarHBondContact O-CG 3.3Å; D121-L125 PolarHBondContact O-N 2.76Å; D121-R145 IonicContact OD1-CZ 3.14Å; D121-R145 IonicContact OD1-NE 2.76Å; D121-R145 PolarHBondContact OD1-NE 3.12Å; D121-R145 IonicContact OD1-NH2 2.67Å; D121-R145 PolarHBondContact OD1-NH2 3.13Å; D121-L149 HydrophobicContact CB-CD1 4.45Å; D121-L149 HydrophobicContact CB-CD2 3.79Å
122	H	94.4	Very high	87.5	Confident	129 Å²	129	79.1 Å²	79.1	60%	0.597	42%	0.415	S	S	*	.	H	α-helix	trans	-61.3	-34.8	176.4	76.6	-100	0	0	0	112.1	P120 L125 Q126	P120-H122 VanDerWaalsContact C-N 3.33Å; P120-H122 PolarHBondContact O-N 3.44Å; H122-L125 PolarHBondContact O-N 3.3Å; H122-Q126 WeakPolarHBondContact O-CG 3.34Å; H122-Q126 PolarHBondContact O-N 3.37Å
123	T	94.9	Very high	89.3	Confident	41 Å²	41	71.2 Å²	71.2	25%	0.252	38%	0.379	S	S	.	.	H	α-helix	trans	-73.4	-39.5	179	-36.8	0	0	0	0	110.7	P120 D121 Q126 I127	P120-T123 WeakPolarHBondContact CD-OG1 3.41Å; P120-T123 WeakPolarHBondContact O-CB 3.05Å; P120-T123 PolarHBondContact O-N 3.24Å; D121-T123 PolarHBondContact O-N 3.03Å; T123-Q126 PolarHBondContact O-N 2.87Å; T123-I127 WeakPolarHBondContact O-CG1 3.36Å; T123-I127 PolarHBondContact O-N 3.3Å
124	L	94.7	Very high	91	Very high	0 Å²	0	68 Å²	68	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-64.5	-38.4	172.6	-70.2	174.6	0	0	0	112	I116 L119 P120 D121 I127 F128 L149	I116-L124 HydrophobicContact CG1-CD2 3.86Å; L119-L124 HydrophobicContact CB-CD2 4.18Å; L119-L124 HydrophobicContact CB-CG 4.14Å; L119-L124 HydrophobicContact CD1-CD2 4.06Å; P120-L124 PolarHBondContact O-N 3.05Å; D121-L124 PolarHBondContact O-N 3.35Å; L124-I127 PolarHBondContact O-N 3.09Å; L124-F128 WeakPolarHBondContact O-CB 3.34Å; L124-F128 VanDerWaalsContact O-CD1 3.3Å; L124-F128 WeakPolarHBondContact O-CD1 3.45Å; L124-F128 VanDerWaalsContact O-CG 3.25Å; L124-F128 WeakPolarHBondContact O-CG 3.49Å; L124-F128 PolarHBondContact O-N 2.99Å; L124-L149 HydrophobicContact CB-CD1 3.96Å; L124-L149 HydrophobicContact CD1-CD1 3.72Å
125	L	95.8	Very high	92.1	Very high	23 Å²	23	69.4 Å²	69.4	12%	0.12	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-39.4	174	-69.9	172	0	0	0	112.4	D121 H122 F128 S129 L149 D152 L155	D121-L125 WeakPolarHBondContact O-CG 3.3Å; D121-L125 PolarHBondContact O-N 2.76Å; H122-L125 PolarHBondContact O-N 3.3Å; L125-F128 PolarHBondContact O-N 3.02Å; L125-S129 PolarHBondContact O-N 2.82Å; L125-L149 HydrophobicContact CD1-CD2 4.31Å; L125-L149 HydrophobicContact CD2-CB 4.15Å; L125-L149 HydrophobicContact CD2-CD2 4.12Å; L125-L149 VanDerWaalsContact CD2-O 3.32Å; L125-L149 WeakPolarHBondContact CD2-O 3.41Å; L125-L149 HydrophobicContact CG-CD2 4.07Å; L125-D152 WeakPolarHBondContact CD1-OD2 3.42Å; L125-D152 HydrophobicContact CD2-CB 3.63Å; L125-L155 HydrophobicContact CD2-CD1 3.95Å; L125-L155 HydrophobicContact CD2-CG 4.35Å
126	Q	95.7	Very high	93.1	Very high	130 Å²	130	64.6 Å²	64.6	61%	0.607	34%	0.339	S	S	*	.	H	α-helix	trans	-60.1	-46.3	172.2	-73.5	-69.9	-39.6	0	0	111.1	H122 T123 F128 S129 H130	H122-Q126 WeakPolarHBondContact O-CG 3.34Å; H122-Q126 PolarHBondContact O-N 3.37Å; T123-Q126 PolarHBondContact O-N 2.87Å; Q126-F128 VanDerWaalsContact C-N 3.35Å; Q126-F128 PolarHBondContact O-N 2.97Å; Q126-S129 PolarHBondContact O-N 3.14Å; Q126-S129 PolarHBondContact O-OG 3.29Å; Q126-H130 PolarHBondContact O-CD2 3.36Å
127	I	95.4	Very high	93.8	Very high	71 Å²	71	63.7 Å²	63.7	36%	0.364	34%	0.338	S	S	.	.	H	α-helix	trans	-60.5	-43.8	174.4	-67	162.9	0	0	0	111	L119 T123 L124 S129 H130	L119-I127 HydrophobicContact CD1-CD1 3.67Å; T123-I127 WeakPolarHBondContact O-CG1 3.36Å; T123-I127 PolarHBondContact O-N 3.3Å; L124-I127 PolarHBondContact O-N 3.09Å; I127-S129 VanDerWaalsContact C-N 3.31Å; I127-S129 PolarHBondContact O-N 3Å; I127-H130 PolarHBondContact O-N 3.36Å
128	F	96.8	Very high	94.5	Very high	3 Å²	3	68.9 Å²	68.9	1%	0.013	35%	0.353	C	S	.	.	H	α-helix	trans	-67.8	-27.9	-179.7	-72.9	6.1	0	0	0	112.7	L124 L125 Q126 H130 L131 L136 C139 W146 L149 A150 L155	L124-F128 WeakPolarHBondContact O-CB 3.34Å; L124-F128 VanDerWaalsContact O-CD1 3.3Å; L124-F128 WeakPolarHBondContact O-CD1 3.45Å; L124-F128 VanDerWaalsContact O-CG 3.25Å; L124-F128 WeakPolarHBondContact O-CG 3.49Å; L124-F128 PolarHBondContact O-N 2.99Å; L125-F128 PolarHBondContact O-N 3.02Å; Q126-F128 VanDerWaalsContact C-N 3.35Å; Q126-F128 PolarHBondContact O-N 2.97Å; F128-H130 PolarHBondContact O-N 3.36Å; F128-L131 HydrophobicContact CB-CD1 4.39Å; F128-L131 HydrophobicContact CD1-CD1 3.7Å; F128-L131 HydrophobicContact CE1-CD1 4.35Å; F128-L131 HydrophobicContact CG-CD1 4.23Å; F128-L131 WeakPolarHBondContact O-CB 3.5Å; F128-L131 PolarHBondContact O-N 3.02Å; F128-L136 HydrophobicContact CB-CD2 4.02Å; F128-L136 HydrophobicContact CG-CD2 4.48Å; F128-C139 HydrophobicContact CE1-CB 4.34Å; F128-C139 HydrophobicContact CE2-CB 4.25Å; F128-C139 HydrophobicContact CZ-CB 3.97Å; F128-W146 HydrophobicContact CE1-CD2 4.47Å; F128-W146 HydrophobicContact CE1-CE3 4.25Å; F128-W146 HydrophobicContact CE1-CH2 4.5Å; F128-W146 HydrophobicContact CE1-CZ3 4.25Å; F128-W146 AromaticContact CZ-CD2 3.79Å; F128-W146 HydrophobicContact CZ-CD2 3.79Å; F128-W146 AromaticContact CZ-CE3 3.79Å; F128-W146 HydrophobicContact CZ-CE3 3.79Å; F128-W146 HydrophobicContact CZ-CG 4.13Å; F128-W146 HydrophobicContact CZ-CZ3 4.26Å; F128-L149 HydrophobicContact CD2-CB 4.25Å; F128-L149 HydrophobicContact CE2-CB 3.84Å; F128-A150 HydrophobicContact CD2-CB 4.26Å; F128-A150 HydrophobicContact CE2-CB 4.03Å; F128-L155 HydrophobicContact CB-CD1 3.77Å; F128-L155 HydrophobicContact CB-CD2 3.93Å; F128-L155 HydrophobicContact CD2-CD1 4.05Å; F128-L155 HydrophobicContact CG-CD1 4.46Å
129	S	95.6	Very high	95	Very high	66 Å²	66	63.2 Å²	63.2	46%	0.462	32%	0.324	S	S	.	.	H	α-helix	trans	-64.2	-20.6	178.6	79.7	0	0	0	0	113.7	L125 Q126 I127	L125-S129 PolarHBondContact O-N 2.82Å; Q126-S129 PolarHBondContact O-N 3.14Å; Q126-S129 PolarHBondContact O-OG 3.29Å; I127-S129 VanDerWaalsContact C-N 3.31Å; I127-S129 PolarHBondContact O-N 3Å
130	H	95.9	Very high	95.2	Very high	156 Å²	156	61.1 Å²	61.1	72%	0.722	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-5.1	173	-62.4	-62.7	0	0	0	114.1	Q126 I127 F128	Q126-H130 PolarHBondContact O-CD2 3.36Å; I127-H130 PolarHBondContact O-N 3.36Å; F128-H130 PolarHBondContact O-N 3.36Å
131	L	95.3	Very high	95.3	Very high	43 Å²	43	68.1 Å²	68.1	23%	0.225	33%	0.333	C	S	.	.	S	Bend	trans	-91.1	132.2	-175.9	-56.5	-179.5	0	0	0	111.4	F128 Q135 L136	F128-L131 HydrophobicContact CB-CD1 4.39Å; F128-L131 HydrophobicContact CD1-CD1 3.7Å; F128-L131 HydrophobicContact CE1-CD1 4.35Å; F128-L131 HydrophobicContact CG-CD1 4.23Å; F128-L131 WeakPolarHBondContact O-CB 3.5Å; F128-L131 PolarHBondContact O-N 3.02Å; L131-Q135 HydrophobicContact CB-CB 4.11Å; L131-L136 HydrophobicContact CB-CD2 4.08Å; L131-L136 HydrophobicContact CB-CG 4.24Å; L131-L136 HydrophobicContact CD1-CD2 4.49Å
132	P	93.8	Very high	95.3	Very high	52 Å²	52	68.8 Å²	68.8	34%	0.338	34%	0.34	S	S	.	.			trans	-66.5	159	172.6	27.5	-34.6	0	0	0	112.1	N134 Q135 L136	P132-N134 WeakPolarHBondContact CG-OD1 3.37Å; P132-N134 PolarHBondContact O-N 3.49Å; P132-Q135 HydrophobicContact CG-CB 4.15Å; P132-Q135 HydrophobicContact CG-CG 3.88Å; P132-Q135 WeakPolarHBondContact O-CA 3.3Å; P132-Q135 WeakPolarHBondContact O-CB 3.25Å; P132-Q135 PolarHBondContact O-N 2.88Å; P132-L136 PolarHBondContact O-N 3.42Å
133	T	94.4	Very high	95.3	Very high	5 Å²	5	65.3 Å²	65.3	3%	0.031	33%	0.33	C	S	.	.	H	α-helix	trans	-45.5	-40.5	-178.7	-43.9	0	0	0	0	114.1	Q135 C137 W156 T158 I159 R160 L175	T133-Q135 PolarHBondContact O-N 3.37Å; T133-C137 WeakPolarHBondContact O-CB 3.33Å; T133-C137 PolarHBondContact O-N 3.26Å; T133-C137 VanDerWaalsContact O-N 3.08Å; T133-C137 PolarHBondContact O-SG 3.02Å; T133-C137 VanDerWaalsContact O-SG 3.4Å; T133-W156 HydrophobicContact CG2-CE3 4.32Å; T133-W156 HydrophobicContact CG2-CH2 4.18Å; T133-W156 HydrophobicContact CG2-CZ3 3.53Å; T133-T158 PolarHBondContact OG1-O 3.43Å; T133-I159 HydrophobicContact CG2-CG1 4.45Å; T133-I159 HydrophobicContact CG2-CG2 4.31Å; T133-R160 PolarHBondContact OG1-N 2.89Å; T133-L175 HydrophobicContact CG2-CD1 4.06Å
134	N	93.3	Very high	95.3	Very high	95 Å²	95	74.1 Å²	74.1	51%	0.508	36%	0.358	S	S	.	.	H	α-helix	trans	-73.6	-22.2	178.4	69.6	-19.6	0	0	0	114.1	P132 R138	P132-N134 WeakPolarHBondContact CG-OD1 3.37Å; P132-N134 PolarHBondContact O-N 3.49Å; N134-R138 WeakPolarHBondContact O-CG 3.39Å
135	Q	95.3	Very high	95.3	Very high	83 Å²	83	77.7 Å²	77.7	39%	0.388	37%	0.372	S	S	.	.	H	α-helix	trans	-86.7	-36.9	173.1	-68.6	-177	18	0	0	111.3	L131 P132 T133 C137 R138 C139	L131-Q135 HydrophobicContact CB-CB 4.11Å; P132-Q135 HydrophobicContact CG-CB 4.15Å; P132-Q135 HydrophobicContact CG-CG 3.88Å; P132-Q135 WeakPolarHBondContact O-CA 3.3Å; P132-Q135 WeakPolarHBondContact O-CB 3.25Å; P132-Q135 PolarHBondContact O-N 2.88Å; T133-Q135 PolarHBondContact O-N 3.37Å; Q135-C137 VanDerWaalsContact C-N 3.34Å; Q135-C137 PolarHBondContact O-N 2.81Å; Q135-R138 CarbonylContact O-C 3.57Å; Q135-R138 WeakPolarHBondContact O-CA 3.32Å; Q135-R138 WeakPolarHBondContact O-CB 3.11Å; Q135-R138 PolarHBondContact O-N 3.33Å; Q135-C139 PolarHBondContact O-N 2.9Å
136	L	96.5	Very high	95.3	Very high	3 Å²	3	78.2 Å²	78.2	2%	0.016	37%	0.372	C	S	.	.	H	α-helix	trans	-55.9	-47.6	168.3	-68.2	174.8	0	0	0	111.4	F128 L131 P132 R138 C139 A140 L155 W156	F128-L136 HydrophobicContact CB-CD2 4.02Å; F128-L136 HydrophobicContact CG-CD2 4.48Å; L131-L136 HydrophobicContact CB-CD2 4.08Å; L131-L136 HydrophobicContact CB-CG 4.24Å; L131-L136 HydrophobicContact CD1-CD2 4.49Å; P132-L136 PolarHBondContact O-N 3.42Å; L136-R138 PolarHBondContact O-N 2.79Å; L136-R138 VanDerWaalsContact O-N 3.13Å; L136-C139 PolarHBondContact O-N 3.32Å; L136-C139 VanDerWaalsContact O-N 3.12Å; L136-A140 PolarHBondContact O-N 3.46Å; L136-L155 HydrophobicContact CD1-CB 4.15Å; L136-L155 HydrophobicContact CD2-CB 4.49Å; L136-L155 HydrophobicContact CD2-CD1 4.05Å; L136-W156 HydrophobicContact CB-CH2 4.15Å; L136-W156 HydrophobicContact CB-CZ2 3.79Å; L136-W156 HydrophobicContact CD1-CZ2 4.17Å
137	C	94.9	Very high	95.2	Very high	47 Å²	47	76.2 Å²	76.2	32%	0.318	36%	0.36	S	S	.	.	H	α-helix	trans	-59.2	-20.6	171.8	-76.9	0	0	0	0	114.7	T133 Q135	T133-C137 WeakPolarHBondContact O-CB 3.33Å; T133-C137 PolarHBondContact O-N 3.26Å; T133-C137 VanDerWaalsContact O-N 3.08Å; T133-C137 PolarHBondContact O-SG 3.02Å; T133-C137 VanDerWaalsContact O-SG 3.4Å; Q135-C137 VanDerWaalsContact C-N 3.34Å; Q135-C137 PolarHBondContact O-N 2.81Å
138	R	96.1	Very high	95.1	Very high	169 Å²	169	78.3 Å²	78.3	64%	0.638	37%	0.372	S	S	*	.	H	α-helix	trans	-86.7	-42.5	172.2	-71.1	170.1	-178.3	-163.3	-0.1	111.1	N134 Q135 L136 A140 R141	N134-R138 WeakPolarHBondContact O-CG 3.39Å; Q135-R138 CarbonylContact O-C 3.57Å; Q135-R138 WeakPolarHBondContact O-CA 3.32Å; Q135-R138 WeakPolarHBondContact O-CB 3.11Å; Q135-R138 PolarHBondContact O-N 3.33Å; L136-R138 PolarHBondContact O-N 2.79Å; L136-R138 VanDerWaalsContact O-N 3.13Å; R138-A140 VanDerWaalsContact C-N 3.27Å; R138-A140 PolarHBondContact O-N 3.27Å; R138-R141 WeakPolarHBondContact O-CB 3.44Å; R138-R141 PolarHBondContact O-N 3.37Å
139	C	95.9	Very high	95.1	Very high	14 Å²	14	78.9 Å²	78.9	10%	0.095	38%	0.375	C	S	.	.	H	α-helix	trans	-57.2	-41.7	174.9	-70.9	0	0	0	0	111.6	F128 Q135 L136 R141 V142 W146 A150	F128-C139 HydrophobicContact CE1-CB 4.34Å; F128-C139 HydrophobicContact CE2-CB 4.25Å; F128-C139 HydrophobicContact CZ-CB 3.97Å; Q135-C139 PolarHBondContact O-N 2.9Å; L136-C139 PolarHBondContact O-N 3.32Å; L136-C139 VanDerWaalsContact O-N 3.12Å; C139-R141 PolarHBondContact O-N 3.39Å; C139-V142 WeakPolarHBondContact O-CB 3.39Å; C139-V142 PolarHBondContact O-N 3.33Å; C139-W146 HydrophobicContact CB-CE3 3.78Å; C139-W146 HydrophobicContact CB-CZ3 4.19Å; C139-W146 WeakPolarHBondContact O-CB 3.26Å; C139-A150 HydrophobicContact CB-CB 4.11Å
140	A	95.8	Very high	95.1	Very high	13 Å²	13	75.7 Å²	75.7	11%	0.107	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-15.5	175.9	0	0	0	0	0	114.4	L136 R138 Y147 A150	L136-A140 PolarHBondContact O-N 3.46Å; R138-A140 VanDerWaalsContact C-N 3.27Å; R138-A140 PolarHBondContact O-N 3.27Å; A140-Y147 HydrophobicContact CB-CD2 4.35Å; A140-Y147 WeakPolarHBondContact O-CD2 3.37Å; A140-A150 HydrophobicContact CB-CB 3.95Å
141	R	96.3	Very high	95	Very high	212 Å²	212	70.6 Å²	70.6	80%	0.8	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	0.1	178.9	-63	174.7	59.6	-170.8	-3.3	114.1	R138 C139	R138-R141 WeakPolarHBondContact O-CB 3.44Å; R138-R141 PolarHBondContact O-N 3.37Å; C139-R141 PolarHBondContact O-N 3.39Å
142	V	95.1	Very high	94.9	Very high	89 Å²	89	69.9 Å²	69.9	54%	0.539	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-54.3	-173.6	176.1	0	0	0	0	112.5	C139 W146	C139-V142 WeakPolarHBondContact O-CB 3.39Å; C139-V142 PolarHBondContact O-N 3.33Å; V142-W146 HydrophobicContact CB-CB 4.22Å; V142-W146 HydrophobicContact CB-CD2 4Å; V142-W146 HydrophobicContact CB-CE3 3.67Å; V142-W146 HydrophobicContact CB-CG 4.28Å; V142-W146 HydrophobicContact CB-CZ3 4.36Å; V142-W146 HydrophobicContact CG1-CD2 4Å; V142-W146 HydrophobicContact CG1-CE3 3.94Å; V142-W146 HydrophobicContact CG1-CG 4.39Å; V142-W146 HydrophobicContact CG1-CZ3 4.39Å; V142-W146 HydrophobicContact CG2-CD2 4.44Å; V142-W146 HydrophobicContact CG2-CE3 3.62Å; V142-W146 HydrophobicContact CG2-CZ3 3.93Å
143	C	93.6	Very high	94.7	Very high	56 Å²	56	69.8 Å²	69.8	38%	0.378	32%	0.323	S	S	.	.			trans	-159.9	169.9	178	75.1	0	0	0	0	110.9	R145 W146 Y147	C143-R145 VanDerWaalsContact C-N 3.32Å; C143-R145 PolarHBondContact O-N 3.26Å; C143-W146 CarbonylContact O-C 3.58Å; C143-W146 PolarHBondContact O-N 2.92Å; C143-W146 VanDerWaalsContact O-N 3.14Å; C143-W146 VanDerWaalsContact SG-CD1 3.5Å; C143-W146 PolarHBondContact SG-N 3.43Å; C143-W146 VanDerWaalsContact SG-N 3.44Å; C143-Y147 PolarHBondContact O-N 3.08Å
144	R	94.4	Very high	94.6	Very high	226 Å²	226	78.1 Å²	78.1	85%	0.853	35%	0.354	S	S	*	.	H	α-helix	trans	-56.4	-40.6	-179.6	-70.2	-175.8	179.4	174.3	-0.5	113.6	Y147 N148	R144-Y147 WeakPolarHBondContact O-CB 3.35Å; R144-Y147 PolarHBondContact O-N 2.96Å; R144-N148 PolarHBondContact O-N 2.99Å; R144-N148 VanDerWaalsContact O-N 3.09Å; R144-N148 PolarHBondContact O-OD1 3.39Å
145	R	94.8	Very high	94.7	Very high	76 Å²	76	74.5 Å²	74.5	29%	0.287	33%	0.334	S	S	.	.	H	α-helix	trans	-63.6	-45.9	176.7	-176.9	177.8	176.1	-152.6	-1.8	111.2	N117 L119 D121 C143 Y147 N148 L149	N117-R145 PolarHBondContact O-NH1 2.85Å; L119-R145 PolarHBondContact O-NH2 2.81Å; D121-R145 IonicContact OD1-CZ 3.14Å; D121-R145 IonicContact OD1-NE 2.76Å; D121-R145 PolarHBondContact OD1-NE 3.12Å; D121-R145 IonicContact OD1-NH2 2.67Å; D121-R145 PolarHBondContact OD1-NH2 3.13Å; C143-R145 VanDerWaalsContact C-N 3.32Å; C143-R145 PolarHBondContact O-N 3.26Å; R145-Y147 VanDerWaalsContact C-N 3.35Å; R145-N148 PolarHBondContact O-N 2.68Å; R145-L149 HydrophobicContact CG-CD1 3.97Å; R145-L149 VanDerWaalsContact O-CG 3.3Å; R145-L149 WeakPolarHBondContact O-CG 3.37Å; R145-L149 PolarHBondContact O-N 3.46Å
146	W	95.8	Very high	94.6	Very high	33 Å²	33	70.6 Å²	70.6	13%	0.125	32%	0.316	C	S	.	.	H	α-helix	trans	-69.1	-30.5	177.4	-76.2	38.5	0	0	0	112.9	I116 F128 C139 V142 C143 A150	I116-W146 HydrophobicContact CD1-CH2 3.81Å; I116-W146 HydrophobicContact CD1-CZ2 3.61Å; I116-W146 HydrophobicContact CG1-CZ2 3.94Å; I116-W146 HydrophobicContact CG2-CZ2 4.3Å; F128-W146 HydrophobicContact CE1-CD2 4.47Å; F128-W146 HydrophobicContact CE1-CE3 4.25Å; F128-W146 HydrophobicContact CE1-CH2 4.5Å; F128-W146 HydrophobicContact CE1-CZ3 4.25Å; F128-W146 AromaticContact CZ-CD2 3.79Å; F128-W146 HydrophobicContact CZ-CD2 3.79Å; F128-W146 AromaticContact CZ-CE3 3.79Å; F128-W146 HydrophobicContact CZ-CE3 3.79Å; F128-W146 HydrophobicContact CZ-CG 4.13Å; F128-W146 HydrophobicContact CZ-CZ3 4.26Å; C139-W146 HydrophobicContact CB-CE3 3.78Å; C139-W146 HydrophobicContact CB-CZ3 4.19Å; C139-W146 WeakPolarHBondContact O-CB 3.26Å; V142-W146 HydrophobicContact CB-CB 4.22Å; V142-W146 HydrophobicContact CB-CD2 4Å; V142-W146 HydrophobicContact CB-CE3 3.67Å; V142-W146 HydrophobicContact CB-CG 4.28Å; V142-W146 HydrophobicContact CB-CZ3 4.36Å; V142-W146 HydrophobicContact CG1-CD2 4Å; V142-W146 HydrophobicContact CG1-CE3 3.94Å; V142-W146 HydrophobicContact CG1-CG 4.39Å; V142-W146 HydrophobicContact CG1-CZ3 4.39Å; V142-W146 HydrophobicContact CG2-CD2 4.44Å; V142-W146 HydrophobicContact CG2-CE3 3.62Å; V142-W146 HydrophobicContact CG2-CZ3 3.93Å; C143-W146 CarbonylContact O-C 3.58Å; C143-W146 PolarHBondContact O-N 2.92Å; C143-W146 VanDerWaalsContact O-N 3.14Å; C143-W146 VanDerWaalsContact SG-CD1 3.5Å; C143-W146 PolarHBondContact SG-N 3.43Å; C143-W146 VanDerWaalsContact SG-N 3.44Å; W146-A150 WeakPolarHBondContact O-CB 3.39Å; W146-A150 PolarHBondContact O-N 3.44Å
147	Y	95	Very high	94.6	Very high	88 Å²	88	72.6 Å²	72.6	35%	0.345	33%	0.33	S	S	.	.	H	α-helix	trans	-59.4	-53.9	169.7	-179.8	-83.8	0	0	0	110.7	A140 C143 R144 R145 L149 A150 W151	A140-Y147 HydrophobicContact CB-CD2 4.35Å; A140-Y147 WeakPolarHBondContact O-CD2 3.37Å; C143-Y147 PolarHBondContact O-N 3.08Å; R144-Y147 WeakPolarHBondContact O-CB 3.35Å; R144-Y147 PolarHBondContact O-N 2.96Å; R145-Y147 VanDerWaalsContact C-N 3.35Å; Y147-L149 PolarHBondContact O-N 2.84Å; Y147-A150 PolarHBondContact O-N 3.41Å; Y147-W151 AromaticContact CD2-NE1 4Å; Y147-W151 AromaticContact CE1-CD1 3.86Å; Y147-W151 AromaticContact CE2-CD1 3.83Å; Y147-W151 AromaticContact CE2-NE1 3.56Å; Y147-W151 AromaticContact CZ-CD1 3.7Å; Y147-W151 AromaticContact CZ-NE1 3.76Å; Y147-W151 VanDerWaalsContact O-CD1 3.22Å; Y147-W151 PolarHBondContact O-N 2.95Å
148	N	93.8	Very high	94.7	Very high	115 Å²	115	72.2 Å²	72.2	62%	0.615	33%	0.326	S	S	*	.	H	α-helix	trans	-60.7	-46.9	-179.8	-66.9	10.3	0	0	0	111.5	R144 R145 W151	R144-N148 PolarHBondContact O-N 2.99Å; R144-N148 VanDerWaalsContact O-N 3.09Å; R144-N148 PolarHBondContact O-OD1 3.39Å; R145-N148 PolarHBondContact O-N 2.68Å; N148-W151 PolarHBondContact O-N 3.07Å
149	L	95.4	Very high	94.7	Very high	15 Å²	15	64.3 Å²	64.3	8%	0.079	30%	0.297	C	S	.	.	H	α-helix	trans	-68.7	-37.1	-178.9	-65.2	173.5	0	0	0	113.1	D121 L124 L125 F128 R145 Y147 W151 D152 L155	D121-L149 HydrophobicContact CB-CD1 4.45Å; D121-L149 HydrophobicContact CB-CD2 3.79Å; L124-L149 HydrophobicContact CB-CD1 3.96Å; L124-L149 HydrophobicContact CD1-CD1 3.72Å; L125-L149 HydrophobicContact CD1-CD2 4.31Å; L125-L149 HydrophobicContact CD2-CB 4.15Å; L125-L149 HydrophobicContact CD2-CD2 4.12Å; L125-L149 VanDerWaalsContact CD2-O 3.32Å; L125-L149 WeakPolarHBondContact CD2-O 3.41Å; L125-L149 HydrophobicContact CG-CD2 4.07Å; F128-L149 HydrophobicContact CD2-CB 4.25Å; F128-L149 HydrophobicContact CE2-CB 3.84Å; R145-L149 HydrophobicContact CG-CD1 3.97Å; R145-L149 VanDerWaalsContact O-CG 3.3Å; R145-L149 WeakPolarHBondContact O-CG 3.37Å; R145-L149 PolarHBondContact O-N 3.46Å; Y147-L149 PolarHBondContact O-N 2.84Å; L149-W151 PolarHBondContact O-N 2.95Å; L149-D152 WeakPolarHBondContact O-CB 3.36Å; L149-D152 PolarHBondContact O-N 3.18Å; L149-L155 WeakPolarHBondContact O-CD1 3.38Å
150	A	96.2	Very high	94.7	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-73	-12.4	179.9	0	0	0	0	0	113.4	F128 C139 A140 W146 Y147 W156	F128-A150 HydrophobicContact CD2-CB 4.26Å; F128-A150 HydrophobicContact CE2-CB 4.03Å; C139-A150 HydrophobicContact CB-CB 4.11Å; A140-A150 HydrophobicContact CB-CB 3.95Å; W146-A150 WeakPolarHBondContact O-CB 3.39Å; W146-A150 PolarHBondContact O-N 3.44Å; Y147-A150 PolarHBondContact O-N 3.41Å; A150-W156 PolarHBondContact O-NE1 2.63Å
151	W	93.8	Very high	94.7	Very high	48 Å²	48	70.4 Å²	70.4	18%	0.182	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	8.7	172.9	-72.2	115.8	0	0	0	113.8	Y147 N148 L149 P153 W156 L175 R178 L179	Y147-W151 AromaticContact CD2-NE1 4Å; Y147-W151 AromaticContact CE1-CD1 3.86Å; Y147-W151 AromaticContact CE2-CD1 3.83Å; Y147-W151 AromaticContact CE2-NE1 3.56Å; Y147-W151 AromaticContact CZ-CD1 3.7Å; Y147-W151 AromaticContact CZ-NE1 3.76Å; Y147-W151 VanDerWaalsContact O-CD1 3.22Å; Y147-W151 PolarHBondContact O-N 2.95Å; N148-W151 PolarHBondContact O-N 3.07Å; L149-W151 PolarHBondContact O-N 2.95Å; W151-P153 WeakPolarHBondContact O-CD 3.48Å; W151-W156 HydrophobicContact CD2-CZ2 4.36Å; W151-W156 HydrophobicContact CE3-CD2 4.46Å; W151-W156 AromaticContact CE3-CE2 3.73Å; W151-W156 HydrophobicContact CE3-CH2 4.38Å; W151-W156 AromaticContact CE3-CZ2 3.7Å; W151-W156 HydrophobicContact CE3-CZ2 3.7Å; W151-W156 AromaticContact CE3-NE1 3.85Å; W151-W156 AromaticContact CH2-CH2 3.88Å; W151-W156 HydrophobicContact CH2-CH2 3.88Å; W151-W156 AromaticContact CH2-CZ2 3.94Å; W151-W156 HydrophobicContact CH2-CZ2 3.94Å; W151-W156 HydrophobicContact CZ3-CD2 4.27Å; W151-W156 AromaticContact CZ3-CE2 3.75Å; W151-W156 HydrophobicContact CZ3-CE3 4.42Å; W151-W156 AromaticContact CZ3-CH2 3.67Å; W151-W156 HydrophobicContact CZ3-CH2 3.67Å; W151-W156 AromaticContact CZ3-CZ2 3.46Å; W151-W156 HydrophobicContact CZ3-CZ2 3.46Å; W151-W156 VanDerWaalsContact CZ3-CZ2 3.46Å; W151-W156 HydrophobicContact CZ3-CZ3 4.14Å; W151-L175 HydrophobicContact CH2-CD2 3.71Å; W151-L175 HydrophobicContact CZ3-CD2 4.14Å; W151-R178 HydrophobicContact CD2-CB 4.47Å; W151-R178 HydrophobicContact CE3-CB 3.95Å; W151-R178 HydrophobicContact CH2-CB 3.87Å; W151-R178 HydrophobicContact CH2-CG 4.01Å; W151-R178 HydrophobicContact CZ2-CB 4.38Å; W151-R178 HydrophobicContact CZ2-CG 4.17Å; W151-R178 HydrophobicContact CZ3-CB 3.63Å; W151-R178 HydrophobicContact CZ3-CG 4.28Å; W151-L179 HydrophobicContact CE3-CD2 4.3Å; W151-L179 HydrophobicContact CZ3-CD2 4.46Å
152	D	92.7	Very high	94.3	Very high	29 Å²	29	65 Å²	65	16%	0.155	31%	0.307	C	S	.	.			trans	-56.8	120.7	171.6	-174.6	-60.3	0	0	0	110.2	L125 L149 R154 L155	L125-D152 WeakPolarHBondContact CD1-OD2 3.42Å; L125-D152 HydrophobicContact CD2-CB 3.63Å; L149-D152 WeakPolarHBondContact O-CB 3.36Å; L149-D152 PolarHBondContact O-N 3.18Å; D152-R154 PolarHBondContact O-N 3.05Å; D152-R154 VanDerWaalsContact OD1-CB 3.26Å; D152-R154 WeakPolarHBondContact OD1-CB 3.5Å; D152-R154 WeakPolarHBondContact OD1-CG 3.43Å; D152-R154 IonicContact OD1-CZ 3.69Å; D152-R154 PolarHBondContact OD1-N 2.78Å; D152-R154 IonicContact OD1-NE 2.84Å; D152-R154 PolarHBondContact OD1-NE 3.4Å; D152-R154 IonicContact OD1-NH2 3.69Å; D152-R154 IonicContact OD2-CZ 3.44Å; D152-R154 IonicContact OD2-NE 3.39Å; D152-R154 PolarHBondContact OD2-NE 2.94Å; D152-R154 IonicContact OD2-NH2 2.68Å; D152-R154 PolarHBondContact OD2-NH2 3.25Å; D152-L155 HydrophobicContact CB-CD1 4.21Å; D152-L155 HydrophobicContact CB-CG 4.26Å; D152-L155 WeakPolarHBondContact O-CB 3.43Å; D152-L155 PolarHBondContact O-N 3.07Å
153	P	90.1	Very high	93.8	Very high	50 Å²	50	62.3 Å²	62.3	33%	0.325	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-56.5	-21.9	-171.3	-30.1	36.7	0	0	0	115.3	W151 L155 W156 T189	W151-P153 WeakPolarHBondContact O-CD 3.48Å; P153-L155 VanDerWaalsContact C-N 3.26Å; P153-L155 PolarHBondContact O-N 3.35Å; P153-W156 PolarHBondContact O-N 3.49Å; P153-T189 HydrophobicContact CB-CG2 3.8Å; P153-T189 WeakPolarHBondContact O-CB 3.39Å; P153-T189 PolarHBondContact O-OG1 2.78Å; P153-T189 VanDerWaalsContact O-OG1 3.07Å
154	R	91.5	Very high	93.5	Very high	179 Å²	179	64.6 Å²	64.6	68%	0.675	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-69.5	-21.9	177.9	-60.3	172.8	-74	-172.2	-6.1	113.2	D152 W156	D152-R154 PolarHBondContact O-N 3.05Å; D152-R154 VanDerWaalsContact OD1-CB 3.26Å; D152-R154 WeakPolarHBondContact OD1-CB 3.5Å; D152-R154 WeakPolarHBondContact OD1-CG 3.43Å; D152-R154 IonicContact OD1-CZ 3.69Å; D152-R154 PolarHBondContact OD1-N 2.78Å; D152-R154 IonicContact OD1-NE 2.84Å; D152-R154 PolarHBondContact OD1-NE 3.4Å; D152-R154 IonicContact OD1-NH2 3.69Å; D152-R154 IonicContact OD2-CZ 3.44Å; D152-R154 IonicContact OD2-NE 3.39Å; D152-R154 PolarHBondContact OD2-NE 2.94Å; D152-R154 IonicContact OD2-NH2 2.68Å; D152-R154 PolarHBondContact OD2-NH2 3.25Å; R154-W156 VanDerWaalsContact C-N 3.29Å
155	L	95.2	Very high	93.2	Very high	20 Å²	20	60.3 Å²	60.3	11%	0.105	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-79.3	-12.8	176.1	-58	178.1	0	0	0	113	L125 F128 L136 L149 D152 P153	L125-L155 HydrophobicContact CD2-CD1 3.95Å; L125-L155 HydrophobicContact CD2-CG 4.35Å; F128-L155 HydrophobicContact CB-CD1 3.77Å; F128-L155 HydrophobicContact CB-CD2 3.93Å; F128-L155 HydrophobicContact CD2-CD1 4.05Å; F128-L155 HydrophobicContact CG-CD1 4.46Å; L136-L155 HydrophobicContact CD1-CB 4.15Å; L136-L155 HydrophobicContact CD2-CB 4.49Å; L136-L155 HydrophobicContact CD2-CD1 4.05Å; L149-L155 WeakPolarHBondContact O-CD1 3.38Å; D152-L155 HydrophobicContact CB-CD1 4.21Å; D152-L155 HydrophobicContact CB-CG 4.26Å; D152-L155 WeakPolarHBondContact O-CB 3.43Å; D152-L155 PolarHBondContact O-N 3.07Å; P153-L155 VanDerWaalsContact C-N 3.26Å; P153-L155 PolarHBondContact O-N 3.35Å
156	W	94.8	Very high	93	Very high	1 Å²	1	59.5 Å²	59.5	0%	0.004	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-111.7	21.6	-167.9	-66	88.8	0	0	0	114	T133 L136 A150 W151 P153 R154 T158 I159 L175 L179 L190	T133-W156 HydrophobicContact CG2-CE3 4.32Å; T133-W156 HydrophobicContact CG2-CH2 4.18Å; T133-W156 HydrophobicContact CG2-CZ3 3.53Å; L136-W156 HydrophobicContact CB-CH2 4.15Å; L136-W156 HydrophobicContact CB-CZ2 3.79Å; L136-W156 HydrophobicContact CD1-CZ2 4.17Å; A150-W156 PolarHBondContact O-NE1 2.63Å; W151-W156 HydrophobicContact CD2-CZ2 4.36Å; W151-W156 HydrophobicContact CE3-CD2 4.46Å; W151-W156 AromaticContact CE3-CE2 3.73Å; W151-W156 HydrophobicContact CE3-CH2 4.38Å; W151-W156 AromaticContact CE3-CZ2 3.7Å; W151-W156 HydrophobicContact CE3-CZ2 3.7Å; W151-W156 AromaticContact CE3-NE1 3.85Å; W151-W156 AromaticContact CH2-CH2 3.88Å; W151-W156 HydrophobicContact CH2-CH2 3.88Å; W151-W156 AromaticContact CH2-CZ2 3.94Å; W151-W156 HydrophobicContact CH2-CZ2 3.94Å; W151-W156 HydrophobicContact CZ3-CD2 4.27Å; W151-W156 AromaticContact CZ3-CE2 3.75Å; W151-W156 HydrophobicContact CZ3-CE3 4.42Å; W151-W156 AromaticContact CZ3-CH2 3.67Å; W151-W156 HydrophobicContact CZ3-CH2 3.67Å; W151-W156 AromaticContact CZ3-CZ2 3.46Å; W151-W156 HydrophobicContact CZ3-CZ2 3.46Å; W151-W156 VanDerWaalsContact CZ3-CZ2 3.46Å; W151-W156 HydrophobicContact CZ3-CZ3 4.14Å; P153-W156 PolarHBondContact O-N 3.49Å; R154-W156 VanDerWaalsContact C-N 3.29Å; W156-T158 PolarHBondContact O-N 3.24Å; W156-I159 HydrophobicContact CE3-CD1 4.4Å; W156-I159 HydrophobicContact CE3-CG1 4.03Å; W156-I159 HydrophobicContact CZ3-CG1 4.49Å; W156-L175 HydrophobicContact CH2-CD2 3.93Å; W156-L175 HydrophobicContact CZ3-CD1 4.11Å; W156-L175 HydrophobicContact CZ3-CD2 3.63Å; W156-L175 HydrophobicContact CZ3-CG 4.4Å; W156-L179 HydrophobicContact CB-CD1 3.77Å; W156-L179 HydrophobicContact CB-CD2 3.55Å; W156-L179 HydrophobicContact CB-CG 4.32Å; W156-L179 HydrophobicContact CD2-CD1 4.47Å; W156-L179 HydrophobicContact CD2-CD2 3.99Å; W156-L179 HydrophobicContact CE3-CD1 4.36Å; W156-L179 HydrophobicContact CG-CD1 4.25Å; W156-L179 HydrophobicContact CG-CD2 3.47Å; W156-L179 VanDerWaalsContact CG-CD2 3.47Å; W156-L179 HydrophobicContact CG-CG 4.47Å; W156-L190 VanDerWaalsContact O-CD1 3.31Å; W156-L190 WeakPolarHBondContact O-CD1 3.42Å
157	S	95.4	Very high	92.9	Very high	45 Å²	45	63.2 Å²	63.2	32%	0.315	32%	0.315	S	S	.	.	S	Bend	trans	-65.9	-16.3	170.5	62.8	0	0	0	0	114	T189 E191 T192	S157-T189 WeakPolarHBondContact CA-O 3.42Å; S157-T189 WeakPolarHBondContact CB-O 3.5Å; S157-E191 PolarHBondContact O-N 3.27Å; S157-T192 PolarHBondContact O-N 3.01Å
158	T	96.9	Very high	92.8	Very high	38 Å²	38	59 Å²	59	23%	0.233	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	117.2	174.6	-64.3	0	0	0	0	111.6	T133 W156 R160 T192	T133-T158 PolarHBondContact OG1-O 3.43Å; W156-T158 PolarHBondContact O-N 3.24Å; T158-R160 HydrophobicContact CG2-CG 3.88Å; T158-T192 CarbonylContact C-O 3.55Å; T158-T192 VanDerWaalsContact CA-O 3.32Å; T158-T192 WeakPolarHBondContact CA-O 3.46Å; T158-T192 HydrophobicContact CG2-CG2 4.07Å
159	I	96.8	Very high	92.9	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.015	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124	168.1	-73.3	176.4	0	0	0	109.4	T133 W156 L161 L175 L179 L190 T192 V193 V194	T133-I159 HydrophobicContact CG2-CG1 4.45Å; T133-I159 HydrophobicContact CG2-CG2 4.31Å; W156-I159 HydrophobicContact CE3-CD1 4.4Å; W156-I159 HydrophobicContact CE3-CG1 4.03Å; W156-I159 HydrophobicContact CZ3-CG1 4.49Å; I159-L161 HydrophobicContact CG2-CD1 3.84Å; I159-L161 HydrophobicContact CG2-CD2 4.48Å; I159-L161 HydrophobicContact CG2-CG 3.7Å; I159-L175 HydrophobicContact CD1-CB 3.97Å; I159-L175 HydrophobicContact CD1-CD1 3.87Å; I159-L175 HydrophobicContact CG1-CD1 4.22Å; I159-L175 HydrophobicContact CG2-CD1 3.84Å; I159-L179 HydrophobicContact CD1-CD1 4.08Å; I159-L190 HydrophobicContact CB-CD1 4.08Å; I159-L190 HydrophobicContact CD1-CD1 3.9Å; I159-L190 HydrophobicContact CD1-CD2 3.62Å; I159-L190 HydrophobicContact CD1-CG 4.44Å; I159-L190 HydrophobicContact CG1-CD1 3.76Å; I159-L190 HydrophobicContact CG1-CD2 4.41Å; I159-T192 PolarHBondContact N-O 3.26Å; I159-V193 HydrophobicContact CB-CG2 4.45Å; I159-V193 WeakPolarHBondContact O-CA 3.33Å; I159-V194 PolarHBondContact O-N 3.34Å
160	R	96.1	Very high	93	Very high	138 Å²	138	62.1 Å²	62.1	52%	0.521	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	120.5	170.8	-58.8	-161.4	168.4	100.9	1.3	110.7	T133 T158 V194	T133-R160 PolarHBondContact OG1-N 2.89Å; T158-R160 HydrophobicContact CG2-CG 3.88Å; R160-V194 CarbonylContact C-O 3.37Å; R160-V194 WeakPolarHBondContact CA-O 3.23Å; R160-V194 HydrophobicContact CG-CB 4.15Å; R160-V194 HydrophobicContact CG-CG2 4.41Å
161	L	94.2	Very high	92.9	Very high	18 Å²	18	63.1 Å²	63.1	9%	0.094	31%	0.311	C	S	.	.			trans	-131.8	87.2	-176.2	-68.1	177.4	0	0	0	109	I159 L166 A171 I172 L175 V194 V195 C198	I159-L161 HydrophobicContact CG2-CD1 3.84Å; I159-L161 HydrophobicContact CG2-CD2 4.48Å; I159-L161 HydrophobicContact CG2-CG 3.7Å; L161-L166 HydrophobicContact CB-CD2 3.83Å; L161-L166 HydrophobicContact CD2-CD2 4.21Å; L161-A171 HydrophobicContact CD1-CB 3.91Å; L161-A171 HydrophobicContact CD2-CB 4.05Å; L161-I172 HydrophobicContact CD1-CG1 3.85Å; L161-L175 HydrophobicContact CD1-CD1 4.33Å; L161-L175 HydrophobicContact CD2-CD1 4.12Å; L161-V194 PolarHBondContact N-O 3.06Å; L161-V195 HydrophobicContact CB-CG1 4.07Å; L161-V195 CarbonylContact O-C 3.57Å; L161-V195 VanDerWaalsContact O-CA 3.28Å; L161-V195 WeakPolarHBondContact O-CA 3.26Å; L161-C198 PolarHBondContact O-SG 2.98Å
162	T	88.9	Confident	93	Very high	97 Å²	97	61 Å²	61	60%	0.595	30%	0.303	S	S	*	.			trans	-111.9	143.9	-177.8	53.7	0	0	0	0	112.1	N196	T162-N196 WeakPolarHBondContact CA-O 3.1Å; T162-N196 HydrophobicContact CG2-CB 4.44Å
163	G	84.5	Confident	93.1	Very high	33 Å²	33	65.4 Å²	65.4	34%	0.34	32%	0.318	S	S	.	.			trans	129.9	137.6	173.1	0	0	0	0	0	114.3	L165 L166 C198	G163-L165 PolarHBondContact O-N 3.19Å; G163-L166 VanDerWaalsContact O-CB 3.31Å; G163-L166 WeakPolarHBondContact O-CB 3.26Å; G163-L166 PolarHBondContact O-N 3.01Å; G163-C198 PolarHBondContact O-SG 2.63Å
164	E	86.4	Confident	93.3	Very high	105 Å²	105	66.6 Å²	66.6	49%	0.491	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-36.9	-168.7	-51.2	-162.1	151.3	0	0	114.8	L166 G197 K199	E164-L166 VanDerWaalsContact C-N 3.33Å; E164-G197 WeakPolarHBondContact CA-O 3.46Å; E164-K199 HydrophobicContact CB-CD 4.1Å; E164-K199 HydrophobicContact CB-CG 4.15Å; E164-K199 HydrophobicContact CG-CD 4.32Å; E164-K199 HydrophobicContact CG-CG 4.46Å; E164-K199 WeakPolarHBondContact OE1-CE 3.4Å; E164-K199 IonicContact OE1-NZ 2.73Å; E164-K199 PolarHBondContact OE1-NZ 3.25Å; E164-K199 WeakPolarHBondContact OE2-CE 3.31Å; E164-K199 IonicContact OE2-NZ 2.7Å; E164-K199 PolarHBondContact OE2-NZ 2.89Å
165	L	88.2	Confident	93.4	Very high	135 Å²	135	58.6 Å²	58.6	71%	0.707	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-8.8	-176.3	-58.5	179.4	0	0	0	113	G163 H167 R200	G163-L165 PolarHBondContact O-N 3.19Å; L165-H167 PolarHBondContact O-N 3.19Å; L165-R200 PolarHBondContact O-NH1 3.23Å
166	L	90.6	Very high	93.3	Very high	59 Å²	59	57.9 Å²	57.9	31%	0.309	29%	0.291	S	S	.	.			trans	-65.7	128.5	-176.7	-177.5	61.3	0	0	0	110.9	L161 G163 E164 A168 R200	L161-L166 HydrophobicContact CB-CD2 3.83Å; L161-L166 HydrophobicContact CD2-CD2 4.21Å; G163-L166 VanDerWaalsContact O-CB 3.31Å; G163-L166 WeakPolarHBondContact O-CB 3.26Å; G163-L166 PolarHBondContact O-N 3.01Å; E164-L166 VanDerWaalsContact C-N 3.33Å; L166-A168 PolarHBondContact O-N 3.06Å; L166-R200 WeakPolarHBondContact O-CB 3.29Å
167	H	93.8	Very high	93.1	Very high	111 Å²	111	64.1 Å²	64.1	51%	0.514	32%	0.32	S	S	.	.			trans	-75.5	74.1	171.2	-68.7	-84.7	0	0	0	110.3	L165 D169 R170 A171 R200	L165-H167 PolarHBondContact O-N 3.19Å; H167-D169 PolarHBondContact O-N 2.84Å; H167-R170 HydrophobicContact CB-CB 4.1Å; H167-R170 WeakPolarHBondContact O-CB 3.42Å; H167-R170 PolarHBondContact O-N 3.43Å; H167-A171 PolarHBondContact O-N 3.16Å; H167-R200 PolarHBondContact CE1-NH1 3.42Å; H167-R200 PolarHBondContact NE2-NH1 2.95Å; H167-R200 VanDerWaalsContact NE2-NH1 3.14Å
168	A	94.6	Very high	92.9	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-52.6	-49.4	-173	0	0	0	0	0	113	L166 R170 A171 I172 V195 C198 L201	L166-A168 PolarHBondContact O-N 3.06Å; A168-R170 PolarHBondContact O-N 2.89Å; A168-R170 VanDerWaalsContact O-N 3.12Å; A168-A171 CarbonylContact O-C 3.6Å; A168-A171 WeakPolarHBondContact O-CA 3.44Å; A168-A171 WeakPolarHBondContact O-CB 3.32Å; A168-A171 PolarHBondContact O-N 3.19Å; A168-I172 WeakPolarHBondContact O-CB 3.14Å; A168-I172 WeakPolarHBondContact O-CG1 3.31Å; A168-I172 PolarHBondContact O-N 3.08Å; A168-V195 HydrophobicContact CB-CG1 3.79Å; A168-C198 HydrophobicContact CB-CB 3.91Å; A168-L201 HydrophobicContact CB-CB 3.83Å; A168-L201 HydrophobicContact CB-CD1 4Å; A168-L201 HydrophobicContact CB-CG 4.46Å
169	D	95.7	Very high	92.6	Very high	26 Å²	26	65.7 Å²	65.7	14%	0.139	32%	0.316	C	S	.	.	H	α-helix	trans	-53.2	-35.3	176	-62.4	11	0	0	0	113.6	H167 R173 L201 T202	H167-D169 PolarHBondContact O-N 2.84Å; D169-R173 VanDerWaalsContact O-CB 3.28Å; D169-R173 WeakPolarHBondContact O-CB 3.49Å; D169-R173 PolarHBondContact O-N 3.25Å; D169-R173 PolarHBondContact O-NH1 2.82Å; D169-L201 WeakPolarHBondContact OD1-CA 3.38Å; D169-L201 WeakPolarHBondContact OD1-CD1 3.45Å; D169-T202 PolarHBondContact OD1-N 2.79Å; D169-T202 PolarHBondContact OD2-OG1 3.41Å
170	R	95.9	Very high	92.2	Very high	169 Å²	169	66.2 Å²	66.2	64%	0.638	32%	0.32	S	S	*	.	H	α-helix	trans	-79.9	-37.8	177.6	-174.5	178.5	-179.7	176.6	1.8	111.3	H167 A168 V174	H167-R170 HydrophobicContact CB-CB 4.1Å; H167-R170 WeakPolarHBondContact O-CB 3.42Å; H167-R170 PolarHBondContact O-N 3.43Å; A168-R170 PolarHBondContact O-N 2.89Å; A168-R170 VanDerWaalsContact O-N 3.12Å; R170-V174 WeakPolarHBondContact O-CB 3.5Å; R170-V174 VanDerWaalsContact O-CG2 3.26Å; R170-V174 WeakPolarHBondContact O-CG2 3.43Å; R170-V174 PolarHBondContact O-N 2.96Å; R170-V174 VanDerWaalsContact O-N 3.08Å
171	A	95.1	Very high	91.7	Very high	22 Å²	22	64.7 Å²	64.7	18%	0.182	32%	0.318	C	S	.	.	H	α-helix	trans	-63.6	-53.6	175	0	0	0	0	0	110.4	L161 H167 A168 R173 V174 L175	L161-A171 HydrophobicContact CD1-CB 3.91Å; L161-A171 HydrophobicContact CD2-CB 4.05Å; H167-A171 PolarHBondContact O-N 3.16Å; A168-A171 CarbonylContact O-C 3.6Å; A168-A171 WeakPolarHBondContact O-CA 3.44Å; A168-A171 WeakPolarHBondContact O-CB 3.32Å; A168-A171 PolarHBondContact O-N 3.19Å; A171-R173 PolarHBondContact O-N 2.83Å; A171-V174 PolarHBondContact O-N 3.08Å; A171-V174 VanDerWaalsContact O-N 3.16Å; A171-L175 WeakPolarHBondContact O-CG 3.49Å; A171-L175 PolarHBondContact O-N 3.24Å
172	I	95.8	Very high	90.9	Very high	3 Å²	3	70.7 Å²	70.7	2%	0.015	35%	0.351	C	S	.	.	H	α-helix	trans	-49.4	-57.4	174.3	-68.9	167.6	0	0	0	110.2	L161 A168 V174 L175 T176 V195 L201 I208 L209	L161-I172 HydrophobicContact CD1-CG1 3.85Å; A168-I172 WeakPolarHBondContact O-CB 3.14Å; A168-I172 WeakPolarHBondContact O-CG1 3.31Å; A168-I172 PolarHBondContact O-N 3.08Å; I172-V174 VanDerWaalsContact C-N 3.29Å; I172-V174 PolarHBondContact O-N 2.99Å; I172-L175 PolarHBondContact O-N 2.99Å; I172-L175 VanDerWaalsContact O-N 3.08Å; I172-T176 HydrophobicContact CG2-CG2 4.26Å; I172-T176 PolarHBondContact O-N 3.43Å; I172-T176 PolarHBondContact O-OG1 3.17Å; I172-V195 HydrophobicContact CD1-CG2 4.49Å; I172-L201 HydrophobicContact CD1-CD1 3.66Å; I172-I208 HydrophobicContact CG2-CB 4.27Å; I172-I208 HydrophobicContact CG2-CG2 3.95Å; I172-L209 HydrophobicContact CD1-CD1 4.27Å; I172-L209 HydrophobicContact CG2-CD2 3.72Å; I172-L209 HydrophobicContact CG2-CG 3.83Å
173	R	94.8	Very high	90.5	Very high	122 Å²	122	68.6 Å²	68.6	46%	0.46	34%	0.338	S	S	.	.	H	α-helix	trans	-58.1	-36.8	-178.6	-171.6	171.5	68.4	-101.7	11.9	114.1	D169 A171 H177 I208	D169-R173 VanDerWaalsContact O-CB 3.28Å; D169-R173 WeakPolarHBondContact O-CB 3.49Å; D169-R173 PolarHBondContact O-N 3.25Å; D169-R173 PolarHBondContact O-NH1 2.82Å; A171-R173 PolarHBondContact O-N 2.83Å; R173-H177 WeakPolarHBondContact O-CB 3.49Å; R173-H177 PolarHBondContact O-N 3.42Å; R173-I208 HydrophobicContact CB-CD1 3.88Å; R173-I208 HydrophobicContact CG-CD1 4.04Å
174	V	94.2	Very high	90.2	Very high	75 Å²	75	72.5 Å²	72.5	46%	0.455	36%	0.357	S	S	.	.	H	α-helix	trans	-75.3	-35.7	178	170.6	0	0	0	0	111.2	R170 A171 I172 R178	R170-V174 WeakPolarHBondContact O-CB 3.5Å; R170-V174 VanDerWaalsContact O-CG2 3.26Å; R170-V174 WeakPolarHBondContact O-CG2 3.43Å; R170-V174 PolarHBondContact O-N 2.96Å; R170-V174 VanDerWaalsContact O-N 3.08Å; A171-V174 PolarHBondContact O-N 3.08Å; A171-V174 VanDerWaalsContact O-N 3.16Å; I172-V174 VanDerWaalsContact C-N 3.29Å; I172-V174 PolarHBondContact O-N 2.99Å; V174-R178 WeakPolarHBondContact O-CB 3.38Å; V174-R178 VanDerWaalsContact O-CG 3.23Å; V174-R178 WeakPolarHBondContact O-CG 3.18Å; V174-R178 PolarHBondContact O-N 3.2Å
175	L	94.3	Very high	89.8	Confident	10 Å²	10	73.7 Å²	73.7	5%	0.052	37%	0.367	C	S	.	.	H	α-helix	trans	-70.7	-51.6	176.2	-65.4	-176.2	0	0	0	111.4	T133 W151 W156 I159 L161 A171 I172 H177 R178 L179	T133-L175 HydrophobicContact CG2-CD1 4.06Å; W151-L175 HydrophobicContact CH2-CD2 3.71Å; W151-L175 HydrophobicContact CZ3-CD2 4.14Å; W156-L175 HydrophobicContact CH2-CD2 3.93Å; W156-L175 HydrophobicContact CZ3-CD1 4.11Å; W156-L175 HydrophobicContact CZ3-CD2 3.63Å; W156-L175 HydrophobicContact CZ3-CG 4.4Å; I159-L175 HydrophobicContact CD1-CB 3.97Å; I159-L175 HydrophobicContact CD1-CD1 3.87Å; I159-L175 HydrophobicContact CG1-CD1 4.22Å; I159-L175 HydrophobicContact CG2-CD1 3.84Å; L161-L175 HydrophobicContact CD1-CD1 4.33Å; L161-L175 HydrophobicContact CD2-CD1 4.12Å; A171-L175 WeakPolarHBondContact O-CG 3.49Å; A171-L175 PolarHBondContact O-N 3.24Å; I172-L175 PolarHBondContact O-N 2.99Å; I172-L175 VanDerWaalsContact O-N 3.08Å; L175-H177 PolarHBondContact O-N 3.35Å; L175-R178 PolarHBondContact O-N 2.91Å; L175-L179 WeakPolarHBondContact O-CG 3.32Å; L175-L179 PolarHBondContact O-N 3.21Å
176	T	92.1	Very high	89.8	Confident	5 Å²	5	69.7 Å²	69.7	3%	0.031	35%	0.348	C	S	.	.	H	α-helix	trans	-60.5	-45.4	179.2	57.2	0	0	0	0	111.4	I172 R178 L179 C180 I208 L209 C212	I172-T176 HydrophobicContact CG2-CG2 4.26Å; I172-T176 PolarHBondContact O-N 3.43Å; I172-T176 PolarHBondContact O-OG1 3.17Å; T176-R178 PolarHBondContact O-N 2.95Å; T176-L179 PolarHBondContact O-N 2.75Å; T176-C180 WeakPolarHBondContact O-CB 3.28Å; T176-C180 PolarHBondContact O-N 2.86Å; T176-C180 PolarHBondContact O-SG 3.14Å; T176-I208 HydrophobicContact CG2-CG2 4.32Å; T176-I208 WeakPolarHBondContact OG1-CG2 3.48Å; T176-L209 HydrophobicContact CG2-CD2 4.08Å; T176-C212 HydrophobicContact CG2-CB 4.35Å
177	H	91.5	Very high	89.6	Confident	133 Å²	133	67 Å²	67	62%	0.616	33%	0.334	S	S	*	.	H	α-helix	trans	-59.2	-30.7	174.5	-172.9	-33.1	0	0	0	112.9	R173 L175 Q181	R173-H177 WeakPolarHBondContact O-CB 3.49Å; R173-H177 PolarHBondContact O-N 3.42Å; L175-H177 PolarHBondContact O-N 3.35Å; H177-Q181 WeakPolarHBondContact O-CG 3.36Å
178	R	90.6	Very high	89.4	Confident	102 Å²	102	66.6 Å²	66.6	39%	0.385	34%	0.335	S	S	.	.	H	α-helix	trans	-75.7	-34.7	174.5	-73.8	-66.2	176.1	-153.7	-4.9	113	W151 V174 L175 T176 Q181	W151-R178 HydrophobicContact CD2-CB 4.47Å; W151-R178 HydrophobicContact CE3-CB 3.95Å; W151-R178 HydrophobicContact CH2-CB 3.87Å; W151-R178 HydrophobicContact CH2-CG 4.01Å; W151-R178 HydrophobicContact CZ2-CB 4.38Å; W151-R178 HydrophobicContact CZ2-CG 4.17Å; W151-R178 HydrophobicContact CZ3-CB 3.63Å; W151-R178 HydrophobicContact CZ3-CG 4.28Å; V174-R178 WeakPolarHBondContact O-CB 3.38Å; V174-R178 VanDerWaalsContact O-CG 3.23Å; V174-R178 WeakPolarHBondContact O-CG 3.18Å; V174-R178 PolarHBondContact O-N 3.2Å; L175-R178 PolarHBondContact O-N 2.91Å; T176-R178 PolarHBondContact O-N 2.95Å; R178-Q181 WeakPolarHBondContact O-CG 3.46Å
179	L	89.9	Confident	89.2	Confident	13 Å²	13	68.8 Å²	68.8	7%	0.068	35%	0.349	C	S	.	.	H	α-helix	trans	-80.8	-25.9	179	-59.1	173.8	0	0	0	113.1	W151 W156 I159 L175 T176 Q181 C187	W151-L179 HydrophobicContact CE3-CD2 4.3Å; W151-L179 HydrophobicContact CZ3-CD2 4.46Å; W156-L179 HydrophobicContact CB-CD1 3.77Å; W156-L179 HydrophobicContact CB-CD2 3.55Å; W156-L179 HydrophobicContact CB-CG 4.32Å; W156-L179 HydrophobicContact CD2-CD1 4.47Å; W156-L179 HydrophobicContact CD2-CD2 3.99Å; W156-L179 HydrophobicContact CE3-CD1 4.36Å; W156-L179 HydrophobicContact CG-CD1 4.25Å; W156-L179 HydrophobicContact CG-CD2 3.47Å; W156-L179 VanDerWaalsContact CG-CD2 3.47Å; W156-L179 HydrophobicContact CG-CG 4.47Å; I159-L179 HydrophobicContact CD1-CD1 4.08Å; L175-L179 WeakPolarHBondContact O-CG 3.32Å; L175-L179 PolarHBondContact O-N 3.21Å; T176-L179 PolarHBondContact O-N 2.75Å; L179-Q181 VanDerWaalsContact C-N 3.28Å; L179-Q181 PolarHBondContact O-N 3.43Å; L179-C187 HydrophobicContact CB-CB 4.28Å; L179-C187 VanDerWaalsContact CB-SG 3.57Å
180	C	89.7	Confident	89.2	Confident	15 Å²	15	67.6 Å²	67.6	10%	0.101	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	24	172.6	-52.2	0	0	0	0	113	T176 T183 N185 C187	T176-C180 WeakPolarHBondContact O-CB 3.28Å; T176-C180 PolarHBondContact O-N 2.86Å; T176-C180 PolarHBondContact O-SG 3.14Å; C180-T183 CarbonylContact C-O 3.49Å; C180-T183 WeakPolarHBondContact CA-O 3.37Å; C180-T183 WeakPolarHBondContact CB-O 3.48Å; C180-T183 VanDerWaalsContact O-O 3.06Å; C180-N185 VanDerWaalsContact SG-C 3.59Å; C180-C187 PolarHBondContact SG-N 3.2Å; C180-C187 VanDerWaalsContact SG-N 3.43Å
181	Q	84.4	Confident	89.2	Confident	105 Å²	105	63.3 Å²	63.3	49%	0.491	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-38.7	179.6	-82.5	-160.7	-119.6	0	0	113.2	H177 R178 L179	H177-Q181 WeakPolarHBondContact O-CG 3.36Å; R178-Q181 WeakPolarHBondContact O-CG 3.46Å; L179-Q181 VanDerWaalsContact C-N 3.28Å; L179-Q181 PolarHBondContact O-N 3.43Å
182	D	79	Confident	89.4	Confident	145 Å²	145	63.4 Å²	63.4	78%	0.775	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-14.1	-178.3	-55.8	-47.2	0	0	0	112.4
183	T	78.7	Confident	89.5	Confident	52 Å²	52	63.2 Å²	63.2	32%	0.319	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	109.7	179.7	41.3	0	0	0	0	109.8	C180 N185 V186	C180-T183 CarbonylContact C-O 3.49Å; C180-T183 WeakPolarHBondContact CA-O 3.37Å; C180-T183 WeakPolarHBondContact CB-O 3.48Å; C180-T183 VanDerWaalsContact O-O 3.06Å; T183-N185 PolarHBondContact O-N 2.85Å; T183-V186 VanDerWaalsContact CB-O 3.26Å; T183-V186 WeakPolarHBondContact CB-O 3.49Å; T183-V186 PolarHBondContact O-N 3.48Å; T183-V186 PolarHBondContact OG1-O 3.05Å
184	P	78.4	Confident	89.6	Confident	115 Å²	115	57.7 Å²	57.7	75%	0.747	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	114.5	-164.9	22.6	-33.5	0	0	0	112.1	V186	P184-V186 PolarHBondContact O-N 3.48Å
185	N	78.4	Confident	89.7	Confident	130 Å²	130	54.1 Å²	54.1	70%	0.695	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	-0.4	-179	-57.4	-31.3	0	0	0	116.9	C180 T183 C212	C180-N185 VanDerWaalsContact SG-C 3.59Å; T183-N185 PolarHBondContact O-N 2.85Å; N185-C212 WeakPolarHBondContact O-CA 3.28Å; N185-C212 PolarHBondContact O-SG 3.47Å
186	V	88.1	Confident	89.8	Confident	51 Å²	51	55.5 Å²	55.5	31%	0.309	29%	0.292	S	S	.	.			trans	-121.4	129	-176.2	-175.8	0	0	0	0	111.5	T183 P184 L188 C212 P214	T183-V186 VanDerWaalsContact CB-O 3.26Å; T183-V186 WeakPolarHBondContact CB-O 3.49Å; T183-V186 PolarHBondContact O-N 3.48Å; T183-V186 PolarHBondContact OG1-O 3.05Å; P184-V186 PolarHBondContact O-N 3.48Å; V186-L188 HydrophobicContact CG1-CD2 3.65Å; V186-L188 HydrophobicContact CG1-CG 4.11Å; V186-C212 CarbonylContact C-O 3.54Å; V186-C212 WeakPolarHBondContact CA-O 3.47Å; V186-P214 HydrophobicContact CG1-CG 3.88Å
187	C	87.1	Confident	89.7	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.014	30%	0.304	C	S	.	.			trans	-105.8	106.3	173.7	-177.7	0	0	0	0	109.3	L179 C180 C212	L179-C187 HydrophobicContact CB-CB 4.28Å; L179-C187 VanDerWaalsContact CB-SG 3.57Å; C180-C187 PolarHBondContact SG-N 3.2Å; C180-C187 VanDerWaalsContact SG-N 3.43Å; C187-C212 PolarHBondContact N-O 2.81Å
188	L	88.7	Confident	89.8	Confident	103 Å²	103	50.2 Å²	50.2	54%	0.539	28%	0.275	S	S	.	.	S	Bend	trans	-87.7	-6.1	-177.1	-62.2	175.4	0	0	0	114	V186 P214	V186-L188 HydrophobicContact CG1-CD2 3.65Å; V186-L188 HydrophobicContact CG1-CG 4.11Å; L188-P214 HydrophobicContact CD2-CG 4.31Å
189	T	91.3	Very high	89.8	Confident	47 Å²	47	49 Å²	49	29%	0.288	27%	0.272	S	S	.	.	S	Bend	trans	-100.3	-17.1	-176.9	59.7	0	0	0	0	114.5	P153 S157 E191	P153-T189 HydrophobicContact CB-CG2 3.8Å; P153-T189 WeakPolarHBondContact O-CB 3.39Å; P153-T189 PolarHBondContact O-OG1 2.78Å; P153-T189 VanDerWaalsContact O-OG1 3.07Å; S157-T189 WeakPolarHBondContact CA-O 3.42Å; S157-T189 WeakPolarHBondContact CB-O 3.5Å; T189-E191 PolarHBondContact O-N 3.26Å
190	L	95.1	Very high	90	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.29	C	S	.	.			trans	-85.1	91.3	-170.8	179.6	57.5	0	0	0	112.6	W156 I159 T192 V193	W156-L190 VanDerWaalsContact O-CD1 3.31Å; W156-L190 WeakPolarHBondContact O-CD1 3.42Å; I159-L190 HydrophobicContact CB-CD1 4.08Å; I159-L190 HydrophobicContact CD1-CD1 3.9Å; I159-L190 HydrophobicContact CD1-CD2 3.62Å; I159-L190 HydrophobicContact CD1-CG 4.44Å; I159-L190 HydrophobicContact CG1-CD1 3.76Å; I159-L190 HydrophobicContact CG1-CD2 4.41Å; L190-T192 WeakPolarHBondContact CD1-O 3.35Å; L190-V193 HydrophobicContact CD1-CG2 3.79Å; L190-V193 HydrophobicContact CD2-CG2 3.74Å; L190-V193 HydrophobicContact CG-CG2 3.81Å
191	E	97.1	Very high	90.3	Very high	79 Å²	79	53.2 Å²	53.2	37%	0.369	29%	0.285	S	S	.	.			trans	-86.5	-26.2	179.4	-60.6	-169.4	125.8	0	0	114.1	S157 T189 R217 R218	S157-E191 PolarHBondContact O-N 3.27Å; T189-E191 PolarHBondContact O-N 3.26Å; E191-R217 HydrophobicContact CB-CG 4.37Å; E191-R217 WeakPolarHBondContact O-CA 3.28Å; E191-R217 PolarHBondContact O-N 2.94Å; E191-R217 IonicContact OE1-CZ 3.5Å; E191-R217 IonicContact OE1-NE 2.89Å; E191-R217 PolarHBondContact OE1-NE 2.84Å; E191-R217 IonicContact OE1-NH2 3.96Å; E191-R218 PolarHBondContact O-N 3.49Å
192	T	98	Very high	90.8	Very high	24 Å²	24	50.2 Å²	50.2	15%	0.147	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	127	-174.1	-66.3	0	0	0	0	112.6	S157 T158 I159 L190 V194 R218	S157-T192 PolarHBondContact O-N 3.01Å; T158-T192 CarbonylContact C-O 3.55Å; T158-T192 VanDerWaalsContact CA-O 3.32Å; T158-T192 WeakPolarHBondContact CA-O 3.46Å; T158-T192 HydrophobicContact CG2-CG2 4.07Å; I159-T192 PolarHBondContact N-O 3.26Å; L190-T192 WeakPolarHBondContact CD1-O 3.35Å; T192-V194 HydrophobicContact CG2-CG2 4.04Å; T192-R218 WeakPolarHBondContact CA-O 3.37Å; T192-R218 HydrophobicContact CG2-CB 4.11Å; T192-R218 HydrophobicContact CG2-CG 4.31Å
193	V	98	Very high	91.7	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	125.6	174.3	176.4	0	0	0	0	110.2	I159 L190 V195 L209 L216 R218 L219 E220	I159-V193 HydrophobicContact CB-CG2 4.45Å; I159-V193 WeakPolarHBondContact O-CA 3.33Å; L190-V193 HydrophobicContact CD1-CG2 3.79Å; L190-V193 HydrophobicContact CD2-CG2 3.74Å; L190-V193 HydrophobicContact CG-CG2 3.81Å; V193-V195 HydrophobicContact CG1-CG2 3.51Å; V193-L209 HydrophobicContact CB-CD1 4.39Å; V193-L209 HydrophobicContact CG1-CD1 3.74Å; V193-L209 HydrophobicContact CG1-CD2 4.44Å; V193-L209 HydrophobicContact CG2-CD1 4.47Å; V193-L209 HydrophobicContact CG2-CD2 4.1Å; V193-L216 HydrophobicContact CB-CD1 4.01Å; V193-L216 HydrophobicContact CG2-CD1 3.61Å; V193-R218 PolarHBondContact N-O 3.04Å; V193-L219 HydrophobicContact CB-CD1 4.08Å; V193-L219 HydrophobicContact CG1-CD1 4.03Å; V193-L219 WeakPolarHBondContact O-CA 3.49Å; V193-E220 PolarHBondContact O-N 3.38Å
194	V	97.7	Very high	92.5	Very high	6 Å²	6	51.9 Å²	51.9	4%	0.036	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	115.1	179.3	-179.9	0	0	0	0	109.3	I159 R160 L161 T192 N196 E220	I159-V194 PolarHBondContact O-N 3.34Å; R160-V194 CarbonylContact C-O 3.37Å; R160-V194 WeakPolarHBondContact CA-O 3.23Å; R160-V194 HydrophobicContact CG-CB 4.15Å; R160-V194 HydrophobicContact CG-CG2 4.41Å; L161-V194 PolarHBondContact N-O 3.06Å; T192-V194 HydrophobicContact CG2-CG2 4.04Å; V194-N196 HydrophobicContact CG1-CB 4.46Å; V194-E220 CarbonylContact C-O 3.53Å; V194-E220 WeakPolarHBondContact CA-O 3.5Å; V194-E220 HydrophobicContact CB-CB 4.29Å; V194-E220 HydrophobicContact CG1-CB 4.05Å; V194-E220 WeakPolarHBondContact CG1-OE2 3.38Å; V194-E220 HydrophobicContact CG2-CB 4.1Å; V194-E220 HydrophobicContact CG2-CG 4.12Å; V194-E220 WeakPolarHBondContact CG2-OE2 3.41Å
195	V	96.3	Very high	93.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.231	C	C	.	.			trans	-126.4	35.3	-173.6	-155.9	0	0	0	0	111.6	L161 A168 I172 V193 C198 L201 E220 V221 C224	L161-V195 HydrophobicContact CB-CG1 4.07Å; L161-V195 CarbonylContact O-C 3.57Å; L161-V195 VanDerWaalsContact O-CA 3.28Å; L161-V195 WeakPolarHBondContact O-CA 3.26Å; A168-V195 HydrophobicContact CB-CG1 3.79Å; I172-V195 HydrophobicContact CD1-CG2 4.49Å; V193-V195 HydrophobicContact CG1-CG2 3.51Å; V195-C198 HydrophobicContact CG1-CB 3.94Å; V195-C198 WeakPolarHBondContact O-CB 3.28Å; V195-L201 HydrophobicContact CB-CD2 3.98Å; V195-L201 HydrophobicContact CG1-CD2 3.86Å; V195-E220 PolarHBondContact N-O 2.88Å; V195-V221 HydrophobicContact CB-CG1 4.36Å; V195-C224 PolarHBondContact O-SG 3.12Å
196	N	94.8	Very high	94.3	Very high	38 Å²	38	40.2 Å²	40.2	20%	0.203	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	137.8	-168.9	-60.2	-9.2	0	0	0	112.6	T162 V194 C198 E220 V221 A222	T162-N196 WeakPolarHBondContact CA-O 3.1Å; T162-N196 HydrophobicContact CG2-CB 4.44Å; V194-N196 HydrophobicContact CG1-CB 4.46Å; N196-C198 VanDerWaalsContact C-N 3.3Å; N196-C198 PolarHBondContact O-N 2.86Å; N196-E220 PolarHBondContact ND2-OE2 3.39Å; N196-E220 WeakPolarHBondContact OD1-CB 3.46Å; N196-E220 PolarHBondContact OD1-O 3.27Å; N196-E220 VanDerWaalsContact OD1-O 3.13Å; N196-V221 WeakPolarHBondContact OD1-CA 3.22Å; N196-V221 PolarHBondContact OD1-N 3.38Å; N196-A222 CarbonylContact C-O 3.47Å; N196-A222 WeakPolarHBondContact CA-O 3.38Å; N196-A222 HydrophobicContact CB-CB 4.3Å; N196-A222 PolarHBondContact OD1-N 2.76Å
197	G	91.4	Very high	94.7	Very high	27 Å²	27	39.9 Å²	39.9	28%	0.278	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	2.8	-179.8	0	0	0	0	0	114.9	E164 K199 A222	E164-G197 WeakPolarHBondContact CA-O 3.46Å; G197-K199 PolarHBondContact O-N 3.2Å; G197-A222 PolarHBondContact N-O 3.36Å
198	C	93.9	Very high	95.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.201	C	C	.	.			trans	-81.5	83	-175.8	-74.8	0	0	0	0	112.9	L161 G163 A168 V195 N196 R200 L201 C224	L161-C198 PolarHBondContact O-SG 2.98Å; G163-C198 PolarHBondContact O-SG 2.63Å; A168-C198 HydrophobicContact CB-CB 3.91Å; V195-C198 HydrophobicContact CG1-CB 3.94Å; V195-C198 WeakPolarHBondContact O-CB 3.28Å; N196-C198 VanDerWaalsContact C-N 3.3Å; N196-C198 PolarHBondContact O-N 2.86Å; C198-R200 PolarHBondContact O-N 2.7Å; C198-L201 HydrophobicContact CB-CB 4.18Å; C198-L201 VanDerWaalsContact O-CB 3.29Å; C198-L201 WeakPolarHBondContact O-CB 3.18Å; C198-L201 PolarHBondContact O-N 2.73Å; C198-C224 PolarHBondContact O-SG 3.33Å; C198-C224 VanDerWaalsContact O-SG 3.38Å
199	K	90.8	Very high	95.4	Very high	78 Å²	78	36.7 Å²	36.7	34%	0.339	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-21.6	175.8	-58.5	-167.1	174.1	161.6	0	115.5	E164 G197 Y225 N226	E164-K199 HydrophobicContact CB-CD 4.1Å; E164-K199 HydrophobicContact CB-CG 4.15Å; E164-K199 HydrophobicContact CG-CD 4.32Å; E164-K199 HydrophobicContact CG-CG 4.46Å; E164-K199 WeakPolarHBondContact OE1-CE 3.4Å; E164-K199 IonicContact OE1-NZ 2.73Å; E164-K199 PolarHBondContact OE1-NZ 3.25Å; E164-K199 WeakPolarHBondContact OE2-CE 3.31Å; E164-K199 IonicContact OE2-NZ 2.7Å; E164-K199 PolarHBondContact OE2-NZ 2.89Å; G197-K199 PolarHBondContact O-N 3.2Å; K199-Y225 HydrophobicContact CB-CE1 3.61Å; K199-Y225 HydrophobicContact CD-CE1 4.12Å; K199-Y225 HydrophobicContact CG-CE1 3.73Å; K199-Y225 PolarHBondContact O-OH 3.19Å; K199-N226 PolarHBondContact O-ND2 3.26Å
200	R	93.3	Very high	95.6	Very high	115 Å²	115	34.6 Å²	34.6	43%	0.434	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	5.7	178.8	-67.3	172.3	166.3	-175.6	-9.8	114.6	L165 L166 H167 C198	L165-R200 PolarHBondContact O-NH1 3.23Å; L166-R200 WeakPolarHBondContact O-CB 3.29Å; H167-R200 PolarHBondContact CE1-NH1 3.42Å; H167-R200 PolarHBondContact NE2-NH1 2.95Å; H167-R200 VanDerWaalsContact NE2-NH1 3.14Å; C198-R200 PolarHBondContact O-N 2.7Å
201	L	95.5	Very high	95.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.188	C	C	.	.			trans	-70.3	133.4	164.8	180	60.3	0	0	0	108.6	A168 D169 I172 V195 C198 V221 C224 N226 I227	A168-L201 HydrophobicContact CB-CB 3.83Å; A168-L201 HydrophobicContact CB-CD1 4Å; A168-L201 HydrophobicContact CB-CG 4.46Å; D169-L201 WeakPolarHBondContact OD1-CA 3.38Å; D169-L201 WeakPolarHBondContact OD1-CD1 3.45Å; I172-L201 HydrophobicContact CD1-CD1 3.66Å; V195-L201 HydrophobicContact CB-CD2 3.98Å; V195-L201 HydrophobicContact CG1-CD2 3.86Å; C198-L201 HydrophobicContact CB-CB 4.18Å; C198-L201 VanDerWaalsContact O-CB 3.29Å; C198-L201 WeakPolarHBondContact O-CB 3.18Å; C198-L201 PolarHBondContact O-N 2.73Å; L201-V221 HydrophobicContact CD2-CB 4.3Å; L201-V221 HydrophobicContact CD2-CG1 3.84Å; L201-C224 HydrophobicContact CB-CB 4.29Å; L201-C224 HydrophobicContact CD2-CB 3.97Å; L201-N226 WeakPolarHBondContact O-CB 3.27Å; L201-I227 HydrophobicContact CD2-CD1 3.86Å; L201-I227 HydrophobicContact CD2-CG1 4.49Å; L201-I227 HydrophobicContact CG-CD1 4.39Å
202	T	96.1	Very high	95.3	Very high	42 Å²	42	37.1 Å²	37.1	26%	0.258	18%	0.177	S	C	.	.			trans	-126.1	173.4	172.3	78.6	0	0	0	0	110.7	D169 R204 G205	D169-T202 PolarHBondContact OD1-N 2.79Å; D169-T202 PolarHBondContact OD2-OG1 3.41Å; T202-R204 PolarHBondContact O-N 3.45Å; T202-R204 PolarHBondContact OG1-N 2.95Å; T202-G205 PolarHBondContact O-N 2.94Å
203	D	96.7	Very high	95.1	Very high	37 Å²	37	36 Å²	36	20%	0.198	17%	0.17	C	C	.	.	H	α-helix	trans	-46.6	-34.6	172.7	-65.3	-21	0	0	0	112.6	G205 L206 H207 I227 S228 A231	D203-G205 VanDerWaalsContact C-N 3.29Å; D203-G205 PolarHBondContact O-N 3.04Å; D203-L206 PolarHBondContact O-N 3.29Å; D203-L206 VanDerWaalsContact O-N 3.17Å; D203-H207 PolarHBondContact O-N 3.33Å; D203-H207 PolarHBondContact O-ND1 3.22Å; D203-I227 VanDerWaalsContact OD1-CA 3.26Å; D203-I227 WeakPolarHBondContact OD1-CA 3.18Å; D203-S228 VanDerWaalsContact CG-OG 3.26Å; D203-S228 PolarHBondContact OD1-N 2.89Å; D203-S228 PolarHBondContact OD1-OG 2.89Å; D203-S228 WeakPolarHBondContact OD2-CB 3.41Å; D203-S228 PolarHBondContact OD2-OG 2.74Å; D203-A231 HydrophobicContact CB-CB 3.7Å; D203-A231 WeakPolarHBondContact OD1-CB 3.29Å
204	R	96.7	Very high	94.9	Very high	195 Å²	195	37.8 Å²	37.8	74%	0.736	18%	0.182	S	C	*	.	H	α-helix	trans	-61.3	-33	176.6	-63.4	176.5	172.3	177.8	-3.1	113.6	T202 I208	T202-R204 PolarHBondContact O-N 3.45Å; T202-R204 PolarHBondContact OG1-N 2.95Å; R204-I208 WeakPolarHBondContact O-CD1 3.31Å; R204-I208 VanDerWaalsContact O-CG1 3.28Å; R204-I208 WeakPolarHBondContact O-CG1 3.3Å; R204-I208 PolarHBondContact O-N 2.93Å
205	G	96.4	Very high	94.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-68.1	-42.1	175.2	0	0	0	0	0	111.8	T202 D203 I208 L209	T202-G205 PolarHBondContact O-N 2.94Å; D203-G205 VanDerWaalsContact C-N 3.29Å; D203-G205 PolarHBondContact O-N 3.04Å; G205-I208 PolarHBondContact O-N 2.81Å; G205-L209 PolarHBondContact O-N 3.31Å
206	L	96.8	Very high	94.7	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-73.1	-38.4	178.2	-68.9	-164	0	0	0	113.2	D203 I208 L209 A210 L219 V221 I227 A231 V235	D203-L206 PolarHBondContact O-N 3.29Å; D203-L206 VanDerWaalsContact O-N 3.17Å; L206-I208 PolarHBondContact O-N 3.33Å; L206-L209 HydrophobicContact CD2-CD1 3.88Å; L206-L209 WeakPolarHBondContact O-CB 3.43Å; L206-L209 PolarHBondContact O-N 2.94Å; L206-A210 WeakPolarHBondContact O-CB 3.03Å; L206-A210 PolarHBondContact O-N 3.23Å; L206-L219 HydrophobicContact CD1-CD2 4.32Å; L206-L219 HydrophobicContact CD2-CD1 4.15Å; L206-L219 HydrophobicContact CD2-CD2 3.89Å; L206-V221 HydrophobicContact CD2-CG1 4.15Å; L206-I227 HydrophobicContact CD1-CD1 3.91Å; L206-I227 HydrophobicContact CD1-CG1 4.13Å; L206-I227 HydrophobicContact CD1-CG2 3.86Å; L206-I227 HydrophobicContact CG-CD1 4.47Å; L206-A231 HydrophobicContact CB-CB 4.02Å; L206-A231 HydrophobicContact CD1-CB 4.09Å; L206-V235 HydrophobicContact CB-CG2 4.04Å; L206-V235 HydrophobicContact CD1-CG2 4.44Å
207	H	96.4	Very high	94.8	Very high	44 Å²	44	42.6 Å²	42.6	20%	0.204	20%	0.199	C	C	.	.	H	α-helix	trans	-55.2	-41	172.5	-80.7	77.5	0	0	0	111.9	D203 L209 A210 Q211 D230 E234	D203-H207 PolarHBondContact O-N 3.33Å; D203-H207 PolarHBondContact O-ND1 3.22Å; H207-L209 PolarHBondContact O-N 3.39Å; H207-A210 PolarHBondContact O-N 2.8Å; H207-Q211 WeakPolarHBondContact O-CB 3.38Å; H207-Q211 WeakPolarHBondContact O-CG 3.49Å; H207-Q211 PolarHBondContact O-N 3.31Å; H207-D230 IonicContact CE1-OD2 2.72Å; H207-D230 PolarHBondContact CE1-OD2 3.47Å; H207-D230 VanDerWaalsContact CE1-OD2 3.27Å; H207-D230 IonicContact NE2-OD2 2.75Å; H207-E234 IonicContact CD2-OE1 3.78Å
208	I	95.8	Very high	95.2	Very high	35 Å²	35	45.8 Å²	45.8	18%	0.179	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-35.8	177	-67.9	168.7	0	0	0	111.8	I172 R173 T176 R204 G205 L206 C212	I172-I208 HydrophobicContact CG2-CB 4.27Å; I172-I208 HydrophobicContact CG2-CG2 3.95Å; R173-I208 HydrophobicContact CB-CD1 3.88Å; R173-I208 HydrophobicContact CG-CD1 4.04Å; T176-I208 HydrophobicContact CG2-CG2 4.32Å; T176-I208 WeakPolarHBondContact OG1-CG2 3.48Å; R204-I208 WeakPolarHBondContact O-CD1 3.31Å; R204-I208 VanDerWaalsContact O-CG1 3.28Å; R204-I208 WeakPolarHBondContact O-CG1 3.3Å; R204-I208 PolarHBondContact O-N 2.93Å; G205-I208 PolarHBondContact O-N 2.81Å; L206-I208 PolarHBondContact O-N 3.33Å; I208-C212 VanDerWaalsContact O-CB 3.28Å; I208-C212 WeakPolarHBondContact O-CB 3.43Å; I208-C212 PolarHBondContact O-N 3.19Å; I208-C212 PolarHBondContact O-SG 3.18Å
209	L	96.3	Very high	95.4	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-68.1	-49.7	173.5	-66.8	174.3	0	0	0	111	I172 T176 V193 G205 L206 H207 Q211 C212 C213 L219	I172-L209 HydrophobicContact CD1-CD1 4.27Å; I172-L209 HydrophobicContact CG2-CD2 3.72Å; I172-L209 HydrophobicContact CG2-CG 3.83Å; T176-L209 HydrophobicContact CG2-CD2 4.08Å; V193-L209 HydrophobicContact CB-CD1 4.39Å; V193-L209 HydrophobicContact CG1-CD1 3.74Å; V193-L209 HydrophobicContact CG1-CD2 4.44Å; V193-L209 HydrophobicContact CG2-CD1 4.47Å; V193-L209 HydrophobicContact CG2-CD2 4.1Å; G205-L209 PolarHBondContact O-N 3.31Å; L206-L209 HydrophobicContact CD2-CD1 3.88Å; L206-L209 WeakPolarHBondContact O-CB 3.43Å; L206-L209 PolarHBondContact O-N 2.94Å; H207-L209 PolarHBondContact O-N 3.39Å; L209-Q211 VanDerWaalsContact C-N 3.28Å; L209-Q211 PolarHBondContact O-N 2.88Å; L209-C212 PolarHBondContact O-N 2.9Å; L209-C213 WeakPolarHBondContact O-CA 3.33Å; L209-C213 WeakPolarHBondContact O-CB 3.18Å; L209-C213 PolarHBondContact O-N 3.01Å; L209-C213 PolarHBondContact O-SG 2.91Å; L209-L219 HydrophobicContact CD1-CD1 4.14Å
210	A	94.1	Very high	95.7	Very high	4 Å²	4	43.7 Å²	43.7	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-57.7	-40.1	179.5	0	0	0	0	0	112.5	L206 H207 E234 V235 R238	L206-A210 WeakPolarHBondContact O-CB 3.03Å; L206-A210 PolarHBondContact O-N 3.23Å; H207-A210 PolarHBondContact O-N 2.8Å; A210-E234 HydrophobicContact CB-CG 3.71Å; A210-E234 WeakPolarHBondContact CB-O 3.47Å; A210-V235 HydrophobicContact CB-CG2 4.01Å; A210-R238 HydrophobicContact CB-CB 4.2Å; A210-R238 WeakPolarHBondContact O-CB 3.3Å; A210-R238 WeakPolarHBondContact O-CD 3.42Å
211	Q	92.8	Very high	95.9	Very high	111 Å²	111	38.2 Å²	38.2	52%	0.519	17%	0.174	S	C	.	.	H	α-helix	trans	-76.2	-27.9	179.8	-70.2	169.8	9.4	0	0	113.5	H207 L209 E234	H207-Q211 WeakPolarHBondContact O-CB 3.38Å; H207-Q211 WeakPolarHBondContact O-CG 3.49Å; H207-Q211 PolarHBondContact O-N 3.31Å; L209-Q211 VanDerWaalsContact C-N 3.28Å; L209-Q211 PolarHBondContact O-N 2.88Å; Q211-E234 PolarHBondContact NE2-OE1 3.32Å
212	C	93.8	Very high	95.9	Very high	20 Å²	20	39.2 Å²	39.2	14%	0.135	18%	0.182	C	C	.	.	H	α-helix	trans	-101	-22.9	-177.1	-63.3	0	0	0	0	114.6	T176 N185 V186 C187 I208 L209 P214	T176-C212 HydrophobicContact CG2-CB 4.35Å; N185-C212 WeakPolarHBondContact O-CA 3.28Å; N185-C212 PolarHBondContact O-SG 3.47Å; V186-C212 CarbonylContact C-O 3.54Å; V186-C212 WeakPolarHBondContact CA-O 3.47Å; C187-C212 PolarHBondContact N-O 2.81Å; I208-C212 VanDerWaalsContact O-CB 3.28Å; I208-C212 WeakPolarHBondContact O-CB 3.43Å; I208-C212 PolarHBondContact O-N 3.19Å; I208-C212 PolarHBondContact O-SG 3.18Å; L209-C212 PolarHBondContact O-N 2.9Å; C212-P214 VanDerWaalsContact O-CD 3.31Å; C212-P214 WeakPolarHBondContact O-CD 3.46Å
213	C	94.4	Very high	95.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.186	C	C	.	.			trans	-126.7	70.4	-160	-50.3	0	0	0	0	112.4	L209 E215 L216 C239	L209-C213 WeakPolarHBondContact O-CA 3.33Å; L209-C213 WeakPolarHBondContact O-CB 3.18Å; L209-C213 PolarHBondContact O-N 3.01Å; L209-C213 PolarHBondContact O-SG 2.91Å; C213-E215 VanDerWaalsContact C-N 3.26Å; C213-E215 PolarHBondContact O-N 3.13Å; C213-L216 HydrophobicContact CB-CB 4.38Å; C213-L216 VanDerWaalsContact O-CB 3.3Å; C213-L216 WeakPolarHBondContact O-CB 3.36Å; C213-L216 PolarHBondContact O-N 3.33Å; C213-C239 PolarHBondContact O-SG 3.19Å
214	P	92.3	Very high	95.6	Very high	38 Å²	38	37 Å²	37	25%	0.247	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-28.2	-177.6	27.2	-35	0	0	0	113.3	V186 L188 C212 L216	V186-P214 HydrophobicContact CG1-CG 3.88Å; L188-P214 HydrophobicContact CD2-CG 4.31Å; C212-P214 VanDerWaalsContact O-CD 3.31Å; C212-P214 WeakPolarHBondContact O-CD 3.46Å; P214-L216 PolarHBondContact O-N 3.49Å
215	E	94	Very high	95.4	Very high	63 Å²	63	32.6 Å²	32.6	29%	0.294	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	11.6	179.3	-63.2	-56.3	150	0	0	114.3	C213 R217 N241	C213-E215 VanDerWaalsContact C-N 3.26Å; C213-E215 PolarHBondContact O-N 3.13Å; E215-R217 PolarHBondContact O-N 3.42Å; E215-N241 PolarHBondContact OE2-ND2 3.21Å
216	L	96.5	Very high	95.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.172	C	C	.	.			trans	-66.6	106.4	-179.6	-173	69	0	0	0	111.2	V193 C213 P214 R218 L219 C239 N241 L242	V193-L216 HydrophobicContact CB-CD1 4.01Å; V193-L216 HydrophobicContact CG2-CD1 3.61Å; C213-L216 HydrophobicContact CB-CB 4.38Å; C213-L216 VanDerWaalsContact O-CB 3.3Å; C213-L216 WeakPolarHBondContact O-CB 3.36Å; C213-L216 PolarHBondContact O-N 3.33Å; P214-L216 PolarHBondContact O-N 3.49Å; L216-R218 WeakPolarHBondContact CD1-O 3.49Å; L216-L219 HydrophobicContact CD2-CB 4.26Å; L216-C239 HydrophobicContact CB-CB 4.17Å; L216-N241 CarbonylContact O-C 3.58Å; L216-L242 HydrophobicContact CG-CD1 4.33Å; L216-L242 VanDerWaalsContact O-CA 3.28Å; L216-L242 WeakPolarHBondContact O-CA 3.44Å; L216-L242 PolarHBondContact O-N 3.01Å
217	R	97.4	Very high	95.1	Very high	83 Å²	83	34.8 Å²	34.8	31%	0.313	17%	0.172	S	C	.	.			trans	-86.8	-28.3	176.1	-61.9	-175	-176.3	-72.1	-18.4	113.7	E191 E215 N241 E243 H244	E191-R217 HydrophobicContact CB-CG 4.37Å; E191-R217 WeakPolarHBondContact O-CA 3.28Å; E191-R217 PolarHBondContact O-N 2.94Å; E191-R217 IonicContact OE1-CZ 3.5Å; E191-R217 IonicContact OE1-NE 2.89Å; E191-R217 PolarHBondContact OE1-NE 2.84Å; E191-R217 IonicContact OE1-NH2 3.96Å; E215-R217 PolarHBondContact O-N 3.42Å; R217-N241 WeakPolarHBondContact CA-O 3.44Å; R217-E243 IonicContact CZ-OE1 3.38Å; R217-E243 IonicContact NH1-OE1 1.77Å; R217-E243 PolarHBondContact NH1-OE1 3.05Å; R217-E243 PolarHBondContact O-N 2.97Å; R217-H244 PolarHBondContact O-N 2.82Å; R217-H244 VanDerWaalsContact O-N 3.09Å
218	R	98.6	Very high	95	Very high	93 Å²	93	34 Å²	34	35%	0.351	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	128.6	-178.6	-175.7	177.9	-48.7	-161.6	-0.8	113	E191 T192 V193 L216 E220 H244	E191-R218 PolarHBondContact O-N 3.49Å; T192-R218 WeakPolarHBondContact CA-O 3.37Å; T192-R218 HydrophobicContact CG2-CB 4.11Å; T192-R218 HydrophobicContact CG2-CG 4.31Å; V193-R218 PolarHBondContact N-O 3.04Å; L216-R218 WeakPolarHBondContact CD1-O 3.49Å; R218-E220 WeakPolarHBondContact CD-OE1 3.34Å; R218-E220 HydrophobicContact CG-CG 4.1Å; R218-E220 IonicContact CZ-OE1 3.87Å; R218-E220 IonicContact NE-OE1 2.95Å; R218-E220 IonicContact NH1-OE1 3.84Å; R218-E220 PolarHBondContact NH1-OE1 3.29Å; R218-H244 WeakPolarHBondContact CA-O 3.28Å; R218-H244 HydrophobicContact CB-CB 4.27Å; R218-H244 HydrophobicContact CG-CB 3.99Å
219	L	98.3	Very high	94.9	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	119	165.6	-177.5	61.6	0	0	0	110.4	V193 L206 L209 L216 V221 V235 L242 H244 L245 D246	V193-L219 HydrophobicContact CB-CD1 4.08Å; V193-L219 HydrophobicContact CG1-CD1 4.03Å; V193-L219 WeakPolarHBondContact O-CA 3.49Å; L206-L219 HydrophobicContact CD1-CD2 4.32Å; L206-L219 HydrophobicContact CD2-CD1 4.15Å; L206-L219 HydrophobicContact CD2-CD2 3.89Å; L209-L219 HydrophobicContact CD1-CD1 4.14Å; L216-L219 HydrophobicContact CD2-CB 4.26Å; L219-V221 HydrophobicContact CD1-CG1 3.77Å; L219-V221 HydrophobicContact CD2-CG1 4.44Å; L219-V221 HydrophobicContact CG-CG1 3.98Å; L219-V235 HydrophobicContact CD2-CG1 3.94Å; L219-V235 HydrophobicContact CD2-CG2 4.22Å; L219-L242 HydrophobicContact CB-CD1 4.1Å; L219-H244 PolarHBondContact N-O 3.06Å; L219-L245 HydrophobicContact CB-CD1 3.94Å; L219-L245 HydrophobicContact CD2-CD1 4.02Å; L219-L245 HydrophobicContact CG-CD1 4.17Å; L219-L245 WeakPolarHBondContact O-CA 3.35Å; L219-D246 PolarHBondContact O-N 3Å
220	E	98.1	Very high	94.7	Very high	33 Å²	33	38.9 Å²	38.9	15%	0.154	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	123.8	169.1	-57.8	171.4	-156.7	0	0	108.4	V193 V194 V195 N196 R218 D246	V193-E220 PolarHBondContact O-N 3.38Å; V194-E220 CarbonylContact C-O 3.53Å; V194-E220 WeakPolarHBondContact CA-O 3.5Å; V194-E220 HydrophobicContact CB-CB 4.29Å; V194-E220 HydrophobicContact CG1-CB 4.05Å; V194-E220 WeakPolarHBondContact CG1-OE2 3.38Å; V194-E220 HydrophobicContact CG2-CB 4.1Å; V194-E220 HydrophobicContact CG2-CG 4.12Å; V194-E220 WeakPolarHBondContact CG2-OE2 3.41Å; V195-E220 PolarHBondContact N-O 2.88Å; N196-E220 PolarHBondContact ND2-OE2 3.39Å; N196-E220 WeakPolarHBondContact OD1-CB 3.46Å; N196-E220 PolarHBondContact OD1-O 3.27Å; N196-E220 VanDerWaalsContact OD1-O 3.13Å; R218-E220 WeakPolarHBondContact CD-OE1 3.34Å; R218-E220 HydrophobicContact CG-CG 4.1Å; R218-E220 IonicContact CZ-OE1 3.87Å; R218-E220 IonicContact NE-OE1 2.95Å; R218-E220 IonicContact NH1-OE1 3.84Å; R218-E220 PolarHBondContact NH1-OE1 3.29Å; E220-D246 HydrophobicContact CB-CB 4.31Å; E220-D246 HydrophobicContact CG-CB 4.27Å
221	V	97.1	Very high	94.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.			trans	-136	28.6	-179.9	-68.7	0	0	0	0	112.7	V195 N196 L201 L206 L219 G223 C224 I227 D246 L247	V195-V221 HydrophobicContact CB-CG1 4.36Å; N196-V221 WeakPolarHBondContact OD1-CA 3.22Å; N196-V221 PolarHBondContact OD1-N 3.38Å; L201-V221 HydrophobicContact CD2-CB 4.3Å; L201-V221 HydrophobicContact CD2-CG1 3.84Å; L206-V221 HydrophobicContact CD2-CG1 4.15Å; L219-V221 HydrophobicContact CD1-CG1 3.77Å; L219-V221 HydrophobicContact CD2-CG1 4.44Å; L219-V221 HydrophobicContact CG-CG1 3.98Å; V221-G223 PolarHBondContact O-N 3.05Å; V221-C224 HydrophobicContact CB-CB 4.36Å; V221-C224 WeakPolarHBondContact O-CB 3.47Å; V221-C224 PolarHBondContact O-N 2.89Å; V221-C224 VanDerWaalsContact O-N 3.12Å; V221-C224 PolarHBondContact O-SG 3.03Å; V221-C224 VanDerWaalsContact O-SG 3.39Å; V221-I227 HydrophobicContact CB-CD1 3.65Å; V221-I227 HydrophobicContact CG1-CD1 4.05Å; V221-I227 HydrophobicContact CG2-CD1 3.62Å; V221-D246 VanDerWaalsContact CG2-O 3.23Å; V221-D246 WeakPolarHBondContact CG2-O 3.39Å; V221-D246 PolarHBondContact N-O 3.12Å; V221-L247 HydrophobicContact CG2-CD2 3.65Å
222	A	96.1	Very high	94.9	Very high	21 Å²	21	33.5 Å²	33.5	17%	0.174	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	131.4	-176.6	0	0	0	0	0	112.9	N196 G197 S248	N196-A222 CarbonylContact C-O 3.47Å; N196-A222 WeakPolarHBondContact CA-O 3.38Å; N196-A222 HydrophobicContact CB-CB 4.3Å; N196-A222 PolarHBondContact OD1-N 2.76Å; G197-A222 PolarHBondContact N-O 3.36Å; A222-S248 CarbonylContact C-O 3.43Å; A222-S248 VanDerWaalsContact CA-O 3.28Å; A222-S248 WeakPolarHBondContact CA-O 3.33Å
223	G	92.9	Very high	94.8	Very high	33 Å²	33	34.7 Å²	34.7	34%	0.34	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	0.1	-178.9	0	0	0	0	0	115.2	V221 Y225 S248	V221-G223 PolarHBondContact O-N 3.05Å; G223-Y225 VanDerWaalsContact C-N 3.29Å; G223-Y225 PolarHBondContact O-N 2.84Å; G223-S248 PolarHBondContact N-O 2.92Å
224	C	93.5	Very high	94.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.179	C	C	.	.			trans	-86.8	65	-177.9	-64.7	0	0	0	0	112.3	V195 C198 L201 V221 N226 I227	V195-C224 PolarHBondContact O-SG 3.12Å; C198-C224 PolarHBondContact O-SG 3.33Å; C198-C224 VanDerWaalsContact O-SG 3.38Å; L201-C224 HydrophobicContact CB-CB 4.29Å; L201-C224 HydrophobicContact CD2-CB 3.97Å; V221-C224 HydrophobicContact CB-CB 4.36Å; V221-C224 WeakPolarHBondContact O-CB 3.47Å; V221-C224 PolarHBondContact O-N 2.89Å; V221-C224 VanDerWaalsContact O-N 3.12Å; V221-C224 PolarHBondContact O-SG 3.03Å; V221-C224 VanDerWaalsContact O-SG 3.39Å; C224-N226 PolarHBondContact O-N 3.17Å; C224-I227 HydrophobicContact CB-CD1 3.58Å; C224-I227 HydrophobicContact CB-CG1 4.21Å; C224-I227 PolarHBondContact O-N 2.86Å; C224-I227 VanDerWaalsContact O-N 3.07Å
225	Y	91.3	Very high	94.8	Very high	102 Å²	102	33.9 Å²	33.9	40%	0.4	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-8.6	-178.8	65.3	-99	0	0	0	116.7	K199 G223 K252	K199-Y225 HydrophobicContact CB-CE1 3.61Å; K199-Y225 HydrophobicContact CD-CE1 4.12Å; K199-Y225 HydrophobicContact CG-CE1 3.73Å; K199-Y225 PolarHBondContact O-OH 3.19Å; G223-Y225 VanDerWaalsContact C-N 3.29Å; G223-Y225 PolarHBondContact O-N 2.84Å; Y225-K252 VanDerWaalsContact O-CE 3.27Å; Y225-K252 WeakPolarHBondContact O-CE 3.28Å
226	N	92.9	Very high	94.8	Very high	47 Å²	47	31.3 Å²	31.3	25%	0.251	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-14.5	179.5	-97.7	-39.3	0	0	0	114.5	K199 L201 C224 K252	K199-N226 PolarHBondContact O-ND2 3.26Å; L201-N226 WeakPolarHBondContact O-CB 3.27Å; C224-N226 PolarHBondContact O-N 3.17Å; N226-K252 PolarHBondContact O-NZ 2.91Å; N226-K252 PolarHBondContact OD1-NZ 3Å
227	I	95.1	Very high	94.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.164	C	C	.	.			trans	-70.2	137.5	178.3	-64.4	165.9	0	0	0	111.1	L201 D203 L206 V221 C224 A231 V232 K252 V253	L201-I227 HydrophobicContact CD2-CD1 3.86Å; L201-I227 HydrophobicContact CD2-CG1 4.49Å; L201-I227 HydrophobicContact CG-CD1 4.39Å; D203-I227 VanDerWaalsContact OD1-CA 3.26Å; D203-I227 WeakPolarHBondContact OD1-CA 3.18Å; L206-I227 HydrophobicContact CD1-CD1 3.91Å; L206-I227 HydrophobicContact CD1-CG1 4.13Å; L206-I227 HydrophobicContact CD1-CG2 3.86Å; L206-I227 HydrophobicContact CG-CD1 4.47Å; V221-I227 HydrophobicContact CB-CD1 3.65Å; V221-I227 HydrophobicContact CG1-CD1 4.05Å; V221-I227 HydrophobicContact CG2-CD1 3.62Å; C224-I227 HydrophobicContact CB-CD1 3.58Å; C224-I227 HydrophobicContact CB-CG1 4.21Å; C224-I227 PolarHBondContact O-N 2.86Å; C224-I227 VanDerWaalsContact O-N 3.07Å; I227-A231 HydrophobicContact CG2-CB 4.33Å; I227-V232 HydrophobicContact CG2-CG2 3.93Å; I227-K252 WeakPolarHBondContact O-CB 3.29Å; I227-V253 HydrophobicContact CG2-CG2 4.36Å
228	S	94.6	Very high	94.1	Very high	26 Å²	26	33.9 Å²	33.9	18%	0.182	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-113.9	172	176.4	72.7	0	0	0	0	113.3	D203 D230 A231 V232	D203-S228 VanDerWaalsContact CG-OG 3.26Å; D203-S228 PolarHBondContact OD1-N 2.89Å; D203-S228 PolarHBondContact OD1-OG 2.89Å; D203-S228 WeakPolarHBondContact OD2-CB 3.41Å; D203-S228 PolarHBondContact OD2-OG 2.74Å; S228-D230 PolarHBondContact O-N 3.3Å; S228-A231 PolarHBondContact O-N 3.33Å; S228-V232 PolarHBondContact O-N 3.14Å
229	N	93.3	Very high	93.8	Very high	47 Å²	47	29.5 Å²	29.5	25%	0.251	15%	0.153	S	C	.	.	H	α-helix	trans	-54.1	-34.6	174.8	-69.4	-10.4	0	0	0	112.8	V232 F233 V253 T254 C255	N229-V232 PolarHBondContact O-N 3.13Å; N229-F233 WeakPolarHBondContact O-CB 3.21Å; N229-F233 PolarHBondContact O-N 2.66Å; N229-V253 VanDerWaalsContact OD1-CA 3.26Å; N229-V253 WeakPolarHBondContact OD1-CA 3.07Å; N229-T254 PolarHBondContact ND2-OG1 2.91Å; N229-T254 PolarHBondContact OD1-N 2.95Å; N229-C255 PolarHBondContact OD1-N 3.32Å; N229-C255 PolarHBondContact OD1-O 3.29Å
230	D	92.6	Very high	93.5	Very high	93 Å²	93	33 Å²	33	50%	0.497	18%	0.176	S	C	.	.	H	α-helix	trans	-62.2	-47.4	-177.3	177.2	71.3	0	0	0	111.9	H207 S228 V232 F233 E234	H207-D230 IonicContact CE1-OD2 2.72Å; H207-D230 PolarHBondContact CE1-OD2 3.47Å; H207-D230 VanDerWaalsContact CE1-OD2 3.27Å; H207-D230 IonicContact NE2-OD2 2.75Å; S228-D230 PolarHBondContact O-N 3.3Å; D230-V232 VanDerWaalsContact C-N 3.34Å; D230-V232 PolarHBondContact O-N 3.34Å; D230-F233 WeakPolarHBondContact O-CB 3.24Å; D230-F233 PolarHBondContact O-N 2.76Å; D230-E234 PolarHBondContact O-N 2.85Å
231	A	94.6	Very high	93.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-68	-31.3	175	0	0	0	0	0	113.8	D203 L206 I227 S228 V235	D203-A231 HydrophobicContact CB-CB 3.7Å; D203-A231 WeakPolarHBondContact OD1-CB 3.29Å; L206-A231 HydrophobicContact CB-CB 4.02Å; L206-A231 HydrophobicContact CD1-CB 4.09Å; I227-A231 HydrophobicContact CG2-CB 4.33Å; S228-A231 PolarHBondContact O-N 3.33Å; A231-V235 WeakPolarHBondContact O-CG2 3.43Å; A231-V235 PolarHBondContact O-N 3.4Å
232	V	95.1	Very high	93.2	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.012	18%	0.183	C	C	.	.	H	α-helix	trans	-71.4	-40.4	174.1	-178.3	0	0	0	0	110.3	I227 S228 N229 D230 V235 V236 L245 L247 V253 I256	I227-V232 HydrophobicContact CG2-CG2 3.93Å; S228-V232 PolarHBondContact O-N 3.14Å; N229-V232 PolarHBondContact O-N 3.13Å; D230-V232 VanDerWaalsContact C-N 3.34Å; D230-V232 PolarHBondContact O-N 3.34Å; V232-V235 PolarHBondContact O-N 2.84Å; V232-V236 HydrophobicContact CG1-CG1 4.36Å; V232-V236 WeakPolarHBondContact O-CG1 3.31Å; V232-V236 WeakPolarHBondContact O-CG2 3.35Å; V232-V236 PolarHBondContact O-N 2.77Å; V232-L245 HydrophobicContact CG1-CD2 4.22Å; V232-L247 HydrophobicContact CG1-CD1 4.19Å; V232-L247 HydrophobicContact CG2-CD1 4.19Å; V232-L247 HydrophobicContact CG2-CD2 4.01Å; V232-V253 HydrophobicContact CG2-CG2 4.06Å; V232-I256 HydrophobicContact CG1-CD1 4.21Å; V232-I256 HydrophobicContact CG1-CG1 4.02Å; V232-I256 HydrophobicContact CG1-CG2 4.09Å
233	F	92.4	Very high	93.2	Very high	46 Å²	46	36.8 Å²	36.8	20%	0.202	19%	0.192	C	C	.	.	H	α-helix	trans	-59.3	-49.3	173.8	170.7	-88.9	0	0	0	112.2	N229 D230 V235 V236 S237 S257 Q260 A262	N229-F233 WeakPolarHBondContact O-CB 3.21Å; N229-F233 PolarHBondContact O-N 2.66Å; D230-F233 WeakPolarHBondContact O-CB 3.24Å; D230-F233 PolarHBondContact O-N 2.76Å; F233-V235 VanDerWaalsContact C-N 3.29Å; F233-V235 PolarHBondContact O-N 3.2Å; F233-V236 PolarHBondContact O-N 3.06Å; F233-S237 VanDerWaalsContact O-CB 3.29Å; F233-S237 WeakPolarHBondContact O-CB 3.43Å; F233-S237 PolarHBondContact O-N 2.97Å; F233-S237 PolarHBondContact O-OG 3.45Å; F233-S257 WeakPolarHBondContact CD2-O 3.29Å; F233-Q260 WeakPolarHBondContact CZ-O 3.38Å; F233-A262 HydrophobicContact CE1-CB 4.43Å; F233-A262 HydrophobicContact CZ-CB 3.83Å
234	E	92.3	Very high	93.5	Very high	19 Å²	19	36.6 Å²	36.6	9%	0.089	18%	0.182	C	C	.	.	H	α-helix	trans	-59.9	-39.2	176.7	-180	81.6	159.1	0	0	110.9	H207 A210 Q211 D230 S237 R238	H207-E234 IonicContact CD2-OE1 3.78Å; A210-E234 HydrophobicContact CB-CG 3.71Å; A210-E234 WeakPolarHBondContact CB-O 3.47Å; Q211-E234 PolarHBondContact NE2-OE1 3.32Å; D230-E234 PolarHBondContact O-N 2.85Å; E234-S237 PolarHBondContact O-OG 3.48Å; E234-R238 VanDerWaalsContact CD-NH2 3.33Å; E234-R238 WeakPolarHBondContact O-CB 3.25Å; E234-R238 WeakPolarHBondContact O-CG 3.37Å; E234-R238 PolarHBondContact O-N 3.03Å; E234-R238 IonicContact OE1-CZ 3.8Å; E234-R238 IonicContact OE1-NE 3.18Å; E234-R238 PolarHBondContact OE1-NE 2.9Å; E234-R238 IonicContact OE1-NH2 3.9Å; E234-R238 PolarHBondContact OE1-NH2 3.48Å; E234-R238 IonicContact OE2-CZ 2.97Å; E234-R238 VanDerWaalsContact OE2-CZ 3.31Å; E234-R238 IonicContact OE2-NE 2.82Å; E234-R238 PolarHBondContact OE2-NE 3.45Å; E234-R238 IonicContact OE2-NH2 3.86Å; E234-R238 PolarHBondContact OE2-NH2 2.88Å
235	V	94.7	Very high	93.7	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-66.2	-52.9	174.4	166.4	0	0	0	0	112.4	L206 A210 L219 A231 V232 F233 S237 R238 C239 L242	L206-V235 HydrophobicContact CB-CG2 4.04Å; L206-V235 HydrophobicContact CD1-CG2 4.44Å; A210-V235 HydrophobicContact CB-CG2 4.01Å; L219-V235 HydrophobicContact CD2-CG1 3.94Å; L219-V235 HydrophobicContact CD2-CG2 4.22Å; A231-V235 WeakPolarHBondContact O-CG2 3.43Å; A231-V235 PolarHBondContact O-N 3.4Å; V232-V235 PolarHBondContact O-N 2.84Å; F233-V235 VanDerWaalsContact C-N 3.29Å; F233-V235 PolarHBondContact O-N 3.2Å; V235-S237 PolarHBondContact O-N 3.42Å; V235-R238 PolarHBondContact O-N 3.39Å; V235-C239 VanDerWaalsContact O-CB 3.29Å; V235-C239 WeakPolarHBondContact O-CB 3.39Å; V235-C239 PolarHBondContact O-N 3.03Å; V235-L242 HydrophobicContact CG1-CD2 3.84Å
236	V	92.6	Very high	94	Very high	9 Å²	9	32.9 Å²	32.9	6%	0.055	17%	0.169	C	C	.	.	H	α-helix	trans	-71.4	-18.4	-175.7	-58	0	0	0	0	113.7	V232 F233 L242 L245 I256 L258 I274 I276	V232-V236 HydrophobicContact CG1-CG1 4.36Å; V232-V236 WeakPolarHBondContact O-CG1 3.31Å; V232-V236 WeakPolarHBondContact O-CG2 3.35Å; V232-V236 PolarHBondContact O-N 2.77Å; F233-V236 PolarHBondContact O-N 3.06Å; V236-L242 HydrophobicContact CG1-CD2 4.12Å; V236-L245 HydrophobicContact CG1-CD2 4.35Å; V236-I256 HydrophobicContact CG1-CG2 4.02Å; V236-I256 HydrophobicContact CG2-CG2 4.05Å; V236-L258 HydrophobicContact CG2-CD2 4Å; V236-I274 HydrophobicContact CB-CD1 4.04Å; V236-I274 HydrophobicContact CB-CG2 4.09Å; V236-I274 HydrophobicContact CG1-CD1 4.44Å; V236-I274 HydrophobicContact CG1-CG2 4.31Å; V236-I274 HydrophobicContact CG2-CD1 3.86Å; V236-I276 HydrophobicContact CG1-CD1 4.13Å
237	S	89.6	Confident	94.2	Very high	21 Å²	21	30.7 Å²	30.7	15%	0.147	16%	0.157	C	C	.	.	H	α-helix	trans	-86.8	-26.1	174.7	59.5	0	0	0	0	113.9	F233 E234 V235	F233-S237 VanDerWaalsContact O-CB 3.29Å; F233-S237 WeakPolarHBondContact O-CB 3.43Å; F233-S237 PolarHBondContact O-N 2.97Å; F233-S237 PolarHBondContact O-OG 3.45Å; E234-S237 PolarHBondContact O-OG 3.48Å; V235-S237 PolarHBondContact O-N 3.42Å
238	R	91.2	Very high	94.3	Very high	117 Å²	117	31.7 Å²	31.7	44%	0.442	16%	0.164	S	C	.	.	H	α-helix	trans	-104	-18.3	179	-60.3	-169.5	-166.7	-75	-12.7	115.6	A210 E234 V235 P240	A210-R238 HydrophobicContact CB-CB 4.2Å; A210-R238 WeakPolarHBondContact O-CB 3.3Å; A210-R238 WeakPolarHBondContact O-CD 3.42Å; E234-R238 VanDerWaalsContact CD-NH2 3.33Å; E234-R238 WeakPolarHBondContact O-CB 3.25Å; E234-R238 WeakPolarHBondContact O-CG 3.37Å; E234-R238 PolarHBondContact O-N 3.03Å; E234-R238 IonicContact OE1-CZ 3.8Å; E234-R238 IonicContact OE1-NE 3.18Å; E234-R238 PolarHBondContact OE1-NE 2.9Å; E234-R238 IonicContact OE1-NH2 3.9Å; E234-R238 PolarHBondContact OE1-NH2 3.48Å; E234-R238 IonicContact OE2-CZ 2.97Å; E234-R238 VanDerWaalsContact OE2-CZ 3.31Å; E234-R238 IonicContact OE2-NE 2.82Å; E234-R238 PolarHBondContact OE2-NE 3.45Å; E234-R238 IonicContact OE2-NH2 3.86Å; E234-R238 PolarHBondContact OE2-NH2 2.88Å; V235-R238 PolarHBondContact O-N 3.39Å; R238-P240 VanDerWaalsContact C-CD 3.44Å; R238-P240 WeakPolarHBondContact O-CD 3.35Å
239	C	92.6	Very high	94.3	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.007	17%	0.165	C	C	.	.			trans	-107.4	75.8	177.9	-59	0	0	0	0	110.5	C213 L216 V235 N241 L242	C213-C239 PolarHBondContact O-SG 3.19Å; L216-C239 HydrophobicContact CB-CB 4.17Å; V235-C239 VanDerWaalsContact O-CB 3.29Å; V235-C239 WeakPolarHBondContact O-CB 3.39Å; V235-C239 PolarHBondContact O-N 3.03Å; C239-N241 PolarHBondContact O-N 3.37Å; C239-N241 VanDerWaalsContact O-N 3.11Å; C239-L242 HydrophobicContact CB-CB 4.26Å; C239-L242 VanDerWaalsContact O-CB 3.29Å; C239-L242 WeakPolarHBondContact O-CB 3.33Å; C239-L242 PolarHBondContact O-N 2.87Å; C239-L242 VanDerWaalsContact O-N 3.13Å
240	P	90.2	Very high	94.3	Very high	76 Å²	76	29.1 Å²	29.1	49%	0.494	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.5	-174.3	28.3	-37.4	0	0	0	113.7	R238 S275	R238-P240 VanDerWaalsContact C-CD 3.44Å; R238-P240 WeakPolarHBondContact O-CD 3.35Å; P240-S275 WeakPolarHBondContact O-CB 3.45Å; P240-S275 PolarHBondContact O-OG 3.06Å
241	N	93.2	Very high	94.1	Very high	55 Å²	55	26.8 Å²	26.8	29%	0.294	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	8.7	178.8	-70.4	-21.1	0	0	0	113.7	E215 L216 R217 C239 E243	E215-N241 PolarHBondContact OE2-ND2 3.21Å; L216-N241 CarbonylContact O-C 3.58Å; R217-N241 WeakPolarHBondContact CA-O 3.44Å; C239-N241 PolarHBondContact O-N 3.37Å; C239-N241 VanDerWaalsContact O-N 3.11Å; N241-E243 PolarHBondContact O-N 2.87Å
242	L	95.7	Very high	93.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.165	C	C	.	.			trans	-71.1	97.9	-176.8	-172.1	71.9	0	0	0	113.2	L216 L219 V235 V236 C239 L245 S275 I276	L216-L242 HydrophobicContact CG-CD1 4.33Å; L216-L242 VanDerWaalsContact O-CA 3.28Å; L216-L242 WeakPolarHBondContact O-CA 3.44Å; L216-L242 PolarHBondContact O-N 3.01Å; L219-L242 HydrophobicContact CB-CD1 4.1Å; V235-L242 HydrophobicContact CG1-CD2 3.84Å; V236-L242 HydrophobicContact CG1-CD2 4.12Å; C239-L242 HydrophobicContact CB-CB 4.26Å; C239-L242 VanDerWaalsContact O-CB 3.29Å; C239-L242 WeakPolarHBondContact O-CB 3.33Å; C239-L242 PolarHBondContact O-N 2.87Å; C239-L242 VanDerWaalsContact O-N 3.13Å; L242-L245 HydrophobicContact CD2-CB 4.46Å; L242-L245 HydrophobicContact CD2-CD1 4.46Å; L242-L245 HydrophobicContact CD2-CD2 4.33Å; L242-S275 CarbonylContact O-C 3.23Å; L242-S275 PolarHBondContact O-OG 2.73Å; L242-I276 HydrophobicContact CD2-CD1 4.29Å; L242-I276 HydrophobicContact CD2-CG1 4.41Å; L242-I276 HydrophobicContact CG-CG1 4.39Å; L242-I276 WeakPolarHBondContact O-CA 3.39Å; L242-I276 WeakPolarHBondContact O-CG1 3.29Å; L242-I276 PolarHBondContact O-N 3.39Å
243	E	96.9	Very high	93.7	Very high	77 Å²	77	31.5 Å²	31.5	36%	0.36	17%	0.165	S	C	.	.			trans	-88.8	-24.9	-179.1	-66.5	169.8	-128.9	0	0	113.6	R217 N241 H277 F278	R217-E243 IonicContact CZ-OE1 3.38Å; R217-E243 IonicContact NH1-OE1 1.77Å; R217-E243 PolarHBondContact NH1-OE1 3.05Å; R217-E243 PolarHBondContact O-N 2.97Å; N241-E243 PolarHBondContact O-N 2.87Å; E243-H277 PolarHBondContact O-N 2.74Å; E243-F278 PolarHBondContact O-N 3.27Å; E243-F278 VanDerWaalsContact O-N 3.11Å
244	H	98.6	Very high	93.6	Very high	30 Å²	30	31.8 Å²	31.8	14%	0.139	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	124.1	-172	-177.7	118.3	0	0	0	111.7	R217 R218 L219 F278	R217-H244 PolarHBondContact O-N 2.82Å; R217-H244 VanDerWaalsContact O-N 3.09Å; R218-H244 WeakPolarHBondContact CA-O 3.28Å; R218-H244 HydrophobicContact CB-CB 4.27Å; R218-H244 HydrophobicContact CG-CB 3.99Å; L219-H244 PolarHBondContact N-O 3.06Å; H244-F278 HydrophobicContact CB-CB 4.3Å; H244-F278 AromaticContact CD2-CD1 3.87Å; H244-F278 AromaticContact CE1-CD1 3.19Å; H244-F278 WeakPolarHBondContact CE1-CD1 3.35Å; H244-F278 AromaticContact CE1-CD2 3.84Å; H244-F278 AromaticContact CE1-CE1 3.29Å; H244-F278 WeakPolarHBondContact CE1-CE1 3.47Å; H244-F278 AromaticContact CE1-CE2 3.9Å; H244-F278 AromaticContact CE1-CG 3.51Å; H244-F278 AromaticContact CE1-CZ 3.66Å; H244-F278 AromaticContact CG-CD1 3.77Å; H244-F278 AromaticContact ND1-CD1 3.35Å; H244-F278 WeakPolarHBondContact ND1-CD1 3.36Å; H244-F278 AromaticContact ND1-CD2 3.86Å; H244-F278 AromaticContact ND1-CE1 3.95Å; H244-F278 AromaticContact ND1-CG 3.32Å; H244-F278 VanDerWaalsContact ND1-CG 3.32Å; H244-F278 WeakPolarHBondContact ND1-CG 3.38Å; H244-F278 AromaticContact NE2-CD1 3.56Å; H244-F278 AromaticContact NE2-CE1 3.53Å
245	L	98.3	Very high	93.4	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	118	-178.2	-177.8	57.3	0	0	0	110.9	L219 V232 V236 L242 L247 I256 I276 F278 L279 D280	L219-L245 HydrophobicContact CB-CD1 3.94Å; L219-L245 HydrophobicContact CD2-CD1 4.02Å; L219-L245 HydrophobicContact CG-CD1 4.17Å; L219-L245 WeakPolarHBondContact O-CA 3.35Å; V232-L245 HydrophobicContact CG1-CD2 4.22Å; V236-L245 HydrophobicContact CG1-CD2 4.35Å; L242-L245 HydrophobicContact CD2-CB 4.46Å; L242-L245 HydrophobicContact CD2-CD1 4.46Å; L242-L245 HydrophobicContact CD2-CD2 4.33Å; L245-L247 HydrophobicContact CD1-CD2 3.86Å; L245-L247 HydrophobicContact CD1-CG 4.13Å; L245-L247 HydrophobicContact CD2-CD1 4.05Å; L245-L247 HydrophobicContact CD2-CG 4.31Å; L245-L247 HydrophobicContact CG-CD1 4.2Å; L245-L247 HydrophobicContact CG-CD2 4.2Å; L245-L247 HydrophobicContact CG-CG 3.92Å; L245-I256 HydrophobicContact CD2-CD1 3.95Å; L245-I276 HydrophobicContact CB-CD1 4.08Å; L245-I276 HydrophobicContact CD2-CD1 3.71Å; L245-F278 PolarHBondContact N-O 2.8Å; L245-L279 HydrophobicContact CB-CD1 4.28Å; L245-L279 HydrophobicContact CD2-CD1 4.32Å; L245-L279 HydrophobicContact CG-CD1 4.24Å; L245-L279 WeakPolarHBondContact O-CA 3.34Å; L245-D280 PolarHBondContact O-N 2.69Å
246	D	98.1	Very high	92.9	Very high	22 Å²	22	32.4 Å²	32.4	12%	0.118	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	110.2	174.2	171.2	15.8	0	0	0	110	L219 E220 V221 S248 D280	L219-D246 PolarHBondContact O-N 3Å; E220-D246 HydrophobicContact CB-CB 4.31Å; E220-D246 HydrophobicContact CG-CB 4.27Å; V221-D246 VanDerWaalsContact CG2-O 3.23Å; V221-D246 WeakPolarHBondContact CG2-O 3.39Å; V221-D246 PolarHBondContact N-O 3.12Å; D246-S248 WeakPolarHBondContact OD1-CB 3.19Å; D246-S248 PolarHBondContact OD1-N 3.09Å; D246-S248 PolarHBondContact OD1-OG 3.32Å; D246-D280 HydrophobicContact CB-CB 4.38Å
247	L	97.1	Very high	92.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.179	C	C	.	.			trans	-109	18	179.7	-60.1	174.9	0	0	0	111.9	V221 V232 L245 G249 C250 V253 I256 L279 D280 M281	V221-L247 HydrophobicContact CG2-CD2 3.65Å; V232-L247 HydrophobicContact CG1-CD1 4.19Å; V232-L247 HydrophobicContact CG2-CD1 4.19Å; V232-L247 HydrophobicContact CG2-CD2 4.01Å; L245-L247 HydrophobicContact CD1-CD2 3.86Å; L245-L247 HydrophobicContact CD1-CG 4.13Å; L245-L247 HydrophobicContact CD2-CD1 4.05Å; L245-L247 HydrophobicContact CD2-CG 4.31Å; L245-L247 HydrophobicContact CG-CD1 4.2Å; L245-L247 HydrophobicContact CG-CD2 4.2Å; L245-L247 HydrophobicContact CG-CG 3.92Å; L247-G249 PolarHBondContact O-N 2.85Å; L247-C250 HydrophobicContact CB-CB 4.31Å; L247-C250 WeakPolarHBondContact O-CB 3.3Å; L247-C250 PolarHBondContact O-N 2.92Å; L247-C250 PolarHBondContact O-SG 3.02Å; L247-V253 HydrophobicContact CD1-CG1 4.15Å; L247-I256 HydrophobicContact CD1-CD1 3.97Å; L247-L279 HydrophobicContact CD1-CD1 4.39Å; L247-D280 PolarHBondContact N-O 3.4Å; L247-M281 HydrophobicContact CB-CG 4.42Å
248	S	97	Very high	91.4	Very high	21 Å²	21	33.1 Å²	33.1	15%	0.147	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	124.5	-172.5	-59.6	0	0	0	0	112.3	A222 G223 D246 C250 D280 T282	A222-S248 CarbonylContact C-O 3.43Å; A222-S248 VanDerWaalsContact CA-O 3.28Å; A222-S248 WeakPolarHBondContact CA-O 3.33Å; G223-S248 PolarHBondContact N-O 2.92Å; D246-S248 WeakPolarHBondContact OD1-CB 3.19Å; D246-S248 PolarHBondContact OD1-N 3.09Å; D246-S248 PolarHBondContact OD1-OG 3.32Å; S248-C250 VanDerWaalsContact C-N 3.29Å; S248-C250 PolarHBondContact O-N 3.3Å; S248-D280 VanDerWaalsContact OG-CG 3.26Å; S248-D280 PolarHBondContact OG-OD1 3.13Å; S248-T282 CarbonylContact C-O 3.58Å; S248-T282 WeakPolarHBondContact CA-O 3.29Å
249	G	93.8	Very high	89.9	Confident	19 Å²	19	32.4 Å²	32.4	20%	0.196	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	9.8	-179	0	0	0	0	0	115.5	L247 S251 T282	L247-G249 PolarHBondContact O-N 2.85Å; G249-S251 PolarHBondContact O-N 2.86Å; G249-T282 PolarHBondContact N-O 3.11Å
250	C	93.6	Very high	87.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.22	C	C	.	.			trans	-77.1	69.9	170.5	-61.6	0	0	0	0	110.1	L247 S248 K252 V253	L247-C250 HydrophobicContact CB-CB 4.31Å; L247-C250 WeakPolarHBondContact O-CB 3.3Å; L247-C250 PolarHBondContact O-N 2.92Å; L247-C250 PolarHBondContact O-SG 3.02Å; S248-C250 VanDerWaalsContact C-N 3.29Å; S248-C250 PolarHBondContact O-N 3.3Å; C250-K252 PolarHBondContact O-N 2.83Å; C250-V253 HydrophobicContact CB-CB 4.46Å; C250-V253 HydrophobicContact CB-CG2 3.83Å; C250-V253 WeakPolarHBondContact O-CB 3.35Å; C250-V253 PolarHBondContact O-N 2.93Å
251	S	88.6	Confident	86	Confident	45 Å²	45	43.1 Å²	43.1	32%	0.315	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-11.7	-166.3	59.2	0	0	0	0	117.1	G249 S286	G249-S251 PolarHBondContact O-N 2.86Å; S251-S286 WeakPolarHBondContact O-CB 3.32Å; S251-S286 PolarHBondContact O-OG 2.71Å
252	K	91.1	Very high	83.7	Confident	99 Å²	99	42.1 Å²	42.1	43%	0.43	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	-87.3	-10.4	171.1	-48.2	174.9	-173.1	170.7	0	113.4	Y225 N226 I227 C250	Y225-K252 VanDerWaalsContact O-CE 3.27Å; Y225-K252 WeakPolarHBondContact O-CE 3.28Å; N226-K252 PolarHBondContact O-NZ 2.91Å; N226-K252 PolarHBondContact OD1-NZ 3Å; I227-K252 WeakPolarHBondContact O-CB 3.29Å; C250-K252 PolarHBondContact O-N 2.83Å
253	V	91.3	Very high	81.2	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	26%	0.255	C	S	.	.			trans	-79	126.7	176	-179.3	0	0	0	0	109.1	I227 N229 V232 L247 C250	I227-V253 HydrophobicContact CG2-CG2 4.36Å; N229-V253 VanDerWaalsContact OD1-CA 3.26Å; N229-V253 WeakPolarHBondContact OD1-CA 3.07Å; V232-V253 HydrophobicContact CG2-CG2 4.06Å; L247-V253 HydrophobicContact CD1-CG1 4.15Å; C250-V253 HydrophobicContact CB-CB 4.46Å; C250-V253 HydrophobicContact CB-CG2 3.83Å; C250-V253 WeakPolarHBondContact O-CB 3.35Å; C250-V253 PolarHBondContact O-N 2.93Å
254	T	89.9	Confident	78.7	Confident	53 Å²	53	49.4 Å²	49.4	33%	0.325	28%	0.277	S	S	.	.			trans	-124.4	-20.7	-179.2	64.3	0	0	0	0	113.1	N229 S286 L287 G291	N229-T254 PolarHBondContact ND2-OG1 2.91Å; N229-T254 PolarHBondContact OD1-N 2.95Å; T254-S286 WeakPolarHBondContact CG2-O 3.34Å; T254-L287 WeakPolarHBondContact O-CD1 3.16Å; T254-G291 WeakPolarHBondContact O-CA 3.45Å
255	C	87.1	Confident	76.2	Confident	30 Å²	30	57 Å²	57	20%	0.203	31%	0.313	C	S	.	.			trans	-155.9	168	174.8	67.2	0	0	0	0	111.3	N229	N229-C255 PolarHBondContact OD1-N 3.32Å; N229-C255 PolarHBondContact OD1-O 3.29Å
256	I	83.9	Confident	73.6	Confident	3 Å²	3	61.5 Å²	61.5	2%	0.015	34%	0.336	C	S	.	.			trans	-127.5	127.7	164.8	-48.7	178.9	0	0	0	105.8	V232 V236 L245 L247 I274 L279 I295	V232-I256 HydrophobicContact CG1-CD1 4.21Å; V232-I256 HydrophobicContact CG1-CG1 4.02Å; V232-I256 HydrophobicContact CG1-CG2 4.09Å; V236-I256 HydrophobicContact CG1-CG2 4.02Å; V236-I256 HydrophobicContact CG2-CG2 4.05Å; L245-I256 HydrophobicContact CD2-CD1 3.95Å; L247-I256 HydrophobicContact CD1-CD1 3.97Å; I256-I274 HydrophobicContact CG2-CD1 3.79Å; I256-L279 HydrophobicContact CD1-CD1 3.89Å; I256-L279 HydrophobicContact CD1-CD2 4.02Å; I256-I295 HydrophobicContact CB-CG1 3.87Å; I256-I295 HydrophobicContact CG1-CD1 4.14Å; I256-I295 HydrophobicContact CG1-CG1 4.02Å; I256-I295 VanDerWaalsContact N-CG1 3.28Å
257	S	79.7	Confident	70.8	Confident	15 Å²	15	63.5 Å²	63.5	11%	0.105	35%	0.352	C	S	.	.			trans	-144.8	166	-177.1	-167.1	0	0	0	0	110.6	F233 T259 H298	F233-S257 WeakPolarHBondContact CD2-O 3.29Å; S257-T259 PolarHBondContact OG-N 3Å; S257-T259 VanDerWaalsContact OG-N 3.08Å; S257-T259 PolarHBondContact OG-OG1 2.75Å; S257-H298 PolarHBondContact OG-CE1 3.11Å
258	L	71.6	Confident	68.3	Low	30 Å²	30	70.1 Å²	70.1	16%	0.157	40%	0.395	C	S	.	.			trans	-109.5	4.3	164	-64.8	173.4	0	0	0	112.4	V236 Q260 I274	V236-L258 HydrophobicContact CG2-CD2 4Å; L258-Q260 PolarHBondContact O-N 2.72Å; L258-I274 HydrophobicContact CD1-CG1 3.79Å; L258-I274 HydrophobicContact CD2-CD1 4.37Å; L258-I274 HydrophobicContact CD2-CG1 4.18Å; L258-I274 HydrophobicContact CG-CD1 4.13Å; L258-I274 HydrophobicContact CG-CG1 3.89Å
259	T	60.5	Low	65.6	Low	102 Å²	102	77 Å²	77	63%	0.626	43%	0.426	S	S	*	.			trans	-93.3	65.9	-169.3	62.9	0	0	0	0	114.9	S257	S257-T259 PolarHBondContact OG-N 3Å; S257-T259 VanDerWaalsContact OG-N 3.08Å; S257-T259 PolarHBondContact OG-OG1 2.75Å
260	Q	50.3	Low	63.4	Low	144 Å²	144	83.4 Å²	83.4	67%	0.673	45%	0.451	S	S	*	.	S	Bend	trans	-149.9	98.5	152.6	-164.6	158.2	-4.6	0	0	111	F233 L258 A262	F233-Q260 WeakPolarHBondContact CZ-O 3.38Å; L258-Q260 PolarHBondContact O-N 2.72Å; Q260-A262 PolarHBondContact O-N 3.29Å
261	E	49.2	Very low	61.4	Low	157 Å²	157	86.3 Å²	86.3	73%	0.734	48%	0.481	S	S	*	.	S	Bend	trans	59.8	-28.8	168.7	-60.5	178.4	170.1	0	0	118.7	S263 L264	E261-S263 PolarHBondContact O-N 3.18Å; E261-S263 VanDerWaalsContact O-N 3.08Å; E261-L264 PolarHBondContact O-N 3.37Å; E261-L264 VanDerWaalsContact O-N 3.08Å
262	A	44.6	Very low	60.1	Low	34 Å²	34	92 Å²	92	28%	0.281	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-61.6	-18.8	178.7	0	0	0	0	0	114.3	F233 Q260 L264 Q265 L266	F233-A262 HydrophobicContact CE1-CB 4.43Å; F233-A262 HydrophobicContact CZ-CB 3.83Å; Q260-A262 PolarHBondContact O-N 3.29Å; A262-L264 PolarHBondContact O-N 2.6Å; A262-L264 VanDerWaalsContact O-N 3.12Å; A262-Q265 PolarHBondContact O-N 2.91Å; A262-L266 PolarHBondContact O-N 2.86Å
263	S	44.4	Very low	59.2	Low	75 Å²	75	92.7 Å²	92.7	52%	0.524	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-62.4	-11.1	172.2	53.4	0	0	0	0	114.2	E261	E261-S263 PolarHBondContact O-N 3.18Å; E261-S263 VanDerWaalsContact O-N 3.08Å
264	L	44	Very low	58.9	Low	156 Å²	156	93 Å²	93	82%	0.817	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-90.9	-6.6	173.2	-65.3	175	0	0	0	114.3	E261 A262	E261-L264 PolarHBondContact O-N 3.37Å; E261-L264 VanDerWaalsContact O-N 3.08Å; A262-L264 PolarHBondContact O-N 2.6Å; A262-L264 VanDerWaalsContact O-N 3.12Å
265	Q	45.9	Very low	58.8	Low	189 Å²	189	91.6 Å²	91.6	88%	0.883	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	-18	175.4	-67.9	-163.4	3.7	0	0	114.5	A262 S267	A262-Q265 PolarHBondContact O-N 2.91Å; Q265-S267 PolarHBondContact O-N 3.31Å
266	L	44.6	Very low	59.2	Low	97 Å²	97	90.1 Å²	90.1	51%	0.508	49%	0.491	S	S	.	.	S	Bend	trans	-72.2	127.3	170.2	-72.1	171.7	0	0	0	110.5	A262	A262-L266 PolarHBondContact O-N 2.86Å
267	S	39.2	Very low	59.8	Low	64 Å²	64	93 Å²	93	45%	0.448	51%	0.505	S	S	.	.			trans	-52.9	141.1	-176.8	59.3	0	0	0	0	112.8	Q265 M269 H270	Q265-S267 PolarHBondContact O-N 3.31Å; S267-M269 PolarHBondContact O-N 3.19Å; S267-H270 PolarHBondContact O-N 2.82Å
268	P	43.7	Very low	60.7	Low	139 Å²	139	94.4 Å²	94.4	90%	0.903	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	21.9	-173.2	32	-38.6	0	0	0	115.2
269	M	40.8	Very low	61.9	Low	164 Å²	164	93 Å²	93	81%	0.808	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-17.6	-177.9	-63.5	-135.9	70.1	0	0	113.8	S267	S267-M269 PolarHBondContact O-N 3.19Å
270	H	47.1	Very low	63.7	Low	154 Å²	154	89.4 Å²	89.4	71%	0.713	48%	0.478	S	S	*	.	S	Bend	trans	-105.2	117.6	170	-65.2	104.6	0	0	0	108.2	S267	S267-H270 PolarHBondContact O-N 2.82Å
271	G	51.2	Low	66	Low	61 Å²	61	82.6 Å²	82.6	63%	0.629	45%	0.447	S	S	*	.			trans	-64.6	169.1	-178.7	0	0	0	0	0	112.8	Q273	G271-Q273 PolarHBondContact O-N 3.03Å
272	Q	61.8	Low	68.3	Low	164 Å²	164	76 Å²	76	77%	0.766	42%	0.417	S	S	*	.	S	Bend	trans	-70.6	38	-175.9	-61.1	164.7	-29.2	0	0	113.8
273	Q	73.1	Confident	70.7	Confident	115 Å²	115	76 Å²	76	54%	0.537	41%	0.413	S	S	.	.			trans	-131.6	126.1	-168.9	-63.9	-180	-0.9	0	0	110.6	G271 H298 P300	G271-Q273 PolarHBondContact O-N 3.03Å; Q273-H298 CarbonylContact C-O 3.44Å; Q273-H298 WeakPolarHBondContact CA-O 3.41Å; Q273-P300 HydrophobicContact CB-CG 4.24Å; Q273-P300 HydrophobicContact CG-CG 3.92Å
274	I	83.6	Confident	73.1	Confident	8 Å²	8	72.5 Å²	72.5	4%	0.041	39%	0.388	C	S	.	.			trans	-78.9	142.4	176.7	-49.3	171.5	0	0	0	108.9	V236 I256 L258 I276 H298	V236-I274 HydrophobicContact CB-CD1 4.04Å; V236-I274 HydrophobicContact CB-CG2 4.09Å; V236-I274 HydrophobicContact CG1-CD1 4.44Å; V236-I274 HydrophobicContact CG1-CG2 4.31Å; V236-I274 HydrophobicContact CG2-CD1 3.86Å; I256-I274 HydrophobicContact CG2-CD1 3.79Å; L258-I274 HydrophobicContact CD1-CG1 3.79Å; L258-I274 HydrophobicContact CD2-CD1 4.37Å; L258-I274 HydrophobicContact CD2-CG1 4.18Å; L258-I274 HydrophobicContact CG-CD1 4.13Å; L258-I274 HydrophobicContact CG-CG1 3.89Å; I274-I276 VanDerWaalsContact C-N 3.26Å; I274-I276 HydrophobicContact CG2-CB 4.4Å; I274-I276 HydrophobicContact CG2-CD1 3.7Å; I274-I276 HydrophobicContact CG2-CG1 3.75Å; I274-I276 PolarHBondContact O-N 2.93Å; I274-H298 HydrophobicContact CD1-CB 4.02Å; I274-H298 HydrophobicContact CG1-CB 4.29Å; I274-H298 PolarHBondContact N-O 3.01Å
275	S	88.5	Confident	75.4	Confident	22 Å²	22	69.6 Å²	69.6	15%	0.154	37%	0.369	C	S	.	.			trans	-79.4	4.1	-175.4	50	0	0	0	0	115.3	P240 L242 H277	P240-S275 WeakPolarHBondContact O-CB 3.45Å; P240-S275 PolarHBondContact O-OG 3.06Å; L242-S275 CarbonylContact O-C 3.23Å; L242-S275 PolarHBondContact O-OG 2.73Å; S275-H277 PolarHBondContact O-CE1 3.38Å; S275-H277 PolarHBondContact O-N 2.84Å; S275-H277 PolarHBondContact O-ND1 2.82Å; S275-H277 VanDerWaalsContact O-ND1 3.11Å
276	I	94.8	Very high	77.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.34	C	S	.	.			trans	-63.9	126	-175.3	-66.9	166	0	0	0	111.7	V236 L242 L245 I274 F278 L279 R301 L302	V236-I276 HydrophobicContact CG1-CD1 4.13Å; L242-I276 HydrophobicContact CD2-CD1 4.29Å; L242-I276 HydrophobicContact CD2-CG1 4.41Å; L242-I276 HydrophobicContact CG-CG1 4.39Å; L242-I276 WeakPolarHBondContact O-CA 3.39Å; L242-I276 WeakPolarHBondContact O-CG1 3.29Å; L242-I276 PolarHBondContact O-N 3.39Å; L245-I276 HydrophobicContact CB-CD1 4.08Å; L245-I276 HydrophobicContact CD2-CD1 3.71Å; I274-I276 VanDerWaalsContact C-N 3.26Å; I274-I276 HydrophobicContact CG2-CB 4.4Å; I274-I276 HydrophobicContact CG2-CD1 3.7Å; I274-I276 HydrophobicContact CG2-CG1 3.75Å; I274-I276 PolarHBondContact O-N 2.93Å; I276-F278 WeakPolarHBondContact CG2-O 3.2Å; I276-L279 HydrophobicContact CG2-CB 4.19Å; I276-R301 CarbonylContact O-C 3.53Å; I276-L302 HydrophobicContact CG2-CD2 3.93Å
277	H	96.6	Very high	80	Confident	64 Å²	64	57.9 Å²	57.9	30%	0.296	32%	0.316	S	S	.	.	S	Bend	trans	-105.1	-24.9	174.5	-60.3	103.3	0	0	0	112.7	E243 S275 R301 T303 H304	E243-H277 PolarHBondContact O-N 2.74Å; S275-H277 PolarHBondContact O-CE1 3.38Å; S275-H277 PolarHBondContact O-N 2.84Å; S275-H277 PolarHBondContact O-ND1 2.82Å; S275-H277 VanDerWaalsContact O-ND1 3.11Å; H277-R301 PolarHBondContact CD2-O 2.77Å; H277-T303 PolarHBondContact O-N 3.2Å; H277-T303 PolarHBondContact O-OG1 3.09Å; H277-H304 PolarHBondContact O-N 3.07Å
278	F	98.5	Very high	82.7	Confident	44 Å²	44	59.1 Å²	59.1	19%	0.193	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	124.1	178.4	180	-71.2	0	0	0	109.7	E243 H244 L245 I276 D280 H304 Y306	E243-F278 PolarHBondContact O-N 3.27Å; E243-F278 VanDerWaalsContact O-N 3.11Å; H244-F278 HydrophobicContact CB-CB 4.3Å; H244-F278 AromaticContact CD2-CD1 3.87Å; H244-F278 AromaticContact CE1-CD1 3.19Å; H244-F278 WeakPolarHBondContact CE1-CD1 3.35Å; H244-F278 AromaticContact CE1-CD2 3.84Å; H244-F278 AromaticContact CE1-CE1 3.29Å; H244-F278 WeakPolarHBondContact CE1-CE1 3.47Å; H244-F278 AromaticContact CE1-CE2 3.9Å; H244-F278 AromaticContact CE1-CG 3.51Å; H244-F278 AromaticContact CE1-CZ 3.66Å; H244-F278 AromaticContact CG-CD1 3.77Å; H244-F278 AromaticContact ND1-CD1 3.35Å; H244-F278 WeakPolarHBondContact ND1-CD1 3.36Å; H244-F278 AromaticContact ND1-CD2 3.86Å; H244-F278 AromaticContact ND1-CE1 3.95Å; H244-F278 AromaticContact ND1-CG 3.32Å; H244-F278 VanDerWaalsContact ND1-CG 3.32Å; H244-F278 WeakPolarHBondContact ND1-CG 3.38Å; H244-F278 AromaticContact NE2-CD1 3.56Å; H244-F278 AromaticContact NE2-CE1 3.53Å; L245-F278 PolarHBondContact N-O 2.8Å; I276-F278 WeakPolarHBondContact CG2-O 3.2Å; F278-D280 HydrophobicContact CE1-CB 4.07Å; F278-H304 WeakPolarHBondContact CA-O 3.28Å; F278-H304 HydrophobicContact CB-CB 4.36Å; F278-H304 HydrophobicContact CD2-CB 3.57Å; F278-H304 AromaticContact CD2-CG 3.91Å; F278-H304 HydrophobicContact CE2-CB 4.18Å; F278-H304 HydrophobicContact CG-CB 4.17Å; F278-Y306 HydrophobicContact CD2-CE2 4.14Å; F278-Y306 HydrophobicContact CE1-CE2 4.41Å; F278-Y306 HydrophobicContact CE2-CD2 4.29Å; F278-Y306 AromaticContact CE2-CE2 3.45Å; F278-Y306 HydrophobicContact CE2-CE2 3.45Å; F278-Y306 VanDerWaalsContact CE2-CE2 3.45Å; F278-Y306 HydrophobicContact CZ-CD2 4.01Å; F278-Y306 AromaticContact CZ-CE2 3.6Å; F278-Y306 HydrophobicContact CZ-CE2 3.6Å
279	L	98.4	Very high	85.2	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	123.4	174.5	177.9	59.4	0	0	0	110.6	L245 L247 I256 I276 M281 I295 L302 H304 L305 Y306	L245-L279 HydrophobicContact CB-CD1 4.28Å; L245-L279 HydrophobicContact CD2-CD1 4.32Å; L245-L279 HydrophobicContact CG-CD1 4.24Å; L245-L279 WeakPolarHBondContact O-CA 3.34Å; L247-L279 HydrophobicContact CD1-CD1 4.39Å; I256-L279 HydrophobicContact CD1-CD1 3.89Å; I256-L279 HydrophobicContact CD1-CD2 4.02Å; I276-L279 HydrophobicContact CG2-CB 4.19Å; L279-M281 HydrophobicContact CD1-CG 3.86Å; L279-M281 HydrophobicContact CD1-SD 4.4Å; L279-M281 HydrophobicContact CD2-CE 3.94Å; L279-M281 HydrophobicContact CD2-CG 4.36Å; L279-M281 HydrophobicContact CD2-SD 4.14Å; L279-M281 HydrophobicContact CG-CE 4.44Å; L279-M281 HydrophobicContact CG-CG 3.99Å; L279-M281 HydrophobicContact CG-SD 4.42Å; L279-I295 HydrophobicContact CD2-CG2 3.67Å; L279-L302 HydrophobicContact CB-CD2 3.67Å; L279-H304 PolarHBondContact N-O 3.14Å; L279-L305 HydrophobicContact CB-CD1 3.88Å; L279-L305 HydrophobicContact CD2-CD1 3.91Å; L279-L305 HydrophobicContact CG-CD1 3.93Å; L279-L305 WeakPolarHBondContact O-CA 3.41Å; L279-Y306 PolarHBondContact O-N 2.91Å
280	D	98.5	Very high	87.7	Confident	26 Å²	26	50.9 Å²	50.9	14%	0.139	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.3	165.7	-156.3	-28.6	0	0	0	109.8	L245 D246 L247 S248 F278 T282 Y306	L245-D280 PolarHBondContact O-N 2.69Å; D246-D280 HydrophobicContact CB-CB 4.38Å; L247-D280 PolarHBondContact N-O 3.4Å; S248-D280 VanDerWaalsContact OG-CG 3.26Å; S248-D280 PolarHBondContact OG-OD1 3.13Å; F278-D280 HydrophobicContact CE1-CB 4.07Å; D280-T282 WeakPolarHBondContact OD1-CB 3.19Å; D280-T282 PolarHBondContact OD1-N 2.99Å; D280-T282 PolarHBondContact OD1-OG1 3.37Å; D280-Y306 HydrophobicContact CB-CD2 4.33Å; D280-Y306 WeakPolarHBondContact OD1-CB 3.34Å
281	M	97.3	Very high	90	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.234	C	C	.	.			trans	-134	29.5	174.2	-64.2	-169.9	-61.6	0	0	110.3	L247 L279 D283 C284 L287 L292 I295 Y306 L307 C310	L247-M281 HydrophobicContact CB-CG 4.42Å; L279-M281 HydrophobicContact CD1-CG 3.86Å; L279-M281 HydrophobicContact CD1-SD 4.4Å; L279-M281 HydrophobicContact CD2-CE 3.94Å; L279-M281 HydrophobicContact CD2-CG 4.36Å; L279-M281 HydrophobicContact CD2-SD 4.14Å; L279-M281 HydrophobicContact CG-CE 4.44Å; L279-M281 HydrophobicContact CG-CG 3.99Å; L279-M281 HydrophobicContact CG-SD 4.42Å; M281-D283 PolarHBondContact O-N 3.02Å; M281-C284 HydrophobicContact CB-CB 4.1Å; M281-C284 VanDerWaalsContact O-CB 3.25Å; M281-C284 WeakPolarHBondContact O-CB 3.2Å; M281-C284 PolarHBondContact O-N 3.47Å; M281-L287 HydrophobicContact CE-CD1 4.31Å; M281-L287 HydrophobicContact CE-CD2 3.47Å; M281-L287 VanDerWaalsContact CE-CD2 3.47Å; M281-L287 HydrophobicContact SD-CD2 4.37Å; M281-L292 HydrophobicContact CE-CD1 4.27Å; M281-I295 HydrophobicContact CE-CD1 3.43Å; M281-I295 VanDerWaalsContact CE-CD1 3.43Å; M281-I295 HydrophobicContact SD-CD1 3.66Å; M281-Y306 PolarHBondContact N-O 3.05Å; M281-L307 HydrophobicContact CB-CD2 4.31Å; M281-L307 HydrophobicContact CE-CD2 3.47Å; M281-L307 VanDerWaalsContact CE-CD2 3.47Å; M281-C310 PolarHBondContact O-SG 3.38Å
282	T	97.5	Very high	92.1	Very high	18 Å²	18	41.1 Å²	41.1	11%	0.11	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.8	137.7	169.6	-66.8	0	0	0	0	110.1	S248 G249 D280 C284 R308	S248-T282 CarbonylContact C-O 3.58Å; S248-T282 WeakPolarHBondContact CA-O 3.29Å; G249-T282 PolarHBondContact N-O 3.11Å; D280-T282 WeakPolarHBondContact OD1-CB 3.19Å; D280-T282 PolarHBondContact OD1-N 2.99Å; D280-T282 PolarHBondContact OD1-OG1 3.37Å; T282-C284 PolarHBondContact O-N 3.41Å; T282-R308 CarbonylContact C-O 3.59Å; T282-R308 WeakPolarHBondContact CA-O 3.42Å; T282-R308 HydrophobicContact CG2-CB 3.78Å; T282-R308 HydrophobicContact CG2-CG 4.04Å
283	D	95.9	Very high	93.7	Very high	36 Å²	36	36.9 Å²	36.9	19%	0.193	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	14.2	-175.7	-61.9	-51.7	0	0	0	116.1	M281 F285 R308 R309	M281-D283 PolarHBondContact O-N 3.02Å; D283-F285 HydrophobicContact CB-CE2 3.85Å; D283-F285 HydrophobicContact CB-CZ 3.83Å; D283-F285 WeakPolarHBondContact O-CD2 3.23Å; D283-F285 VanDerWaalsContact O-CE2 3.27Å; D283-F285 WeakPolarHBondContact O-CE2 3.33Å; D283-F285 PolarHBondContact O-N 3.35Å; D283-F285 WeakPolarHBondContact OD1-CZ 3.45Å; D283-R308 PolarHBondContact N-O 3.22Å; D283-R309 VanDerWaalsContact CG-NH2 3.28Å; D283-R309 IonicContact OD1-CZ 2.82Å; D283-R309 VanDerWaalsContact OD1-CZ 3.28Å; D283-R309 IonicContact OD1-NE 3.67Å; D283-R309 PolarHBondContact OD1-NE 2.86Å; D283-R309 IonicContact OD1-NH2 3.01Å; D283-R309 PolarHBondContact OD1-NH2 3.43Å; D283-R309 IonicContact OD2-CZ 3.35Å; D283-R309 IonicContact OD2-NE 2.84Å; D283-R309 IonicContact OD2-NH2 3.03Å; D283-R309 PolarHBondContact OD2-NH2 3.28Å
284	C	94.5	Very high	94.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.			trans	-78.2	70.1	164.9	-67.1	0	0	0	0	110.8	M281 T282 S286 L287	M281-C284 HydrophobicContact CB-CB 4.1Å; M281-C284 VanDerWaalsContact O-CB 3.25Å; M281-C284 WeakPolarHBondContact O-CB 3.2Å; M281-C284 PolarHBondContact O-N 3.47Å; T282-C284 PolarHBondContact O-N 3.41Å; C284-S286 PolarHBondContact O-N 2.93Å; C284-L287 HydrophobicContact CB-CB 4.27Å; C284-L287 VanDerWaalsContact O-CB 3.26Å; C284-L287 WeakPolarHBondContact O-CB 3.26Å; C284-L287 PolarHBondContact O-N 2.8Å
285	F	92.4	Very high	95.2	Very high	95 Å²	95	32.5 Å²	32.5	42%	0.417	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-14.5	-177.3	-52.6	-74.2	0	0	0	115.5	D283 R309 R312	D283-F285 HydrophobicContact CB-CE2 3.85Å; D283-F285 HydrophobicContact CB-CZ 3.83Å; D283-F285 WeakPolarHBondContact O-CD2 3.23Å; D283-F285 VanDerWaalsContact O-CE2 3.27Å; D283-F285 WeakPolarHBondContact O-CE2 3.33Å; D283-F285 PolarHBondContact O-N 3.35Å; D283-F285 WeakPolarHBondContact OD1-CZ 3.45Å; F285-R309 WeakPolarHBondContact CD1-O 3.17Å; F285-R309 HydrophobicContact CE1-CB 3.92Å; F285-R312 PolarHBondContact O-NE 2.81Å; F285-R312 VanDerWaalsContact O-NE 3.1Å
286	S	91.5	Very high	95.4	Very high	39 Å²	39	31.5 Å²	31.5	27%	0.273	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-2	-179.7	-50	0	0	0	0	113	S251 T254 C284	S251-S286 WeakPolarHBondContact O-CB 3.32Å; S251-S286 PolarHBondContact O-OG 2.71Å; T254-S286 WeakPolarHBondContact CG2-O 3.34Å; C284-S286 PolarHBondContact O-N 2.93Å
287	L	94.8	Very high	95.3	Very high	1 Å²	1	34 Å²	34	1%	0.005	17%	0.172	C	C	.	.			trans	-76.1	123.9	177.1	177.6	66.7	0	0	0	110.8	T254 M281 C284 I295 L307 C310 L313	T254-L287 WeakPolarHBondContact O-CD1 3.16Å; M281-L287 HydrophobicContact CE-CD1 4.31Å; M281-L287 HydrophobicContact CE-CD2 3.47Å; M281-L287 VanDerWaalsContact CE-CD2 3.47Å; M281-L287 HydrophobicContact SD-CD2 4.37Å; C284-L287 HydrophobicContact CB-CB 4.27Å; C284-L287 VanDerWaalsContact O-CB 3.26Å; C284-L287 WeakPolarHBondContact O-CB 3.26Å; C284-L287 PolarHBondContact O-N 2.8Å; L287-I295 HydrophobicContact CD1-CD1 4.09Å; L287-L307 HydrophobicContact CD2-CD2 3.81Å; L287-C310 HydrophobicContact CD2-CB 4.23Å; L287-L313 HydrophobicContact CD2-CD1 4.11Å; L287-L313 HydrophobicContact CD2-CD2 4.4Å; L287-L313 HydrophobicContact CG-CD2 4.1Å
288	E	95.7	Very high	95	Very high	91 Å²	91	31.8 Å²	31.8	43%	0.425	16%	0.163	S	C	.	.			trans	-119.2	169.3	179.6	-66.4	-179.6	177.6	0	0	111.1	E290 G291 L292 R312	E288-E290 PolarHBondContact O-N 3Å; E288-E290 VanDerWaalsContact O-N 3.17Å; E288-G291 WeakPolarHBondContact O-CA 3.38Å; E288-G291 PolarHBondContact O-N 3.39Å; E288-L292 PolarHBondContact O-N 2.97Å; E288-R312 HydrophobicContact CG-CB 3.92Å; E288-R312 HydrophobicContact CG-CG 4.38Å; E288-R312 WeakPolarHBondContact OE1-CD 3.49Å; E288-R312 IonicContact OE1-CZ 2.67Å; E288-R312 IonicContact OE1-NE 3.86Å; E288-R312 IonicContact OE1-NH1 3.66Å; E288-R312 PolarHBondContact OE1-NH1 3.19Å
289	D	96.3	Very high	94.7	Very high	28 Å²	28	29.7 Å²	29.7	15%	0.15	15%	0.153	C	C	.	.	H	α-helix	trans	-54.2	-37.7	-174.1	-65.2	8.7	0	0	0	113.3	L292 R293 L313 T314 A317	D289-L292 PolarHBondContact O-N 2.82Å; D289-R293 WeakPolarHBondContact O-CB 3.27Å; D289-R293 PolarHBondContact O-N 3.06Å; D289-L313 VanDerWaalsContact OD1-CA 3.31Å; D289-L313 WeakPolarHBondContact OD1-CA 3.19Å; D289-T314 PolarHBondContact OD1-N 3.46Å; D289-T314 WeakPolarHBondContact OD2-CB 3.4Å; D289-T314 WeakPolarHBondContact OD2-CG2 3.27Å; D289-T314 PolarHBondContact OD2-OG1 2.96Å; D289-A317 HydrophobicContact CB-CB 4.02Å
290	E	94.4	Very high	94.4	Very high	102 Å²	102	31.1 Å²	31.1	48%	0.477	16%	0.163	S	C	.	.	H	α-helix	trans	-71.1	-34	177.1	-163.7	57.1	-137.8	0	0	112.4	E288 R293 T294	E288-E290 PolarHBondContact O-N 3Å; E288-E290 VanDerWaalsContact O-N 3.17Å; E290-R293 PolarHBondContact O-N 3.37Å; E290-R293 VanDerWaalsContact OE1-CD 3.27Å; E290-R293 WeakPolarHBondContact OE1-CD 3.26Å; E290-R293 IonicContact OE1-CZ 2.84Å; E290-R293 IonicContact OE1-NE 2.69Å; E290-R293 PolarHBondContact OE1-NE 2.97Å; E290-R293 IonicContact OE1-NH2 3.36Å; E290-R293 IonicContact OE2-CZ 2.81Å; E290-R293 IonicContact OE2-NE 2.72Å; E290-R293 PolarHBondContact OE2-NE 2.85Å; E290-R293 IonicContact OE2-NH2 3.62Å; E290-R293 PolarHBondContact OE2-NH2 2.98Å; E290-T294 WeakPolarHBondContact O-CB 3.36Å; E290-T294 PolarHBondContact O-N 3.02Å; E290-T294 PolarHBondContact O-OG1 3.04Å
291	G	94.3	Very high	94.1	Very high	10 Å²	10	36.1 Å²	36.1	10%	0.103	18%	0.18	C	C	.	.	H	α-helix	trans	-63.8	-45.5	171	0	0	0	0	0	111.3	T254 E288 T294 I295	T254-G291 WeakPolarHBondContact O-CA 3.45Å; E288-G291 WeakPolarHBondContact O-CA 3.38Å; E288-G291 PolarHBondContact O-N 3.39Å; G291-T294 PolarHBondContact O-N 2.97Å; G291-I295 VanDerWaalsContact O-CG1 3.27Å; G291-I295 WeakPolarHBondContact O-CG1 3.26Å; G291-I295 PolarHBondContact O-N 2.82Å
292	L	96.2	Very high	94.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-70	-34.4	176.4	-164.8	68.5	0	0	0	112.6	M281 E288 D289 T294 I295 A296 L305 L307 L313 A317	M281-L292 HydrophobicContact CE-CD1 4.27Å; E288-L292 PolarHBondContact O-N 2.97Å; D289-L292 PolarHBondContact O-N 2.82Å; L292-T294 VanDerWaalsContact C-N 3.33Å; L292-T294 PolarHBondContact O-N 3.22Å; L292-I295 PolarHBondContact O-N 3.11Å; L292-A296 VanDerWaalsContact O-CB 3.27Å; L292-A296 WeakPolarHBondContact O-CB 3.46Å; L292-A296 PolarHBondContact O-N 3.32Å; L292-L305 HydrophobicContact CD1-CD2 4.43Å; L292-L307 HydrophobicContact CD1-CD1 4Å; L292-L307 HydrophobicContact CD1-CD2 4.11Å; L292-L307 HydrophobicContact CD2-CD1 3.82Å; L292-L313 HydrophobicContact CB-CD2 4.03Å; L292-L313 HydrophobicContact CD2-CD1 4.27Å; L292-L313 HydrophobicContact CD2-CD2 4.25Å; L292-A317 HydrophobicContact CB-CB 4.3Å; L292-A317 HydrophobicContact CD2-CB 3.77Å
293	R	95.4	Very high	94.1	Very high	75 Å²	75	35.9 Å²	35.9	28%	0.283	18%	0.178	S	C	.	.	H	α-helix	trans	-56.9	-48.7	170.3	-172.6	-150.1	-53.5	-88.6	-3.1	110.6	D289 E290 I295 A296 S297 H320	D289-R293 WeakPolarHBondContact O-CB 3.27Å; D289-R293 PolarHBondContact O-N 3.06Å; E290-R293 PolarHBondContact O-N 3.37Å; E290-R293 VanDerWaalsContact OE1-CD 3.27Å; E290-R293 WeakPolarHBondContact OE1-CD 3.26Å; E290-R293 IonicContact OE1-CZ 2.84Å; E290-R293 IonicContact OE1-NE 2.69Å; E290-R293 PolarHBondContact OE1-NE 2.97Å; E290-R293 IonicContact OE1-NH2 3.36Å; E290-R293 IonicContact OE2-CZ 2.81Å; E290-R293 IonicContact OE2-NE 2.72Å; E290-R293 PolarHBondContact OE2-NE 2.85Å; E290-R293 IonicContact OE2-NH2 3.62Å; E290-R293 PolarHBondContact OE2-NH2 2.98Å; R293-I295 VanDerWaalsContact C-N 3.33Å; R293-I295 PolarHBondContact O-N 3.38Å; R293-A296 PolarHBondContact O-N 3.27Å; R293-S297 PolarHBondContact O-N 2.65Å; R293-S297 PolarHBondContact O-OG 2.84Å; R293-H320 HydrophobicContact CB-CB 4.21Å; R293-H320 HydrophobicContact CG-CB 4.11Å; R293-H320 PolarHBondContact NH1-CE1 2.97Å; R293-H320 PolarHBondContact NH1-NE2 2.85Å
294	T	93.1	Very high	94.2	Very high	31 Å²	31	36.6 Å²	36.6	19%	0.19	18%	0.18	C	C	.	.	H	α-helix	trans	-62.5	-40.2	-179.9	-55	0	0	0	0	111.5	E290 G291 L292 S297 H298	E290-T294 WeakPolarHBondContact O-CB 3.36Å; E290-T294 PolarHBondContact O-N 3.02Å; E290-T294 PolarHBondContact O-OG1 3.04Å; G291-T294 PolarHBondContact O-N 2.97Å; L292-T294 VanDerWaalsContact C-N 3.33Å; L292-T294 PolarHBondContact O-N 3.22Å; T294-S297 PolarHBondContact O-OG 3.11Å; T294-S297 VanDerWaalsContact O-OG 3.07Å; T294-H298 PolarHBondContact O-N 3.27Å; T294-H298 PolarHBondContact O-ND1 3.43Å
295	I	93.9	Very high	94.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.3	-45.1	174.6	-67.7	167.9	0	0	0	110.8	I256 L279 M281 L287 G291 L292 R293 S297 H298 C299 L302	I256-I295 HydrophobicContact CB-CG1 3.87Å; I256-I295 HydrophobicContact CG1-CD1 4.14Å; I256-I295 HydrophobicContact CG1-CG1 4.02Å; I256-I295 VanDerWaalsContact N-CG1 3.28Å; L279-I295 HydrophobicContact CD2-CG2 3.67Å; M281-I295 HydrophobicContact CE-CD1 3.43Å; M281-I295 VanDerWaalsContact CE-CD1 3.43Å; M281-I295 HydrophobicContact SD-CD1 3.66Å; L287-I295 HydrophobicContact CD1-CD1 4.09Å; G291-I295 VanDerWaalsContact O-CG1 3.27Å; G291-I295 WeakPolarHBondContact O-CG1 3.26Å; G291-I295 PolarHBondContact O-N 2.82Å; L292-I295 PolarHBondContact O-N 3.11Å; R293-I295 VanDerWaalsContact C-N 3.33Å; R293-I295 PolarHBondContact O-N 3.38Å; I295-S297 PolarHBondContact O-N 2.9Å; I295-H298 PolarHBondContact O-N 3.31Å; I295-C299 WeakPolarHBondContact O-CB 3.43Å; I295-C299 PolarHBondContact O-N 2.98Å; I295-L302 HydrophobicContact CG2-CD1 4.33Å
296	A	93.6	Very high	94.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.6	-39.3	-176.8	0	0	0	0	0	112.3	L292 R293 H324 C325	L292-A296 VanDerWaalsContact O-CB 3.27Å; L292-A296 WeakPolarHBondContact O-CB 3.46Å; L292-A296 PolarHBondContact O-N 3.32Å; R293-A296 PolarHBondContact O-N 3.27Å; A296-H324 HydrophobicContact CB-CB 4.06Å; A296-H324 VanDerWaalsContact O-CB 3.24Å; A296-H324 WeakPolarHBondContact O-CB 3.43Å; A296-C325 PolarHBondContact O-SG 2.8Å
297	S	91.9	Very high	95	Very high	52 Å²	52	31.9 Å²	31.9	36%	0.364	15%	0.154	S	C	.	.	H	α-helix	trans	-68.4	-35.9	177.7	62.2	0	0	0	0	113.2	R293 T294 I295	R293-S297 PolarHBondContact O-N 2.65Å; R293-S297 PolarHBondContact O-OG 2.84Å; T294-S297 PolarHBondContact O-OG 3.11Å; T294-S297 VanDerWaalsContact O-OG 3.07Å; I295-S297 PolarHBondContact O-N 2.9Å
298	H	90.4	Very high	95.1	Very high	19 Å²	19	36 Å²	36	9%	0.088	17%	0.169	C	C	.	.	H	α-helix	trans	-85.2	-24.1	177.6	-68.2	97.7	0	0	0	114.1	S257 Q273 I274 T294 I295 P300	S257-H298 PolarHBondContact OG-CE1 3.11Å; Q273-H298 CarbonylContact C-O 3.44Å; Q273-H298 WeakPolarHBondContact CA-O 3.41Å; I274-H298 HydrophobicContact CD1-CB 4.02Å; I274-H298 HydrophobicContact CG1-CB 4.29Å; I274-H298 PolarHBondContact N-O 3.01Å; T294-H298 PolarHBondContact O-N 3.27Å; T294-H298 PolarHBondContact O-ND1 3.43Å; I295-H298 PolarHBondContact O-N 3.31Å; H298-P300 WeakPolarHBondContact O-CD 3.19Å
299	C	92.3	Very high	95.2	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.166	C	C	.	.			trans	-115.5	57.6	-176.6	-56.7	0	0	0	0	113.1	I295 R301 L302 C325	I295-C299 WeakPolarHBondContact O-CB 3.43Å; I295-C299 PolarHBondContact O-N 2.98Å; C299-R301 PolarHBondContact O-N 3.27Å; C299-L302 HydrophobicContact CB-CD1 3.76Å; C299-L302 HydrophobicContact CB-CG 3.82Å; C299-L302 WeakPolarHBondContact O-CG 3.5Å; C299-L302 PolarHBondContact O-N 3.42Å; C299-C325 PolarHBondContact O-SG 2.99Å; C299-C325 VanDerWaalsContact O-SG 3.38Å
300	P	91.6	Very high	95.2	Very high	30 Å²	30	34.7 Å²	34.7	20%	0.195	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-11.5	-176.7	29	-36.1	0	0	0	114	Q273 H298 H324	Q273-P300 HydrophobicContact CB-CG 4.24Å; Q273-P300 HydrophobicContact CG-CG 3.92Å; H298-P300 WeakPolarHBondContact O-CD 3.19Å; P300-H324 WeakPolarHBondContact CA-O 3.49Å; P300-H324 WeakPolarHBondContact CB-O 3.33Å
301	R	93.3	Very high	95.2	Very high	131 Å²	131	32.4 Å²	32.4	49%	0.494	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	1.8	178.3	-62.5	-171.3	-178.2	-172.9	2.8	114.4	I276 H277 C299 T303	I276-R301 CarbonylContact O-C 3.53Å; H277-R301 PolarHBondContact CD2-O 2.77Å; C299-R301 PolarHBondContact O-N 3.27Å; R301-T303 PolarHBondContact O-N 2.63Å
302	L	96.3	Very high	95.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.171	C	C	.	.			trans	-54.4	130.4	179	-78.2	169.4	0	0	0	112.2	I276 L279 I295 C299 L305 C325 S327 I328	I276-L302 HydrophobicContact CG2-CD2 3.93Å; L279-L302 HydrophobicContact CB-CD2 3.67Å; I295-L302 HydrophobicContact CG2-CD1 4.33Å; C299-L302 HydrophobicContact CB-CD1 3.76Å; C299-L302 HydrophobicContact CB-CG 3.82Å; C299-L302 WeakPolarHBondContact O-CG 3.5Å; C299-L302 PolarHBondContact O-N 3.42Å; L302-L305 HydrophobicContact CD1-CD2 4.49Å; L302-C325 HydrophobicContact CB-CB 4.35Å; L302-S327 CarbonylContact O-C 3.59Å; L302-I328 HydrophobicContact CB-CG1 4.31Å; L302-I328 WeakPolarHBondContact O-CG1 3.44Å; L302-I328 PolarHBondContact O-N 2.88Å
303	T	97.6	Very high	95.3	Very high	13 Å²	13	38 Å²	38	8%	0.08	17%	0.172	C	C	.	.			trans	-122.8	-27.1	176.7	58.1	0	0	0	0	112.6	H277 R301 R329 E330	H277-T303 PolarHBondContact O-N 3.2Å; H277-T303 PolarHBondContact O-OG1 3.09Å; R301-T303 PolarHBondContact O-N 2.63Å; T303-R329 WeakPolarHBondContact O-CA 3.32Å; T303-R329 WeakPolarHBondContact O-CB 3.14Å; T303-R329 PolarHBondContact O-N 3.31Å; T303-E330 PolarHBondContact O-N 2.79Å
304	H	98.6	Very high	95.4	Very high	52 Å²	52	36.8 Å²	36.8	24%	0.241	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	126.4	174.5	-49.2	74.1	0	0	0	108.1	H277 F278 L279 Y306 E330	H277-H304 PolarHBondContact O-N 3.07Å; F278-H304 WeakPolarHBondContact CA-O 3.28Å; F278-H304 HydrophobicContact CB-CB 4.36Å; F278-H304 HydrophobicContact CD2-CB 3.57Å; F278-H304 AromaticContact CD2-CG 3.91Å; F278-H304 HydrophobicContact CE2-CB 4.18Å; F278-H304 HydrophobicContact CG-CB 4.17Å; L279-H304 PolarHBondContact N-O 3.14Å; H304-Y306 HydrophobicContact CB-CE2 3.79Å; H304-E330 WeakPolarHBondContact CA-O 3.17Å; H304-E330 HydrophobicContact CB-CB 4.41Å; H304-E330 IonicContact CD2-OE2 3.31Å
305	L	98.6	Very high	95.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	122	-179.1	-177.6	61.8	0	0	0	111	L279 L292 L302 L307 L321 E330 L331 S332	L279-L305 HydrophobicContact CB-CD1 3.88Å; L279-L305 HydrophobicContact CD2-CD1 3.91Å; L279-L305 HydrophobicContact CG-CD1 3.93Å; L279-L305 WeakPolarHBondContact O-CA 3.41Å; L292-L305 HydrophobicContact CD1-CD2 4.43Å; L302-L305 HydrophobicContact CD1-CD2 4.49Å; L305-L307 HydrophobicContact CD1-CD2 3.94Å; L305-L307 HydrophobicContact CD1-CG 4.28Å; L305-L307 HydrophobicContact CD2-CD1 3.96Å; L305-L307 HydrophobicContact CD2-CG 4.34Å; L305-L307 HydrophobicContact CG-CD1 4.12Å; L305-L307 HydrophobicContact CG-CD2 4.18Å; L305-L307 HydrophobicContact CG-CG 3.96Å; L305-L321 HydrophobicContact CD2-CD1 3.41Å; L305-L321 VanDerWaalsContact CD2-CD1 3.41Å; L305-L321 HydrophobicContact CD2-CD2 3.88Å; L305-L321 HydrophobicContact CD2-CG 4.29Å; L305-E330 PolarHBondContact N-O 3.01Å; L305-L331 HydrophobicContact CB-CD1 4.14Å; L305-L331 HydrophobicContact CD2-CD1 4.23Å; L305-L331 HydrophobicContact CG-CD1 4.29Å; L305-L331 WeakPolarHBondContact O-CA 3.43Å; L305-S332 PolarHBondContact O-N 2.97Å
306	Y	98.6	Very high	95.9	Very high	35 Å²	35	40.1 Å²	40.1	14%	0.137	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	121.3	-179.5	-50	-94.6	0	0	0	109.5	F278 L279 D280 M281 H304 E330 Y356	F278-Y306 HydrophobicContact CD2-CE2 4.14Å; F278-Y306 HydrophobicContact CE1-CE2 4.41Å; F278-Y306 HydrophobicContact CE2-CD2 4.29Å; F278-Y306 AromaticContact CE2-CE2 3.45Å; F278-Y306 HydrophobicContact CE2-CE2 3.45Å; F278-Y306 VanDerWaalsContact CE2-CE2 3.45Å; F278-Y306 HydrophobicContact CZ-CD2 4.01Å; F278-Y306 AromaticContact CZ-CE2 3.6Å; F278-Y306 HydrophobicContact CZ-CE2 3.6Å; L279-Y306 PolarHBondContact O-N 2.91Å; D280-Y306 HydrophobicContact CB-CD2 4.33Å; D280-Y306 WeakPolarHBondContact OD1-CB 3.34Å; M281-Y306 PolarHBondContact N-O 3.05Å; H304-Y306 HydrophobicContact CB-CE2 3.79Å; Y306-E330 PolarHBondContact OH-OE2 3.01Å; Y306-Y356 HydrophobicContact CE1-CE1 4.46Å
307	L	98	Very high	96	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.187	C	C	.	.			trans	-127.2	30.6	-172.5	-57.7	173.6	0	0	0	110.3	M281 L287 L292 L305 R309 C310 L313 S332 L333 C336	M281-L307 HydrophobicContact CB-CD2 4.31Å; M281-L307 HydrophobicContact CE-CD2 3.47Å; M281-L307 VanDerWaalsContact CE-CD2 3.47Å; L287-L307 HydrophobicContact CD2-CD2 3.81Å; L292-L307 HydrophobicContact CD1-CD1 4Å; L292-L307 HydrophobicContact CD1-CD2 4.11Å; L292-L307 HydrophobicContact CD2-CD1 3.82Å; L305-L307 HydrophobicContact CD1-CD2 3.94Å; L305-L307 HydrophobicContact CD1-CG 4.28Å; L305-L307 HydrophobicContact CD2-CD1 3.96Å; L305-L307 HydrophobicContact CD2-CG 4.34Å; L305-L307 HydrophobicContact CG-CD1 4.12Å; L305-L307 HydrophobicContact CG-CD2 4.18Å; L305-L307 HydrophobicContact CG-CG 3.96Å; L307-R309 PolarHBondContact O-N 3.03Å; L307-C310 HydrophobicContact CB-CB 4.3Å; L307-C310 VanDerWaalsContact O-CB 3.28Å; L307-C310 WeakPolarHBondContact O-CB 3.2Å; L307-C310 PolarHBondContact O-N 2.9Å; L307-C310 VanDerWaalsContact O-N 3.12Å; L307-C310 PolarHBondContact O-SG 2.85Å; L307-C310 VanDerWaalsContact O-SG 3.41Å; L307-L313 HydrophobicContact CB-CD1 4.07Å; L307-L313 HydrophobicContact CD1-CD1 3.79Å; L307-L313 HydrophobicContact CG-CD1 4.35Å; L307-S332 WeakPolarHBondContact CA-O 3.34Å; L307-S332 PolarHBondContact N-O 2.79Å; L307-L333 HydrophobicContact CB-CD2 4.34Å; L307-L333 HydrophobicContact CD1-CD2 3.87Å; L307-C336 PolarHBondContact O-SG 3.36Å
308	R	97.9	Very high	96.3	Very high	88 Å²	88	37.7 Å²	37.7	33%	0.332	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	132.7	-171.9	167.7	-177.7	-63.9	-167.9	0	110.3	T282 D283 C310 S334	T282-R308 CarbonylContact C-O 3.59Å; T282-R308 WeakPolarHBondContact CA-O 3.42Å; T282-R308 HydrophobicContact CG2-CB 3.78Å; T282-R308 HydrophobicContact CG2-CG 4.04Å; D283-R308 PolarHBondContact N-O 3.22Å; R308-C310 PolarHBondContact O-N 2.97Å; R308-S334 CarbonylContact C-O 3.59Å; R308-S334 VanDerWaalsContact CA-O 3.24Å; R308-S334 WeakPolarHBondContact CA-O 3.21Å
309	R	96.8	Very high	96.7	Very high	91 Å²	91	41 Å²	41	34%	0.343	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	16.8	-176.3	-65.5	179.4	-63.7	-112.3	4.9	115.1	D283 F285 L307 S311 S334 D335	D283-R309 VanDerWaalsContact CG-NH2 3.28Å; D283-R309 IonicContact OD1-CZ 2.82Å; D283-R309 VanDerWaalsContact OD1-CZ 3.28Å; D283-R309 IonicContact OD1-NE 3.67Å; D283-R309 PolarHBondContact OD1-NE 2.86Å; D283-R309 IonicContact OD1-NH2 3.01Å; D283-R309 PolarHBondContact OD1-NH2 3.43Å; D283-R309 IonicContact OD2-CZ 3.35Å; D283-R309 IonicContact OD2-NE 2.84Å; D283-R309 IonicContact OD2-NH2 3.03Å; D283-R309 PolarHBondContact OD2-NH2 3.28Å; F285-R309 WeakPolarHBondContact CD1-O 3.17Å; F285-R309 HydrophobicContact CE1-CB 3.92Å; L307-R309 PolarHBondContact O-N 3.03Å; R309-S311 PolarHBondContact O-N 2.63Å; R309-S334 PolarHBondContact N-O 3Å; R309-D335 HydrophobicContact CB-CB 4.28Å; R309-D335 HydrophobicContact CG-CB 3.4Å
310	C	96.3	Very high	96.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.185	C	C	.	.			trans	-72.1	72.1	163.5	-63	0	0	0	0	109.6	M281 L287 L307 R308 R312 L313 C336	M281-C310 PolarHBondContact O-SG 3.38Å; L287-C310 HydrophobicContact CD2-CB 4.23Å; L307-C310 HydrophobicContact CB-CB 4.3Å; L307-C310 VanDerWaalsContact O-CB 3.28Å; L307-C310 WeakPolarHBondContact O-CB 3.2Å; L307-C310 PolarHBondContact O-N 2.9Å; L307-C310 VanDerWaalsContact O-N 3.12Å; L307-C310 PolarHBondContact O-SG 2.85Å; L307-C310 VanDerWaalsContact O-SG 3.41Å; R308-C310 PolarHBondContact O-N 2.97Å; C310-R312 VanDerWaalsContact C-N 3.26Å; C310-R312 PolarHBondContact O-N 2.81Å; C310-L313 HydrophobicContact CB-CD1 3.58Å; C310-L313 HydrophobicContact CB-CG 3.94Å; C310-L313 WeakPolarHBondContact O-CB 3.22Å; C310-L313 PolarHBondContact O-N 3.06Å; C310-C336 PolarHBondContact O-SG 3.04Å
311	S	93.9	Very high	97.1	Very high	53 Å²	53	40.3 Å²	40.3	37%	0.371	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-11.3	-163.2	56.1	0	0	0	0	115.3	R309 L338	R309-S311 PolarHBondContact O-N 2.63Å; S311-L338 WeakPolarHBondContact O-CD1 3.33Å
312	R	95.8	Very high	97.1	Very high	126 Å²	126	34.5 Å²	34.5	48%	0.475	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-14.5	174.4	-53.1	-174.6	-172.4	-148.5	-3.5	113.6	F285 E288 C310	F285-R312 PolarHBondContact O-NE 2.81Å; F285-R312 VanDerWaalsContact O-NE 3.1Å; E288-R312 HydrophobicContact CG-CB 3.92Å; E288-R312 HydrophobicContact CG-CG 4.38Å; E288-R312 WeakPolarHBondContact OE1-CD 3.49Å; E288-R312 IonicContact OE1-CZ 2.67Å; E288-R312 IonicContact OE1-NE 3.86Å; E288-R312 IonicContact OE1-NH1 3.66Å; E288-R312 PolarHBondContact OE1-NH1 3.19Å; C310-R312 VanDerWaalsContact C-N 3.26Å; C310-R312 PolarHBondContact O-N 2.81Å
313	L	97.6	Very high	97.1	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	18%	0.178	C	C	.	.			trans	-68.5	130	-178.3	-68.6	180	0	0	0	112.3	L287 D289 L292 L307 C310 A317 L338	L287-L313 HydrophobicContact CD2-CD1 4.11Å; L287-L313 HydrophobicContact CD2-CD2 4.4Å; L287-L313 HydrophobicContact CG-CD2 4.1Å; D289-L313 VanDerWaalsContact OD1-CA 3.31Å; D289-L313 WeakPolarHBondContact OD1-CA 3.19Å; L292-L313 HydrophobicContact CB-CD2 4.03Å; L292-L313 HydrophobicContact CD2-CD1 4.27Å; L292-L313 HydrophobicContact CD2-CD2 4.25Å; L307-L313 HydrophobicContact CB-CD1 4.07Å; L307-L313 HydrophobicContact CD1-CD1 3.79Å; L307-L313 HydrophobicContact CG-CD1 4.35Å; C310-L313 HydrophobicContact CB-CD1 3.58Å; C310-L313 HydrophobicContact CB-CG 3.94Å; C310-L313 WeakPolarHBondContact O-CB 3.22Å; C310-L313 PolarHBondContact O-N 3.06Å; L313-A317 HydrophobicContact CD2-CB 3.87Å; L313-L338 WeakPolarHBondContact O-CB 3.39Å
314	T	98.2	Very high	96.9	Very high	49 Å²	49	41.3 Å²	41.3	30%	0.301	19%	0.189	S	C	.	.			trans	-108.4	-179.6	176	91.3	0	0	0	0	112.7	D289 E316 A317 L338	D289-T314 PolarHBondContact OD1-N 3.46Å; D289-T314 WeakPolarHBondContact OD2-CB 3.4Å; D289-T314 WeakPolarHBondContact OD2-CG2 3.27Å; D289-T314 PolarHBondContact OD2-OG1 2.96Å; T314-E316 PolarHBondContact O-N 3.21Å; T314-E316 PolarHBondContact OG1-N 2.91Å; T314-A317 WeakPolarHBondContact O-CB 3.47Å; T314-A317 PolarHBondContact O-N 3.2Å; T314-L338 HydrophobicContact CG2-CB 4.38Å; T314-L338 HydrophobicContact CG2-CD1 4.24Å
315	D	98.3	Very high	96.7	Very high	34 Å²	34	38.9 Å²	38.9	18%	0.182	18%	0.178	C	C	.	.	H	α-helix	trans	-59.9	-26.8	175.3	-62.3	-29.6	0	0	0	113	L318 R319 V339 G340 F342 G343	D315-L318 PolarHBondContact O-N 2.82Å; D315-R319 PolarHBondContact O-N 3.34Å; D315-R319 VanDerWaalsContact O-N 3.15Å; D315-V339 VanDerWaalsContact OD1-CA 3.3Å; D315-V339 WeakPolarHBondContact OD1-CA 3.26Å; D315-G340 PolarHBondContact OD1-N 3.07Å; D315-F342 HydrophobicContact CB-CB 4.24Å; D315-G343 WeakPolarHBondContact OD1-CA 3.18Å; D315-G343 PolarHBondContact OD1-N 3.34Å
316	E	97.8	Very high	96.5	Very high	67 Å²	67	42.3 Å²	42.3	31%	0.313	20%	0.2	S	C	.	.	H	α-helix	trans	-66.2	-36.5	176.4	173.4	65.6	-176.9	0	0	111.8	T314 L318 R319 H320	T314-E316 PolarHBondContact O-N 3.21Å; T314-E316 PolarHBondContact OG1-N 2.91Å; E316-L318 PolarHBondContact O-N 3.29Å; E316-R319 VanDerWaalsContact O-CB 3.32Å; E316-R319 WeakPolarHBondContact O-CB 3.26Å; E316-R319 PolarHBondContact O-N 3.44Å; E316-R319 IonicContact OE1-CZ 3.12Å; E316-R319 IonicContact OE1-NE 3.79Å; E316-R319 IonicContact OE1-NH2 2.71Å; E316-R319 PolarHBondContact OE1-NH2 2.94Å; E316-R319 IonicContact OE2-CZ 3.63Å; E316-R319 IonicContact OE2-NE 3.78Å; E316-R319 PolarHBondContact OE2-NE 2.73Å; E316-R319 IonicContact OE2-NH2 2.73Å; E316-R319 PolarHBondContact OE2-NH2 2.72Å; E316-H320 WeakPolarHBondContact CG-NE2 3.45Å; E316-H320 PolarHBondContact O-CD2 2.97Å; E316-H320 PolarHBondContact O-N 3.05Å; E316-H320 IonicContact OE1-CD2 4Å; E316-H320 IonicContact OE1-CE1 3.6Å; E316-H320 CovalentContact OE1-NE2 1.77Å; E316-H320 IonicContact OE1-NE2 3.77Å; E316-H320 PolarHBondContact OE1-NE2 3.37Å; E316-H320 IonicContact OE2-NE2 2.67Å; E316-H320 PolarHBondContact OE2-NE2 3.22Å
317	A	97.4	Very high	96.3	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.6	-37.3	173.9	0	0	0	0	0	112	D289 L292 L313 T314 H320 L321	D289-A317 HydrophobicContact CB-CB 4.02Å; L292-A317 HydrophobicContact CB-CB 4.3Å; L292-A317 HydrophobicContact CD2-CB 3.77Å; L313-A317 HydrophobicContact CD2-CB 3.87Å; T314-A317 WeakPolarHBondContact O-CB 3.47Å; T314-A317 PolarHBondContact O-N 3.2Å; A317-H320 PolarHBondContact O-N 2.67Å; A317-L321 PolarHBondContact O-N 2.75Å
318	L	97.9	Very high	96.2	Very high	2 Å²	2	43 Å²	43	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-74.8	-28.4	179.7	-57.9	175.6	0	0	0	112.2	D315 E316 H320 L321 A322 L333 V339 E346 V347	D315-L318 PolarHBondContact O-N 2.82Å; E316-L318 PolarHBondContact O-N 3.29Å; L318-H320 VanDerWaalsContact C-N 3.34Å; L318-L321 HydrophobicContact CD2-CD2 4.11Å; L318-L321 PolarHBondContact O-N 3.25Å; L318-A322 WeakPolarHBondContact O-CB 3.4Å; L318-A322 PolarHBondContact O-N 3.36Å; L318-L333 HydrophobicContact CD1-CD1 3.72Å; L318-L333 HydrophobicContact CD2-CD1 3.73Å; L318-L333 HydrophobicContact CD2-CD2 3.74Å; L318-L333 HydrophobicContact CD2-CG 4.38Å; L318-L333 HydrophobicContact CG-CD1 4.4Å; L318-V339 HydrophobicContact CD1-CB 4.39Å; L318-V339 HydrophobicContact CD1-CG1 3.51Å; L318-V339 HydrophobicContact CD1-CG2 3.91Å; L318-E346 HydrophobicContact CB-CB 4.46Å; L318-V347 HydrophobicContact CB-CG2 4.34Å; L318-V347 HydrophobicContact CD1-CG2 4.15Å; L318-V347 HydrophobicContact CD2-CG2 4.28Å; L318-V347 HydrophobicContact CG-CG2 4.49Å
319	R	97.3	Very high	96.2	Very high	89 Å²	89	43.7 Å²	43.7	34%	0.336	21%	0.213	S	C	.	.	H	α-helix	trans	-61	-41.5	169.8	-167.2	179.2	68.3	87.5	-8.7	111.9	D315 E316 L323 E346	D315-R319 PolarHBondContact O-N 3.34Å; D315-R319 VanDerWaalsContact O-N 3.15Å; E316-R319 VanDerWaalsContact O-CB 3.32Å; E316-R319 WeakPolarHBondContact O-CB 3.26Å; E316-R319 PolarHBondContact O-N 3.44Å; E316-R319 IonicContact OE1-CZ 3.12Å; E316-R319 IonicContact OE1-NE 3.79Å; E316-R319 IonicContact OE1-NH2 2.71Å; E316-R319 PolarHBondContact OE1-NH2 2.94Å; E316-R319 IonicContact OE2-CZ 3.63Å; E316-R319 IonicContact OE2-NE 3.78Å; E316-R319 PolarHBondContact OE2-NE 2.73Å; E316-R319 IonicContact OE2-NH2 2.73Å; E316-R319 PolarHBondContact OE2-NH2 2.72Å; R319-L323 VanDerWaalsContact O-CB 3.32Å; R319-L323 WeakPolarHBondContact O-CB 3.35Å; R319-L323 PolarHBondContact O-N 2.96Å; R319-L323 VanDerWaalsContact O-N 3.12Å; R319-E346 HydrophobicContact CB-CG 4.08Å; R319-E346 HydrophobicContact CG-CG 4.35Å
320	H	96.3	Very high	96.3	Very high	13 Å²	13	42 Å²	42	6%	0.06	21%	0.209	C	C	.	.	H	α-helix	trans	-72.5	-40.4	176	-65.4	-55.6	0	0	0	112.3	R293 E316 A317 L318 A322 L323 H324	R293-H320 HydrophobicContact CB-CB 4.21Å; R293-H320 HydrophobicContact CG-CB 4.11Å; R293-H320 PolarHBondContact NH1-CE1 2.97Å; R293-H320 PolarHBondContact NH1-NE2 2.85Å; E316-H320 WeakPolarHBondContact CG-NE2 3.45Å; E316-H320 PolarHBondContact O-CD2 2.97Å; E316-H320 PolarHBondContact O-N 3.05Å; E316-H320 IonicContact OE1-CD2 4Å; E316-H320 IonicContact OE1-CE1 3.6Å; E316-H320 CovalentContact OE1-NE2 1.77Å; E316-H320 IonicContact OE1-NE2 3.77Å; E316-H320 PolarHBondContact OE1-NE2 3.37Å; E316-H320 IonicContact OE2-NE2 2.67Å; E316-H320 PolarHBondContact OE2-NE2 3.22Å; A317-H320 PolarHBondContact O-N 2.67Å; L318-H320 VanDerWaalsContact C-N 3.34Å; H320-A322 VanDerWaalsContact C-N 3.34Å; H320-A322 PolarHBondContact O-N 3.29Å; H320-L323 PolarHBondContact O-N 2.87Å; H320-L323 VanDerWaalsContact O-N 3.14Å; H320-H324 PolarHBondContact O-CD2 3.24Å; H320-H324 VanDerWaalsContact O-CD2 3.27Å; H320-H324 PolarHBondContact O-N 3.5Å
321	L	95.8	Very high	96.4	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-58.1	-45.9	174.9	-170.9	67.7	0	0	0	111.8	L305 A317 L318 L323 C325 I328 L331	L305-L321 HydrophobicContact CD2-CD1 3.41Å; L305-L321 VanDerWaalsContact CD2-CD1 3.41Å; L305-L321 HydrophobicContact CD2-CD2 3.88Å; L305-L321 HydrophobicContact CD2-CG 4.29Å; A317-L321 PolarHBondContact O-N 2.75Å; L318-L321 HydrophobicContact CD2-CD2 4.11Å; L318-L321 PolarHBondContact O-N 3.25Å; L321-L323 VanDerWaalsContact C-N 3.32Å; L321-L323 PolarHBondContact O-N 2.92Å; L321-C325 HydrophobicContact CD1-CB 4.16Å; L321-C325 WeakPolarHBondContact O-CA 3.33Å; L321-C325 WeakPolarHBondContact O-CB 3.42Å; L321-C325 PolarHBondContact O-N 3.44Å; L321-I328 HydrophobicContact CD1-CD1 3.54Å; L321-I328 HydrophobicContact CD2-CD1 3.96Å; L321-I328 HydrophobicContact CG-CD1 3.62Å; L321-L331 HydrophobicContact CD2-CD1 3.85Å; L321-L331 HydrophobicContact CD2-CD2 4.12Å
322	A	94.9	Very high	96.6	Very high	9 Å²	9	39.5 Å²	39.5	7%	0.074	19%	0.192	C	C	.	.	H	α-helix	trans	-69.6	-26.2	176.7	0	0	0	0	0	113.7	L318 H320 E346 R349 L350	L318-A322 WeakPolarHBondContact O-CB 3.4Å; L318-A322 PolarHBondContact O-N 3.36Å; H320-A322 VanDerWaalsContact C-N 3.34Å; H320-A322 PolarHBondContact O-N 3.29Å; A322-E346 VanDerWaalsContact CB-O 3.29Å; A322-E346 WeakPolarHBondContact CB-O 3.29Å; A322-R349 HydrophobicContact CB-CB 4.29Å; A322-L350 HydrophobicContact CB-CD2 4.47Å
323	L	94.9	Very high	96.8	Very high	89 Å²	89	33.6 Å²	33.6	47%	0.466	17%	0.169	S	C	.	.	H	α-helix	trans	-77.7	-39.4	178	-178.2	61.4	0	0	0	112.9	R319 H320 L321	R319-L323 VanDerWaalsContact O-CB 3.32Å; R319-L323 WeakPolarHBondContact O-CB 3.35Å; R319-L323 PolarHBondContact O-N 2.96Å; R319-L323 VanDerWaalsContact O-N 3.12Å; H320-L323 PolarHBondContact O-N 2.87Å; H320-L323 VanDerWaalsContact O-N 3.14Å; L321-L323 VanDerWaalsContact C-N 3.32Å; L321-L323 PolarHBondContact O-N 2.92Å
324	H	94.3	Very high	96.8	Very high	67 Å²	67	33.6 Å²	33.6	31%	0.31	17%	0.169	S	C	.	.	H	α-helix	trans	-106.7	-22.6	-171.7	-58.7	-66.6	0	0	0	114.7	A296 P300 H320 P326	A296-H324 HydrophobicContact CB-CB 4.06Å; A296-H324 VanDerWaalsContact O-CB 3.24Å; A296-H324 WeakPolarHBondContact O-CB 3.43Å; P300-H324 WeakPolarHBondContact CA-O 3.49Å; P300-H324 WeakPolarHBondContact CB-O 3.33Å; H320-H324 PolarHBondContact O-CD2 3.24Å; H320-H324 VanDerWaalsContact O-CD2 3.27Å; H320-H324 PolarHBondContact O-N 3.5Å; H324-P326 VanDerWaalsContact O-CD 3.26Å; H324-P326 WeakPolarHBondContact O-CD 3.46Å
325	C	94.6	Very high	96.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.			trans	-119.4	57.9	-176.1	-54.8	0	0	0	0	113.4	A296 C299 L302 L321 S327 I328 L350	A296-C325 PolarHBondContact O-SG 2.8Å; C299-C325 PolarHBondContact O-SG 2.99Å; C299-C325 VanDerWaalsContact O-SG 3.38Å; L302-C325 HydrophobicContact CB-CB 4.35Å; L321-C325 HydrophobicContact CD1-CB 4.16Å; L321-C325 WeakPolarHBondContact O-CA 3.33Å; L321-C325 WeakPolarHBondContact O-CB 3.42Å; L321-C325 PolarHBondContact O-N 3.44Å; C325-S327 PolarHBondContact O-N 3.32Å; C325-I328 HydrophobicContact CB-CD1 3.56Å; C325-I328 HydrophobicContact CB-CG1 4.03Å; C325-I328 WeakPolarHBondContact O-CG1 3.49Å; C325-I328 PolarHBondContact O-N 3.09Å; C325-L350 WeakPolarHBondContact O-CD2 3.29Å
326	P	93.1	Very high	96.7	Very high	73 Å²	73	30.9 Å²	30.9	47%	0.474	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-5.7	-175.8	29.9	-37.5	0	0	0	114.8	H324 C353	H324-P326 VanDerWaalsContact O-CD 3.26Å; H324-P326 WeakPolarHBondContact O-CD 3.46Å; P326-C353 PolarHBondContact O-SG 2.77Å
327	S	94.8	Very high	96.6	Very high	50 Å²	50	34.8 Å²	34.8	35%	0.35	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-0.7	-179.9	-69	0	0	0	0	114.6	L302 C325 R329	L302-S327 CarbonylContact O-C 3.59Å; C325-S327 PolarHBondContact O-N 3.32Å; S327-R329 WeakPolarHBondContact O-CG 3.25Å; S327-R329 PolarHBondContact O-N 3.32Å
328	I	97.2	Very high	96.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.18	C	C	.	.			trans	-61.6	131	-174.6	-71.3	168.9	0	0	0	112.3	L302 L321 C325 L331 L350 C353 L354	L302-I328 HydrophobicContact CB-CG1 4.31Å; L302-I328 WeakPolarHBondContact O-CG1 3.44Å; L302-I328 PolarHBondContact O-N 2.88Å; L321-I328 HydrophobicContact CD1-CD1 3.54Å; L321-I328 HydrophobicContact CD2-CD1 3.96Å; L321-I328 HydrophobicContact CG-CD1 3.62Å; C325-I328 HydrophobicContact CB-CD1 3.56Å; C325-I328 HydrophobicContact CB-CG1 4.03Å; C325-I328 WeakPolarHBondContact O-CG1 3.49Å; C325-I328 PolarHBondContact O-N 3.09Å; I328-L331 HydrophobicContact CG2-CB 4.1Å; I328-L350 HydrophobicContact CB-CD1 4Å; I328-L350 HydrophobicContact CB-CD2 4.3Å; I328-L350 HydrophobicContact CG2-CD1 3.97Å; I328-C353 CarbonylContact O-C 3.45Å; I328-C353 VanDerWaalsContact O-CB 3.3Å; I328-C353 WeakPolarHBondContact O-CB 3.29Å; I328-L354 HydrophobicContact CG2-CD1 4.24Å; I328-L354 PolarHBondContact O-N 2.76Å
329	R	97.7	Very high	96.6	Very high	102 Å²	102	37.6 Å²	37.6	39%	0.385	18%	0.18	S	C	.	.			trans	-116.4	-36.2	-177.7	-56.2	177.4	-175.3	166.9	1.8	111.1	T303 S327 R355 Y356	T303-R329 WeakPolarHBondContact O-CA 3.32Å; T303-R329 WeakPolarHBondContact O-CB 3.14Å; T303-R329 PolarHBondContact O-N 3.31Å; S327-R329 WeakPolarHBondContact O-CG 3.25Å; S327-R329 PolarHBondContact O-N 3.32Å; R329-R355 WeakPolarHBondContact O-CA 3.39Å; R329-R355 PolarHBondContact O-N 2.87Å; R329-Y356 PolarHBondContact O-N 3.14Å
330	E	98.6	Very high	96.7	Very high	54 Å²	54	33.5 Å²	33.5	25%	0.252	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	124.6	178	-50.5	-149.3	161.2	0	0	110.3	T303 H304 L305 Y306 Y356	T303-E330 PolarHBondContact O-N 2.79Å; H304-E330 WeakPolarHBondContact CA-O 3.17Å; H304-E330 HydrophobicContact CB-CB 4.41Å; H304-E330 IonicContact CD2-OE2 3.31Å; L305-E330 PolarHBondContact N-O 3.01Å; Y306-E330 PolarHBondContact OH-OE2 3.01Å; E330-Y356 WeakPolarHBondContact CA-O 3.49Å; E330-Y356 HydrophobicContact CB-CD1 4.18Å; E330-Y356 HydrophobicContact CB-CG 4.22Å; E330-Y356 HydrophobicContact CG-CG 4.4Å
331	L	98.6	Very high	96.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	127.4	-179	-176.7	59.4	0	0	0	110.7	L305 L321 I328 L333 V347 L350 L354 Y356 L357 S358	L305-L331 HydrophobicContact CB-CD1 4.14Å; L305-L331 HydrophobicContact CD2-CD1 4.23Å; L305-L331 HydrophobicContact CG-CD1 4.29Å; L305-L331 WeakPolarHBondContact O-CA 3.43Å; L321-L331 HydrophobicContact CD2-CD1 3.85Å; L321-L331 HydrophobicContact CD2-CD2 4.12Å; I328-L331 HydrophobicContact CG2-CB 4.1Å; L331-L333 HydrophobicContact CD1-CD2 4.08Å; L331-L333 HydrophobicContact CD1-CG 4.35Å; L331-L333 HydrophobicContact CD2-CD1 4.09Å; L331-L333 HydrophobicContact CD2-CG 4.31Å; L331-L333 HydrophobicContact CG-CD1 4.37Å; L331-L333 HydrophobicContact CG-CD2 4.31Å; L331-L333 HydrophobicContact CG-CG 4.04Å; L331-V347 HydrophobicContact CD2-CG1 4.04Å; L331-V347 HydrophobicContact CD2-CG2 3.74Å; L331-L350 HydrophobicContact CD2-CD1 4.5Å; L331-L354 HydrophobicContact CB-CD1 4.15Å; L331-Y356 PolarHBondContact N-O 2.81Å; L331-L357 HydrophobicContact CB-CD1 4.2Å; L331-L357 HydrophobicContact CD2-CD1 4.31Å; L331-L357 HydrophobicContact CG-CD1 4.33Å; L331-L357 CarbonylContact O-C 3.43Å; L331-L357 WeakPolarHBondContact O-CA 3.45Å; L331-S358 PolarHBondContact O-N 2.82Å
332	S	98.5	Very high	96.9	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.014	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	113.1	173.7	170	0	0	0	0	111.1	L305 L307 S358	L305-S332 PolarHBondContact O-N 2.97Å; L307-S332 WeakPolarHBondContact CA-O 3.34Å; L307-S332 PolarHBondContact N-O 2.79Å; S332-S358 CarbonylContact C-O 3.49Å
333	L	98.3	Very high	97.1	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.197	C	C	.	.			trans	-111.7	22	176.6	-56.9	173.4	0	0	0	111.3	L307 L318 L331 D335 C336 V339 V347 S358 V359 C362	L307-L333 HydrophobicContact CB-CD2 4.34Å; L307-L333 HydrophobicContact CD1-CD2 3.87Å; L318-L333 HydrophobicContact CD1-CD1 3.72Å; L318-L333 HydrophobicContact CD2-CD1 3.73Å; L318-L333 HydrophobicContact CD2-CD2 3.74Å; L318-L333 HydrophobicContact CD2-CG 4.38Å; L318-L333 HydrophobicContact CG-CD1 4.4Å; L331-L333 HydrophobicContact CD1-CD2 4.08Å; L331-L333 HydrophobicContact CD1-CG 4.35Å; L331-L333 HydrophobicContact CD2-CD1 4.09Å; L331-L333 HydrophobicContact CD2-CG 4.31Å; L331-L333 HydrophobicContact CG-CD1 4.37Å; L331-L333 HydrophobicContact CG-CD2 4.31Å; L331-L333 HydrophobicContact CG-CG 4.04Å; L333-D335 PolarHBondContact O-N 3.03Å; L333-C336 HydrophobicContact CB-CB 4.34Å; L333-C336 WeakPolarHBondContact O-CB 3.27Å; L333-C336 PolarHBondContact O-N 2.84Å; L333-C336 PolarHBondContact O-SG 3.45Å; L333-V339 HydrophobicContact CD1-CG1 4.45Å; L333-V347 HydrophobicContact CD1-CG2 4.29Å; L333-S358 CarbonylContact C-O 3.52Å; L333-S358 PolarHBondContact N-O 2.98Å; L333-V359 HydrophobicContact CB-CG1 4.47Å; L333-C362 PolarHBondContact O-SG 3.48Å
334	S	98.3	Very high	97.2	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.014	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	137.4	-171.5	-49.7	0	0	0	0	111.3	R308 R309 C336 S358 A360	R308-S334 CarbonylContact C-O 3.59Å; R308-S334 VanDerWaalsContact CA-O 3.24Å; R308-S334 WeakPolarHBondContact CA-O 3.21Å; R309-S334 PolarHBondContact N-O 3Å; S334-C336 PolarHBondContact O-N 2.76Å; S334-S358 PolarHBondContact N-O 2.87Å; S334-S358 VanDerWaalsContact N-O 3.14Å; S334-S358 WeakPolarHBondContact OG-CB 3.47Å; S334-S358 PolarHBondContact OG-O 3.08Å; S334-S358 PolarHBondContact OG-OG 3.12Å; S334-A360 CarbonylContact C-O 3.46Å; S334-A360 WeakPolarHBondContact CA-O 3.39Å
335	D	97.9	Very high	97.4	Very high	26 Å²	26	39 Å²	39	14%	0.139	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	13.3	-168.8	-76.7	-82.1	0	0	0	115.6	R309 L333 R337 A360	R309-D335 HydrophobicContact CB-CB 4.28Å; R309-D335 HydrophobicContact CG-CB 3.4Å; L333-D335 PolarHBondContact O-N 3.03Å; D335-R337 PolarHBondContact O-N 2.79Å; D335-R337 IonicContact OD1-CZ 3.17Å; D335-R337 IonicContact OD1-NE 3.63Å; D335-R337 IonicContact OD1-NH2 2.69Å; D335-R337 PolarHBondContact OD1-NH2 3.44Å; D335-R337 VanDerWaalsContact OD1-NH2 3.11Å; D335-A360 PolarHBondContact N-O 3.21Å
336	C	97.5	Very high	97.5	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.186	C	C	.	.			trans	-76.6	70.9	168.1	-66.1	0	0	0	0	110.4	L307 C310 L333 S334 L338 V339 C362	L307-C336 PolarHBondContact O-SG 3.36Å; C310-C336 PolarHBondContact O-SG 3.04Å; L333-C336 HydrophobicContact CB-CB 4.34Å; L333-C336 WeakPolarHBondContact O-CB 3.27Å; L333-C336 PolarHBondContact O-N 2.84Å; L333-C336 PolarHBondContact O-SG 3.45Å; S334-C336 PolarHBondContact O-N 2.76Å; C336-L338 PolarHBondContact O-N 3.32Å; C336-V339 HydrophobicContact CB-CB 4.38Å; C336-V339 HydrophobicContact CB-CG2 3.87Å; C336-V339 WeakPolarHBondContact O-CB 3.07Å; C336-V339 PolarHBondContact O-N 3.4Å; C336-C362 PolarHBondContact O-SG 2.81Å
337	R	95.4	Very high	97.7	Very high	149 Å²	149	36.6 Å²	36.6	56%	0.562	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-13.5	-167.4	-64.3	176.2	-167.7	172.4	4.7	116.2	D335 R364	D335-R337 PolarHBondContact O-N 2.79Å; D335-R337 IonicContact OD1-CZ 3.17Å; D335-R337 IonicContact OD1-NE 3.63Å; D335-R337 IonicContact OD1-NH2 2.69Å; D335-R337 PolarHBondContact OD1-NH2 3.44Å; D335-R337 VanDerWaalsContact OD1-NH2 3.11Å; R337-R364 VanDerWaalsContact O-CD 3.3Å; R337-R364 WeakPolarHBondContact O-CD 3.42Å; R337-R364 PolarHBondContact O-NE 3.48Å
338	L	97.4	Very high	97.8	Very high	61 Å²	61	34.3 Å²	34.3	32%	0.319	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-22.6	175.2	-61.9	179.5	0	0	0	113	S311 L313 T314 C336 R364	S311-L338 WeakPolarHBondContact O-CD1 3.33Å; L313-L338 WeakPolarHBondContact O-CB 3.39Å; T314-L338 HydrophobicContact CG2-CB 4.38Å; T314-L338 HydrophobicContact CG2-CD1 4.24Å; C336-L338 PolarHBondContact O-N 3.32Å; L338-R364 WeakPolarHBondContact O-CD 3.36Å; L338-R364 PolarHBondContact O-NH1 2.77Å
339	V	97.9	Very high	97.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	17%	0.169	C	C	.	.			trans	-69.3	134.8	175.7	174.8	0	0	0	0	110.9	D315 L318 L333 C336	D315-V339 VanDerWaalsContact OD1-CA 3.3Å; D315-V339 WeakPolarHBondContact OD1-CA 3.26Å; L318-V339 HydrophobicContact CD1-CB 4.39Å; L318-V339 HydrophobicContact CD1-CG1 3.51Å; L318-V339 HydrophobicContact CD1-CG2 3.91Å; L333-V339 HydrophobicContact CD1-CG1 4.45Å; C336-V339 HydrophobicContact CB-CB 4.38Å; C336-V339 HydrophobicContact CB-CG2 3.87Å; C336-V339 WeakPolarHBondContact O-CB 3.07Å; C336-V339 PolarHBondContact O-N 3.4Å
340	G	98.1	Very high	97.3	Very high	4 Å²	4	35.1 Å²	35.1	4%	0.041	15%	0.151	C	C	.	.			trans	-135.9	-155.4	177.3	0	0	0	0	0	113.7	D315 F342 G343 L344 R364	D315-G340 PolarHBondContact OD1-N 3.07Å; G340-F342 VanDerWaalsContact C-N 3.29Å; G340-F342 PolarHBondContact O-N 3.18Å; G340-G343 PolarHBondContact O-N 2.57Å; G340-G343 VanDerWaalsContact O-N 3.1Å; G340-L344 PolarHBondContact O-N 2.94Å; G340-L344 VanDerWaalsContact O-N 3.11Å; G340-R364 WeakPolarHBondContact CA-O 3.46Å
341	D	98.5	Very high	96.6	Very high	30 Å²	30	38.9 Å²	38.9	16%	0.16	17%	0.169	C	C	.	.	H	α-helix	trans	-65.5	-27.2	-175.2	-67.8	-36.4	0	0	0	114.1	L344 R345 I365 T366 V368 G369	D341-L344 PolarHBondContact O-N 2.93Å; D341-R345 PolarHBondContact O-N 2.92Å; D341-I365 WeakPolarHBondContact OD1-CA 3.41Å; D341-T366 PolarHBondContact OD1-N 2.84Å; D341-T366 WeakPolarHBondContact OD2-CB 3.32Å; D341-T366 WeakPolarHBondContact OD2-CG2 3.44Å; D341-T366 PolarHBondContact OD2-N 3.41Å; D341-T366 PolarHBondContact OD2-OG1 3.36Å; D341-V368 HydrophobicContact CB-CB 4.33Å; D341-V368 HydrophobicContact CB-CG1 4.33Å; D341-G369 VanDerWaalsContact CG-N 3.25Å; D341-G369 WeakPolarHBondContact OD1-CA 3.35Å; D341-G369 PolarHBondContact OD1-N 2.9Å
342	F	98.3	Very high	95.6	Very high	149 Å²	149	39.5 Å²	39.5	65%	0.654	18%	0.175	S	C	*	.	H	α-helix	trans	-68.5	-38.8	172	-63.9	-72	0	0	0	111.4	D315 G340 L344 R345 E346	D315-F342 HydrophobicContact CB-CB 4.24Å; G340-F342 VanDerWaalsContact C-N 3.29Å; G340-F342 PolarHBondContact O-N 3.18Å; F342-L344 VanDerWaalsContact C-N 3.32Å; F342-L344 PolarHBondContact O-N 2.96Å; F342-R345 WeakPolarHBondContact O-CB 3.4Å; F342-R345 PolarHBondContact O-N 2.95Å; F342-R345 VanDerWaalsContact O-N 3.16Å; F342-E346 PolarHBondContact O-N 3.03Å
343	G	98.1	Very high	95.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62	-40.2	172.8	0	0	0	0	0	112.2	D315 G340 E346 V347	D315-G343 WeakPolarHBondContact OD1-CA 3.18Å; D315-G343 PolarHBondContact OD1-N 3.34Å; G340-G343 PolarHBondContact O-N 2.57Å; G340-G343 VanDerWaalsContact O-N 3.1Å; G343-E346 PolarHBondContact O-N 2.92Å; G343-V347 WeakPolarHBondContact O-CG2 3.29Å; G343-V347 PolarHBondContact O-N 3.2Å
344	L	98.3	Very high	95.2	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-68.7	-31.2	173	-68.9	-154.6	0	0	0	113.7	G340 D341 F342 E346 V347 A348 L357 V359 I365 V373	G340-L344 PolarHBondContact O-N 2.94Å; G340-L344 VanDerWaalsContact O-N 3.11Å; D341-L344 PolarHBondContact O-N 2.93Å; F342-L344 VanDerWaalsContact C-N 3.32Å; F342-L344 PolarHBondContact O-N 2.96Å; L344-E346 VanDerWaalsContact C-N 3.34Å; L344-V347 PolarHBondContact O-N 2.8Å; L344-A348 VanDerWaalsContact O-CB 3.3Å; L344-A348 WeakPolarHBondContact O-CB 3.36Å; L344-A348 PolarHBondContact O-N 2.75Å; L344-L357 HydrophobicContact CD2-CD2 4.45Å; L344-V359 HydrophobicContact CD2-CG1 3.95Å; L344-I365 HydrophobicContact CD1-CD1 3.95Å; L344-I365 HydrophobicContact CD1-CG1 4.26Å; L344-I365 HydrophobicContact CD1-CG2 3.56Å; L344-I365 HydrophobicContact CD2-CD1 4.05Å; L344-I365 HydrophobicContact CG-CD1 3.9Å; L344-I365 HydrophobicContact CG-CG1 4.24Å; L344-I365 HydrophobicContact CG-CG2 4.42Å; L344-V373 HydrophobicContact CB-CG2 4.11Å; L344-V373 HydrophobicContact CD1-CG2 4.18Å; L344-V373 HydrophobicContact CD2-CG2 4.47Å; L344-V373 HydrophobicContact CG-CG2 4.49Å
345	R	98	Very high	95.1	Very high	114 Å²	114	45.8 Å²	45.8	43%	0.43	20%	0.204	S	C	.	.	H	α-helix	trans	-63.6	-37.6	169.3	173.9	-178.8	170.3	-96.3	8.9	112	D341 F342 Y372	D341-R345 PolarHBondContact O-N 2.92Å; F342-R345 WeakPolarHBondContact O-CB 3.4Å; F342-R345 PolarHBondContact O-N 2.95Å; F342-R345 VanDerWaalsContact O-N 3.16Å; R345-Y372 HydrophobicContact CB-CD1 4.28Å; R345-Y372 HydrophobicContact CB-CD2 3.8Å; R345-Y372 HydrophobicContact CB-CE1 4.49Å; R345-Y372 HydrophobicContact CB-CE2 4.01Å; R345-Y372 HydrophobicContact CB-CG 3.95Å; R345-Y372 HydrophobicContact CG-CD1 4.12Å; R345-Y372 HydrophobicContact CG-CD2 4.38Å; R345-Y372 HydrophobicContact CG-CE1 4.04Å; R345-Y372 HydrophobicContact CG-CE2 4.3Å; R345-Y372 HydrophobicContact CG-CG 4.31Å
346	E	97.7	Very high	95.2	Very high	21 Å²	21	46.5 Å²	46.5	10%	0.098	21%	0.205	C	C	.	.	H	α-helix	trans	-74.3	-41.6	174.6	-61.7	-52.7	125.4	0	0	112	L318 R319 A322 F342 G343 L344 A348 R349	L318-E346 HydrophobicContact CB-CB 4.46Å; R319-E346 HydrophobicContact CB-CG 4.08Å; R319-E346 HydrophobicContact CG-CG 4.35Å; A322-E346 VanDerWaalsContact CB-O 3.29Å; A322-E346 WeakPolarHBondContact CB-O 3.29Å; F342-E346 PolarHBondContact O-N 3.03Å; G343-E346 PolarHBondContact O-N 2.92Å; L344-E346 VanDerWaalsContact C-N 3.34Å; E346-A348 PolarHBondContact O-N 3.47Å; E346-R349 VanDerWaalsContact O-CB 3.23Å; E346-R349 WeakPolarHBondContact O-CB 3.44Å; E346-R349 PolarHBondContact O-N 3.29Å; E346-R349 WeakPolarHBondContact OE2-CD 3.46Å; E346-R349 IonicContact OE2-CZ 3.86Å; E346-R349 IonicContact OE2-NE 3.33Å; E346-R349 IonicContact OE2-NH1 3.11Å; E346-R349 PolarHBondContact OE2-NH1 3.36Å
347	V	97.2	Very high	95.2	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-58.3	-34.2	172.2	167.7	0	0	0	0	111.9	L318 L331 L333 G343 L344 R349 L350 L354 L357	L318-V347 HydrophobicContact CB-CG2 4.34Å; L318-V347 HydrophobicContact CD1-CG2 4.15Å; L318-V347 HydrophobicContact CD2-CG2 4.28Å; L318-V347 HydrophobicContact CG-CG2 4.49Å; L331-V347 HydrophobicContact CD2-CG1 4.04Å; L331-V347 HydrophobicContact CD2-CG2 3.74Å; L333-V347 HydrophobicContact CD1-CG2 4.29Å; G343-V347 WeakPolarHBondContact O-CG2 3.29Å; G343-V347 PolarHBondContact O-N 3.2Å; L344-V347 PolarHBondContact O-N 2.8Å; V347-R349 PolarHBondContact O-N 3.13Å; V347-L350 HydrophobicContact CG1-CD1 4.33Å; V347-L350 VanDerWaalsContact O-CB 3.3Å; V347-L350 WeakPolarHBondContact O-CB 3.48Å; V347-L350 WeakPolarHBondContact O-CG 3.29Å; V347-L350 PolarHBondContact O-N 3.2Å; V347-L354 HydrophobicContact CG1-CD2 3.94Å; V347-L357 HydrophobicContact CG1-CD1 4.29Å
348	A	96.1	Very high	95.4	Very high	2 Å²	2	39.4 Å²	39.4	2%	0.017	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.5	175.5	0	0	0	0	0	113.6	L344 E346 L350 Y376	L344-A348 VanDerWaalsContact O-CB 3.3Å; L344-A348 WeakPolarHBondContact O-CB 3.36Å; L344-A348 PolarHBondContact O-N 2.75Å; E346-A348 PolarHBondContact O-N 3.47Å; A348-L350 PolarHBondContact O-N 3.23Å; A348-Y376 HydrophobicContact CB-CD2 4.19Å; A348-Y376 VanDerWaalsContact O-CB 3.27Å; A348-Y376 WeakPolarHBondContact O-CB 3.26Å
349	R	94.5	Very high	95.4	Very high	114 Å²	114	36.6 Å²	36.6	43%	0.43	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-5	174.1	-56.2	169.4	60.3	-147.8	-11.8	113.5	A322 E346 V347 E351	A322-R349 HydrophobicContact CB-CB 4.29Å; E346-R349 VanDerWaalsContact O-CB 3.23Å; E346-R349 WeakPolarHBondContact O-CB 3.44Å; E346-R349 PolarHBondContact O-N 3.29Å; E346-R349 WeakPolarHBondContact OE2-CD 3.46Å; E346-R349 IonicContact OE2-CZ 3.86Å; E346-R349 IonicContact OE2-NE 3.33Å; E346-R349 IonicContact OE2-NH1 3.11Å; E346-R349 PolarHBondContact OE2-NH1 3.36Å; V347-R349 PolarHBondContact O-N 3.13Å; R349-E351 PolarHBondContact O-N 3.31Å
350	L	90.1	Very high	95.5	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	17%	0.166	C	C	.	.	S	Bend	trans	-76	32.6	167.5	-59.5	171.5	0	0	0	112.4	A322 C325 I328 L331 V347 A348 G352 C353	A322-L350 HydrophobicContact CB-CD2 4.47Å; C325-L350 WeakPolarHBondContact O-CD2 3.29Å; I328-L350 HydrophobicContact CB-CD1 4Å; I328-L350 HydrophobicContact CB-CD2 4.3Å; I328-L350 HydrophobicContact CG2-CD1 3.97Å; L331-L350 HydrophobicContact CD2-CD1 4.5Å; V347-L350 HydrophobicContact CG1-CD1 4.33Å; V347-L350 VanDerWaalsContact O-CB 3.3Å; V347-L350 WeakPolarHBondContact O-CB 3.48Å; V347-L350 WeakPolarHBondContact O-CG 3.29Å; V347-L350 PolarHBondContact O-N 3.2Å; A348-L350 PolarHBondContact O-N 3.23Å; L350-G352 PolarHBondContact O-N 2.81Å; L350-C353 PolarHBondContact O-N 3.04Å; L350-C353 VanDerWaalsContact O-N 3.12Å
351	E	84.2	Confident	95.4	Very high	134 Å²	134	39.5 Å²	39.5	63%	0.626	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-27.4	112.3	-170.5	-68.3	-178.3	179	0	0	115.5	R349 C353	R349-E351 PolarHBondContact O-N 3.31Å; E351-C353 PolarHBondContact O-N 3.36Å
352	G	78.2	Confident	95.4	Very high	12 Å²	12	38.1 Å²	38.1	12%	0.124	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	-2.4	173.1	0	0	0	0	0	117.3	L350 Y376 R379	L350-G352 PolarHBondContact O-N 2.81Å; G352-Y376 PolarHBondContact N-O 2.88Å; G352-R379 WeakPolarHBondContact O-CD 3.47Å; G352-R379 WeakPolarHBondContact O-CG 3.2Å; G352-R379 PolarHBondContact O-NH1 3.4Å
353	C	90.6	Very high	95.3	Very high	43 Å²	43	34 Å²	34	29%	0.291	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-39.2	171	-78	0	0	0	0	111.8	P326 I328 L350 E351	P326-C353 PolarHBondContact O-SG 2.77Å; I328-C353 CarbonylContact O-C 3.45Å; I328-C353 VanDerWaalsContact O-CB 3.3Å; I328-C353 WeakPolarHBondContact O-CB 3.29Å; L350-C353 PolarHBondContact O-N 3.04Å; L350-C353 VanDerWaalsContact O-N 3.12Å; E351-C353 PolarHBondContact O-N 3.36Å
354	L	96.3	Very high	95.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	18%	0.182	C	C	.	.			trans	-62.1	134.9	-175.2	-162.6	68.1	0	0	0	113	I328 L331 V347 Y356 L357 C377 R379 L380	I328-L354 HydrophobicContact CG2-CD1 4.24Å; I328-L354 PolarHBondContact O-N 2.76Å; L331-L354 HydrophobicContact CB-CD1 4.15Å; V347-L354 HydrophobicContact CG1-CD2 3.94Å; L354-Y356 WeakPolarHBondContact CD1-O 3.47Å; L354-L357 HydrophobicContact CD2-CB 4.28Å; L354-L357 HydrophobicContact CD2-CD2 4.44Å; L354-C377 HydrophobicContact CB-CB 4.3Å; L354-C377 HydrophobicContact CD2-CB 4.42Å; L354-R379 CarbonylContact O-C 3.47Å; L354-L380 HydrophobicContact CD2-CD1 4.39Å; L354-L380 HydrophobicContact CG-CD1 4.29Å; L354-L380 PolarHBondContact O-N 2.95Å
355	R	97.6	Very high	95.2	Very high	94 Å²	94	40.5 Å²	40.5	36%	0.355	18%	0.181	S	C	.	.			trans	-131.1	-33.8	-176.3	-61.9	174.2	-170.5	-170.3	-0.8	112.3	R329 R381 Y382	R329-R355 WeakPolarHBondContact O-CA 3.39Å; R329-R355 PolarHBondContact O-N 2.87Å; R355-R381 WeakPolarHBondContact O-CA 3.48Å; R355-R381 PolarHBondContact O-N 2.9Å; R355-Y382 PolarHBondContact O-N 3.46Å
356	Y	98.6	Very high	95.3	Very high	41 Å²	41	37.1 Å²	37.1	16%	0.161	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	129.2	177.5	175.4	-72.7	0	0	0	108.9	Y306 R329 E330 L331 L354 Y382	Y306-Y356 HydrophobicContact CE1-CE1 4.46Å; R329-Y356 PolarHBondContact O-N 3.14Å; E330-Y356 WeakPolarHBondContact CA-O 3.49Å; E330-Y356 HydrophobicContact CB-CD1 4.18Å; E330-Y356 HydrophobicContact CB-CG 4.22Å; E330-Y356 HydrophobicContact CG-CG 4.4Å; L331-Y356 PolarHBondContact N-O 2.81Å; L354-Y356 WeakPolarHBondContact CD1-O 3.47Å; Y356-Y382 WeakPolarHBondContact CA-O 3.48Å; Y356-Y382 HydrophobicContact CD1-CD1 4.37Å; Y356-Y382 AromaticContact CD2-CD1 3.25Å; Y356-Y382 HydrophobicContact CD2-CD1 3.25Å; Y356-Y382 HydrophobicContact CD2-CD2 4.12Å; Y356-Y382 AromaticContact CD2-CE1 3.83Å; Y356-Y382 HydrophobicContact CD2-CE1 3.83Å; Y356-Y382 AromaticContact CD2-CG 3.43Å; Y356-Y382 HydrophobicContact CD2-CG 3.43Å; Y356-Y382 VanDerWaalsContact CD2-CG 3.43Å; Y356-Y382 HydrophobicContact CE1-CD1 4.34Å; Y356-Y382 HydrophobicContact CE1-CE1 4.3Å; Y356-Y382 AromaticContact CE2-CD1 3.21Å; Y356-Y382 HydrophobicContact CE2-CD1 3.21Å; Y356-Y382 HydrophobicContact CE2-CD2 4.03Å; Y356-Y382 AromaticContact CE2-CE1 3.23Å; Y356-Y382 HydrophobicContact CE2-CE1 3.23Å; Y356-Y382 HydrophobicContact CE2-CE2 4.09Å; Y356-Y382 AromaticContact CE2-CG 3.64Å; Y356-Y382 HydrophobicContact CE2-CG 3.64Å; Y356-Y382 AromaticContact CE2-CZ 3.71Å; Y356-Y382 AromaticContact CG-CD1 3.85Å; Y356-Y382 HydrophobicContact CG-CD1 3.85Å; Y356-Y382 HydrophobicContact CG-CG 4.26Å; Y356-Y382 AromaticContact CZ-CD1 3.78Å; Y356-Y382 AromaticContact CZ-CE1 3.49Å; Y356-Y382 VanDerWaalsContact CZ-CE1 3.49Å
357	L	98.6	Very high	95.3	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	130.3	169.5	-177.3	61.7	0	0	0	109.6	L331 L344 V347 L354 V359 V373 L380 Y382 L383 N384	L331-L357 HydrophobicContact CB-CD1 4.2Å; L331-L357 HydrophobicContact CD2-CD1 4.31Å; L331-L357 HydrophobicContact CG-CD1 4.33Å; L331-L357 CarbonylContact O-C 3.43Å; L331-L357 WeakPolarHBondContact O-CA 3.45Å; L344-L357 HydrophobicContact CD2-CD2 4.45Å; V347-L357 HydrophobicContact CG1-CD1 4.29Å; L354-L357 HydrophobicContact CD2-CB 4.28Å; L354-L357 HydrophobicContact CD2-CD2 4.44Å; L357-V359 HydrophobicContact CD1-CG1 3.84Å; L357-V359 HydrophobicContact CD2-CG1 4.16Å; L357-V359 HydrophobicContact CG-CG1 3.83Å; L357-V373 HydrophobicContact CD2-CB 4.47Å; L357-V373 HydrophobicContact CD2-CG1 3.87Å; L357-V373 HydrophobicContact CD2-CG2 3.92Å; L357-L380 HydrophobicContact CB-CD1 4.12Å; L357-Y382 PolarHBondContact N-O 2.87Å; L357-L383 HydrophobicContact CB-CD1 4Å; L357-L383 HydrophobicContact CD2-CD1 4.03Å; L357-L383 HydrophobicContact CG-CD1 4.1Å; L357-L383 CarbonylContact O-C 3.42Å; L357-L383 WeakPolarHBondContact O-CA 3.32Å; L357-N384 PolarHBondContact O-N 3.12Å
358	S	98.8	Very high	95.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	102.8	174.9	-172.7	0	0	0	0	111.1	L331 S332 L333 S334 N384	L331-S358 PolarHBondContact O-N 2.82Å; S332-S358 CarbonylContact C-O 3.49Å; L333-S358 CarbonylContact C-O 3.52Å; L333-S358 PolarHBondContact N-O 2.98Å; S334-S358 PolarHBondContact N-O 2.87Å; S334-S358 VanDerWaalsContact N-O 3.14Å; S334-S358 WeakPolarHBondContact OG-CB 3.47Å; S334-S358 PolarHBondContact OG-O 3.08Å; S334-S358 PolarHBondContact OG-OG 3.12Å; S358-N384 CarbonylContact C-O 3.57Å; S358-N384 WeakPolarHBondContact CA-O 3.49Å; S358-N384 PolarHBondContact OG-ND2 2.71Å; S358-N384 VanDerWaalsContact OG-ND2 3.14Å
359	V	98.4	Very high	95.5	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	20%	0.196	C	C	.	.			trans	-113.9	20	-177.4	-63.5	0	0	0	0	112	L333 L344 L357 H361 C362 I365 N384 A385 C388	L333-V359 HydrophobicContact CB-CG1 4.47Å; L344-V359 HydrophobicContact CD2-CG1 3.95Å; L357-V359 HydrophobicContact CD1-CG1 3.84Å; L357-V359 HydrophobicContact CD2-CG1 4.16Å; L357-V359 HydrophobicContact CG-CG1 3.83Å; V359-H361 PolarHBondContact O-N 3.26Å; V359-C362 VanDerWaalsContact O-CB 3.28Å; V359-C362 WeakPolarHBondContact O-CB 3.47Å; V359-C362 PolarHBondContact O-N 3.33Å; V359-C362 VanDerWaalsContact O-N 3.15Å; V359-I365 HydrophobicContact CB-CD1 3.75Å; V359-I365 HydrophobicContact CG1-CD1 4.09Å; V359-I365 HydrophobicContact CG2-CD1 4.17Å; V359-N384 WeakPolarHBondContact CG2-O 3.43Å; V359-N384 PolarHBondContact N-O 3.12Å; V359-A385 HydrophobicContact CG2-CB 3.99Å; V359-C388 PolarHBondContact O-SG 2.95Å; V359-C388 VanDerWaalsContact O-SG 3.37Å
360	A	98.4	Very high	95.6	Very high	6 Å²	6	35.5 Å²	35.5	5%	0.05	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	138.6	179.8	0	0	0	0	0	112.6	S334 D335 C362 N384 R386	S334-A360 CarbonylContact C-O 3.46Å; S334-A360 WeakPolarHBondContact CA-O 3.39Å; D335-A360 PolarHBondContact N-O 3.21Å; A360-C362 PolarHBondContact O-N 3.06Å; A360-N384 PolarHBondContact N-O 2.73Å; A360-R386 CarbonylContact C-O 3.59Å; A360-R386 WeakPolarHBondContact CA-O 3.24Å; A360-R386 HydrophobicContact CB-CB 3.94Å; A360-R386 WeakPolarHBondContact CB-O 3.28Å
361	H	97.9	Very high	96	Very high	60 Å²	60	41.9 Å²	41.9	28%	0.278	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	16.8	-177.9	-56.9	-50.5	0	0	0	115.8	V359 T363 R386	V359-H361 PolarHBondContact O-N 3.26Å; H361-T363 PolarHBondContact O-N 3.22Å; H361-R386 PolarHBondContact N-O 3.28Å
362	C	97.6	Very high	96.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.186	C	C	.	.			trans	-84.5	88.8	160.3	-67	0	0	0	0	109.3	L333 C336 V359 A360 R364 I365 C388	L333-C362 PolarHBondContact O-SG 3.48Å; C336-C362 PolarHBondContact O-SG 2.81Å; V359-C362 VanDerWaalsContact O-CB 3.28Å; V359-C362 WeakPolarHBondContact O-CB 3.47Å; V359-C362 PolarHBondContact O-N 3.33Å; V359-C362 VanDerWaalsContact O-N 3.15Å; A360-C362 PolarHBondContact O-N 3.06Å; C362-R364 PolarHBondContact O-N 2.89Å; C362-I365 HydrophobicContact CB-CD1 3.54Å; C362-I365 HydrophobicContact CB-CG1 4.09Å; C362-I365 PolarHBondContact O-N 2.81Å; C362-C388 PolarHBondContact O-SG 3.4Å; C362-C388 VanDerWaalsContact O-SG 3.34Å
363	T	95.6	Very high	97.6	Very high	63 Å²	63	39.1 Å²	39.1	39%	0.387	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-13.9	-174.3	54.1	0	0	0	0	114.6	H361 I365 E389	H361-T363 PolarHBondContact O-N 3.22Å; T363-I365 VanDerWaalsContact C-N 3.29Å; T363-I365 PolarHBondContact O-N 3.32Å; T363-E389 HydrophobicContact CG2-CG 4.43Å
364	R	97.6	Very high	97.9	Very high	138 Å²	138	37.1 Å²	37.1	52%	0.521	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	3.2	175.4	-61.4	178.8	174	-169.8	-5.7	114.4	R337 L338 G340 C362	R337-R364 VanDerWaalsContact O-CD 3.3Å; R337-R364 WeakPolarHBondContact O-CD 3.42Å; R337-R364 PolarHBondContact O-NE 3.48Å; L338-R364 WeakPolarHBondContact O-CD 3.36Å; L338-R364 PolarHBondContact O-NH1 2.77Å; G340-R364 WeakPolarHBondContact CA-O 3.46Å; C362-R364 PolarHBondContact O-N 2.89Å
365	I	98.2	Very high	97.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	20%	0.197	C	C	.	.			trans	-98.5	133.1	179.9	-68.6	173.7	0	0	0	109.7	D341 L344 V359 C362 T363 V370	D341-I365 WeakPolarHBondContact OD1-CA 3.41Å; L344-I365 HydrophobicContact CD1-CD1 3.95Å; L344-I365 HydrophobicContact CD1-CG1 4.26Å; L344-I365 HydrophobicContact CD1-CG2 3.56Å; L344-I365 HydrophobicContact CD2-CD1 4.05Å; L344-I365 HydrophobicContact CG-CD1 3.9Å; L344-I365 HydrophobicContact CG-CG1 4.24Å; L344-I365 HydrophobicContact CG-CG2 4.42Å; V359-I365 HydrophobicContact CB-CD1 3.75Å; V359-I365 HydrophobicContact CG1-CD1 4.09Å; V359-I365 HydrophobicContact CG2-CD1 4.17Å; C362-I365 HydrophobicContact CB-CD1 3.54Å; C362-I365 HydrophobicContact CB-CG1 4.09Å; C362-I365 PolarHBondContact O-N 2.81Å; T363-I365 VanDerWaalsContact C-N 3.29Å; T363-I365 PolarHBondContact O-N 3.32Å; I365-V370 HydrophobicContact CG2-CG2 4.23Å
366	T	98.5	Very high	97.8	Very high	43 Å²	43	44.5 Å²	44.5	26%	0.264	20%	0.196	S	C	.	.	B	Isolated β-bridge	trans	-126.7	-175.4	-177.8	78.2	0	0	0	0	111.6	D341 V368 G369 V370 G390	D341-T366 PolarHBondContact OD1-N 2.84Å; D341-T366 WeakPolarHBondContact OD2-CB 3.32Å; D341-T366 WeakPolarHBondContact OD2-CG2 3.44Å; D341-T366 PolarHBondContact OD2-N 3.41Å; D341-T366 PolarHBondContact OD2-OG1 3.36Å; T366-V368 PolarHBondContact O-N 3.12Å; T366-V368 VanDerWaalsContact O-N 3.08Å; T366-V368 PolarHBondContact OG1-N 2.73Å; T366-V368 VanDerWaalsContact OG1-N 3.08Å; T366-G369 PolarHBondContact O-N 3.19Å; T366-V370 PolarHBondContact O-N 2.99Å; T366-G390 VanDerWaalsContact CA-O 3.32Å; T366-G390 WeakPolarHBondContact CA-O 3.48Å; T366-G390 WeakPolarHBondContact CB-O 3.37Å
367	D	98.6	Very high	97.6	Very high	28 Å²	28	42.5 Å²	42.5	15%	0.15	19%	0.189	C	C	.	.	H	α-helix	trans	-49	-28.3	167.2	-62.7	-29.9	0	0	0	113.6	R371 T392 G395	D367-R371 WeakPolarHBondContact O-CB 3.48Å; D367-R371 PolarHBondContact O-N 2.92Å; D367-T392 PolarHBondContact OD1-N 3.33Å; D367-T392 PolarHBondContact OD1-OG1 3.25Å; D367-T392 WeakPolarHBondContact OD2-CB 3.45Å; D367-T392 WeakPolarHBondContact OD2-CG2 3.27Å; D367-T392 PolarHBondContact OD2-OG1 3.47Å; D367-G395 VanDerWaalsContact CG-N 3.26Å; D367-G395 WeakPolarHBondContact OD1-CA 3.21Å; D367-G395 PolarHBondContact OD1-N 3.16Å
368	V	98.5	Very high	97.4	Very high	74 Å²	74	45.4 Å²	45.4	45%	0.448	21%	0.207	S	C	.	.	H	α-helix	trans	-69.1	-50.7	-178.4	178.7	0	0	0	0	111.6	D341 T366 R371 Y372	D341-V368 HydrophobicContact CB-CB 4.33Å; D341-V368 HydrophobicContact CB-CG1 4.33Å; T366-V368 PolarHBondContact O-N 3.12Å; T366-V368 VanDerWaalsContact O-N 3.08Å; T366-V368 PolarHBondContact OG1-N 2.73Å; T366-V368 VanDerWaalsContact OG1-N 3.08Å; V368-R371 WeakPolarHBondContact O-CB 3.36Å; V368-R371 PolarHBondContact O-N 2.85Å; V368-Y372 HydrophobicContact CG1-CD2 4.29Å; V368-Y372 HydrophobicContact CG1-CE2 3.85Å; V368-Y372 WeakPolarHBondContact O-CD2 3.37Å; V368-Y372 PolarHBondContact O-N 3.11Å; V368-Y372 VanDerWaalsContact O-N 3.16Å
369	G	98.2	Very high	97.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.1	-40.6	176.6	0	0	0	0	0	111.8	D341 T366 R371 Y372 V373	D341-G369 VanDerWaalsContact CG-N 3.25Å; D341-G369 WeakPolarHBondContact OD1-CA 3.35Å; D341-G369 PolarHBondContact OD1-N 2.9Å; T366-G369 PolarHBondContact O-N 3.19Å; G369-R371 VanDerWaalsContact C-N 3.32Å; G369-R371 PolarHBondContact O-N 3.1Å; G369-Y372 PolarHBondContact O-N 2.82Å; G369-V373 PolarHBondContact O-N 2.81Å; G369-V373 VanDerWaalsContact O-N 3.12Å
370	V	98.3	Very high	97.2	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.024	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-38.1	174.8	171.4	0	0	0	0	111.6	I365 T366 Y372 V373 A374 L391 L399	I365-V370 HydrophobicContact CG2-CG2 4.23Å; T366-V370 PolarHBondContact O-N 2.99Å; V370-Y372 PolarHBondContact O-N 3.01Å; V370-V373 PolarHBondContact O-N 3.41Å; V370-A374 VanDerWaalsContact O-CB 3.22Å; V370-A374 WeakPolarHBondContact O-CB 3.21Å; V370-A374 PolarHBondContact O-N 3.37Å; V370-L391 HydrophobicContact CB-CD1 4.34Å; V370-L391 HydrophobicContact CG1-CD1 4.32Å; V370-L391 HydrophobicContact CG2-CD1 3.99Å; V370-L399 HydrophobicContact CG1-CD1 3.58Å; V370-L399 HydrophobicContact CG1-CD2 4.03Å; V370-L399 HydrophobicContact CG1-CG 3.58Å
371	R	98.1	Very high	97.1	Very high	138 Å²	138	57.8 Å²	57.8	52%	0.521	25%	0.253	S	S	.	.	H	α-helix	trans	-62.4	-39	173.3	179	-175	176.2	-165.8	-0.4	112.7	D367 V368 G369 R375 H398	D367-R371 WeakPolarHBondContact O-CB 3.48Å; D367-R371 PolarHBondContact O-N 2.92Å; V368-R371 WeakPolarHBondContact O-CB 3.36Å; V368-R371 PolarHBondContact O-N 2.85Å; G369-R371 VanDerWaalsContact C-N 3.32Å; G369-R371 PolarHBondContact O-N 3.1Å; R371-R375 WeakPolarHBondContact O-CB 3.38Å; R371-R375 PolarHBondContact O-N 3.39Å; R371-H398 HydrophobicContact CB-CB 4.37Å
372	Y	97.7	Very high	97.2	Very high	84 Å²	84	58 Å²	58	33%	0.329	25%	0.251	S	S	.	.	H	α-helix	trans	-62.6	-53.1	174.4	-77.1	-68	0	0	0	111	R345 V368 G369 V370 A374 R375 Y376	R345-Y372 HydrophobicContact CB-CD1 4.28Å; R345-Y372 HydrophobicContact CB-CD2 3.8Å; R345-Y372 HydrophobicContact CB-CE1 4.49Å; R345-Y372 HydrophobicContact CB-CE2 4.01Å; R345-Y372 HydrophobicContact CB-CG 3.95Å; R345-Y372 HydrophobicContact CG-CD1 4.12Å; R345-Y372 HydrophobicContact CG-CD2 4.38Å; R345-Y372 HydrophobicContact CG-CE1 4.04Å; R345-Y372 HydrophobicContact CG-CE2 4.3Å; R345-Y372 HydrophobicContact CG-CG 4.31Å; V368-Y372 HydrophobicContact CG1-CD2 4.29Å; V368-Y372 HydrophobicContact CG1-CE2 3.85Å; V368-Y372 WeakPolarHBondContact O-CD2 3.37Å; V368-Y372 PolarHBondContact O-N 3.11Å; V368-Y372 VanDerWaalsContact O-N 3.16Å; G369-Y372 PolarHBondContact O-N 2.82Å; V370-Y372 PolarHBondContact O-N 3.01Å; Y372-A374 VanDerWaalsContact C-N 3.33Å; Y372-A374 PolarHBondContact O-N 3.44Å; Y372-R375 PolarHBondContact O-N 3.04Å; Y372-Y376 HydrophobicContact CD1-CE2 4.25Å; Y372-Y376 WeakPolarHBondContact O-CD2 3.41Å; Y372-Y376 PolarHBondContact O-N 2.85Å; Y372-Y376 VanDerWaalsContact O-N 3.17Å
373	V	97.4	Very high	97.2	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.018	25%	0.252	C	S	.	.	H	α-helix	trans	-59.2	-44.3	178.1	176.6	0	0	0	0	111.1	L344 L357 G369 V370 R375 Y376 C377 L380	L344-V373 HydrophobicContact CB-CG2 4.11Å; L344-V373 HydrophobicContact CD1-CG2 4.18Å; L344-V373 HydrophobicContact CD2-CG2 4.47Å; L344-V373 HydrophobicContact CG-CG2 4.49Å; L357-V373 HydrophobicContact CD2-CB 4.47Å; L357-V373 HydrophobicContact CD2-CG1 3.87Å; L357-V373 HydrophobicContact CD2-CG2 3.92Å; G369-V373 PolarHBondContact O-N 2.81Å; G369-V373 VanDerWaalsContact O-N 3.12Å; V370-V373 PolarHBondContact O-N 3.41Å; V373-R375 VanDerWaalsContact C-N 3.33Å; V373-R375 PolarHBondContact O-N 3.38Å; V373-Y376 PolarHBondContact O-N 2.83Å; V373-C377 HydrophobicContact CG1-CB 4.16Å; V373-C377 WeakPolarHBondContact O-CA 3.01Å; V373-C377 WeakPolarHBondContact O-CB 3.35Å; V373-C377 PolarHBondContact O-N 2.84Å; V373-L380 HydrophobicContact CG1-CD2 4.13Å
374	A	96.4	Very high	97.3	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.008	24%	0.237	C	C	.	.	H	α-helix	trans	-59.1	-42.9	179	0	0	0	0	0	112.3	V370 Y372 H398 L399 S402	V370-A374 VanDerWaalsContact O-CB 3.22Å; V370-A374 WeakPolarHBondContact O-CB 3.21Å; V370-A374 PolarHBondContact O-N 3.37Å; Y372-A374 VanDerWaalsContact C-N 3.33Å; Y372-A374 PolarHBondContact O-N 3.44Å; A374-H398 HydrophobicContact CB-CB 4.19Å; A374-L399 HydrophobicContact CB-CD2 4.07Å; A374-L399 HydrophobicContact CB-CG 4.45Å; A374-S402 WeakPolarHBondContact O-CB 3.29Å
375	R	96	Very high	97.4	Very high	163 Å²	163	49.1 Å²	49.1	62%	0.615	21%	0.212	S	C	*	.	H	α-helix	trans	-69.5	-40.9	-177.5	-175.7	175.2	-176.2	-175.4	3.3	113.6	R371 Y372 V373	R371-R375 WeakPolarHBondContact O-CB 3.38Å; R371-R375 PolarHBondContact O-N 3.39Å; Y372-R375 PolarHBondContact O-N 3.04Å; V373-R375 VanDerWaalsContact C-N 3.33Å; V373-R375 PolarHBondContact O-N 3.38Å
376	Y	96.1	Very high	97.4	Very high	86 Å²	86	51.2 Å²	51.2	34%	0.337	22%	0.22	S	C	.	.	H	α-helix	trans	-106.5	-8.8	-171.2	-60.3	-82.4	0	0	0	114.3	A348 G352 Y372 V373 P378	A348-Y376 HydrophobicContact CB-CD2 4.19Å; A348-Y376 VanDerWaalsContact O-CB 3.27Å; A348-Y376 WeakPolarHBondContact O-CB 3.26Å; G352-Y376 PolarHBondContact N-O 2.88Å; Y372-Y376 HydrophobicContact CD1-CE2 4.25Å; Y372-Y376 WeakPolarHBondContact O-CD2 3.41Å; Y372-Y376 PolarHBondContact O-N 2.85Å; Y372-Y376 VanDerWaalsContact O-N 3.17Å; V373-Y376 PolarHBondContact O-N 2.83Å; Y376-P378 VanDerWaalsContact O-CD 3.23Å; Y376-P378 WeakPolarHBondContact O-CD 3.09Å
377	C	95.7	Very high	97.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	21%	0.208	C	C	.	.			trans	-114.6	55.5	175.3	-51.3	0	0	0	0	113.5	L354 V373 R379 L380	L354-C377 HydrophobicContact CB-CB 4.3Å; L354-C377 HydrophobicContact CD2-CB 4.42Å; V373-C377 HydrophobicContact CG1-CB 4.16Å; V373-C377 WeakPolarHBondContact O-CA 3.01Å; V373-C377 WeakPolarHBondContact O-CB 3.35Å; V373-C377 PolarHBondContact O-N 2.84Å; C377-R379 PolarHBondContact O-N 3.38Å; C377-L380 VanDerWaalsContact O-CB 3.28Å; C377-L380 WeakPolarHBondContact O-CB 3.22Å; C377-L380 PolarHBondContact O-N 3.48Å
378	P	94.3	Very high	97.3	Very high	61 Å²	61	47.9 Å²	47.9	40%	0.396	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-0.4	-177.6	30.8	-38.1	0	0	0	114.7	Y376	Y376-P378 VanDerWaalsContact O-CD 3.23Å; Y376-P378 WeakPolarHBondContact O-CD 3.09Å
379	R	95	Very high	97.1	Very high	142 Å²	142	50 Å²	50	54%	0.536	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	1.6	171.6	-58.3	-153.8	-170.8	123	-9.8	113.8	G352 L354 C377 R381	G352-R379 WeakPolarHBondContact O-CD 3.47Å; G352-R379 WeakPolarHBondContact O-CG 3.2Å; G352-R379 PolarHBondContact O-NH1 3.4Å; L354-R379 CarbonylContact O-C 3.47Å; C377-R379 PolarHBondContact O-N 3.38Å; R379-R381 WeakPolarHBondContact O-CG 3.49Å
380	L	96.8	Very high	97	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	22%	0.218	C	C	.	.			trans	-55.7	136.3	176.6	-165.4	69.9	0	0	0	111.1	L354 L357 V373 C377 Y382 L383 L399 K405 L406	L354-L380 HydrophobicContact CD2-CD1 4.39Å; L354-L380 HydrophobicContact CG-CD1 4.29Å; L354-L380 PolarHBondContact O-N 2.95Å; L357-L380 HydrophobicContact CB-CD1 4.12Å; V373-L380 HydrophobicContact CG1-CD2 4.13Å; C377-L380 VanDerWaalsContact O-CB 3.28Å; C377-L380 WeakPolarHBondContact O-CB 3.22Å; C377-L380 PolarHBondContact O-N 3.48Å; L380-Y382 WeakPolarHBondContact CD1-O 3.31Å; L380-L383 HydrophobicContact CD2-CB 4.17Å; L380-L399 HydrophobicContact CD2-CD2 4.42Å; L380-K405 CarbonylContact O-C 3.56Å; L380-K405 VanDerWaalsContact O-C 3.24Å; L380-L406 PolarHBondContact O-N 3.34Å
381	R	97.4	Very high	97	Very high	125 Å²	125	50.9 Å²	50.9	47%	0.472	22%	0.216	S	C	.	.			trans	-124.8	-30.7	-176.8	-59.2	-178	178.8	-174.1	-3.4	112.5	R355 R379 K407 S408	R355-R381 WeakPolarHBondContact O-CA 3.48Å; R355-R381 PolarHBondContact O-N 2.9Å; R379-R381 WeakPolarHBondContact O-CG 3.49Å; R381-K407 WeakPolarHBondContact O-CA 3.5Å; R381-K407 PolarHBondContact O-N 3.08Å; R381-S408 PolarHBondContact O-N 3.33Å
382	Y	98.5	Very high	97.1	Very high	64 Å²	64	45.7 Å²	45.7	25%	0.251	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	125.6	177.5	-178.8	-76.4	0	0	0	108.7	R355 Y356 L357 L380 N384 S408	R355-Y382 PolarHBondContact O-N 3.46Å; Y356-Y382 WeakPolarHBondContact CA-O 3.48Å; Y356-Y382 HydrophobicContact CD1-CD1 4.37Å; Y356-Y382 AromaticContact CD2-CD1 3.25Å; Y356-Y382 HydrophobicContact CD2-CD1 3.25Å; Y356-Y382 HydrophobicContact CD2-CD2 4.12Å; Y356-Y382 AromaticContact CD2-CE1 3.83Å; Y356-Y382 HydrophobicContact CD2-CE1 3.83Å; Y356-Y382 AromaticContact CD2-CG 3.43Å; Y356-Y382 HydrophobicContact CD2-CG 3.43Å; Y356-Y382 VanDerWaalsContact CD2-CG 3.43Å; Y356-Y382 HydrophobicContact CE1-CD1 4.34Å; Y356-Y382 HydrophobicContact CE1-CE1 4.3Å; Y356-Y382 AromaticContact CE2-CD1 3.21Å; Y356-Y382 HydrophobicContact CE2-CD1 3.21Å; Y356-Y382 HydrophobicContact CE2-CD2 4.03Å; Y356-Y382 AromaticContact CE2-CE1 3.23Å; Y356-Y382 HydrophobicContact CE2-CE1 3.23Å; Y356-Y382 HydrophobicContact CE2-CE2 4.09Å; Y356-Y382 AromaticContact CE2-CG 3.64Å; Y356-Y382 HydrophobicContact CE2-CG 3.64Å; Y356-Y382 AromaticContact CE2-CZ 3.71Å; Y356-Y382 AromaticContact CG-CD1 3.85Å; Y356-Y382 HydrophobicContact CG-CD1 3.85Å; Y356-Y382 HydrophobicContact CG-CG 4.26Å; Y356-Y382 AromaticContact CZ-CD1 3.78Å; Y356-Y382 AromaticContact CZ-CE1 3.49Å; Y356-Y382 VanDerWaalsContact CZ-CE1 3.49Å; L357-Y382 PolarHBondContact N-O 2.87Å; L380-Y382 WeakPolarHBondContact CD1-O 3.31Å; Y382-N384 HydrophobicContact CD1-CB 4.48Å; Y382-N384 HydrophobicContact CE1-CB 3.49Å; Y382-N384 VanDerWaalsContact CE1-CB 3.49Å; Y382-S408 WeakPolarHBondContact CA-O 3.44Å; Y382-S408 WeakPolarHBondContact CD2-OG 3.19Å; Y382-S408 WeakPolarHBondContact CE2-OG 3.5Å
383	L	98.5	Very high	97.1	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132.7	164.3	-179.4	63.5	0	0	0	109.2	L357 L380 A385 L399 L406 S408 L409 D410	L357-L383 HydrophobicContact CB-CD1 4Å; L357-L383 HydrophobicContact CD2-CD1 4.03Å; L357-L383 HydrophobicContact CG-CD1 4.1Å; L357-L383 CarbonylContact O-C 3.42Å; L357-L383 WeakPolarHBondContact O-CA 3.32Å; L380-L383 HydrophobicContact CD2-CB 4.17Å; L383-A385 HydrophobicContact CG-CB 4.49Å; L383-L399 HydrophobicContact CD2-CD1 3.46Å; L383-L399 VanDerWaalsContact CD2-CD1 3.46Å; L383-L399 HydrophobicContact CD2-CD2 3.75Å; L383-L399 HydrophobicContact CD2-CG 4.26Å; L383-L406 HydrophobicContact CB-CD1 4.31Å; L383-S408 PolarHBondContact N-O 3.07Å; L383-L409 HydrophobicContact CB-CD1 3.97Å; L383-L409 HydrophobicContact CD2-CD1 4.03Å; L383-L409 HydrophobicContact CG-CD1 4.2Å; L383-L409 CarbonylContact O-C 3.59Å; L383-L409 VanDerWaalsContact O-CA 3.32Å; L383-L409 WeakPolarHBondContact O-CA 3.47Å; L383-D410 PolarHBondContact O-N 3.08Å
384	N	98.8	Very high	97.1	Very high	12 Å²	12	49.3 Å²	49.3	6%	0.064	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	110.5	164.9	174.9	12.1	0	0	0	108.6	L357 S358 V359 A360 Y382 R386 D410	L357-N384 PolarHBondContact O-N 3.12Å; S358-N384 CarbonylContact C-O 3.57Å; S358-N384 WeakPolarHBondContact CA-O 3.49Å; S358-N384 PolarHBondContact OG-ND2 2.71Å; S358-N384 VanDerWaalsContact OG-ND2 3.14Å; V359-N384 WeakPolarHBondContact CG2-O 3.43Å; V359-N384 PolarHBondContact N-O 3.12Å; A360-N384 PolarHBondContact N-O 2.73Å; Y382-N384 HydrophobicContact CD1-CB 4.48Å; Y382-N384 HydrophobicContact CE1-CB 3.49Å; Y382-N384 VanDerWaalsContact CE1-CB 3.49Å; N384-R386 WeakPolarHBondContact OD1-CB 3.2Å; N384-R386 PolarHBondContact OD1-N 3.14Å; N384-D410 HydrophobicContact CB-CB 4.23Å
385	A	98.2	Very high	97.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	22%	0.22	C	C	.	.			trans	-119.6	27.4	174.1	0	0	0	0	0	110.9	V359 L383 G387 C388 L391 D410 V411 C414	V359-A385 HydrophobicContact CG2-CB 3.99Å; L383-A385 HydrophobicContact CG-CB 4.49Å; A385-G387 PolarHBondContact O-N 2.86Å; A385-C388 HydrophobicContact CB-CB 4.33Å; A385-C388 WeakPolarHBondContact O-CB 3.39Å; A385-C388 PolarHBondContact O-N 3.43Å; A385-L391 HydrophobicContact CB-CD2 3.78Å; A385-D410 PolarHBondContact N-O 3.36Å; A385-V411 HydrophobicContact CB-CG1 4.41Å; A385-C414 PolarHBondContact O-SG 3.43Å; A385-C414 VanDerWaalsContact O-SG 3.33Å
386	R	98.3	Very high	97.3	Very high	43 Å²	43	41.5 Å²	41.5	16%	0.162	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51	120	177.5	172.8	174	-176.4	70.7	3.1	111.5	A360 H361 N384 C388 D410 G412 R438	A360-R386 CarbonylContact C-O 3.59Å; A360-R386 WeakPolarHBondContact CA-O 3.24Å; A360-R386 HydrophobicContact CB-CB 3.94Å; A360-R386 WeakPolarHBondContact CB-O 3.28Å; H361-R386 PolarHBondContact N-O 3.28Å; N384-R386 WeakPolarHBondContact OD1-CB 3.2Å; N384-R386 PolarHBondContact OD1-N 3.14Å; R386-C388 VanDerWaalsContact C-N 3.33Å; R386-D410 WeakPolarHBondContact CD-OD2 3.36Å; R386-D410 PolarHBondContact N-O 3.23Å; R386-G412 CarbonylContact C-O 3.59Å; R386-G412 WeakPolarHBondContact CA-O 3.16Å; R386-G412 WeakPolarHBondContact CG-O 3.38Å; R386-R438 PolarHBondContact NH1-O 3.23Å
387	G	97.4	Very high	97.4	Very high	2 Å²	2	37.4 Å²	37.4	2%	0.021	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	24.4	-178.7	0	0	0	0	0	114.8	A385 E389 G412 K413	A385-G387 PolarHBondContact O-N 2.86Å; G387-E389 PolarHBondContact O-N 3.35Å; G387-G412 PolarHBondContact N-O 3.31Å; G387-K413 WeakPolarHBondContact CA-O 3.27Å
388	C	97.6	Very high	97.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.189	C	C	.	.			trans	-79.9	92.7	156.7	-68.2	0	0	0	0	107.8	V359 C362 A385 R386 G390 L391 C414	V359-C388 PolarHBondContact O-SG 2.95Å; V359-C388 VanDerWaalsContact O-SG 3.37Å; C362-C388 PolarHBondContact O-SG 3.4Å; C362-C388 VanDerWaalsContact O-SG 3.34Å; A385-C388 HydrophobicContact CB-CB 4.33Å; A385-C388 WeakPolarHBondContact O-CB 3.39Å; A385-C388 PolarHBondContact O-N 3.43Å; R386-C388 VanDerWaalsContact C-N 3.33Å; C388-G390 PolarHBondContact O-N 3.41Å; C388-L391 HydrophobicContact CB-CB 4.22Å; C388-L391 VanDerWaalsContact O-CB 3.31Å; C388-L391 WeakPolarHBondContact O-CB 3.26Å; C388-L391 PolarHBondContact O-N 2.84Å; C388-L391 VanDerWaalsContact O-N 3.11Å; C388-C414 PolarHBondContact O-SG 3.44Å
389	E	95.2	Very high	97.6	Very high	117 Å²	117	37.6 Å²	37.6	55%	0.547	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-28.5	-170.1	-69.3	164.3	-166.2	0	0	113.5	T363 G387 L391	T363-E389 HydrophobicContact CG2-CG 4.43Å; G387-E389 PolarHBondContact O-N 3.35Å; E389-L391 VanDerWaalsContact C-N 3.33Å; E389-L391 PolarHBondContact O-N 3.46Å
390	G	96.4	Very high	97.7	Very high	24 Å²	24	30.9 Å²	30.9	25%	0.247	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-85.5	12	175.9	0	0	0	0	0	115.9	T366 C388	T366-G390 VanDerWaalsContact CA-O 3.32Å; T366-G390 WeakPolarHBondContact CA-O 3.48Å; T366-G390 WeakPolarHBondContact CB-O 3.37Å; C388-G390 PolarHBondContact O-N 3.41Å
391	L	98.3	Very high	97.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.169	C	C	.	.			trans	-89.1	127	175.5	179.7	58.2	0	0	0	110.9	V370 A385 C388 E389 V411 V417	V370-L391 HydrophobicContact CB-CD1 4.34Å; V370-L391 HydrophobicContact CG1-CD1 4.32Å; V370-L391 HydrophobicContact CG2-CD1 3.99Å; A385-L391 HydrophobicContact CB-CD2 3.78Å; C388-L391 HydrophobicContact CB-CB 4.22Å; C388-L391 VanDerWaalsContact O-CB 3.31Å; C388-L391 WeakPolarHBondContact O-CB 3.26Å; C388-L391 PolarHBondContact O-N 2.84Å; C388-L391 VanDerWaalsContact O-N 3.11Å; E389-L391 VanDerWaalsContact C-N 3.33Å; E389-L391 PolarHBondContact O-N 3.46Å; L391-V411 HydrophobicContact CD2-CB 4.36Å; L391-V411 HydrophobicContact CD2-CG1 3.68Å; L391-V417 HydrophobicContact CG-CG2 4.4Å
392	T	98.4	Very high	97.5	Very high	28 Å²	28	33.4 Å²	33.4	17%	0.172	16%	0.162	C	C	.	.			trans	-123.3	180	-178.3	87.7	0	0	0	0	112.5	D367 H394 G395 L396 L416	D367-T392 PolarHBondContact OD1-N 3.33Å; D367-T392 PolarHBondContact OD1-OG1 3.25Å; D367-T392 WeakPolarHBondContact OD2-CB 3.45Å; D367-T392 WeakPolarHBondContact OD2-CG2 3.27Å; D367-T392 PolarHBondContact OD2-OG1 3.47Å; T392-H394 PolarHBondContact O-N 3.35Å; T392-H394 VanDerWaalsContact O-N 3.14Å; T392-H394 PolarHBondContact OG1-N 2.98Å; T392-G395 PolarHBondContact O-N 3.08Å; T392-G395 VanDerWaalsContact O-N 3.14Å; T392-L396 PolarHBondContact O-N 2.55Å; T392-L396 VanDerWaalsContact O-N 3.17Å; T392-L416 WeakPolarHBondContact CA-O 3.33Å; T392-L416 HydrophobicContact CG2-CB 3.85Å; T392-L416 HydrophobicContact CG2-CD1 3.97Å
393	D	98.3	Very high	97.4	Very high	24 Å²	24	30.4 Å²	30.4	13%	0.128	15%	0.15	C	C	.	.	H	α-helix	trans	-56.1	-22.2	170.8	-63	-32.8	0	0	0	114	G397 S418 S420 G421	D393-G397 PolarHBondContact O-N 2.94Å; D393-S418 PolarHBondContact OD1-N 3Å; D393-S418 WeakPolarHBondContact OD2-CB 3.47Å; D393-S418 PolarHBondContact OD2-OG 3.38Å; D393-S420 WeakPolarHBondContact OD2-CB 3.24Å; D393-G421 WeakPolarHBondContact OD1-CA 3.45Å; D393-G421 PolarHBondContact OD1-N 2.77Å
394	H	98.3	Very high	97	Very high	139 Å²	139	34.1 Å²	34.1	64%	0.644	17%	0.174	S	C	*	.	H	α-helix	trans	-71.4	-43.4	174.1	-70.2	-73.6	0	0	0	112.2	T392 G397 H398	T392-H394 PolarHBondContact O-N 3.35Å; T392-H394 VanDerWaalsContact O-N 3.14Å; T392-H394 PolarHBondContact OG1-N 2.98Å; H394-G397 CarbonylContact O-C 3.57Å; H394-G397 WeakPolarHBondContact O-CA 3.47Å; H394-G397 PolarHBondContact O-N 2.83Å; H394-G397 VanDerWaalsContact O-N 3.15Å; H394-H398 PolarHBondContact O-CD2 3.4Å; H394-H398 VanDerWaalsContact O-CD2 3.27Å; H394-H398 PolarHBondContact O-N 3.48Å
395	G	98	Very high	96.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.1	-41	173.8	0	0	0	0	0	112	D367 T392 G397 H398 L399	D367-G395 VanDerWaalsContact CG-N 3.26Å; D367-G395 WeakPolarHBondContact OD1-CA 3.21Å; D367-G395 PolarHBondContact OD1-N 3.16Å; T392-G395 PolarHBondContact O-N 3.08Å; T392-G395 VanDerWaalsContact O-N 3.14Å; G395-G397 VanDerWaalsContact C-N 3.32Å; G395-G397 PolarHBondContact O-N 3.38Å; G395-H398 PolarHBondContact O-N 2.84Å; G395-L399 WeakPolarHBondContact O-CG 3.34Å; G395-L399 PolarHBondContact O-N 3.4Å
396	L	98.1	Very high	96.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.2	-40.3	170	-64.1	-170.7	0	0	0	112	T392 H398 L399 A400 L409 V411 V417 L425	T392-L396 PolarHBondContact O-N 2.55Å; T392-L396 VanDerWaalsContact O-N 3.17Å; L396-H398 VanDerWaalsContact C-N 3.31Å; L396-H398 PolarHBondContact O-N 2.76Å; L396-L399 HydrophobicContact CD2-CD1 4.15Å; L396-L399 PolarHBondContact O-N 3.15Å; L396-A400 VanDerWaalsContact O-CB 3.29Å; L396-A400 WeakPolarHBondContact O-CB 3.45Å; L396-A400 PolarHBondContact O-N 3.34Å; L396-L409 HydrophobicContact CD2-CD2 4.07Å; L396-V411 HydrophobicContact CD2-CG1 4.17Å; L396-V417 HydrophobicContact CD1-CB 4.28Å; L396-V417 HydrophobicContact CD1-CG1 3.53Å; L396-V417 HydrophobicContact CD1-CG2 3.85Å; L396-V417 HydrophobicContact CG-CG2 4.29Å; L396-L425 HydrophobicContact CB-CD1 4.37Å; L396-L425 HydrophobicContact CB-CG 4.42Å; L396-L425 HydrophobicContact CD1-CD1 3.99Å; L396-L425 HydrophobicContact CD2-CD1 4.19Å; L396-L425 HydrophobicContact CG-CD1 4.42Å
397	G	97.9	Very high	96.7	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-33.9	173.9	0	0	0	0	0	113.9	D393 H394 G395 R401	D393-G397 PolarHBondContact O-N 2.94Å; H394-G397 CarbonylContact O-C 3.57Å; H394-G397 WeakPolarHBondContact O-CA 3.47Å; H394-G397 PolarHBondContact O-N 2.83Å; H394-G397 VanDerWaalsContact O-N 3.15Å; G395-G397 VanDerWaalsContact C-N 3.32Å; G395-G397 PolarHBondContact O-N 3.38Å; G397-R401 WeakPolarHBondContact O-CG 3.13Å; G397-R401 PolarHBondContact O-N 2.97Å; G397-R401 PolarHBondContact O-NH1 3.48Å
398	H	97.8	Very high	96.7	Very high	64 Å²	64	42.9 Å²	42.9	30%	0.296	21%	0.214	S	C	.	.	H	α-helix	trans	-70.5	-46.1	172.9	-71.2	-49	0	0	0	111.8	R371 A374 H394 G395 L396 A400 R401 S402	R371-H398 HydrophobicContact CB-CB 4.37Å; A374-H398 HydrophobicContact CB-CB 4.19Å; H394-H398 PolarHBondContact O-CD2 3.4Å; H394-H398 VanDerWaalsContact O-CD2 3.27Å; H394-H398 PolarHBondContact O-N 3.48Å; G395-H398 PolarHBondContact O-N 2.84Å; L396-H398 VanDerWaalsContact C-N 3.31Å; L396-H398 PolarHBondContact O-N 2.76Å; H398-A400 PolarHBondContact O-N 3.37Å; H398-R401 PolarHBondContact O-N 3.21Å; H398-S402 WeakPolarHBondContact O-CB 3.33Å; H398-S402 PolarHBondContact O-N 2.96Å; H398-S402 VanDerWaalsContact O-N 3.1Å; H398-S402 PolarHBondContact O-OG 2.84Å
399	L	97.1	Very high	96.8	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.6	-46.2	174.7	-70.7	164.4	0	0	0	111.9	V370 A374 L380 L383 G395 L396 R401 S402 C403	V370-L399 HydrophobicContact CG1-CD1 3.58Å; V370-L399 HydrophobicContact CG1-CD2 4.03Å; V370-L399 HydrophobicContact CG1-CG 3.58Å; A374-L399 HydrophobicContact CB-CD2 4.07Å; A374-L399 HydrophobicContact CB-CG 4.45Å; L380-L399 HydrophobicContact CD2-CD2 4.42Å; L383-L399 HydrophobicContact CD2-CD1 3.46Å; L383-L399 VanDerWaalsContact CD2-CD1 3.46Å; L383-L399 HydrophobicContact CD2-CD2 3.75Å; L383-L399 HydrophobicContact CD2-CG 4.26Å; G395-L399 WeakPolarHBondContact O-CG 3.34Å; G395-L399 PolarHBondContact O-N 3.4Å; L396-L399 HydrophobicContact CD2-CD1 4.15Å; L396-L399 PolarHBondContact O-N 3.15Å; L399-R401 PolarHBondContact O-N 3.19Å; L399-S402 PolarHBondContact O-N 3.33Å; L399-C403 WeakPolarHBondContact O-CA 3.47Å; L399-C403 WeakPolarHBondContact O-CB 3.28Å; L399-C403 PolarHBondContact O-N 3.22Å
400	A	96	Very high	96.9	Very high	2 Å²	2	38.6 Å²	38.6	2%	0.017	20%	0.195	C	C	.	.	H	α-helix	trans	-56.3	-48.9	-179.3	0	0	0	0	0	112	L396 H398 Q424 L425 Y428	L396-A400 VanDerWaalsContact O-CB 3.29Å; L396-A400 WeakPolarHBondContact O-CB 3.45Å; L396-A400 PolarHBondContact O-N 3.34Å; H398-A400 PolarHBondContact O-N 3.37Å; A400-Q424 HydrophobicContact CB-CB 4.46Å; A400-Q424 WeakPolarHBondContact CB-O 3.41Å; A400-L425 HydrophobicContact CB-CD2 4.19Å; A400-Y428 HydrophobicContact CB-CD2 4.15Å; A400-Y428 WeakPolarHBondContact O-CB 3.17Å
401	R	95.8	Very high	97	Very high	133 Å²	133	37.5 Å²	37.5	50%	0.502	18%	0.183	S	C	.	.	H	α-helix	trans	-77.2	-24.6	-176	-66.6	175.3	-175.7	81.4	-3	113.9	G397 H398 L399 Q424 Y428	G397-R401 WeakPolarHBondContact O-CG 3.13Å; G397-R401 PolarHBondContact O-N 2.97Å; G397-R401 PolarHBondContact O-NH1 3.48Å; H398-R401 PolarHBondContact O-N 3.21Å; L399-R401 PolarHBondContact O-N 3.19Å; R401-Q424 VanDerWaalsContact CZ-OE1 3.29Å; R401-Y428 HydrophobicContact CG-CD2 4.17Å; R401-Y428 HydrophobicContact CG-CE2 4.1Å
402	S	95.6	Very high	97	Very high	45 Å²	45	37.5 Å²	37.5	32%	0.315	18%	0.183	S	C	.	.	H	α-helix	trans	-114.9	-14.6	-171.7	-54.6	0	0	0	0	115.3	A374 H398 L399 P404	A374-S402 WeakPolarHBondContact O-CB 3.29Å; H398-S402 WeakPolarHBondContact O-CB 3.33Å; H398-S402 PolarHBondContact O-N 2.96Å; H398-S402 VanDerWaalsContact O-N 3.1Å; H398-S402 PolarHBondContact O-OG 2.84Å; L399-S402 PolarHBondContact O-N 3.33Å; S402-P404 VanDerWaalsContact O-CD 3.27Å; S402-P404 WeakPolarHBondContact O-CD 3.3Å
403	C	94.9	Very high	96.9	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.197	C	C	.	.			trans	-118	60.8	178.8	-58.7	0	0	0	0	113.2	L399 K405 L406	L399-C403 WeakPolarHBondContact O-CA 3.47Å; L399-C403 WeakPolarHBondContact O-CB 3.28Å; L399-C403 PolarHBondContact O-N 3.22Å; C403-K405 PolarHBondContact O-N 3.4Å; C403-L406 HydrophobicContact CB-CB 4.38Å; C403-L406 VanDerWaalsContact O-CB 3.26Å; C403-L406 WeakPolarHBondContact O-CB 3.43Å; C403-L406 PolarHBondContact O-N 3.5Å
404	P	91.1	Very high	96.9	Very high	83 Å²	83	40 Å²	40	54%	0.539	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-2.6	-178.5	29.5	-37.4	0	0	0	114.5	S402	S402-P404 VanDerWaalsContact O-CD 3.27Å; S402-P404 WeakPolarHBondContact O-CD 3.3Å
405	K	93.9	Very high	96.7	Very high	127 Å²	127	35.6 Å²	35.6	55%	0.552	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.1	5.8	176.2	-64.7	-178.5	-179.6	176.1	0	113.2	L380 C403 K407	L380-K405 CarbonylContact O-C 3.56Å; L380-K405 VanDerWaalsContact O-C 3.24Å; C403-K405 PolarHBondContact O-N 3.4Å; K405-K407 PolarHBondContact O-N 2.8Å
406	L	96.8	Very high	96.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.198	C	C	.	.			trans	-62.2	126.6	174.6	-167.7	67.5	0	0	0	110.4	L380 L383 C403 S408 L409 L432	L380-L406 PolarHBondContact O-N 3.34Å; L383-L406 HydrophobicContact CB-CD1 4.31Å; C403-L406 HydrophobicContact CB-CB 4.38Å; C403-L406 VanDerWaalsContact O-CB 3.26Å; C403-L406 WeakPolarHBondContact O-CB 3.43Å; C403-L406 PolarHBondContact O-N 3.5Å; L406-S408 WeakPolarHBondContact CD1-O 3.34Å; L406-L409 HydrophobicContact CD2-CB 4.38Å; L406-L432 HydrophobicContact CD2-CD2 4.19Å; L406-L432 HydrophobicContact CG-CD2 4.03Å
407	K	97.5	Very high	96.6	Very high	101 Å²	101	40.2 Å²	40.2	44%	0.439	20%	0.198	S	C	.	.			trans	-118.7	-20.9	179.5	-65	-169.4	176.2	-168.5	0	112.8	R381 K405 R433 R434	R381-K407 WeakPolarHBondContact O-CA 3.5Å; R381-K407 PolarHBondContact O-N 3.08Å; K405-K407 PolarHBondContact O-N 2.8Å; K407-R433 WeakPolarHBondContact O-CA 3.36Å; K407-R433 PolarHBondContact O-N 2.94Å; K407-R434 PolarHBondContact O-N 3.47Å
408	S	98.4	Very high	96.6	Very high	13 Å²	13	41.6 Å²	41.6	9%	0.091	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	128	-176.1	-167.2	0	0	0	0	109.8	R381 Y382 L383 L406 R434	R381-S408 PolarHBondContact O-N 3.33Å; Y382-S408 WeakPolarHBondContact CA-O 3.44Å; Y382-S408 WeakPolarHBondContact CD2-OG 3.19Å; Y382-S408 WeakPolarHBondContact CE2-OG 3.5Å; L383-S408 PolarHBondContact N-O 3.07Å; L406-S408 WeakPolarHBondContact CD1-O 3.34Å; S408-R434 CarbonylContact C-O 3.59Å; S408-R434 VanDerWaalsContact CA-O 3.28Å; S408-R434 WeakPolarHBondContact CA-O 3.47Å
409	L	98.5	Very high	96.6	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	126.7	176	-176.8	64.1	0	0	0	109.5	L383 L396 L406 V411 L425 L432 R434 V435 S436	L383-L409 HydrophobicContact CB-CD1 3.97Å; L383-L409 HydrophobicContact CD2-CD1 4.03Å; L383-L409 HydrophobicContact CG-CD1 4.2Å; L383-L409 CarbonylContact O-C 3.59Å; L383-L409 VanDerWaalsContact O-CA 3.32Å; L383-L409 WeakPolarHBondContact O-CA 3.47Å; L396-L409 HydrophobicContact CD2-CD2 4.07Å; L406-L409 HydrophobicContact CD2-CB 4.38Å; L409-V411 HydrophobicContact CD1-CG1 3.78Å; L409-V411 HydrophobicContact CD2-CG1 4.34Å; L409-V411 HydrophobicContact CG-CG1 3.96Å; L409-L425 HydrophobicContact CD2-CD1 3.48Å; L409-L425 VanDerWaalsContact CD2-CD1 3.48Å; L409-L425 HydrophobicContact CD2-CD2 4.09Å; L409-L425 HydrophobicContact CD2-CG 4.46Å; L409-L432 HydrophobicContact CB-CD2 4.42Å; L409-R434 PolarHBondContact N-O 3.15Å; L409-V435 CarbonylContact O-C 3.55Å; L409-V435 WeakPolarHBondContact O-CA 3.31Å; L409-S436 PolarHBondContact O-N 2.85Å
410	D	98.6	Very high	96.6	Very high	25 Å²	25	42 Å²	42	13%	0.134	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	117.9	164.9	-174.6	6.3	0	0	0	108.9	L383 N384 A385 R386 G412 S436	L383-D410 PolarHBondContact O-N 3.08Å; N384-D410 HydrophobicContact CB-CB 4.23Å; A385-D410 PolarHBondContact N-O 3.36Å; R386-D410 WeakPolarHBondContact CD-OD2 3.36Å; R386-D410 PolarHBondContact N-O 3.23Å; D410-G412 PolarHBondContact OD1-N 3.34Å; D410-G412 VanDerWaalsContact OD1-N 3.09Å; D410-S436 VanDerWaalsContact CG-OG 3.26Å; D410-S436 WeakPolarHBondContact OD1-CB 3.2Å; D410-S436 PolarHBondContact OD1-OG 2.88Å
411	V	98.1	Very high	96.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.216	C	C	.	.			trans	-132.8	21.8	175.3	-65.2	0	0	0	0	110.9	A385 L391 L396 L409 C414 V417 S436 L437 C440	A385-V411 HydrophobicContact CB-CG1 4.41Å; L391-V411 HydrophobicContact CD2-CB 4.36Å; L391-V411 HydrophobicContact CD2-CG1 3.68Å; L396-V411 HydrophobicContact CD2-CG1 4.17Å; L409-V411 HydrophobicContact CD1-CG1 3.78Å; L409-V411 HydrophobicContact CD2-CG1 4.34Å; L409-V411 HydrophobicContact CG-CG1 3.96Å; V411-C414 VanDerWaalsContact O-CB 3.22Å; V411-C414 WeakPolarHBondContact O-CB 3.43Å; V411-C414 PolarHBondContact O-N 3.28Å; V411-C414 PolarHBondContact O-SG 3.23Å; V411-C414 VanDerWaalsContact O-SG 3.36Å; V411-V417 HydrophobicContact CG2-CG1 4.25Å; V411-S436 PolarHBondContact N-O 3.31Å; V411-L437 HydrophobicContact CG2-CD2 3.75Å; V411-C440 PolarHBondContact O-SG 2.98Å
412	G	97.5	Very high	96.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	150.9	172.8	0	0	0	0	0	111.6	R386 G387 D410 C414 S436 R438	R386-G412 CarbonylContact C-O 3.59Å; R386-G412 WeakPolarHBondContact CA-O 3.16Å; R386-G412 WeakPolarHBondContact CG-O 3.38Å; G387-G412 PolarHBondContact N-O 3.31Å; D410-G412 PolarHBondContact OD1-N 3.34Å; D410-G412 VanDerWaalsContact OD1-N 3.09Å; G412-C414 PolarHBondContact O-N 3.12Å; G412-S436 PolarHBondContact N-O 3.03Å; G412-R438 CarbonylContact C-O 3.51Å; G412-R438 VanDerWaalsContact C-O 3.23Å; G412-R438 WeakPolarHBondContact CA-O 3.39Å
413	K	97	Very high	96.8	Very high	105 Å²	105	36.5 Å²	36.5	46%	0.457	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	21.1	-170.4	-61	-172.4	163.3	-155.5	0	114.8	G387 P415 R438 A439	G387-K413 WeakPolarHBondContact CA-O 3.27Å; K413-P415 WeakPolarHBondContact O-CD 3.45Å; K413-R438 PolarHBondContact N-O 3.05Å; K413-A439 VanDerWaalsContact CA-O 3.31Å; K413-A439 WeakPolarHBondContact CA-O 3.44Å; K413-A439 HydrophobicContact CG-CB 3.95Å; K413-A439 PolarHBondContact N-O 3.18Å
414	C	97.3	Very high	96.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.2	C	C	.	.			trans	-97.8	101.5	162.5	-63.8	0	0	0	0	107.8	A385 C388 V411 G412 L416 V417 C440	A385-C414 PolarHBondContact O-SG 3.43Å; A385-C414 VanDerWaalsContact O-SG 3.33Å; C388-C414 PolarHBondContact O-SG 3.44Å; V411-C414 VanDerWaalsContact O-CB 3.22Å; V411-C414 WeakPolarHBondContact O-CB 3.43Å; V411-C414 PolarHBondContact O-N 3.28Å; V411-C414 PolarHBondContact O-SG 3.23Å; V411-C414 VanDerWaalsContact O-SG 3.36Å; G412-C414 PolarHBondContact O-N 3.12Å; C414-L416 VanDerWaalsContact C-N 3.29Å; C414-L416 PolarHBondContact O-N 3.15Å; C414-V417 HydrophobicContact CB-CB 4.24Å; C414-V417 HydrophobicContact CB-CG2 3.73Å; C414-V417 PolarHBondContact O-N 2.99Å; C414-C440 PolarHBondContact O-SG 3.36Å
415	P	95.3	Very high	97.1	Very high	46 Å²	46	34.5 Å²	34.5	30%	0.299	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.6	-172.6	27.5	-33.8	0	0	0	113.1	K413 V417 S442	K413-P415 WeakPolarHBondContact O-CD 3.45Å; P415-V417 VanDerWaalsContact C-N 3.32Å; P415-S442 WeakPolarHBondContact O-CB 3.09Å; P415-S442 PolarHBondContact O-OG 3Å
416	L	96.8	Very high	97.2	Very high	97 Å²	97	28.5 Å²	28.5	51%	0.508	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	6.1	-179.9	-53.9	178.7	0	0	0	114	T392 C414	T392-L416 WeakPolarHBondContact CA-O 3.33Å; T392-L416 HydrophobicContact CG2-CB 3.85Å; T392-L416 HydrophobicContact CG2-CD1 3.97Å; C414-L416 VanDerWaalsContact C-N 3.29Å; C414-L416 PolarHBondContact O-N 3.15Å
417	V	97.4	Very high	97.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.175	C	C	.	.			trans	-90.3	123.4	169.8	164.6	0	0	0	0	109	L391 L396 V411 C414 P415 L422 S442 V443	L391-V417 HydrophobicContact CG-CG2 4.4Å; L396-V417 HydrophobicContact CD1-CB 4.28Å; L396-V417 HydrophobicContact CD1-CG1 3.53Å; L396-V417 HydrophobicContact CD1-CG2 3.85Å; L396-V417 HydrophobicContact CG-CG2 4.29Å; V411-V417 HydrophobicContact CG2-CG1 4.25Å; C414-V417 HydrophobicContact CB-CB 4.24Å; C414-V417 HydrophobicContact CB-CG2 3.73Å; C414-V417 PolarHBondContact O-N 2.99Å; P415-V417 VanDerWaalsContact C-N 3.32Å; V417-L422 HydrophobicContact CG1-CD2 4.45Å; V417-S442 WeakPolarHBondContact O-CB 3.23Å; V417-V443 HydrophobicContact CG1-CG2 4.31Å
418	S	97.4	Very high	96.9	Very high	31 Å²	31	33.9 Å²	33.9	22%	0.217	17%	0.174	C	C	.	.			trans	-123.5	-179.7	-178.4	88.3	0	0	0	0	113	D393 S420 G421 L422 S442	D393-S418 PolarHBondContact OD1-N 3Å; D393-S418 WeakPolarHBondContact OD2-CB 3.47Å; D393-S418 PolarHBondContact OD2-OG 3.38Å; S418-S420 PolarHBondContact O-N 3.01Å; S418-S420 VanDerWaalsContact O-N 3.08Å; S418-S420 PolarHBondContact OG-N 2.76Å; S418-S420 VanDerWaalsContact OG-N 3.16Å; S418-G421 PolarHBondContact O-N 3.02Å; S418-G421 VanDerWaalsContact O-N 3.15Å; S418-L422 PolarHBondContact O-N 3.08Å; S418-S442 WeakPolarHBondContact CA-O 3.36Å; S418-S442 WeakPolarHBondContact CB-O 3.4Å
419	D	97.1	Very high	96.6	Very high	17 Å²	17	33.3 Å²	33.3	9%	0.091	17%	0.17	C	C	.	.	H	α-helix	trans	-50.6	-29.9	171.7	-65.6	-40.5	0	0	0	113.8	L422 E423 T444 R446 G447	D419-L422 PolarHBondContact O-N 2.97Å; D419-E423 WeakPolarHBondContact O-CB 3.35Å; D419-E423 WeakPolarHBondContact O-CG 3.27Å; D419-E423 PolarHBondContact O-N 3.22Å; D419-T444 PolarHBondContact OD1-N 3.06Å; D419-T444 WeakPolarHBondContact OD2-CB 3.44Å; D419-T444 WeakPolarHBondContact OD2-CG2 3.41Å; D419-T444 PolarHBondContact OD2-OG1 3.14Å; D419-R446 HydrophobicContact CB-CB 4.35Å; D419-R446 HydrophobicContact CB-CG 4.32Å; D419-G447 VanDerWaalsContact CG-N 3.28Å; D419-G447 VanDerWaalsContact OD1-CA 3.29Å; D419-G447 WeakPolarHBondContact OD1-CA 3.22Å; D419-G447 PolarHBondContact OD1-N 3.5Å
420	S	97.6	Very high	96.3	Very high	54 Å²	54	38.9 Å²	38.9	38%	0.378	20%	0.195	S	C	.	.	H	α-helix	trans	-66	-40.3	179.6	175	0	0	0	0	112.8	D393 S418 L422 Q424	D393-S420 WeakPolarHBondContact OD2-CB 3.24Å; S418-S420 PolarHBondContact O-N 3.01Å; S418-S420 VanDerWaalsContact O-N 3.08Å; S418-S420 PolarHBondContact OG-N 2.76Å; S418-S420 VanDerWaalsContact OG-N 3.16Å; S420-L422 VanDerWaalsContact C-N 3.35Å; S420-Q424 WeakPolarHBondContact O-CG 3.17Å; S420-Q424 PolarHBondContact O-N 3.33Å; S420-Q424 VanDerWaalsContact O-N 3.14Å; S420-Q424 PolarHBondContact O-NE2 2.99Å
421	G	97.4	Very high	96.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69.2	-35.1	173.5	0	0	0	0	0	111.9	D393 S418 Q424 L425	D393-G421 WeakPolarHBondContact OD1-CA 3.45Å; D393-G421 PolarHBondContact OD1-N 2.77Å; S418-G421 PolarHBondContact O-N 3.02Å; S418-G421 VanDerWaalsContact O-N 3.15Å; G421-Q424 PolarHBondContact O-N 3.23Å; G421-L425 WeakPolarHBondContact O-CG 3.44Å; G421-L425 PolarHBondContact O-N 3.17Å
422	L	97.4	Very high	96	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69.1	-37.5	175.9	-54.1	-171.9	0	0	0	112.4	V417 S418 D419 S420 L425 A426 L437 V443 L448 L451	V417-L422 HydrophobicContact CG1-CD2 4.45Å; S418-L422 PolarHBondContact O-N 3.08Å; D419-L422 PolarHBondContact O-N 2.97Å; S420-L422 VanDerWaalsContact C-N 3.35Å; L422-L425 HydrophobicContact CD2-CD1 4.25Å; L422-L425 PolarHBondContact O-N 2.91Å; L422-A426 VanDerWaalsContact O-CB 3.29Å; L422-A426 WeakPolarHBondContact O-CB 3.37Å; L422-A426 PolarHBondContact O-N 2.79Å; L422-L437 HydrophobicContact CD1-CD1 3.68Å; L422-L437 HydrophobicContact CD2-CD1 4.15Å; L422-L437 HydrophobicContact CD2-CD2 3.66Å; L422-V443 HydrophobicContact CD1-CB 4.45Å; L422-V443 HydrophobicContact CD1-CG1 3.67Å; L422-V443 HydrophobicContact CD1-CG2 3.94Å; L422-L448 HydrophobicContact CD1-CD2 4.36Å; L422-L451 HydrophobicContact CB-CD1 4.1Å; L422-L451 HydrophobicContact CB-CG 4.19Å; L422-L451 HydrophobicContact CD1-CD1 4.15Å; L422-L451 HydrophobicContact CD2-CD1 4.25Å; L422-L451 HydrophobicContact CG-CD1 4.38Å
423	E	97.2	Very high	96	Very high	65 Å²	65	42.6 Å²	42.6	30%	0.304	22%	0.219	S	C	.	.	H	α-helix	trans	-63.9	-41.3	172.4	-80.1	176.2	177.3	0	0	111.9	D419 A426 M427 R446 A450	D419-E423 WeakPolarHBondContact O-CB 3.35Å; D419-E423 WeakPolarHBondContact O-CG 3.27Å; D419-E423 PolarHBondContact O-N 3.22Å; E423-A426 PolarHBondContact O-N 3.34Å; E423-M427 PolarHBondContact O-N 3.44Å; E423-R446 VanDerWaalsContact CD-NH2 3.31Å; E423-R446 IonicContact OE1-CZ 3.27Å; E423-R446 IonicContact OE1-NE 2.72Å; E423-R446 PolarHBondContact OE1-NE 3.31Å; E423-R446 IonicContact OE1-NH2 3.71Å; E423-R446 PolarHBondContact OE1-NH2 2.84Å; E423-R446 VanDerWaalsContact OE1-NH2 3.12Å; E423-R446 IonicContact OE2-CZ 3.84Å; E423-R446 IonicContact OE2-NE 3.05Å; E423-R446 IonicContact OE2-NH2 3.28Å; E423-R446 PolarHBondContact OE2-NH2 3.43Å; E423-A450 HydrophobicContact CB-CB 4.47Å; E423-A450 HydrophobicContact CG-CB 3.53Å
424	Q	96.2	Very high	96	Very high	41 Å²	41	43.7 Å²	43.7	19%	0.192	22%	0.22	C	C	.	.	H	α-helix	trans	-65.5	-42.7	174.3	-71.6	178.6	79	0	0	112.1	A400 R401 S420 G421 M427 Y428	A400-Q424 HydrophobicContact CB-CB 4.46Å; A400-Q424 WeakPolarHBondContact CB-O 3.41Å; R401-Q424 VanDerWaalsContact CZ-OE1 3.29Å; S420-Q424 WeakPolarHBondContact O-CG 3.17Å; S420-Q424 PolarHBondContact O-N 3.33Å; S420-Q424 VanDerWaalsContact O-N 3.14Å; S420-Q424 PolarHBondContact O-NE2 2.99Å; G421-Q424 PolarHBondContact O-N 3.23Å; Q424-M427 PolarHBondContact O-N 3.44Å; Q424-Y428 WeakPolarHBondContact O-CD2 3.28Å; Q424-Y428 PolarHBondContact O-N 3.21Å
425	L	96.2	Very high	96.1	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-62	-42.3	173.5	-73.8	166.9	0	0	0	112.1	L396 A400 L409 G421 L422 M427 C429 L432 L451	L396-L425 HydrophobicContact CB-CD1 4.37Å; L396-L425 HydrophobicContact CB-CG 4.42Å; L396-L425 HydrophobicContact CD1-CD1 3.99Å; L396-L425 HydrophobicContact CD2-CD1 4.19Å; L396-L425 HydrophobicContact CG-CD1 4.42Å; A400-L425 HydrophobicContact CB-CD2 4.19Å; L409-L425 HydrophobicContact CD2-CD1 3.48Å; L409-L425 VanDerWaalsContact CD2-CD1 3.48Å; L409-L425 HydrophobicContact CD2-CD2 4.09Å; L409-L425 HydrophobicContact CD2-CG 4.46Å; G421-L425 WeakPolarHBondContact O-CG 3.44Å; G421-L425 PolarHBondContact O-N 3.17Å; L422-L425 HydrophobicContact CD2-CD1 4.25Å; L422-L425 PolarHBondContact O-N 2.91Å; L425-M427 VanDerWaalsContact C-N 3.33Å; L425-M427 PolarHBondContact O-N 3.1Å; L425-C429 WeakPolarHBondContact O-CA 3.47Å; L425-C429 VanDerWaalsContact O-CB 3.29Å; L425-C429 WeakPolarHBondContact O-CB 3.21Å; L425-C429 PolarHBondContact O-N 2.67Å; L425-L432 HydrophobicContact CB-CD1 4.35Å; L425-L451 HydrophobicContact CB-CD2 4.35Å
426	A	95.4	Very high	96.2	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-60.1	-42.1	177.5	0	0	0	0	0	112.1	L422 E423 A450 L451 N454	L422-A426 VanDerWaalsContact O-CB 3.29Å; L422-A426 WeakPolarHBondContact O-CB 3.37Å; L422-A426 PolarHBondContact O-N 2.79Å; E423-A426 PolarHBondContact O-N 3.34Å; A426-A450 HydrophobicContact CB-CB 4.27Å; A426-A450 WeakPolarHBondContact CB-O 3.15Å; A426-L451 HydrophobicContact CB-CD2 4.18Å; A426-N454 HydrophobicContact CB-CB 4.13Å; A426-N454 WeakPolarHBondContact O-CB 3.38Å
427	M	94.4	Very high	96.2	Very high	112 Å²	112	37.9 Å²	37.9	55%	0.552	19%	0.188	S	C	*	.	H	α-helix	trans	-64.3	-43	-178.1	-173.2	176.8	-175.5	0	0	113.2	E423 Q424 L425	E423-M427 PolarHBondContact O-N 3.44Å; Q424-M427 PolarHBondContact O-N 3.44Å; L425-M427 VanDerWaalsContact C-N 3.33Å; L425-M427 PolarHBondContact O-N 3.1Å
428	Y	93.5	Very high	96.2	Very high	102 Å²	102	42.1 Å²	42.1	40%	0.4	20%	0.204	S	C	.	.	H	α-helix	trans	-109.5	-21.3	-171.1	-58.8	-78.2	0	0	0	115	A400 R401 Q424	A400-Y428 HydrophobicContact CB-CD2 4.15Å; A400-Y428 WeakPolarHBondContact O-CB 3.17Å; R401-Y428 HydrophobicContact CG-CD2 4.17Å; R401-Y428 HydrophobicContact CG-CE2 4.1Å; Q424-Y428 WeakPolarHBondContact O-CD2 3.28Å; Q424-Y428 PolarHBondContact O-N 3.21Å
429	C	93.1	Very high	96.1	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.007	20%	0.202	C	C	.	.			trans	-111.3	49.3	-177.1	-64.1	0	0	0	0	113.1	L425 G431 L432 C455	L425-C429 WeakPolarHBondContact O-CA 3.47Å; L425-C429 VanDerWaalsContact O-CB 3.29Å; L425-C429 WeakPolarHBondContact O-CB 3.21Å; L425-C429 PolarHBondContact O-N 2.67Å; C429-G431 PolarHBondContact O-N 3.42Å; C429-L432 HydrophobicContact CB-CD1 3.75Å; C429-L432 HydrophobicContact CB-CG 3.88Å; C429-L432 WeakPolarHBondContact O-CB 3.44Å; C429-L432 VanDerWaalsContact O-CG 3.29Å; C429-L432 WeakPolarHBondContact O-CG 3.35Å; C429-L432 PolarHBondContact O-N 3.2Å; C429-C455 PolarHBondContact O-SG 3.14Å
430	Q	92.3	Very high	96.1	Very high	119 Å²	119	40.9 Å²	40.9	56%	0.556	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-23.7	176.4	-62.5	171.2	4.3	0	0	113.9	L432	Q430-L432 VanDerWaalsContact C-N 3.29Å; Q430-L432 PolarHBondContact O-N 3.32Å
431	G	93.4	Very high	95.8	Very high	36 Å²	36	45.3 Å²	45.3	37%	0.371	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	3.1	176.1	0	0	0	0	0	116.7	C429	C429-G431 PolarHBondContact O-N 3.42Å
432	L	96.1	Very high	95.6	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.232	C	C	.	.			trans	-60.9	136.6	177	-80.2	167.6	0	0	0	112.3	L406 L409 L425 C429 Q430 V435 L451 C455	L406-L432 HydrophobicContact CD2-CD2 4.19Å; L406-L432 HydrophobicContact CG-CD2 4.03Å; L409-L432 HydrophobicContact CB-CD2 4.42Å; L425-L432 HydrophobicContact CB-CD1 4.35Å; C429-L432 HydrophobicContact CB-CD1 3.75Å; C429-L432 HydrophobicContact CB-CG 3.88Å; C429-L432 WeakPolarHBondContact O-CB 3.44Å; C429-L432 VanDerWaalsContact O-CG 3.29Å; C429-L432 WeakPolarHBondContact O-CG 3.35Å; C429-L432 PolarHBondContact O-N 3.2Å; Q430-L432 VanDerWaalsContact C-N 3.29Å; Q430-L432 PolarHBondContact O-N 3.32Å; L432-V435 HydrophobicContact CB-CG2 4.41Å; L432-V435 HydrophobicContact CD1-CG2 4.23Å; L432-V435 HydrophobicContact CD2-CG2 4.33Å; L432-L451 HydrophobicContact CD1-CD2 4.49Å; L432-C455 HydrophobicContact CB-CB 4.38Å
433	R	97.1	Very high	95.5	Very high	66 Å²	66	48 Å²	48	25%	0.249	23%	0.232	C	C	.	.			trans	-125.7	-27.9	-178.1	-68.7	-177.7	-178.8	-92.7	-13.4	113.3	K407 E457 Q459 L460	K407-R433 WeakPolarHBondContact O-CA 3.36Å; K407-R433 PolarHBondContact O-N 2.94Å; R433-E457 IonicContact CZ-OE2 3.38Å; R433-E457 IonicContact NH1-OE2 2.72Å; R433-E457 PolarHBondContact NH1-OE2 3.47Å; R433-E457 IonicContact NH2-OE2 2.69Å; R433-E457 PolarHBondContact NH2-OE2 3.11Å; R433-Q459 HydrophobicContact CB-CG 4.06Å; R433-Q459 HydrophobicContact CG-CG 4.32Å; R433-Q459 WeakPolarHBondContact O-CA 3.31Å; R433-Q459 WeakPolarHBondContact O-CB 3.45Å; R433-Q459 PolarHBondContact O-N 3.08Å; R433-L460 PolarHBondContact O-N 2.84Å
434	R	98.3	Very high	95.3	Very high	129 Å²	129	47.9 Å²	47.9	49%	0.487	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	128.5	174.4	-56.2	-165.3	178.2	96.3	3.4	109.9	K407 S408 L409 L460	K407-R434 PolarHBondContact O-N 3.47Å; S408-R434 CarbonylContact C-O 3.59Å; S408-R434 VanDerWaalsContact CA-O 3.28Å; S408-R434 WeakPolarHBondContact CA-O 3.47Å; L409-R434 PolarHBondContact N-O 3.15Å; R434-L460 WeakPolarHBondContact CA-O 3.11Å; R434-L460 HydrophobicContact CB-CB 4.33Å; R434-L460 HydrophobicContact CG-CB 3.99Å
435	V	98.1	Very high	95.2	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	124	177.3	174.1	0	0	0	0	108	L409 L432 L437 L451 L458 L460 L461 N462	L409-V435 CarbonylContact O-C 3.55Å; L409-V435 WeakPolarHBondContact O-CA 3.31Å; L432-V435 HydrophobicContact CB-CG2 4.41Å; L432-V435 HydrophobicContact CD1-CG2 4.23Å; L432-V435 HydrophobicContact CD2-CG2 4.33Å; V435-L437 HydrophobicContact CG1-CD1 3.92Å; V435-L437 HydrophobicContact CG1-CD2 3.93Å; V435-L437 HydrophobicContact CG1-CG 3.74Å; V435-L451 HydrophobicContact CG1-CD1 4.26Å; V435-L458 HydrophobicContact CB-CD1 4.26Å; V435-L458 HydrophobicContact CG2-CD1 3.85Å; V435-L460 PolarHBondContact N-O 3.32Å; V435-L461 HydrophobicContact CB-CD1 4.1Å; V435-L461 HydrophobicContact CG1-CD1 4.07Å; V435-L461 CarbonylContact O-C 3.58Å; V435-L461 VanDerWaalsContact O-CA 3.3Å; V435-L461 WeakPolarHBondContact O-CA 3.45Å; V435-N462 PolarHBondContact O-N 3.1Å
436	S	98.1	Very high	95.1	Very high	17 Å²	17	53.2 Å²	53.2	12%	0.119	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.6	172.5	163.9	0	0	0	0	109.3	L409 D410 V411 G412	L409-S436 PolarHBondContact O-N 2.85Å; D410-S436 VanDerWaalsContact CG-OG 3.26Å; D410-S436 WeakPolarHBondContact OD1-CB 3.2Å; D410-S436 PolarHBondContact OD1-OG 2.88Å; V411-S436 PolarHBondContact N-O 3.31Å; G412-S436 PolarHBondContact N-O 3.03Å
437	L	97.5	Very high	95.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.256	C	S	.	.			trans	-123.7	14.1	-178.4	-54.9	169.6	0	0	0	109.8	V411 L422 V435 A439 C440 V443 L448 L451 L461 N462 V463 C466	V411-L437 HydrophobicContact CG2-CD2 3.75Å; L422-L437 HydrophobicContact CD1-CD1 3.68Å; L422-L437 HydrophobicContact CD2-CD1 4.15Å; L422-L437 HydrophobicContact CD2-CD2 3.66Å; V435-L437 HydrophobicContact CG1-CD1 3.92Å; V435-L437 HydrophobicContact CG1-CD2 3.93Å; V435-L437 HydrophobicContact CG1-CG 3.74Å; L437-A439 PolarHBondContact O-N 3.5Å; L437-C440 VanDerWaalsContact O-CB 3.26Å; L437-C440 WeakPolarHBondContact O-CB 3.39Å; L437-C440 PolarHBondContact O-N 3.17Å; L437-C440 PolarHBondContact O-SG 3.37Å; L437-V443 HydrophobicContact CD1-CG1 4.18Å; L437-L448 HydrophobicContact CD1-CD2 3.63Å; L437-L451 HydrophobicContact CD1-CD1 4.42Å; L437-L461 HydrophobicContact CD1-CD1 4.28Å; L437-N462 PolarHBondContact N-O 3.11Å; L437-V463 HydrophobicContact CB-CG1 4.34Å; L437-V463 HydrophobicContact CD1-CG1 4.2Å; L437-C466 PolarHBondContact O-SG 3.42Å
438	R	96.9	Very high	95.2	Very high	90 Å²	90	47.9 Å²	47.9	34%	0.34	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	120.9	-170.6	174.5	171.2	179.4	-170.6	0.6	112.2	R386 G412 K413 N462 Q464 D465	R386-R438 PolarHBondContact NH1-O 3.23Å; G412-R438 CarbonylContact C-O 3.51Å; G412-R438 VanDerWaalsContact C-O 3.23Å; G412-R438 WeakPolarHBondContact CA-O 3.39Å; K413-R438 PolarHBondContact N-O 3.05Å; R438-N462 WeakPolarHBondContact CB-OD1 3.3Å; R438-Q464 CarbonylContact C-O 3.46Å; R438-Q464 VanDerWaalsContact CA-O 3.27Å; R438-Q464 WeakPolarHBondContact CA-O 3.46Å; R438-Q464 HydrophobicContact CG-CB 3.94Å; R438-Q464 WeakPolarHBondContact CG-O 3.27Å; R438-D465 IonicContact CZ-OD2 3.08Å; R438-D465 IonicContact NE-OD2 2.76Å; R438-D465 PolarHBondContact NE-OD2 3.38Å; R438-D465 IonicContact NH2-OD2 2.66Å; R438-D465 PolarHBondContact NH2-OD2 2.84Å
439	A	95.8	Very high	95.3	Very high	21 Å²	21	46.9 Å²	46.9	17%	0.174	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	43	-173	0	0	0	0	0	113.6	K413 L437 Q464 D465	K413-A439 VanDerWaalsContact CA-O 3.31Å; K413-A439 WeakPolarHBondContact CA-O 3.44Å; K413-A439 HydrophobicContact CG-CB 3.95Å; K413-A439 PolarHBondContact N-O 3.18Å; L437-A439 PolarHBondContact O-N 3.5Å; A439-Q464 PolarHBondContact N-O 3.42Å; A439-D465 WeakPolarHBondContact CA-O 3.5Å; A439-D465 HydrophobicContact CB-CB 3.89Å
440	C	95.4	Very high	95.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.234	C	C	.	.			trans	-93.8	107.9	157.1	-72.3	0	0	0	0	108.4	V411 C414 L437 V443 C466	V411-C440 PolarHBondContact O-SG 2.98Å; C414-C440 PolarHBondContact O-SG 3.36Å; L437-C440 VanDerWaalsContact O-CB 3.26Å; L437-C440 WeakPolarHBondContact O-CB 3.39Å; L437-C440 PolarHBondContact O-N 3.17Å; L437-C440 PolarHBondContact O-SG 3.37Å; C440-V443 HydrophobicContact CB-CB 4.09Å; C440-V443 HydrophobicContact CB-CG2 3.66Å; C440-C466 PolarHBondContact N-SG 3.23Å; C440-C466 VanDerWaalsContact N-SG 3.43Å; C440-C466 PolarHBondContact O-SG 3.32Å
441	E	91.9	Very high	95.6	Very high	148 Å²	148	42.2 Å²	42.2	69%	0.692	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-36.5	-175.7	-66.1	164.6	-166.2	0	0	111.8	V443	E441-V443 PolarHBondContact O-N 3.07Å
442	S	94.2	Very high	95.7	Very high	57 Å²	57	40.5 Å²	40.5	40%	0.399	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	6.6	180	-52.8	0	0	0	0	115	P415 V417 S418	P415-S442 WeakPolarHBondContact O-CB 3.09Å; P415-S442 PolarHBondContact O-OG 3Å; V417-S442 WeakPolarHBondContact O-CB 3.23Å; S418-S442 WeakPolarHBondContact CA-O 3.36Å; S418-S442 WeakPolarHBondContact CB-O 3.4Å
443	V	94.9	Very high	95.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.215	C	C	.	.			trans	-100.3	125.9	-179.6	167.5	0	0	0	0	110.7	V417 L422 L437 C440 E441 L448	V417-V443 HydrophobicContact CG1-CG2 4.31Å; L422-V443 HydrophobicContact CD1-CB 4.45Å; L422-V443 HydrophobicContact CD1-CG1 3.67Å; L422-V443 HydrophobicContact CD1-CG2 3.94Å; L437-V443 HydrophobicContact CD1-CG1 4.18Å; C440-V443 HydrophobicContact CB-CB 4.09Å; C440-V443 HydrophobicContact CB-CG2 3.66Å; E441-V443 PolarHBondContact O-N 3.07Å; V443-L448 HydrophobicContact CG1-CD2 4.4Å
444	T	93.4	Very high	95.6	Very high	61 Å²	61	43.5 Å²	43.5	37%	0.374	22%	0.221	S	C	.	.			trans	-116.7	-174.3	-178.1	86.5	0	0	0	0	112.2	D419 R446	D419-T444 PolarHBondContact OD1-N 3.06Å; D419-T444 WeakPolarHBondContact OD2-CB 3.44Å; D419-T444 WeakPolarHBondContact OD2-CG2 3.41Å; D419-T444 PolarHBondContact OD2-OG1 3.14Å; T444-R446 PolarHBondContact O-N 3.14Å; T444-R446 PolarHBondContact OG1-N 2.87Å
445	G	92.3	Very high	95.3	Very high	9 Å²	9	37.4 Å²	37.4	9%	0.093	20%	0.198	C	C	.	.	H	α-helix	trans	-62.9	-11.2	170.2	0	0	0	0	0	115.5	K449 A472	G445-K449 WeakPolarHBondContact O-CD 3.47Å; G445-K449 WeakPolarHBondContact O-CG 3.26Å; G445-K449 PolarHBondContact O-N 3.17Å; G445-A472 WeakPolarHBondContact O-CB 3.46Å
446	R	95.2	Very high	95	Very high	146 Å²	146	41.2 Å²	41.2	55%	0.551	22%	0.224	S	C	*	.	H	α-helix	trans	-74.3	-55.2	179.1	172.2	-177	166.6	-170.3	-9.5	111.8	D419 E423 T444 L448 K449 A450	D419-R446 HydrophobicContact CB-CB 4.35Å; D419-R446 HydrophobicContact CB-CG 4.32Å; E423-R446 VanDerWaalsContact CD-NH2 3.31Å; E423-R446 IonicContact OE1-CZ 3.27Å; E423-R446 IonicContact OE1-NE 2.72Å; E423-R446 PolarHBondContact OE1-NE 3.31Å; E423-R446 IonicContact OE1-NH2 3.71Å; E423-R446 PolarHBondContact OE1-NH2 2.84Å; E423-R446 VanDerWaalsContact OE1-NH2 3.12Å; E423-R446 IonicContact OE2-CZ 3.84Å; E423-R446 IonicContact OE2-NE 3.05Å; E423-R446 IonicContact OE2-NH2 3.28Å; E423-R446 PolarHBondContact OE2-NH2 3.43Å; T444-R446 PolarHBondContact O-N 3.14Å; T444-R446 PolarHBondContact OG1-N 2.87Å; R446-L448 VanDerWaalsContact C-N 3.26Å; R446-L448 PolarHBondContact O-N 2.82Å; R446-K449 WeakPolarHBondContact O-CB 3.27Å; R446-K449 PolarHBondContact O-N 3.42Å; R446-A450 PolarHBondContact O-N 3.45Å; R446-A450 VanDerWaalsContact O-N 3.09Å
447	G	95.2	Very high	94.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-32.9	-178.4	0	0	0	0	0	112.5	D419 A450 L451	D419-G447 VanDerWaalsContact CG-N 3.28Å; D419-G447 VanDerWaalsContact OD1-CA 3.29Å; D419-G447 WeakPolarHBondContact OD1-CA 3.22Å; D419-G447 PolarHBondContact OD1-N 3.5Å; G447-A450 PolarHBondContact O-N 3.18Å; G447-L451 WeakPolarHBondContact O-CG 3.19Å; G447-L451 PolarHBondContact O-N 3.12Å
448	L	96.2	Very high	94.7	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-67.5	-35.5	173	-57.7	-170.4	0	0	0	113.4	L422 L437 V443 R446 L451 A452 L461 V463 V468 L473 V476	L422-L448 HydrophobicContact CD1-CD2 4.36Å; L437-L448 HydrophobicContact CD1-CD2 3.63Å; V443-L448 HydrophobicContact CG1-CD2 4.4Å; R446-L448 VanDerWaalsContact C-N 3.26Å; R446-L448 PolarHBondContact O-N 2.82Å; L448-L451 HydrophobicContact CD2-CD1 4.39Å; L448-A452 VanDerWaalsContact O-CB 3.26Å; L448-A452 WeakPolarHBondContact O-CB 3.37Å; L448-A452 PolarHBondContact O-N 3.19Å; L448-L461 HydrophobicContact CD1-CD2 4.47Å; L448-L461 HydrophobicContact CD2-CD1 4.23Å; L448-L461 HydrophobicContact CD2-CD2 4.26Å; L448-V463 HydrophobicContact CD1-CG1 3.89Å; L448-V463 HydrophobicContact CD2-CG1 3.89Å; L448-V468 HydrophobicContact CD1-CB 4.28Å; L448-V468 HydrophobicContact CD1-CG1 3.42Å; L448-V468 VanDerWaalsContact CD1-CG1 3.42Å; L448-V468 HydrophobicContact CD1-CG2 3.82Å; L448-L473 HydrophobicContact CD1-CD2 4.32Å; L448-V476 HydrophobicContact CB-CG2 4.21Å
449	K	96	Very high	94.7	Very high	80 Å²	80	43.2 Å²	43.2	35%	0.348	24%	0.235	S	C	.	.	H	α-helix	trans	-65.5	-41.5	172.7	-73.9	167.4	-177	179.6	0	110.4	G445 R446 A452 A453 F475	G445-K449 WeakPolarHBondContact O-CD 3.47Å; G445-K449 WeakPolarHBondContact O-CG 3.26Å; G445-K449 PolarHBondContact O-N 3.17Å; R446-K449 WeakPolarHBondContact O-CB 3.27Å; R446-K449 PolarHBondContact O-N 3.42Å; K449-A452 PolarHBondContact O-N 2.91Å; K449-A453 WeakPolarHBondContact O-CB 3.3Å; K449-A453 PolarHBondContact O-N 3.27Å; K449-F475 HydrophobicContact CB-CD1 4.04Å; K449-F475 HydrophobicContact CB-CE1 4.03Å; K449-F475 HydrophobicContact CB-CZ 4.48Å; K449-F475 HydrophobicContact CG-CB 4.15Å; K449-F475 HydrophobicContact CG-CD1 3.79Å; K449-F475 HydrophobicContact CG-CD2 4.3Å; K449-F475 HydrophobicContact CG-CE1 4.23Å; K449-F475 HydrophobicContact CG-CG 3.84Å; K449-F475 WeakPolarHBondContact O-CE1 3.43Å
450	A	96.1	Very high	94.8	Very high	18 Å²	18	44.1 Å²	44.1	15%	0.149	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-48.3	175.8	0	0	0	0	0	112.5	E423 A426 R446 G447 A453 N454	E423-A450 HydrophobicContact CB-CB 4.47Å; E423-A450 HydrophobicContact CG-CB 3.53Å; A426-A450 HydrophobicContact CB-CB 4.27Å; A426-A450 WeakPolarHBondContact CB-O 3.15Å; R446-A450 PolarHBondContact O-N 3.45Å; R446-A450 VanDerWaalsContact O-N 3.09Å; G447-A450 PolarHBondContact O-N 3.18Å; A450-A453 PolarHBondContact O-N 3.5Å; A450-N454 PolarHBondContact O-N 2.94Å; A450-N454 PolarHBondContact O-ND2 3.47Å
451	L	95.6	Very high	94.9	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-57.6	-48.9	173.7	-75.6	171.4	0	0	0	111.6	L422 L425 A426 L432 V435 L437 G447 L448 A453 N454 C455	L422-L451 HydrophobicContact CB-CD1 4.1Å; L422-L451 HydrophobicContact CB-CG 4.19Å; L422-L451 HydrophobicContact CD1-CD1 4.15Å; L422-L451 HydrophobicContact CD2-CD1 4.25Å; L422-L451 HydrophobicContact CG-CD1 4.38Å; L425-L451 HydrophobicContact CB-CD2 4.35Å; A426-L451 HydrophobicContact CB-CD2 4.18Å; L432-L451 HydrophobicContact CD1-CD2 4.49Å; V435-L451 HydrophobicContact CG1-CD1 4.26Å; L437-L451 HydrophobicContact CD1-CD1 4.42Å; G447-L451 WeakPolarHBondContact O-CG 3.19Å; G447-L451 PolarHBondContact O-N 3.12Å; L448-L451 HydrophobicContact CD2-CD1 4.39Å; L451-A453 VanDerWaalsContact C-N 3.3Å; L451-A453 PolarHBondContact O-N 2.88Å; L451-N454 PolarHBondContact O-N 2.98Å; L451-C455 WeakPolarHBondContact O-CA 3.29Å; L451-C455 VanDerWaalsContact O-CB 3.26Å; L451-C455 WeakPolarHBondContact O-CB 3.33Å; L451-C455 PolarHBondContact O-N 3.12Å
452	A	95.3	Very high	95.1	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-65.7	-30.2	-178	0	0	0	0	0	114.1	L448 K449 F475 V476 H479	L448-A452 VanDerWaalsContact O-CB 3.26Å; L448-A452 WeakPolarHBondContact O-CB 3.37Å; L448-A452 PolarHBondContact O-N 3.19Å; K449-A452 PolarHBondContact O-N 2.91Å; A452-F475 HydrophobicContact CB-CD1 3.91Å; A452-F475 HydrophobicContact CB-CE1 4.03Å; A452-V476 HydrophobicContact CB-CB 4.25Å; A452-V476 HydrophobicContact CB-CG1 4.45Å; A452-V476 HydrophobicContact CB-CG2 3.99Å; A452-H479 HydrophobicContact CB-CB 4.41Å; A452-H479 VanDerWaalsContact O-CB 3.31Å; A452-H479 WeakPolarHBondContact O-CB 3.17Å
453	A	95.3	Very high	95.2	Very high	58 Å²	58	35.2 Å²	35.2	48%	0.479	19%	0.19	S	C	.	.	H	α-helix	trans	-71.3	-32.1	177.5	0	0	0	0	0	113.1	K449 A450 L451 F475	K449-A453 WeakPolarHBondContact O-CB 3.3Å; K449-A453 PolarHBondContact O-N 3.27Å; A450-A453 PolarHBondContact O-N 3.5Å; L451-A453 VanDerWaalsContact C-N 3.3Å; L451-A453 PolarHBondContact O-N 2.88Å; A453-F475 HydrophobicContact CB-CE1 4.49Å
454	N	94.9	Very high	95.3	Very high	71 Å²	71	37.8 Å²	37.8	38%	0.38	20%	0.201	S	C	.	.	H	α-helix	trans	-110	-30.1	-172.5	-62.3	-85.6	0	0	0	114	A426 A450 L451 C456	A426-N454 HydrophobicContact CB-CB 4.13Å; A426-N454 WeakPolarHBondContact O-CB 3.38Å; A450-N454 PolarHBondContact O-N 2.94Å; A450-N454 PolarHBondContact O-ND2 3.47Å; L451-N454 PolarHBondContact O-N 2.98Å; N454-C456 PolarHBondContact O-N 3.44Å
455	C	93.9	Very high	95.3	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.007	20%	0.202	C	C	.	.			trans	-100.6	59.9	179.4	-54.8	0	0	0	0	110.6	C429 L432 L451 E457 L458 C480	C429-C455 PolarHBondContact O-SG 3.14Å; L432-C455 HydrophobicContact CB-CB 4.38Å; L451-C455 WeakPolarHBondContact O-CA 3.29Å; L451-C455 VanDerWaalsContact O-CB 3.26Å; L451-C455 WeakPolarHBondContact O-CB 3.33Å; L451-C455 PolarHBondContact O-N 3.12Å; C455-E457 PolarHBondContact O-N 2.59Å; C455-E457 VanDerWaalsContact O-N 3.13Å; C455-L458 VanDerWaalsContact O-CB 3.3Å; C455-L458 WeakPolarHBondContact O-CB 3.43Å; C455-L458 PolarHBondContact O-N 3.33Å; C455-C480 PolarHBondContact O-SG 2.85Å
456	C	91	Very high	95.3	Very high	83 Å²	83	38.6 Å²	38.6	56%	0.561	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.7	-175.5	60.3	0	0	0	0	114.3	N454 L458	N454-C456 PolarHBondContact O-N 3.44Å; C456-L458 PolarHBondContact O-N 2.92Å
457	E	92.8	Very high	95	Very high	79 Å²	79	40 Å²	40	37%	0.369	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	9.4	175.3	-82.3	-74.1	111.1	0	0	114.4	R433 C455 Q459	R433-E457 IonicContact CZ-OE2 3.38Å; R433-E457 IonicContact NH1-OE2 2.72Å; R433-E457 PolarHBondContact NH1-OE2 3.47Å; R433-E457 IonicContact NH2-OE2 2.69Å; R433-E457 PolarHBondContact NH2-OE2 3.11Å; C455-E457 PolarHBondContact O-N 2.59Å; C455-E457 VanDerWaalsContact O-N 3.13Å; E457-Q459 VanDerWaalsContact O-CG 3.25Å; E457-Q459 WeakPolarHBondContact O-CG 3.32Å; E457-Q459 PolarHBondContact O-N 3.5Å
458	L	96	Very high	94.8	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	22%	0.217	C	C	.	.			trans	-59.9	128.8	177.7	-163.9	69.3	0	0	0	111.7	V435 C455 C456 L461 C480 C483	V435-L458 HydrophobicContact CB-CD1 4.26Å; V435-L458 HydrophobicContact CG2-CD1 3.85Å; C455-L458 VanDerWaalsContact O-CB 3.3Å; C455-L458 WeakPolarHBondContact O-CB 3.43Å; C455-L458 PolarHBondContact O-N 3.33Å; C456-L458 PolarHBondContact O-N 2.92Å; L458-L461 HydrophobicContact CD2-CB 4.04Å; L458-L461 HydrophobicContact CD2-CD2 4.5Å; L458-C480 HydrophobicContact CB-CB 4.06Å; L458-C483 WeakPolarHBondContact O-CA 3.38Å; L458-C483 WeakPolarHBondContact O-CB 3.43Å; L458-C483 PolarHBondContact O-N 2.59Å
459	Q	96.6	Very high	94.6	Very high	67 Å²	67	42.6 Å²	42.6	31%	0.313	23%	0.233	S	C	.	.			trans	-114.1	-28.2	-173.5	-50.4	-172.6	-43.8	0	0	112.5	R433 E457 I484	R433-Q459 HydrophobicContact CB-CG 4.06Å; R433-Q459 HydrophobicContact CG-CG 4.32Å; R433-Q459 WeakPolarHBondContact O-CA 3.31Å; R433-Q459 WeakPolarHBondContact O-CB 3.45Å; R433-Q459 PolarHBondContact O-N 3.08Å; E457-Q459 VanDerWaalsContact O-CG 3.25Å; E457-Q459 WeakPolarHBondContact O-CG 3.32Å; E457-Q459 PolarHBondContact O-N 3.5Å; Q459-I484 PolarHBondContact O-N 3.38Å
460	L	97.8	Very high	94.4	Very high	41 Å²	41	40 Å²	40	22%	0.215	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	132.4	174.3	-174.2	149.5	0	0	0	110.2	R433 R434 V435 N462 I484	R433-L460 PolarHBondContact O-N 2.84Å; R434-L460 WeakPolarHBondContact CA-O 3.11Å; R434-L460 HydrophobicContact CB-CB 4.33Å; R434-L460 HydrophobicContact CG-CB 3.99Å; V435-L460 PolarHBondContact N-O 3.32Å; L460-N462 HydrophobicContact CD2-CB 4.35Å; L460-I484 CarbonylContact C-O 3.59Å; L460-I484 WeakPolarHBondContact CA-O 3.15Å
461	L	97.5	Very high	94.3	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	111	171.7	178.3	62.3	0	0	0	108.9	V435 L437 L448 L458 V463 V476 I484 I485 E486	V435-L461 HydrophobicContact CB-CD1 4.1Å; V435-L461 HydrophobicContact CG1-CD1 4.07Å; V435-L461 CarbonylContact O-C 3.58Å; V435-L461 VanDerWaalsContact O-CA 3.3Å; V435-L461 WeakPolarHBondContact O-CA 3.45Å; L437-L461 HydrophobicContact CD1-CD1 4.28Å; L448-L461 HydrophobicContact CD1-CD2 4.47Å; L448-L461 HydrophobicContact CD2-CD1 4.23Å; L448-L461 HydrophobicContact CD2-CD2 4.26Å; L458-L461 HydrophobicContact CD2-CB 4.04Å; L458-L461 HydrophobicContact CD2-CD2 4.5Å; L461-V463 HydrophobicContact CD1-CG1 3.92Å; L461-V463 HydrophobicContact CD2-CG1 4.33Å; L461-V463 HydrophobicContact CG-CG1 3.94Å; L461-V476 HydrophobicContact CD2-CB 4.49Å; L461-V476 HydrophobicContact CD2-CG1 3.91Å; L461-V476 HydrophobicContact CD2-CG2 3.93Å; L461-I484 PolarHBondContact N-O 2.69Å; L461-I485 CarbonylContact O-C 3.24Å; L461-I485 WeakPolarHBondContact O-CA 3.49Å; L461-E486 PolarHBondContact O-N 2.72Å
462	N	97.5	Very high	94.2	Very high	13 Å²	13	44.2 Å²	44.2	7%	0.07	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	117.4	170.4	-170.2	-38.8	0	0	0	110.3	V435 L437 R438 L460 Q464 E486	V435-N462 PolarHBondContact O-N 3.1Å; L437-N462 PolarHBondContact N-O 3.11Å; R438-N462 WeakPolarHBondContact CB-OD1 3.3Å; L460-N462 HydrophobicContact CD2-CB 4.35Å; N462-Q464 PolarHBondContact ND2-OE1 3.17Å; N462-Q464 VanDerWaalsContact OD1-CB 3.29Å; N462-Q464 WeakPolarHBondContact OD1-CB 3.38Å; N462-Q464 WeakPolarHBondContact OD1-CG 3.3Å; N462-Q464 PolarHBondContact OD1-N 3.47Å; N462-E486 HydrophobicContact CB-CB 4.07Å; N462-E486 WeakPolarHBondContact CB-OE2 3.32Å; N462-E486 PolarHBondContact ND2-OE2 3.38Å
463	V	96.6	Very high	94.2	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.018	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	33.9	176.9	-69.1	0	0	0	0	109.8	L437 L448 L461 V468 L473 I485 E486 H487	L437-V463 HydrophobicContact CB-CG1 4.34Å; L437-V463 HydrophobicContact CD1-CG1 4.2Å; L448-V463 HydrophobicContact CD1-CG1 3.89Å; L448-V463 HydrophobicContact CD2-CG1 3.89Å; L461-V463 HydrophobicContact CD1-CG1 3.92Å; L461-V463 HydrophobicContact CD2-CG1 4.33Å; L461-V463 HydrophobicContact CG-CG1 3.94Å; V463-V468 HydrophobicContact CB-CG2 4.26Å; V463-L473 HydrophobicContact CG2-CD2 3.82Å; V463-I485 HydrophobicContact CG2-CG2 4.29Å; V463-E486 CarbonylContact C-O 3.55Å; V463-E486 PolarHBondContact N-O 2.96Å; V463-H487 HydrophobicContact CG2-CB 4.35Å
464	Q	95.7	Very high	94.1	Very high	53 Å²	53	46.6 Å²	46.6	25%	0.248	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	146.3	166.1	-67.2	175.7	-36.1	0	0	109.4	R438 A439 N462 C466 E486 T488	R438-Q464 CarbonylContact C-O 3.46Å; R438-Q464 VanDerWaalsContact CA-O 3.27Å; R438-Q464 WeakPolarHBondContact CA-O 3.46Å; R438-Q464 HydrophobicContact CG-CB 3.94Å; R438-Q464 WeakPolarHBondContact CG-O 3.27Å; A439-Q464 PolarHBondContact N-O 3.42Å; N462-Q464 PolarHBondContact ND2-OE1 3.17Å; N462-Q464 VanDerWaalsContact OD1-CB 3.29Å; N462-Q464 WeakPolarHBondContact OD1-CB 3.38Å; N462-Q464 WeakPolarHBondContact OD1-CG 3.3Å; N462-Q464 PolarHBondContact OD1-N 3.47Å; Q464-C466 PolarHBondContact O-N 3.15Å; Q464-E486 HydrophobicContact CG-CB 4.28Å; Q464-E486 PolarHBondContact N-O 3.2Å; Q464-T488 HydrophobicContact CB-CG2 3.96Å; Q464-T488 HydrophobicContact CG-CG2 4.18Å
465	D	93.8	Very high	94.2	Very high	72 Å²	72	46 Å²	46	39%	0.385	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	28.7	176.9	-41.9	-35.9	0	0	0	113.6	R438 A439 T488	R438-D465 IonicContact CZ-OD2 3.08Å; R438-D465 IonicContact NE-OD2 2.76Å; R438-D465 PolarHBondContact NE-OD2 3.38Å; R438-D465 IonicContact NH2-OD2 2.66Å; R438-D465 PolarHBondContact NH2-OD2 2.84Å; A439-D465 WeakPolarHBondContact CA-O 3.5Å; A439-D465 HydrophobicContact CB-CB 3.89Å; D465-T488 PolarHBondContact N-OG1 1.77Å
466	C	92.9	Very high	94.2	Very high	16 Å²	16	45.9 Å²	45.9	11%	0.108	23%	0.231	C	C	.	.	S	Bend	trans	-123.2	148.2	177.7	-68.8	0	0	0	0	112.3	L437 C440 Q464 V468	L437-C466 PolarHBondContact O-SG 3.42Å; C440-C466 PolarHBondContact N-SG 3.23Å; C440-C466 VanDerWaalsContact N-SG 3.43Å; C440-C466 PolarHBondContact O-SG 3.32Å; Q464-C466 PolarHBondContact O-N 3.15Å; C466-V468 VanDerWaalsContact C-N 3.25Å; C466-V468 HydrophobicContact CB-CG2 3.82Å; C466-V468 PolarHBondContact O-N 3.03Å
467	E	88.4	Confident	94.4	Very high	175 Å²	175	50.1 Å²	50.1	82%	0.818	24%	0.235	S	C	*	.			trans	-80.5	63.7	-178.8	-61.3	-156.2	160.6	0	0	113.1
468	V	91.6	Very high	94.4	Very high	6 Å²	6	54.8 Å²	54.8	4%	0.036	25%	0.25	C	C	.	.			trans	-101.1	125.7	-175	-177.1	0	0	0	0	111.5	L448 V463 C466 A472 L473 N489	L448-V468 HydrophobicContact CD1-CB 4.28Å; L448-V468 HydrophobicContact CD1-CG1 3.42Å; L448-V468 VanDerWaalsContact CD1-CG1 3.42Å; L448-V468 HydrophobicContact CD1-CG2 3.82Å; V463-V468 HydrophobicContact CB-CG2 4.26Å; C466-V468 VanDerWaalsContact C-N 3.25Å; C466-V468 HydrophobicContact CB-CG2 3.82Å; C466-V468 PolarHBondContact O-N 3.03Å; V468-A472 HydrophobicContact CG1-CB 4.03Å; V468-L473 HydrophobicContact CB-CD2 4.42Å; V468-L473 HydrophobicContact CG1-CD2 3.57Å; V468-L473 HydrophobicContact CG1-CG 3.82Å; V468-N489 PolarHBondContact O-ND2 2.69Å
469	S	91.2	Very high	94.4	Very high	50 Å²	50	58.8 Å²	58.8	35%	0.35	27%	0.268	S	S	.	.			trans	-69.4	143.5	176.5	72.5	0	0	0	0	112.4	E471 A472 L473	S469-E471 PolarHBondContact O-N 3.27Å; S469-A472 PolarHBondContact O-N 3.37Å; S469-L473 PolarHBondContact O-N 3.46Å
470	P	91.9	Very high	94.3	Very high	25 Å²	25	55.7 Å²	55.7	16%	0.162	25%	0.253	C	S	.	.	H	α-helix	trans	-58.4	-21.3	178	-25.7	35.1	0	0	0	113.7	R474 A491 F492	P470-R474 WeakPolarHBondContact O-CB 3.38Å; P470-R474 VanDerWaalsContact O-CG 3.27Å; P470-R474 WeakPolarHBondContact O-CG 3.34Å; P470-R474 PolarHBondContact O-N 2.84Å; P470-R474 PolarHBondContact O-NE 2.83Å; P470-A491 WeakPolarHBondContact CB-O 3.47Å; P470-A491 HydrophobicContact CG-CB 3.96Å; P470-A491 WeakPolarHBondContact CG-O 3.44Å; P470-F492 HydrophobicContact CB-CB 4.39Å; P470-F492 HydrophobicContact CB-CD2 4.46Å
471	E	93.2	Very high	93.9	Very high	110 Å²	110	64.4 Å²	64.4	51%	0.514	28%	0.284	S	S	.	.	H	α-helix	trans	-66.4	-40.9	175.4	-50.8	-129.6	111.7	0	0	112.9	S469 R474 F475	S469-E471 PolarHBondContact O-N 3.27Å; E471-R474 PolarHBondContact O-N 3.2Å; E471-R474 IonicContact OE1-CZ 3.57Å; E471-R474 IonicContact OE1-NH1 3.89Å; E471-R474 PolarHBondContact OE1-NH1 3.47Å; E471-R474 IonicContact OE1-NH2 3.53Å; E471-F475 WeakPolarHBondContact O-CB 3.3Å; E471-F475 PolarHBondContact O-N 2.81Å
472	A	94.4	Very high	93.5	Very high	0 Å²	0	74 Å²	74	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-68.4	-42.5	176.2	0	0	0	0	0	110.3	G445 V468 S469 R474 F475 V476	G445-A472 WeakPolarHBondContact O-CB 3.46Å; V468-A472 HydrophobicContact CG1-CB 4.03Å; S469-A472 PolarHBondContact O-N 3.37Å; A472-R474 VanDerWaalsContact C-N 3.35Å; A472-R474 PolarHBondContact O-N 3.27Å; A472-F475 CarbonylContact O-C 3.53Å; A472-F475 WeakPolarHBondContact O-CA 3.34Å; A472-F475 WeakPolarHBondContact O-CB 3.23Å; A472-F475 PolarHBondContact O-N 3.32Å; A472-V476 WeakPolarHBondContact O-CG2 3.48Å; A472-V476 PolarHBondContact O-N 3.31Å
473	L	94.8	Very high	93.4	Very high	1 Å²	1	74.3 Å²	74.3	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-62.1	-41.4	174.9	-54.9	179.6	0	0	0	111.7	L448 V463 V468 S469 F475 V476 R477 I485 H487 N489 F492	L448-L473 HydrophobicContact CD1-CD2 4.32Å; V463-L473 HydrophobicContact CG2-CD2 3.82Å; V468-L473 HydrophobicContact CB-CD2 4.42Å; V468-L473 HydrophobicContact CG1-CD2 3.57Å; V468-L473 HydrophobicContact CG1-CG 3.82Å; S469-L473 PolarHBondContact O-N 3.46Å; L473-F475 VanDerWaalsContact C-N 3.32Å; L473-F475 PolarHBondContact O-N 2.87Å; L473-V476 PolarHBondContact O-N 3.28Å; L473-R477 PolarHBondContact O-N 3.48Å; L473-I485 HydrophobicContact CD2-CG2 4.05Å; L473-H487 HydrophobicContact CD1-CB 4.24Å; L473-N489 HydrophobicContact CD1-CB 4.38Å; L473-F492 VanDerWaalsContact C-CE2 3.49Å; L473-F492 HydrophobicContact CB-CD1 3.85Å; L473-F492 HydrophobicContact CB-CD2 3.56Å; L473-F492 HydrophobicContact CB-CE1 3.7Å; L473-F492 HydrophobicContact CB-CE2 3.4Å; L473-F492 VanDerWaalsContact CB-CE2 3.4Å; L473-F492 HydrophobicContact CB-CG 3.79Å; L473-F492 HydrophobicContact CB-CZ 3.47Å; L473-F492 VanDerWaalsContact CB-CZ 3.47Å; L473-F492 HydrophobicContact CD1-CB 3.9Å; L473-F492 HydrophobicContact CD1-CD1 3.62Å; L473-F492 HydrophobicContact CD1-CD2 4.21Å; L473-F492 HydrophobicContact CD1-CE1 4.22Å; L473-F492 HydrophobicContact CD1-CG 3.61Å; L473-F492 HydrophobicContact CG-CD1 4.34Å; L473-F492 HydrophobicContact CG-CG 4.35Å
474	R	94.3	Very high	93.4	Very high	108 Å²	108	79.4 Å²	79.4	41%	0.408	35%	0.349	S	S	.	.	H	α-helix	trans	-60.2	-37.9	169.8	-79.2	-177.7	-101.6	126.3	-10.4	112.3	P470 E471 A472 R478 F492	P470-R474 WeakPolarHBondContact O-CB 3.38Å; P470-R474 VanDerWaalsContact O-CG 3.27Å; P470-R474 WeakPolarHBondContact O-CG 3.34Å; P470-R474 PolarHBondContact O-N 2.84Å; P470-R474 PolarHBondContact O-NE 2.83Å; E471-R474 PolarHBondContact O-N 3.2Å; E471-R474 IonicContact OE1-CZ 3.57Å; E471-R474 IonicContact OE1-NH1 3.89Å; E471-R474 PolarHBondContact OE1-NH1 3.47Å; E471-R474 IonicContact OE1-NH2 3.53Å; A472-R474 VanDerWaalsContact C-N 3.35Å; A472-R474 PolarHBondContact O-N 3.27Å; R474-R478 VanDerWaalsContact O-CG 3.29Å; R474-R478 WeakPolarHBondContact O-CG 3.12Å; R474-R478 PolarHBondContact O-N 3.27Å; R474-F492 HydrophobicContact CG-CD2 4.31Å; R474-F492 HydrophobicContact CG-CE2 3.92Å
475	F	95.5	Very high	93.4	Very high	58 Å²	58	78.1 Å²	78.1	25%	0.254	34%	0.343	S	S	.	.	H	α-helix	trans	-67.9	-44.6	176.1	-173.3	-80.9	0	0	0	112	K449 A452 A453 E471 A472 L473 R477 R478 H479	K449-F475 HydrophobicContact CB-CD1 4.04Å; K449-F475 HydrophobicContact CB-CE1 4.03Å; K449-F475 HydrophobicContact CB-CZ 4.48Å; K449-F475 HydrophobicContact CG-CB 4.15Å; K449-F475 HydrophobicContact CG-CD1 3.79Å; K449-F475 HydrophobicContact CG-CD2 4.3Å; K449-F475 HydrophobicContact CG-CE1 4.23Å; K449-F475 HydrophobicContact CG-CG 3.84Å; K449-F475 WeakPolarHBondContact O-CE1 3.43Å; A452-F475 HydrophobicContact CB-CD1 3.91Å; A452-F475 HydrophobicContact CB-CE1 4.03Å; A453-F475 HydrophobicContact CB-CE1 4.49Å; E471-F475 WeakPolarHBondContact O-CB 3.3Å; E471-F475 PolarHBondContact O-N 2.81Å; A472-F475 CarbonylContact O-C 3.53Å; A472-F475 WeakPolarHBondContact O-CA 3.34Å; A472-F475 WeakPolarHBondContact O-CB 3.23Å; A472-F475 PolarHBondContact O-N 3.32Å; L473-F475 VanDerWaalsContact C-N 3.32Å; L473-F475 PolarHBondContact O-N 2.87Å; F475-R477 PolarHBondContact O-N 2.84Å; F475-R478 PolarHBondContact O-N 3.16Å; F475-H479 AromaticContact CD1-CE1 3.82Å; F475-H479 AromaticContact CD1-ND1 3.53Å; F475-H479 AromaticContact CD2-CE1 3.73Å; F475-H479 AromaticContact CE1-CE1 3.47Å; F475-H479 VanDerWaalsContact CE1-CE1 3.47Å; F475-H479 WeakPolarHBondContact CE1-CE1 3.1Å; F475-H479 AromaticContact CE1-ND1 3.43Å; F475-H479 WeakPolarHBondContact CE1-ND1 3.35Å; F475-H479 AromaticContact CE2-CE1 3.38Å; F475-H479 WeakPolarHBondContact CE2-CE1 3.32Å; F475-H479 AromaticContact CG-CE1 3.94Å; F475-H479 AromaticContact CG-ND1 3.91Å; F475-H479 AromaticContact CZ-CE1 3.24Å; F475-H479 WeakPolarHBondContact CZ-CE1 3.42Å; F475-H479 AromaticContact CZ-ND1 3.73Å; F475-H479 AromaticContact CZ-NE2 3.82Å; F475-H479 PolarHBondContact O-N 2.57Å; F475-H479 PolarHBondContact O-ND1 2.94Å
476	V	95.2	Very high	93.5	Very high	0 Å²	0	78.1 Å²	78.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-56.7	-50.7	174.5	179.1	0	0	0	0	110.1	L448 A452 L461 A472 L473 R478 H479 C480 I485	L448-V476 HydrophobicContact CB-CG2 4.21Å; A452-V476 HydrophobicContact CB-CB 4.25Å; A452-V476 HydrophobicContact CB-CG1 4.45Å; A452-V476 HydrophobicContact CB-CG2 3.99Å; L461-V476 HydrophobicContact CD2-CB 4.49Å; L461-V476 HydrophobicContact CD2-CG1 3.91Å; L461-V476 HydrophobicContact CD2-CG2 3.93Å; A472-V476 WeakPolarHBondContact O-CG2 3.48Å; A472-V476 PolarHBondContact O-N 3.31Å; L473-V476 PolarHBondContact O-N 3.28Å; V476-R478 PolarHBondContact O-N 3.01Å; V476-H479 PolarHBondContact O-N 3.23Å; V476-C480 HydrophobicContact CG1-CB 4.28Å; V476-C480 PolarHBondContact O-N 2.72Å; V476-I485 HydrophobicContact CB-CD1 3.92Å; V476-I485 HydrophobicContact CG1-CD1 3.78Å; V476-I485 HydrophobicContact CG1-CG1 4.24Å
477	R	93.8	Very high	93.5	Very high	171 Å²	171	78.6 Å²	78.6	65%	0.645	34%	0.341	S	S	*	.	H	α-helix	trans	-62.4	-25.3	-178.2	-169.5	169.7	179.6	164.8	-1.1	114	L473 F475 I485	L473-R477 PolarHBondContact O-N 3.48Å; F475-R477 PolarHBondContact O-N 2.84Å; R477-I485 HydrophobicContact CB-CD1 4.21Å
478	R	94.4	Very high	93.6	Very high	178 Å²	178	73.6 Å²	73.6	67%	0.672	32%	0.323	S	S	*	.	H	α-helix	trans	-75.1	-41.3	175.7	-75.8	168.9	179.6	-180	-0.7	112.9	R474 F475 V476	R474-R478 VanDerWaalsContact O-CG 3.29Å; R474-R478 WeakPolarHBondContact O-CG 3.12Å; R474-R478 PolarHBondContact O-N 3.27Å; F475-R478 PolarHBondContact O-N 3.16Å; V476-R478 PolarHBondContact O-N 3.01Å
479	H	94.9	Very high	93.2	Very high	86 Å²	86	75.2 Å²	75.2	40%	0.398	33%	0.331	S	S	.	.	H	α-helix	trans	-88.9	-52.9	-176	-61.8	84.3	0	0	0	111.5	A452 F475 V476 R481	A452-H479 HydrophobicContact CB-CB 4.41Å; A452-H479 VanDerWaalsContact O-CB 3.31Å; A452-H479 WeakPolarHBondContact O-CB 3.17Å; F475-H479 AromaticContact CD1-CE1 3.82Å; F475-H479 AromaticContact CD1-ND1 3.53Å; F475-H479 AromaticContact CD2-CE1 3.73Å; F475-H479 AromaticContact CE1-CE1 3.47Å; F475-H479 VanDerWaalsContact CE1-CE1 3.47Å; F475-H479 WeakPolarHBondContact CE1-CE1 3.1Å; F475-H479 AromaticContact CE1-ND1 3.43Å; F475-H479 WeakPolarHBondContact CE1-ND1 3.35Å; F475-H479 AromaticContact CE2-CE1 3.38Å; F475-H479 WeakPolarHBondContact CE2-CE1 3.32Å; F475-H479 AromaticContact CG-CE1 3.94Å; F475-H479 AromaticContact CG-ND1 3.91Å; F475-H479 AromaticContact CZ-CE1 3.24Å; F475-H479 WeakPolarHBondContact CZ-CE1 3.42Å; F475-H479 AromaticContact CZ-ND1 3.73Å; F475-H479 AromaticContact CZ-NE2 3.82Å; F475-H479 PolarHBondContact O-N 2.57Å; F475-H479 PolarHBondContact O-ND1 2.94Å; V476-H479 PolarHBondContact O-N 3.23Å; H479-R481 PolarHBondContact O-N 3.16Å; H479-R481 VanDerWaalsContact O-N 3.14Å
480	C	94.6	Very high	92.5	Very high	1 Å²	1	77.9 Å²	77.9	1%	0.007	35%	0.347	C	S	.	.	S	Bend	trans	-90.1	66.9	179.7	-51.4	0	0	0	0	110.2	C455 L458 V476 R482 C483	C455-C480 PolarHBondContact O-SG 2.85Å; L458-C480 HydrophobicContact CB-CB 4.06Å; V476-C480 HydrophobicContact CG1-CB 4.28Å; V476-C480 PolarHBondContact O-N 2.72Å; C480-R482 PolarHBondContact O-N 3.08Å; C480-C483 HydrophobicContact CB-CB 3.69Å; C480-C483 WeakPolarHBondContact O-CB 3.45Å; C480-C483 PolarHBondContact O-N 2.99Å
481	R	89.6	Confident	91.7	Very high	225 Å²	225	80.1 Å²	80.1	85%	0.849	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-15.9	-171.2	-61.8	-175.3	-174.8	179.3	2.8	115.8	H479	H479-R481 PolarHBondContact O-N 3.16Å; H479-R481 VanDerWaalsContact O-N 3.14Å
482	R	89.8	Confident	90.9	Very high	204 Å²	204	76 Å²	76	77%	0.77	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	7.6	177.5	-68.4	177.8	173	160.5	-4.3	113.2	C480	C480-R482 PolarHBondContact O-N 3.08Å
483	C	95.1	Very high	89.2	Confident	18 Å²	18	87.3 Å²	87.3	12%	0.122	39%	0.393	C	S	.	.			trans	-80.9	122.2	-179.2	-168	0	0	0	0	111.4	L458 C480	L458-C483 WeakPolarHBondContact O-CA 3.38Å; L458-C483 WeakPolarHBondContact O-CB 3.43Å; L458-C483 PolarHBondContact O-N 2.59Å; C480-C483 HydrophobicContact CB-CB 3.69Å; C480-C483 WeakPolarHBondContact O-CB 3.45Å; C480-C483 PolarHBondContact O-N 2.99Å
484	I	96.1	Very high	89	Confident	111 Å²	111	91.7 Å²	91.7	57%	0.569	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	122.8	161.5	-59.6	175.2	0	0	0	106.9	Q459 L460 L461 E486	Q459-I484 PolarHBondContact O-N 3.38Å; L460-I484 CarbonylContact C-O 3.59Å; L460-I484 WeakPolarHBondContact CA-O 3.15Å; L461-I484 PolarHBondContact N-O 2.69Å; I484-E486 HydrophobicContact CG2-CG 4.45Å
485	I	95.8	Very high	88.7	Confident	25 Å²	25	90.8 Å²	90.8	13%	0.128	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	115.5	178.6	-58.1	175.3	0	0	0	107.6	L461 V463 L473 V476 R477 F492	L461-I485 CarbonylContact O-C 3.24Å; L461-I485 WeakPolarHBondContact O-CA 3.49Å; V463-I485 HydrophobicContact CG2-CG2 4.29Å; L473-I485 HydrophobicContact CD2-CG2 4.05Å; V476-I485 HydrophobicContact CB-CD1 3.92Å; V476-I485 HydrophobicContact CG1-CD1 3.78Å; V476-I485 HydrophobicContact CG1-CG1 4.24Å; R477-I485 HydrophobicContact CB-CD1 4.21Å; I485-F492 HydrophobicContact CD1-CE1 4.34Å; I485-F492 HydrophobicContact CD1-CZ 4.24Å; I485-F492 HydrophobicContact CG2-CE1 4.37Å
486	E	95.8	Very high	88.3	Confident	72 Å²	72	92.6 Å²	92.6	34%	0.336	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	116.3	173.6	-60.5	174.9	165.7	0	0	107.8	L461 N462 V463 Q464 I484	L461-E486 PolarHBondContact O-N 2.72Å; N462-E486 HydrophobicContact CB-CB 4.07Å; N462-E486 WeakPolarHBondContact CB-OE2 3.32Å; N462-E486 PolarHBondContact ND2-OE2 3.38Å; V463-E486 CarbonylContact C-O 3.55Å; V463-E486 PolarHBondContact N-O 2.96Å; Q464-E486 HydrophobicContact CG-CB 4.28Å; Q464-E486 PolarHBondContact N-O 3.2Å; I484-E486 HydrophobicContact CG2-CG 4.45Å
487	H	93.5	Very high	87.9	Confident	26 Å²	26	98.1 Å²	98.1	12%	0.12	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	164.4	-174.6	62.8	98.8	0	0	0	110.8	V463 L473 N489 F492 Y493	V463-H487 HydrophobicContact CG2-CB 4.35Å; L473-H487 HydrophobicContact CD1-CB 4.24Å; H487-N489 PolarHBondContact CE1-O 3.1Å; H487-N489 PolarHBondContact ND1-O 3.34Å; H487-F492 AromaticContact CD2-CD1 3.8Å; H487-F492 AromaticContact CE1-CD1 3.78Å; H487-F492 AromaticContact NE2-CD1 3.61Å; H487-Y493 AromaticContact CE1-CE2 3.73Å; H487-Y493 AromaticContact CE1-CZ 3.71Å
488	T	90	Very high	87.5	Confident	71 Å²	71	93.5 Å²	93.5	44%	0.436	43%	0.434	S	S	.	.			trans	-110.2	-6.9	168.3	47.1	0	0	0	0	113.3	Q464 D465 P490	Q464-T488 HydrophobicContact CB-CG2 3.96Å; Q464-T488 HydrophobicContact CG-CG2 4.18Å; D465-T488 PolarHBondContact N-OG1 1.77Å; T488-P490 WeakPolarHBondContact O-CD 3.12Å
489	N	83.4	Confident	87.1	Confident	39 Å²	39	87.9 Å²	87.9	21%	0.209	42%	0.418	C	S	.	.			trans	-66.8	118.3	-179.7	-171.6	-33.2	0	0	0	110.8	V468 L473 H487 A491	V468-N489 PolarHBondContact O-ND2 2.69Å; L473-N489 HydrophobicContact CD1-CB 4.38Å; H487-N489 PolarHBondContact CE1-O 3.1Å; H487-N489 PolarHBondContact ND1-O 3.34Å; N489-A491 VanDerWaalsContact C-N 3.33Å; N489-A491 PolarHBondContact O-N 2.84Å; N489-A491 PolarHBondContact OD1-N 3.36Å
490	P	76.6	Confident	86.5	Confident	106 Å²	106	88 Å²	88	69%	0.688	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-75.1	-19.4	-177.4	30.8	-35.7	0	0	0	113.4	T488 F492	T488-P490 WeakPolarHBondContact O-CD 3.12Å; P490-F492 PolarHBondContact O-N 2.69Å
491	A	75.8	Confident	85.9	Confident	72 Å²	72	94.7 Å²	94.7	60%	0.595	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-86.6	24.9	-178.4	0	0	0	0	0	113.6	P470 N489	P470-A491 WeakPolarHBondContact CB-O 3.47Å; P470-A491 HydrophobicContact CG-CB 3.96Å; P470-A491 WeakPolarHBondContact CG-O 3.44Å; N489-A491 VanDerWaalsContact C-N 3.33Å; N489-A491 PolarHBondContact O-N 2.84Å; N489-A491 PolarHBondContact OD1-N 3.36Å
492	F	75.8	Confident	85.6	Confident	25 Å²	25	83.8 Å²	83.8	11%	0.11	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-127.5	4.8	178.6	-175.9	-114.2	0	0	0	114	P470 L473 R474 I485 H487 P490	P470-F492 HydrophobicContact CB-CB 4.39Å; P470-F492 HydrophobicContact CB-CD2 4.46Å; L473-F492 VanDerWaalsContact C-CE2 3.49Å; L473-F492 HydrophobicContact CB-CD1 3.85Å; L473-F492 HydrophobicContact CB-CD2 3.56Å; L473-F492 HydrophobicContact CB-CE1 3.7Å; L473-F492 HydrophobicContact CB-CE2 3.4Å; L473-F492 VanDerWaalsContact CB-CE2 3.4Å; L473-F492 HydrophobicContact CB-CG 3.79Å; L473-F492 HydrophobicContact CB-CZ 3.47Å; L473-F492 VanDerWaalsContact CB-CZ 3.47Å; L473-F492 HydrophobicContact CD1-CB 3.9Å; L473-F492 HydrophobicContact CD1-CD1 3.62Å; L473-F492 HydrophobicContact CD1-CD2 4.21Å; L473-F492 HydrophobicContact CD1-CE1 4.22Å; L473-F492 HydrophobicContact CD1-CG 3.61Å; L473-F492 HydrophobicContact CG-CD1 4.34Å; L473-F492 HydrophobicContact CG-CG 4.35Å; R474-F492 HydrophobicContact CG-CD2 4.31Å; R474-F492 HydrophobicContact CG-CE2 3.92Å; I485-F492 HydrophobicContact CD1-CE1 4.34Å; I485-F492 HydrophobicContact CD1-CZ 4.24Å; I485-F492 HydrophobicContact CG2-CE1 4.37Å; H487-F492 AromaticContact CD2-CD1 3.8Å; H487-F492 AromaticContact CE1-CD1 3.78Å; H487-F492 AromaticContact NE2-CD1 3.61Å; P490-F492 PolarHBondContact O-N 2.69Å
493	Y	59.6	Low	85.2	Confident	237 Å²	237	72.9 Å²	72.9	93%	0.929	39%	0.386	S	S	*	.			trans	-75.9	0	169.8	-72.7	-74.7	0	0	0	112.1	H487	H487-Y493 AromaticContact CE1-CE2 3.73Å; H487-Y493 AromaticContact CE1-CZ 3.71Å

Retrieved 493 of 493 residues in 284.1 ms (Link to these results)

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