A0A087XWM8_POEFO Loading...

Retinoic acid receptor RXR

Receptor for retinoic acid that acts as a transcription factor. Forms homo- or heterodimers with retinoic acid receptors (rars) and binds to target response elements in response to their ligands, all-trans or 9-cis retinoic acid, to regulate gene expression in various biological processes.

AlphaFold DB , UniProt , Accession A0A087XWM8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 444 aa.

Structure Viewer

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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	40.3	Very low	37.4	Very low	239 Å²	239	129.1 Å²	129.1	100%	1.177	81%	0.811	S	S	*	*				0	142.6	0	-69	154.9	84.3	0	0	107.6
2	S	37.5	Very low	36.8	Very low	127 Å²	127	132 Å²	132	89%	0.888	82%	0.817	S	S	*	*			trans	33.4	108.7	169	-50	0	0	0	0	120.5
3	A	32.6	Very low	36.5	Very low	97 Å²	97	130.5 Å²	130.5	80%	0.802	81%	0.814	S	S	*	*			trans	-113.6	-179.8	141	0	0	0	0	0	107.2
4	P	49.1	Very low	36.5	Very low	125 Å²	125	130.4 Å²	130.4	81%	0.812	82%	0.816	S	S	*	*			cis	-132.4	-166.2	-5.8	35.4	-13.4	0	0	0	114
5	Q	37.5	Very low	36.2	Very low	177 Å²	177	129.8 Å²	129.8	83%	0.827	81%	0.811	S	S	*	*			trans	-69.1	-173.3	158.3	-89	-165.3	-1.5	0	0	111.6
6	P	51.1	Low	35.9	Very low	95 Å²	95	132.4 Å²	132.4	62%	0.617	82%	0.818	S	S	*	*			cis	-154.7	-168.8	24.6	48.4	-26.7	0	0	0	119.9
7	N	31.7	Very low	35.6	Very low	139 Å²	139	136.5 Å²	136.5	74%	0.743	82%	0.822	S	S	*	*			trans	65.8	139.4	154.4	-63.6	-7.1	0	0	0	119.5
8	S	35.5	Very low	35.5	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	83%	0.825	S	S	*	*			cis	90.3	113.2	18.3	87	0	0	0	0	117.6
9	S	31.1	Very low	35.1	Very low	129 Å²	129	134.6 Å²	134.6	90%	0.902	82%	0.818	S	S	*	*			trans	-173.1	167.1	148.2	55.2	0	0	0	0	110.3
10	A	32.7	Very low	35.1	Very low	88 Å²	88	133.8 Å²	133.8	73%	0.727	82%	0.818	S	S	*	*			trans	-131.4	171.5	-178.1	0	0	0	0	0	112
11	S	32.7	Very low	35.1	Very low	105 Å²	105	132.1 Å²	132.1	73%	0.734	81%	0.809	S	S	*	*			trans	55.7	121.6	163.4	59.7	0	0	0	0	119.3
12	N	29.9	Very low	34.5	Very low	164 Å²	164	129.3 Å²	129.3	88%	0.877	79%	0.791	S	S	*	*				-165.6	141	120.3	-99.1	-31.6	0	0	0	112.1
13	S	33.1	Very low	34.2	Very low	112 Å²	112	128.3 Å²	128.3	78%	0.783	78%	0.784	S	S	*	*			trans	-91.1	162	165.9	-52	0	0	0	0	109.9
14	P	36.1	Very low	34	Very low	130 Å²	130	130.1 Å²	130.1	84%	0.844	79%	0.785	S	S	*	*				-135.7	153	121.3	36.6	-27.6	0	0	0	113.6
15	T	32.3	Very low	33.1	Very low	121 Å²	121	131.6 Å²	131.6	74%	0.742	78%	0.784	S	S	*	*			trans	-81.7	155.8	173.4	46.5	0	0	0	0	111.9
16	N	30.8	Very low	33	Very low	172 Å²	172	127.9 Å²	127.9	92%	0.92	78%	0.778	S	S	*	*			trans	-151.5	147.1	151.8	-117.5	-28.5	0	0	0	112.1
17	F	30.7	Very low	32.2	Very low	201 Å²	201	128.4 Å²	128.4	88%	0.882	78%	0.781	S	S	*	*			trans	-104	115.1	-168.7	-104.5	-102.7	0	0	0	112.7
18	I	33.9	Very low	32.1	Very low	172 Å²	172	126.8 Å²	126.8	88%	0.882	78%	0.781	S	S	*	*			trans	-149.9	137	151.4	-50.7	179.7	0	0	0	104.8
19	G	28.8	Very low	31.9	Very low	66 Å²	66	130.6 Å²	130.6	68%	0.68	79%	0.792	S	S	*	*			cis	146.9	103.6	5.1	0	0	0	0	0	107.5
20	S	34.3	Very low	31.8	Very low	117 Å²	117	130 Å²	130	82%	0.818	79%	0.788	S	S	*	*			trans	-72.5	149.3	-172	-177.6	0	0	0	0	112.6
21	P	35.3	Very low	31.8	Very low	99 Å²	99	131.2 Å²	131.2	64%	0.643	79%	0.791	S	S	*	*				-135.7	135.9	120.4	35.9	-26	0	0	0	113.7
22	F	29	Very low	32.1	Very low	180 Å²	180	132.1 Å²	132.1	79%	0.789	80%	0.795	S	S	*	*				156.1	103.8	124.1	-86.7	-66.5	0	0	0	113
23	S	29.9	Very low	32.1	Very low	107 Å²	107	130 Å²	130	75%	0.748	79%	0.788	S	S	*	*			trans	25.2	96.6	147.4	-50.7	0	0	0	0	119.8
24	V	28	Very low	32	Very low	135 Å²	135	131.5 Å²	131.5	82%	0.818	79%	0.792	S	S	*	*			trans	-74.5	128	153.9	177.9	0	0	0	0	108.9
25	I	31.6	Very low	31.8	Very low	155 Å²	155	129.8 Å²	129.8	80%	0.795	78%	0.783	S	S	*	*			trans	-107.9	117.7	169.2	-62.2	177.7	0	0	0	108.6
26	S	35.8	Very low	31.9	Very low	100 Å²	100	130.1 Å²	130.1	70%	0.699	79%	0.787	S	S	*	*			trans	-117.9	137.1	172	-57.9	0	0	0	0	110.3
27	P	32.9	Very low	31.8	Very low	106 Å²	106	127.5 Å²	127.5	69%	0.688	78%	0.782	S	S	*	*			trans	-118.4	109.4	148.1	31.8	-20.1	0	0	0	109.1
28	S	29.5	Very low	31.9	Very low	104 Å²	104	126.6 Å²	126.6	73%	0.727	79%	0.785	S	S	*	*				58.3	102.5	77.3	76.6	0	0	0	0	113.3
29	L	31.1	Very low	31.5	Very low	179 Å²	179	121.8 Å²	121.8	94%	0.937	78%	0.778	S	S	*	*			trans	-74.2	137.4	170.8	-77.5	74.7	0	0	0	110.9
30	S	30.7	Very low	31.5	Very low	116 Å²	116	129 Å²	129	81%	0.811	79%	0.791	S	S	*	*			trans	-150.5	124.5	154.1	57.9	0	0	0	0	111.6
31	S	32.5	Very low	31	Very low	114 Å²	114	126.8 Å²	126.8	80%	0.797	79%	0.787	S	S	*	*			trans	-48	160.6	171.4	-63	0	0	0	0	114.4
32	P	38.2	Very low	31.3	Very low	125 Å²	125	127.6 Å²	127.6	81%	0.812	79%	0.792	S	S	*	*			cis	-144.8	171.2	46.2	41	-20.3	0	0	0	120.5
33	V	30.5	Very low	31.3	Very low	120 Å²	120	126.2 Å²	126.2	73%	0.727	79%	0.792	S	S	*	*			trans	-73.3	143	176.8	174.9	0	0	0	0	112
34	V	30.6	Very low	31.2	Very low	143 Å²	143	126 Å²	126	87%	0.867	79%	0.79	S	S	*	*			trans	-135.3	124.7	151.8	-178.6	0	0	0	0	109.1
35	S	31.5	Very low	31.1	Very low	93 Å²	93	124.3 Å²	124.3	65%	0.65	79%	0.785	S	S	*	*			trans	-124.9	143	172.5	-56	0	0	0	0	109.6
36	P	34.3	Very low	31	Very low	128 Å²	128	122 Å²	122	83%	0.831	78%	0.782	S	S	*	*			trans	-104.6	107.5	159.9	32.8	-23.2	0	0	0	110.1
37	S	29.3	Very low	30.6	Very low	118 Å²	118	125 Å²	125	83%	0.825	79%	0.785	S	S	*	*			trans	-83.4	147.1	173.9	33.4	0	0	0	0	112.2
38	L	31.9	Very low	30.6	Very low	181 Å²	181	126.7 Å²	126.7	95%	0.948	79%	0.787	S	S	*	*			trans	-75.5	147.9	173.9	-73.8	160.1	0	0	0	111.5
39	G	26.9	Very low	30.6	Very low	71 Å²	71	126.2 Å²	126.2	73%	0.732	78%	0.783	S	S	*	*			trans	-136.2	142.8	173.5	0	0	0	0	0	111.5
40	F	28.4	Very low	30.5	Very low	217 Å²	217	123.1 Å²	123.1	95%	0.952	78%	0.777	S	S	*	*			trans	-75.3	163.6	-171.4	-85.6	-121.5	0	0	0	114.1
41	G	24.1	Very low	30.5	Very low	71 Å²	71	122.5 Å²	122.5	73%	0.732	77%	0.772	S	S	*	*			trans	-82	-138	172.9	0	0	0	0	0	113.5
42	P	41.6	Very low	30.6	Very low	116 Å²	116	121.2 Å²	121.2	75%	0.753	77%	0.769	S	S	*	*			cis	-145.4	-168.7	6.2	44.4	-24.5	0	0	0	116.4
43	I	28.9	Very low	31	Very low	151 Å²	151	121 Å²	121	77%	0.774	77%	0.767	S	S	*	*			trans	80.4	116.1	148.2	-79.4	168.2	0	0	0	122.3
44	S	26.5	Very low	31.1	Very low	102 Å²	102	122.5 Å²	122.5	71%	0.713	77%	0.77	S	S	*	*			trans	70.1	111.8	136.7	-61.9	0	0	0	0	127
45	S	26.9	Very low	31.2	Very low	101 Å²	101	121.7 Å²	121.7	71%	0.706	77%	0.77	S	S	*	*				78.6	137.9	117.6	70.2	0	0	0	0	125.4
46	S	28	Very low	31	Very low	106 Å²	106	120.7 Å²	120.7	74%	0.741	78%	0.775	S	S	*	*			trans	70.7	151.1	150.3	45.4	0	0	0	0	119.1
47	Q	28.9	Very low	30.9	Very low	164 Å²	164	122.5 Å²	122.5	77%	0.766	77%	0.774	S	S	*	*			cis	-162.5	173	7.6	-132	177.7	3.9	0	0	112.7
48	I	32.8	Very low	31	Very low	140 Å²	140	124.6 Å²	124.6	72%	0.718	77%	0.771	S	S	*	*			trans	71.6	138.7	149.4	-72.3	163.6	0	0	0	118.4
49	S	29.4	Very low	30.8	Very low	94 Å²	94	120.1 Å²	120.1	66%	0.657	76%	0.755	S	S	*	*			cis	-169.4	160.3	-13.6	-94.7	0	0	0	0	114.2
50	S	29.7	Very low	30.9	Very low	114 Å²	114	123.1 Å²	123.1	80%	0.797	76%	0.759	S	S	*	*			trans	69.3	148.4	147.5	-68.1	0	0	0	0	121.8
51	S	30.8	Very low	30.9	Very low	103 Å²	103	118.2 Å²	118.2	72%	0.72	75%	0.751	S	S	*	*			cis	-172.6	134.6	-11	49	0	0	0	0	115.4
52	A	32.9	Very low	31.1	Very low	87 Å²	87	120.8 Å²	120.8	72%	0.719	76%	0.758	S	S	*	*			trans	50.3	173.6	142.6	0	0	0	0	0	122
53	P	46.3	Very low	30.7	Very low	120 Å²	120	120.7 Å²	120.7	78%	0.779	76%	0.76	S	S	*	*			cis	-109.1	169.5	-15.3	22.2	0.1	0	0	0	112.8
54	I	32.8	Very low	30.8	Very low	153 Å²	153	122.2 Å²	122.2	79%	0.785	76%	0.764	S	S	*	*			cis	97.3	109	28.7	-61.6	171.9	0	0	0	116.1
55	S	32.6	Very low	31	Very low	125 Å²	125	124.5 Å²	124.5	87%	0.874	77%	0.768	S	S	*	*			trans	174.9	139.4	145.9	-74.4	0	0	0	0	107
56	G	29	Very low	31.2	Very low	73 Å²	73	128 Å²	128	75%	0.753	78%	0.777	S	S	*	*			cis	132.5	134.3	10.5	0	0	0	0	0	108.2
57	M	32.4	Very low	31.3	Very low	165 Å²	165	131.7 Å²	131.7	81%	0.813	78%	0.78	S	S	*	*			cis	-158.4	154.2	4.6	-80.4	-176.2	73.5	0	0	111
58	H	30.3	Very low	32.4	Very low	162 Å²	162	128.7 Å²	128.7	75%	0.75	77%	0.774	S	S	*	*			trans	32.1	156.7	136.7	-62.2	-75	0	0	0	123.4
59	S	28.8	Very low	33	Very low	88 Å²	88	126.5 Å²	126.5	62%	0.615	77%	0.769	S	S	*	*			cis	-174	160.3	-12.5	-102.6	0	0	0	0	112.5
60	V	27.9	Very low	33.1	Very low	134 Å²	134	131.6 Å²	131.6	81%	0.812	78%	0.78	S	S	*	*			trans	51.4	125	151.6	-56.4	0	0	0	0	125.4
61	S	28.6	Very low	33	Very low	114 Å²	114	129.4 Å²	129.4	80%	0.797	78%	0.776	S	S	*	*				30.5	129.1	128	-162.5	0	0	0	0	123.8
62	S	28.7	Very low	33	Very low	125 Å²	125	133 Å²	133	87%	0.874	79%	0.786	S	S	*	*				178	-162.4	120.5	46.2	0	0	0	0	111.8
63	S	33.2	Very low	33.1	Very low	113 Å²	113	139.1 Å²	139.1	79%	0.79	79%	0.79	S	S	*	*			trans	-137.4	174.3	-152.3	-167.2	0	0	0	0	116.3
64	E	30	Very low	32.6	Very low	184 Å²	184	139.1 Å²	139.1	86%	0.86	79%	0.79	S	S	*	*			trans	92.4	161	164	-56.2	-164.4	117.2	0	0	120.6
65	D	30.9	Very low	32.5	Very low	149 Å²	149	139.8 Å²	139.8	80%	0.797	79%	0.792	S	S	*	*			trans	-102.3	147.1	-149.3	-70	-109.7	0	0	0	117.6
66	I	32.1	Very low	32.8	Very low	176 Å²	176	143 Å²	143	90%	0.903	79%	0.793	S	S	*	*			trans	-141.7	150.1	151.3	-58	-175.9	0	0	0	109.9
67	K	29.6	Very low	32.8	Very low	182 Å²	182	144.2 Å²	144.2	79%	0.791	80%	0.796	S	S	*	*			trans	-155.3	171.1	-166.2	-162.4	-170.3	175	179.7	0	111.9
68	P	51.6	Low	32.8	Very low	101 Å²	101	145.2 Å²	145.2	66%	0.656	80%	0.798	S	S	*	*				-102	-132.7	-69.8	42.4	-25.6	0	0	0	109
69	P	46.5	Very low	33.2	Very low	95 Å²	95	143 Å²	143	62%	0.617	80%	0.801	S	S	*	*			cis	-106.8	-178.6	12.4	31.5	-11.6	0	0	0	113.4
70	F	30.1	Very low	33.7	Very low	201 Å²	201	145.1 Å²	145.1	88%	0.882	81%	0.813	S	S	*	*			cis	-115.2	-132.2	3	-59.1	-100.1	0	0	0	109.8
71	G	28.6	Very low	33.7	Very low	68 Å²	68	142 Å²	142	70%	0.701	81%	0.808	S	S	*	*			cis	138.1	128.2	-6.8	0	0	0	0	0	112.2
72	L	30.8	Very low	34	Very low	178 Å²	178	144.2 Å²	144.2	93%	0.932	81%	0.809	S	S	*	*			cis	-124.1	-179.8	-8.7	-82.7	170.6	0	0	0	110.9
73	R	33.9	Very low	34.6	Very low	216 Å²	216	146.9 Å²	146.9	82%	0.815	81%	0.81	S	S	*	*			trans	-87.5	155.3	-158.8	-58.7	175.2	178.8	168.2	-1.6	116.1
74	P	36.3	Very low	34.9	Very low	119 Å²	119	150.1 Å²	150.1	77%	0.773	82%	0.815	S	S	*	*			trans	-80.1	156.3	154.1	35.7	-34	0	0	0	111.8
75	M	31.3	Very low	35.5	Very low	168 Å²	168	146 Å²	146	83%	0.828	81%	0.806	S	S	*	*			trans	-141	147.4	170.5	-71.4	-89.5	66.1	0	0	111.1
76	Q	39.2	Very low	36.6	Very low	192 Å²	192	146.7 Å²	146.7	90%	0.897	81%	0.805	S	S	*	*			trans	-90	153	169.9	-67	172.2	-44.7	0	0	110.8
77	A	28.5	Very low	37.9	Very low	98 Å²	98	144.8 Å²	144.8	81%	0.81	79%	0.79	S	S	*	*			trans	-149.1	159.1	162.2	0	0	0	0	0	109.9
78	H	33	Very low	40.6	Very low	186 Å²	186	142.4 Å²	142.4	86%	0.861	78%	0.776	S	S	*	*			trans	-90.8	163.2	-175.1	-69.4	-2.9	0	0	0	113.9
79	S	37.9	Very low	42.7	Very low	116 Å²	116	142.7 Å²	142.7	81%	0.811	77%	0.771	S	S	*	*			trans	-60.9	157.6	171.8	-45.3	0	0	0	0	112.8
80	P	40.1	Very low	45.1	Very low	132 Å²	132	138.2 Å²	138.2	86%	0.857	74%	0.743	S	S	*	*				-146.6	162.2	92.6	38.6	-23.9	0	0	0	115.6
81	G	26.8	Very low	48.3	Very low	70 Å²	70	131.9 Å²	131.9	72%	0.722	72%	0.72	S	S	*	*			trans	122.5	106.4	152.4	0	0	0	0	0	119.3
82	I	35.8	Very low	51.6	Low	160 Å²	160	128.7 Å²	128.7	82%	0.821	69%	0.687	S	S	*	*			trans	46.9	106.5	137.2	-54	177.9	0	0	0	119.8
83	M	40.6	Very low	54.7	Low	180 Å²	180	120.4 Å²	120.4	89%	0.887	64%	0.644	S	S	*	*			trans	41.3	111.8	143.7	-61.3	-170.1	179.7	0	0	121.3
84	M	39.3	Very low	57.6	Low	181 Å²	181	112.2 Å²	112.2	89%	0.892	63%	0.627	S	S	*	*			trans	-127.6	114.3	134.4	-70.5	-154.7	83.8	0	0	110.9	Q86	M84-Q86 PolarHBondContact O-N 2.74Å
85	S	43.6	Very low	60.5	Low	97 Å²	97	107.6 Å²	107.6	68%	0.678	60%	0.596	S	S	*	*			trans	-71.5	121.3	173.2	49.2	0	0	0	0	110.7	K87	S85-K87 PolarHBondContact O-N 2.77Å
86	Q	52.3	Low	63.6	Low	164 Å²	164	107.7 Å²	107.7	77%	0.766	59%	0.587	S	S	*	*			trans	-63.3	100.1	170.4	-73.8	-172.8	-8.7	0	0	109.2	M84 R88	M84-Q86 PolarHBondContact O-N 2.74Å; Q86-R88 VanDerWaalsContact C-N 3.32Å; Q86-R88 PolarHBondContact O-N 2.82Å
87	K	61.2	Low	66.2	Low	136 Å²	136	99.4 Å²	99.4	59%	0.591	55%	0.55	S	S	*	*			trans	-66.8	83.9	-177.3	-68.5	167.9	-173.9	163.2	0	110.5	S85	S85-K87 PolarHBondContact O-N 2.77Å
88	R	84.8	Confident	69.3	Low	133 Å²	133	97.9 Å²	97.9	50%	0.502	53%	0.534	S	S	.	.			trans	-56.1	144.4	176.9	-57.8	-155.6	-161.4	-80.3	5.3	110.5	Q86 S97 Y105	Q86-R88 VanDerWaalsContact C-N 3.32Å; Q86-R88 PolarHBondContact O-N 2.82Å; R88-S97 WeakPolarHBondContact O-CB 3.22Å; R88-S97 PolarHBondContact O-N 3.47Å; R88-S97 VanDerWaalsContact O-N 3.15Å; R88-Y105 HydrophobicContact CB-CD1 4.35Å; R88-Y105 HydrophobicContact CB-CG 4.45Å; R88-Y105 VanDerWaalsContact CD-CE2 3.49Å; R88-Y105 PolarHBondContact NE-OH 3.42Å
89	L	95.8	Very high	72	Confident	106 Å²	106	90.1 Å²	90.1	56%	0.555	50%	0.503	S	S	*	.	B	Isolated β-bridge	trans	-92.9	161.1	179.1	-58.9	-179.3	0	0	0	111.5	V91	L89-V91 PolarHBondContact O-N 3.42Å
90	C	97.2	Very high	74.5	Confident	2 Å²	2	90.6 Å²	90.6	1%	0.014	49%	0.491	C	S	.	.			trans	-75.2	112.1	175.5	175.1	0	0	0	0	110.2	I92 C93 G94 D95 Y105 S106 C107	C90-I92 PolarHBondContact O-N 3.39Å; C90-C93 PolarHBondContact O-N 3.23Å; C90-C93 VanDerWaalsContact O-N 3.08Å; C90-G94 PolarHBondContact O-N 3.34Å; C90-D95 HydrophobicContact CB-CB 4.49Å; C90-D95 WeakPolarHBondContact CB-O 3.43Å; C90-D95 PolarHBondContact N-O 2.84Å; C90-Y105 WeakPolarHBondContact CA-O 3.38Å; C90-S106 VanDerWaalsContact SG-CA 3.58Å; C90-C107 HydrophobicContact CB-CB 4.03Å; C90-C107 PolarHBondContact SG-N 3.06Å
91	V	96.8	Very high	77	Confident	68 Å²	68	85 Å²	85	41%	0.412	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.8	-174.9	-58.6	0	0	0	0	113.5	L89 V104 Y105 M153	L89-V91 PolarHBondContact O-N 3.42Å; V91-V104 HydrophobicContact CG2-CB 4.14Å; V91-V104 HydrophobicContact CG2-CG2 4.06Å; V91-Y105 PolarHBondContact N-O 2.98Å; V91-M153 HydrophobicContact CB-SD 4.35Å; V91-M153 HydrophobicContact CG2-CB 3.81Å; V91-M153 HydrophobicContact CG2-CG 4.13Å; V91-M153 HydrophobicContact CG2-SD 4.47Å
92	I	98	Very high	80.1	Confident	0 Å²	0	81.9 Å²	81.9	0%	0	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-35.9	178.8	-55.7	94.1	0	0	0	112.3	C90 V104 C110 V134 R146 K149 M155	C90-I92 PolarHBondContact O-N 3.39Å; I92-V104 HydrophobicContact CD1-CG2 3.85Å; I92-C110 HydrophobicContact CB-CB 4.44Å; I92-C110 HydrophobicContact CD1-CB 4.34Å; I92-V134 HydrophobicContact CG2-CG1 4.07Å; I92-V134 WeakPolarHBondContact O-CG1 3.5Å; I92-V134 VanDerWaalsContact O-O 3.11Å; I92-R146 HydrophobicContact CG2-CG 4.47Å; I92-K149 HydrophobicContact CG2-CB 4.48Å; I92-K149 HydrophobicContact CG2-CD 4.41Å; I92-K149 HydrophobicContact CG2-CG 4.39Å; I92-K149 VanDerWaalsContact O-CD 3.31Å; I92-K149 WeakPolarHBondContact O-CD 3.37Å; I92-K149 WeakPolarHBondContact O-CE 3.5Å; I92-K149 PolarHBondContact O-NZ 3.44Å; I92-M155 HydrophobicContact CD1-CE 3.86Å; I92-M155 HydrophobicContact CD1-SD 4.23Å
93	C	96.9	Very high	82.6	Confident	4 Å²	4	76.4 Å²	76.4	3%	0.027	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.2	8.8	-168.8	67.5	0	0	0	0	116.9	C90 D95 V134 D135 K136 R139	C90-C93 PolarHBondContact O-N 3.23Å; C90-C93 VanDerWaalsContact O-N 3.08Å; C93-D95 PolarHBondContact O-N 2.89Å; C93-V134 HydrophobicContact CB-CG1 4.28Å; C93-D135 CarbonylContact O-C 3.57Å; C93-D135 WeakPolarHBondContact O-CA 3.2Å; C93-K136 PolarHBondContact O-N 3.33Å; C93-R139 HydrophobicContact CB-CB 4.28Å; C93-R139 PolarHBondContact SG-NH1 3.3Å
94	G	94.9	Very high	85.2	Confident	45 Å²	45	68.5 Å²	68.5	46%	0.464	36%	0.364	S	S	.	.	S	Bend	trans	70.9	-5.2	177.7	0	0	0	0	0	116	C90	C90-G94 PolarHBondContact O-N 3.34Å
95	D	96.4	Very high	87.9	Confident	21 Å²	21	63.7 Å²	63.7	11%	0.112	34%	0.337	C	S	.	.	S	Bend	trans	-66.1	162.2	174.8	-160.1	2.1	0	0	0	111.8	C90 C93 S97 C107 K136 R139	C90-D95 HydrophobicContact CB-CB 4.49Å; C90-D95 WeakPolarHBondContact CB-O 3.43Å; C90-D95 PolarHBondContact N-O 2.84Å; C93-D95 PolarHBondContact O-N 2.89Å; D95-S97 PolarHBondContact O-N 2.95Å; D95-C107 HydrophobicContact CB-CB 4.22Å; D95-K136 HydrophobicContact CB-CB 4.22Å; D95-K136 HydrophobicContact CB-CD 4.09Å; D95-K136 HydrophobicContact CB-CG 4.08Å; D95-K136 VanDerWaalsContact OD1-CD 3.32Å; D95-K136 WeakPolarHBondContact OD1-CD 3.25Å; D95-K136 WeakPolarHBondContact OD1-CE 3.48Å; D95-K136 IonicContact OD1-NZ 2.71Å; D95-K136 PolarHBondContact OD1-NZ 3.36Å; D95-R139 IonicContact OD2-CZ 3.3Å; D95-R139 VanDerWaalsContact OD2-CZ 3.3Å; D95-R139 IonicContact OD2-NH1 2.71Å; D95-R139 PolarHBondContact OD2-NH1 3.37Å; D95-R139 IonicContact OD2-NH2 2.99Å; D95-R139 PolarHBondContact OD2-NH2 3.22Å
96	R	96.1	Very high	90.4	Very high	170 Å²	170	59.1 Å²	59.1	64%	0.642	31%	0.305	S	S	*	.	B	Isolated β-bridge	trans	-59.3	125.9	178.8	-179.8	175.7	173.3	-176.5	-4.5	110	C107	R96-C107 WeakPolarHBondContact O-CB 3.45Å
97	S	94.9	Very high	92.5	Very high	19 Å²	19	51.5 Å²	51.5	13%	0.133	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-71.7	147	175.4	-166.8	0	0	0	0	111.1	R88 D95 G99 S106	R88-S97 WeakPolarHBondContact O-CB 3.22Å; R88-S97 PolarHBondContact O-N 3.47Å; R88-S97 VanDerWaalsContact O-N 3.15Å; D95-S97 PolarHBondContact O-N 2.95Å; S97-G99 PolarHBondContact OG-N 2.74Å; S97-G99 PolarHBondContact OG-O 3.1Å; S97-S106 PolarHBondContact OG-N 2.83Å; S97-S106 VanDerWaalsContact OG-N 3.09Å; S97-S106 PolarHBondContact OG-O 3.29Å
98	S	92.2	Very high	94.2	Very high	66 Å²	66	49.5 Å²	49.5	46%	0.462	26%	0.263	S	S	.	.			trans	-99.8	-16.2	168.4	48.3	0	0	0	0	112.7	H101 S106 E108	S98-H101 PolarHBondContact OG-NE2 3.22Å; S98-S106 PolarHBondContact N-O 2.74Å; S98-S106 PolarHBondContact OG-O 2.78Å; S98-E108 WeakPolarHBondContact CB-OE1 3.19Å; S98-E108 PolarHBondContact OG-OE1 3.26Å
99	G	90.3	Very high	94.7	Very high	22 Å²	22	44.7 Å²	44.7	23%	0.227	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.7	-166.9	-177.4	0	0	0	0	0	112.4	S97 Y105 S106	S97-G99 PolarHBondContact OG-N 2.74Å; S97-G99 PolarHBondContact OG-O 3.1Å; G99-Y105 WeakPolarHBondContact O-CA 3.37Å; G99-S106 PolarHBondContact O-N 3.07Å
100	K	90.8	Very high	94.8	Very high	127 Å²	127	39.6 Å²	39.6	55%	0.552	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	118.4	164.7	-74.7	-170.2	178.3	-176	0	109.2	V104 Y105	K100-V104 CarbonylContact C-O 3.34Å; K100-V104 WeakPolarHBondContact CA-O 3.39Å; K100-Y105 HydrophobicContact CD-CE2 4.4Å; K100-Y105 HydrophobicContact CG-CD1 3.84Å; K100-Y105 HydrophobicContact CG-CD2 4.19Å; K100-Y105 HydrophobicContact CG-CE1 3.65Å; K100-Y105 HydrophobicContact CG-CE2 4.02Å; K100-Y105 HydrophobicContact CG-CG 4.11Å
101	H	91.7	Very high	94.8	Very high	15 Å²	15	41.9 Å²	41.9	7%	0.069	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.3	174	-48.3	-73.5	0	0	0	109.5	S98 G103 V104 S106 E108 K111	S98-H101 PolarHBondContact OG-NE2 3.22Å; H101-G103 PolarHBondContact O-N 3.04Å; H101-G103 VanDerWaalsContact O-N 3.13Å; H101-V104 PolarHBondContact N-O 2.86Å; H101-V104 PolarHBondContact O-N 2.71Å; H101-V104 VanDerWaalsContact O-O 3.09Å; H101-S106 PolarHBondContact CD2-O 2.99Å; H101-S106 VanDerWaalsContact CD2-O 3.32Å; H101-S106 PolarHBondContact CD2-OG 2.92Å; H101-E108 IonicContact CE1-OE1 3.46Å; H101-E108 IonicContact NE2-OE1 3.77Å; H101-E108 PolarHBondContact NE2-OE1 3.33Å; H101-K111 HydrophobicContact CB-CB 3.98Å; H101-K111 HydrophobicContact CB-CD 4.31Å; H101-K111 HydrophobicContact CB-CG 3.82Å; H101-K111 PolarHBondContact CE1-NZ 2.79Å; H101-K111 WeakPolarHBondContact ND1-CD 3.45Å; H101-K111 VanDerWaalsContact ND1-CE 3.27Å; H101-K111 WeakPolarHBondContact ND1-CE 3.11Å
102	Y	92.2	Very high	94.7	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.016	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	31.4	-174.8	-48.7	-59.2	0	0	0	113.8	K111 F114 K115 M155 K156 A159 V160 Q179	Y102-K111 HydrophobicContact CE2-CB 4.44Å; Y102-K111 HydrophobicContact CE2-CG 3.9Å; Y102-F114 HydrophobicContact CD1-CD1 4.46Å; Y102-F114 HydrophobicContact CD2-CB 4.25Å; Y102-F114 AromaticContact CD2-CD1 3.51Å; Y102-F114 HydrophobicContact CD2-CD1 3.51Å; Y102-F114 HydrophobicContact CD2-CE1 4.29Å; Y102-F114 HydrophobicContact CD2-CG 4.23Å; Y102-F114 HydrophobicContact CE2-CD1 4.17Å; Y102-F114 AromaticContact CG-CD1 3.7Å; Y102-F114 HydrophobicContact CG-CD1 3.7Å; Y102-F114 HydrophobicContact CG-CE1 4.01Å; Y102-K115 HydrophobicContact CE2-CB 4.24Å; Y102-K115 VanDerWaalsContact OH-CD 3.28Å; Y102-K115 WeakPolarHBondContact OH-CD 2.99Å; Y102-M155 HydrophobicContact CD2-CE 4.29Å; Y102-M155 WeakPolarHBondContact O-CA 3.35Å; Y102-K156 PolarHBondContact O-N 3.26Å; Y102-A159 HydrophobicContact CD1-CB 4.05Å; Y102-V160 HydrophobicContact CD1-CG2 3.61Å; Y102-V160 HydrophobicContact CE1-CB 4.43Å; Y102-V160 HydrophobicContact CE1-CG2 3.65Å; Y102-V160 HydrophobicContact CG-CG2 4.15Å; Y102-Q179 HydrophobicContact CD1-CG 4.14Å; Y102-Q179 HydrophobicContact CE1-CG 4.21Å; Y102-Q179 VanDerWaalsContact N-CD 3.34Å
103	G	89.5	Confident	94.7	Very high	44 Å²	44	40 Å²	40	45%	0.454	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	104.6	-24.4	-178.5	0	0	0	0	0	115.1	H101	H101-G103 PolarHBondContact O-N 3.04Å; H101-G103 VanDerWaalsContact O-N 3.13Å
104	V	94.1	Very high	94.7	Very high	14 Å²	14	39.8 Å²	39.8	9%	0.085	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	150.6	-163.8	-43.9	0	0	0	0	113	V91 I92 K100 H101 S106 M153 G154 M155	V91-V104 HydrophobicContact CG2-CB 4.14Å; V91-V104 HydrophobicContact CG2-CG2 4.06Å; I92-V104 HydrophobicContact CD1-CG2 3.85Å; K100-V104 CarbonylContact C-O 3.34Å; K100-V104 WeakPolarHBondContact CA-O 3.39Å; H101-V104 PolarHBondContact N-O 2.86Å; H101-V104 PolarHBondContact O-N 2.71Å; H101-V104 VanDerWaalsContact O-O 3.09Å; V104-S106 PolarHBondContact O-N 3.29Å; V104-S106 VanDerWaalsContact O-N 3.15Å; V104-M153 WeakPolarHBondContact CG1-O 3.38Å; V104-G154 WeakPolarHBondContact CG1-O 3.35Å; V104-M155 HydrophobicContact CG1-CG 4.24Å; V104-M155 HydrophobicContact CG2-CE 3.62Å; V104-M155 HydrophobicContact CG2-CG 3.51Å; V104-M155 HydrophobicContact CG2-SD 4.31Å
105	Y	95.3	Very high	94.7	Very high	81 Å²	81	40.4 Å²	40.4	32%	0.318	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	115.2	174.5	-76.7	-71.8	0	0	0	111	R88 C90 V91 G99 K100	R88-Y105 HydrophobicContact CB-CD1 4.35Å; R88-Y105 HydrophobicContact CB-CG 4.45Å; R88-Y105 VanDerWaalsContact CD-CE2 3.49Å; R88-Y105 PolarHBondContact NE-OH 3.42Å; C90-Y105 WeakPolarHBondContact CA-O 3.38Å; V91-Y105 PolarHBondContact N-O 2.98Å; G99-Y105 WeakPolarHBondContact O-CA 3.37Å; K100-Y105 HydrophobicContact CD-CE2 4.4Å; K100-Y105 HydrophobicContact CG-CD1 3.84Å; K100-Y105 HydrophobicContact CG-CD2 4.19Å; K100-Y105 HydrophobicContact CG-CE1 3.65Å; K100-Y105 HydrophobicContact CG-CE2 4.02Å; K100-Y105 HydrophobicContact CG-CG 4.11Å
106	S	96.6	Very high	94.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	160.2	-176.3	61.2	0	0	0	0	114.4	C90 S97 S98 G99 H101 V104 M155	C90-S106 VanDerWaalsContact SG-CA 3.58Å; S97-S106 PolarHBondContact OG-N 2.83Å; S97-S106 VanDerWaalsContact OG-N 3.09Å; S97-S106 PolarHBondContact OG-O 3.29Å; S98-S106 PolarHBondContact N-O 2.74Å; S98-S106 PolarHBondContact OG-O 2.78Å; G99-S106 PolarHBondContact O-N 3.07Å; H101-S106 PolarHBondContact CD2-O 2.99Å; H101-S106 VanDerWaalsContact CD2-O 3.32Å; H101-S106 PolarHBondContact CD2-OG 2.92Å; V104-S106 PolarHBondContact O-N 3.29Å; V104-S106 VanDerWaalsContact O-N 3.15Å; S106-M155 VanDerWaalsContact OG-CE 3.25Å; S106-M155 WeakPolarHBondContact OG-CE 3.37Å
107	C	97.2	Very high	94.5	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.034	21%	0.209	C	C	.	.			trans	-84.5	155.6	173.2	65.7	0	0	0	0	111.2	C90 D95 R96 G109 C110 K111 R139	C90-C107 HydrophobicContact CB-CB 4.03Å; C90-C107 PolarHBondContact SG-N 3.06Å; D95-C107 HydrophobicContact CB-CB 4.22Å; R96-C107 WeakPolarHBondContact O-CB 3.45Å; C107-G109 PolarHBondContact O-N 2.71Å; C107-C110 PolarHBondContact O-N 3.08Å; C107-K111 PolarHBondContact O-N 2.85Å; C107-R139 PolarHBondContact SG-NH1 3.23Å
108	E	95.9	Very high	94.4	Very high	94 Å²	94	38.5 Å²	38.5	44%	0.439	21%	0.207	S	C	.	.	H	α-helix	trans	-49.8	-35.4	176.2	-65.1	-56.9	116.8	0	0	113.2	S98 H101 C110 K111 G112	S98-E108 WeakPolarHBondContact CB-OE1 3.19Å; S98-E108 PolarHBondContact OG-OE1 3.26Å; H101-E108 IonicContact CE1-OE1 3.46Å; H101-E108 IonicContact NE2-OE1 3.77Å; H101-E108 PolarHBondContact NE2-OE1 3.33Å; E108-C110 VanDerWaalsContact C-N 3.33Å; E108-C110 PolarHBondContact O-N 3.04Å; E108-K111 WeakPolarHBondContact OE1-CD 3.34Å; E108-K111 IonicContact OE1-NZ 2.87Å; E108-K111 PolarHBondContact OE1-NZ 2.77Å; E108-K111 WeakPolarHBondContact OE2-CD 3.3Å; E108-K111 WeakPolarHBondContact OE2-CE 3.5Å; E108-K111 IonicContact OE2-NZ 2.71Å; E108-K111 PolarHBondContact OE2-NZ 3.25Å; E108-G112 PolarHBondContact O-N 3.35Å
109	G	96.8	Very high	94.2	Very high	31 Å²	31	40.8 Å²	40.8	32%	0.32	21%	0.206	S	C	.	.	H	α-helix	trans	-64.2	-29.9	176.9	0	0	0	0	0	114.6	C107 F113 R146	C107-G109 PolarHBondContact O-N 2.71Å; G109-F113 WeakPolarHBondContact O-CB 3.28Å; G109-R146 PolarHBondContact O-NH2 2.58Å
110	C	97.9	Very high	94.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-90.8	-39.9	176	-67.1	0	0	0	0	111.9	I92 C107 E108 G112 F113 F114	I92-C110 HydrophobicContact CB-CB 4.44Å; I92-C110 HydrophobicContact CD1-CB 4.34Å; C107-C110 PolarHBondContact O-N 3.08Å; E108-C110 VanDerWaalsContact C-N 3.33Å; E108-C110 PolarHBondContact O-N 3.04Å; C110-G112 PolarHBondContact O-N 3.04Å; C110-F113 PolarHBondContact O-N 2.91Å; C110-F114 WeakPolarHBondContact O-CB 3.38Å; C110-F114 PolarHBondContact O-N 2.95Å
111	K	96.2	Very high	94	Very high	49 Å²	49	46.2 Å²	46.2	21%	0.213	23%	0.228	C	C	.	.	H	α-helix	trans	-49.5	-56.4	167.5	173.4	-161.8	-168.4	-178.9	0	111.7	H101 Y102 C107 E108 F113 F114 K115	H101-K111 HydrophobicContact CB-CB 3.98Å; H101-K111 HydrophobicContact CB-CD 4.31Å; H101-K111 HydrophobicContact CB-CG 3.82Å; H101-K111 PolarHBondContact CE1-NZ 2.79Å; H101-K111 WeakPolarHBondContact ND1-CD 3.45Å; H101-K111 VanDerWaalsContact ND1-CE 3.27Å; H101-K111 WeakPolarHBondContact ND1-CE 3.11Å; Y102-K111 HydrophobicContact CE2-CB 4.44Å; Y102-K111 HydrophobicContact CE2-CG 3.9Å; C107-K111 PolarHBondContact O-N 2.85Å; E108-K111 WeakPolarHBondContact OE1-CD 3.34Å; E108-K111 IonicContact OE1-NZ 2.87Å; E108-K111 PolarHBondContact OE1-NZ 2.77Å; E108-K111 WeakPolarHBondContact OE2-CD 3.3Å; E108-K111 WeakPolarHBondContact OE2-CE 3.5Å; E108-K111 IonicContact OE2-NZ 2.71Å; E108-K111 PolarHBondContact OE2-NZ 3.25Å; K111-F113 VanDerWaalsContact C-N 3.31Å; K111-F113 PolarHBondContact O-N 3.37Å; K111-F114 PolarHBondContact O-N 2.78Å; K111-K115 VanDerWaalsContact O-CB 3.29Å; K111-K115 WeakPolarHBondContact O-CB 3.32Å; K111-K115 PolarHBondContact O-N 3.42Å
112	G	95.3	Very high	94	Very high	18 Å²	18	48.5 Å²	48.5	19%	0.186	24%	0.24	C	C	.	.	H	α-helix	trans	-66.4	-29.1	-179.5	0	0	0	0	0	114	E108 C110 R116	E108-G112 PolarHBondContact O-N 3.35Å; C110-G112 PolarHBondContact O-N 3.04Å; G112-R116 WeakPolarHBondContact O-CG 3.31Å; G112-R116 PolarHBondContact O-N 3.15Å; G112-R116 PolarHBondContact O-NE 2.82Å; G112-R116 PolarHBondContact O-NH1 2.81Å
113	F	97.9	Very high	94.1	Very high	10 Å²	10	53.8 Å²	53.8	4%	0.044	28%	0.278	C	S	.	.	H	α-helix	trans	-68.7	-50.4	172.5	170.1	-97.9	0	0	0	111.5	G109 C110 K111 R116 T117 Y124 Q143 R146 Y147	G109-F113 WeakPolarHBondContact O-CB 3.28Å; C110-F113 PolarHBondContact O-N 2.91Å; K111-F113 VanDerWaalsContact C-N 3.31Å; K111-F113 PolarHBondContact O-N 3.37Å; F113-R116 PolarHBondContact O-N 2.85Å; F113-T117 PolarHBondContact O-N 2.99Å; F113-T117 PolarHBondContact O-OG1 3.5Å; F113-Y124 AromaticContact CE2-CE2 3.82Å; F113-Y124 HydrophobicContact CE2-CE2 3.82Å; F113-Y124 HydrophobicContact CZ-CD2 4.25Å; F113-Y124 AromaticContact CZ-CE2 3.54Å; F113-Y124 HydrophobicContact CZ-CE2 3.54Å; F113-Q143 HydrophobicContact CE2-CB 4.15Å; F113-Q143 HydrophobicContact CE2-CG 4.17Å; F113-Q143 HydrophobicContact CZ-CB 4.24Å; F113-Q143 WeakPolarHBondContact CZ-O 3.29Å; F113-R146 HydrophobicContact CD1-CG 4.04Å; F113-R146 HydrophobicContact CE1-CB 4.14Å; F113-R146 HydrophobicContact CE1-CG 3.84Å; F113-R146 HydrophobicContact CZ-CB 4.3Å; F113-R146 HydrophobicContact CZ-CG 4.35Å; F113-Y147 HydrophobicContact CE1-CD2 4.15Å; F113-Y147 HydrophobicContact CE1-CG 4.42Å
114	F	97	Very high	94.4	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-48.5	177.9	-167.7	-97.1	0	0	0	111.4	Y102 C110 K111 R116 T117 V118 Y147 C150 L151 M155 K156 R157 V160	Y102-F114 HydrophobicContact CD1-CD1 4.46Å; Y102-F114 HydrophobicContact CD2-CB 4.25Å; Y102-F114 AromaticContact CD2-CD1 3.51Å; Y102-F114 HydrophobicContact CD2-CD1 3.51Å; Y102-F114 HydrophobicContact CD2-CE1 4.29Å; Y102-F114 HydrophobicContact CD2-CG 4.23Å; Y102-F114 HydrophobicContact CE2-CD1 4.17Å; Y102-F114 AromaticContact CG-CD1 3.7Å; Y102-F114 HydrophobicContact CG-CD1 3.7Å; Y102-F114 HydrophobicContact CG-CE1 4.01Å; C110-F114 WeakPolarHBondContact O-CB 3.38Å; C110-F114 PolarHBondContact O-N 2.95Å; K111-F114 PolarHBondContact O-N 2.78Å; F114-R116 VanDerWaalsContact C-N 3.3Å; F114-R116 PolarHBondContact O-N 3.43Å; F114-T117 PolarHBondContact O-N 3.27Å; F114-V118 HydrophobicContact CD1-CG2 4.17Å; F114-V118 HydrophobicContact CE1-CG2 3.83Å; F114-V118 HydrophobicContact CE2-CG2 4.4Å; F114-V118 HydrophobicContact CZ-CG2 3.95Å; F114-V118 PolarHBondContact O-N 3.41Å; F114-Y147 AromaticContact CD2-CD2 3.91Å; F114-Y147 HydrophobicContact CD2-CD2 3.91Å; F114-Y147 AromaticContact CD2-CE2 3.56Å; F114-Y147 HydrophobicContact CD2-CE2 3.56Å; F114-Y147 HydrophobicContact CE2-CD2 4.16Å; F114-Y147 AromaticContact CE2-CE2 3.53Å; F114-Y147 HydrophobicContact CE2-CE2 3.53Å; F114-Y147 HydrophobicContact CZ-CE2 4.49Å; F114-C150 HydrophobicContact CD2-CB 3.6Å; F114-C150 HydrophobicContact CE2-CB 4.02Å; F114-L151 HydrophobicContact CE2-CD2 3.86Å; F114-L151 HydrophobicContact CE2-CG 4.43Å; F114-L151 HydrophobicContact CZ-CD2 4.17Å; F114-M155 HydrophobicContact CB-SD 3.86Å; F114-M155 HydrophobicContact CD1-CB 4.32Å; F114-M155 HydrophobicContact CD1-SD 4.35Å; F114-M155 HydrophobicContact CD2-CB 3.86Å; F114-M155 HydrophobicContact CD2-CG 4.47Å; F114-M155 HydrophobicContact CD2-SD 3.81Å; F114-M155 HydrophobicContact CE1-CB 4.01Å; F114-M155 HydrophobicContact CE2-CB 3.51Å; F114-M155 HydrophobicContact CE2-SD 4.46Å; F114-M155 HydrophobicContact CG-CB 4.25Å; F114-M155 HydrophobicContact CG-SD 3.75Å; F114-M155 HydrophobicContact CZ-CB 3.6Å; F114-M155 VanDerWaalsContact CZ-O 3.29Å; F114-M155 WeakPolarHBondContact CZ-O 3.1Å; F114-K156 WeakPolarHBondContact CE1-O 3.17Å; F114-R157 HydrophobicContact CZ-CG 4.28Å; F114-V160 HydrophobicContact CD1-CG2 3.68Å; F114-V160 HydrophobicContact CE1-CG2 3.57Å
115	K	93.8	Very high	94.5	Very high	59 Å²	59	58.6 Å²	58.6	26%	0.257	30%	0.295	S	S	.	.	H	α-helix	trans	-53.1	-41.4	175.5	177	158.8	157.6	167.3	0	113	Y102 K111 R119 V160 E180	Y102-K115 HydrophobicContact CE2-CB 4.24Å; Y102-K115 VanDerWaalsContact OH-CD 3.28Å; Y102-K115 WeakPolarHBondContact OH-CD 2.99Å; K111-K115 VanDerWaalsContact O-CB 3.29Å; K111-K115 WeakPolarHBondContact O-CB 3.32Å; K111-K115 PolarHBondContact O-N 3.42Å; K115-R119 WeakPolarHBondContact O-CB 3.13Å; K115-R119 WeakPolarHBondContact O-CG 3.45Å; K115-R119 PolarHBondContact O-N 3.09Å; K115-V160 HydrophobicContact CG-CG1 4.49Å; K115-E180 IonicContact NZ-OE1 3.58Å; K115-E180 PolarHBondContact NZ-OE1 3.39Å
116	R	94.9	Very high	94.6	Very high	154 Å²	154	55.7 Å²	55.7	58%	0.581	29%	0.286	S	S	*	.	H	α-helix	trans	-75.8	-33.1	175.9	-74	-172.8	-58.5	-93.5	0.8	113.7	G112 F113 F114 K120	G112-R116 WeakPolarHBondContact O-CG 3.31Å; G112-R116 PolarHBondContact O-N 3.15Å; G112-R116 PolarHBondContact O-NE 2.82Å; G112-R116 PolarHBondContact O-NH1 2.81Å; F113-R116 PolarHBondContact O-N 2.85Å; F114-R116 VanDerWaalsContact C-N 3.3Å; F114-R116 PolarHBondContact O-N 3.43Å; R116-K120 PolarHBondContact O-N 3.02Å
117	T	94.9	Very high	94.6	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-66.7	-50.4	-179.9	-52.2	0	0	0	0	110	F113 F114 D121 L122 Y124 Y147	F113-T117 PolarHBondContact O-N 2.99Å; F113-T117 PolarHBondContact O-OG1 3.5Å; F114-T117 PolarHBondContact O-N 3.27Å; T117-D121 CarbonylContact O-C 3.39Å; T117-D121 VanDerWaalsContact O-CA 3.31Å; T117-D121 WeakPolarHBondContact O-CA 3.15Å; T117-D121 PolarHBondContact O-N 3.37Å; T117-L122 HydrophobicContact CG2-CB 4.22Å; T117-L122 WeakPolarHBondContact CG2-O 3.43Å; T117-L122 PolarHBondContact O-N 2.89Å; T117-Y124 HydrophobicContact CG2-CD2 4.26Å; T117-Y124 HydrophobicContact CG2-CE2 3.51Å; T117-Y124 PolarHBondContact OG1-OH 3.1Å; T117-Y147 HydrophobicContact CG2-CD1 3.92Å; T117-Y147 HydrophobicContact CG2-CD2 3.69Å; T117-Y147 HydrophobicContact CG2-CE1 3.7Å; T117-Y147 HydrophobicContact CG2-CE2 3.47Å; T117-Y147 VanDerWaalsContact CG2-CE2 3.47Å; T117-Y147 HydrophobicContact CG2-CG 3.91Å; T117-Y147 VanDerWaalsContact CG2-CZ 3.47Å
118	V	92.8	Very high	94.5	Very high	16 Å²	16	71 Å²	71	10%	0.097	35%	0.349	C	S	.	.	H	α-helix	trans	-69.5	-45.5	-178.4	-176.9	0	0	0	0	112	F114 K120 D121 Y147 R157 V160	F114-V118 HydrophobicContact CD1-CG2 4.17Å; F114-V118 HydrophobicContact CE1-CG2 3.83Å; F114-V118 HydrophobicContact CE2-CG2 4.4Å; F114-V118 HydrophobicContact CZ-CG2 3.95Å; F114-V118 PolarHBondContact O-N 3.41Å; V118-K120 PolarHBondContact O-N 2.89Å; V118-K120 VanDerWaalsContact O-N 3.17Å; V118-D121 PolarHBondContact O-N 3.05Å; V118-D121 VanDerWaalsContact O-N 3.08Å; V118-Y147 HydrophobicContact CG2-CE2 4.4Å; V118-R157 HydrophobicContact CG1-CB 4.4Å; V118-R157 HydrophobicContact CG1-CG 4.48Å; V118-R157 HydrophobicContact CG2-CG 4Å; V118-V160 HydrophobicContact CB-CB 4.06Å; V118-V160 HydrophobicContact CB-CG1 3.98Å; V118-V160 HydrophobicContact CB-CG2 4.16Å; V118-V160 HydrophobicContact CG1-CB 3.96Å; V118-V160 HydrophobicContact CG1-CG1 4.24Å; V118-V160 HydrophobicContact CG1-CG2 4.39Å; V118-V160 HydrophobicContact CG2-CG2 4.16Å
119	R	86.4	Confident	94.4	Very high	113 Å²	113	71.8 Å²	71.8	43%	0.426	36%	0.357	S	S	.	.	H	α-helix	trans	-67.8	-14.9	-177.2	-73.3	-166.4	175.8	170	-8	116	K115 V160	K115-R119 WeakPolarHBondContact O-CB 3.13Å; K115-R119 WeakPolarHBondContact O-CG 3.45Å; K115-R119 PolarHBondContact O-N 3.09Å; R119-V160 HydrophobicContact CG-CG1 3.7Å; R119-V160 PolarHBondContact NE-O 2.92Å
120	K	89.8	Confident	94.3	Very high	160 Å²	160	76.6 Å²	76.6	70%	0.696	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	13.6	175.1	-68.5	-168.8	172.8	-158.7	0	111.8	R116 V118 L122	R116-K120 PolarHBondContact O-N 3.02Å; V118-K120 PolarHBondContact O-N 2.89Å; V118-K120 VanDerWaalsContact O-N 3.17Å; K120-L122 HydrophobicContact CB-CD1 4.21Å; K120-L122 HydrophobicContact CB-CD2 3.81Å; K120-L122 HydrophobicContact CB-CG 3.71Å; K120-L122 PolarHBondContact O-N 3.26Å; K120-L122 VanDerWaalsContact O-N 3.1Å
121	D	87.5	Confident	94.3	Very high	104 Å²	104	83.7 Å²	83.7	56%	0.556	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	25.5	57.2	-165	-158	36.2	0	0	0	114.6	T117 V118 S123 R157	T117-D121 CarbonylContact O-C 3.39Å; T117-D121 VanDerWaalsContact O-CA 3.31Å; T117-D121 WeakPolarHBondContact O-CA 3.15Å; T117-D121 PolarHBondContact O-N 3.37Å; V118-D121 PolarHBondContact O-N 3.05Å; V118-D121 VanDerWaalsContact O-N 3.08Å; D121-S123 PolarHBondContact O-N 3.48Å; D121-S123 VanDerWaalsContact O-N 3.14Å; D121-R157 IonicContact OD1-CZ 2.7Å; D121-R157 IonicContact OD1-NH1 3.05Å; D121-R157 PolarHBondContact OD1-NH1 3.06Å; D121-R157 IonicContact OD1-NH2 3.38Å
122	L	93	Very high	94.3	Very high	62 Å²	62	82.3 Å²	82.3	33%	0.325	40%	0.398	S	S	.	.			trans	-75	108.4	-174	-60.5	175.9	0	0	0	110.4	T117 K120 Y124	T117-L122 HydrophobicContact CG2-CB 4.22Å; T117-L122 WeakPolarHBondContact CG2-O 3.43Å; T117-L122 PolarHBondContact O-N 2.89Å; K120-L122 HydrophobicContact CB-CD1 4.21Å; K120-L122 HydrophobicContact CB-CD2 3.81Å; K120-L122 HydrophobicContact CB-CG 3.71Å; K120-L122 PolarHBondContact O-N 3.26Å; K120-L122 VanDerWaalsContact O-N 3.1Å; L122-Y124 HydrophobicContact CB-CE1 4Å; L122-Y124 HydrophobicContact CB-CE2 4.5Å; L122-Y124 HydrophobicContact CD1-CE1 4.44Å; L122-Y124 WeakPolarHBondContact CD1-OH 3.43Å
123	S	93.4	Very high	94.3	Very high	115 Å²	115	87.6 Å²	87.6	80%	0.804	42%	0.422	S	S	*	.			trans	-70.3	142.1	161.4	-168	0	0	0	0	110.5	D121	D121-S123 PolarHBondContact O-N 3.48Å; D121-S123 VanDerWaalsContact O-N 3.14Å
124	Y	96.8	Very high	94.3	Very high	35 Å²	35	87.9 Å²	87.9	14%	0.137	42%	0.424	C	S	.	.			trans	-127.7	148	176.6	-62.1	-52.2	0	0	0	109.4	F113 T117 L122 Q143 Y144	F113-Y124 AromaticContact CE2-CE2 3.82Å; F113-Y124 HydrophobicContact CE2-CE2 3.82Å; F113-Y124 HydrophobicContact CZ-CD2 4.25Å; F113-Y124 AromaticContact CZ-CE2 3.54Å; F113-Y124 HydrophobicContact CZ-CE2 3.54Å; T117-Y124 HydrophobicContact CG2-CD2 4.26Å; T117-Y124 HydrophobicContact CG2-CE2 3.51Å; T117-Y124 PolarHBondContact OG1-OH 3.1Å; L122-Y124 HydrophobicContact CB-CE1 4Å; L122-Y124 HydrophobicContact CB-CE2 4.5Å; L122-Y124 HydrophobicContact CD1-CE1 4.44Å; L122-Y124 WeakPolarHBondContact CD1-OH 3.43Å; Y124-Q143 HydrophobicContact CD1-CB 3.76Å; Y124-Q143 HydrophobicContact CD2-CB 3.77Å; Y124-Q143 HydrophobicContact CE1-CB 3.95Å; Y124-Q143 HydrophobicContact CE1-CG 4.39Å; Y124-Q143 HydrophobicContact CE2-CB 3.94Å; Y124-Q143 HydrophobicContact CG-CB 3.68Å; Y124-Y144 WeakPolarHBondContact O-CD2 3.39Å
125	T	95.8	Very high	94.3	Very high	125 Å²	125	90.4 Å²	90.4	77%	0.767	44%	0.438	S	S	*	.			trans	-115.9	135.1	174.5	-53.7	0	0	0	0	109.4
126	C	97.3	Very high	94.4	Very high	19 Å²	19	93.4 Å²	93.4	13%	0.128	45%	0.451	C	S	.	.			trans	-76.2	143	170.4	-160.9	0	0	0	0	110.4	D128 K130 C132 Y144 C145	C126-D128 PolarHBondContact SG-N 3.43Å; C126-D128 VanDerWaalsContact SG-N 3.42Å; C126-D128 PolarHBondContact SG-O 3.42Å; C126-D128 VanDerWaalsContact SG-O 3.34Å; C126-K130 HydrophobicContact CB-CG 3.93Å; C126-C132 PolarHBondContact SG-SG 2.93Å; C126-Y144 HydrophobicContact CB-CD1 3.73Å; C126-Y144 HydrophobicContact CB-CE1 4.41Å; C126-Y144 HydrophobicContact CB-CG 4.17Å; C126-C145 VanDerWaalsContact SG-SG 3.65Å
127	R	96.2	Very high	94.4	Very high	245 Å²	245	97.5 Å²	97.5	93%	0.925	47%	0.466	S	S	*	.	S	Bend	trans	-95.6	-14	171.3	-64	-176.3	179.5	-177	-1.7	113.1
128	D	94.6	Very high	94.4	Very high	82 Å²	82	101.4 Å²	101.4	44%	0.439	48%	0.484	S	S	.	.	S	Bend	trans	-109.8	-169.9	177.4	-41.8	-48.9	0	0	0	109.4	C126 K130 C132	C126-D128 PolarHBondContact SG-N 3.43Å; C126-D128 VanDerWaalsContact SG-N 3.42Å; C126-D128 PolarHBondContact SG-O 3.42Å; C126-D128 VanDerWaalsContact SG-O 3.34Å; D128-K130 PolarHBondContact O-N 3.32Å; D128-C132 PolarHBondContact OD2-SG 3.03Å
129	N	94.9	Very high	94.6	Very high	110 Å²	110	102.6 Å²	102.6	59%	0.588	49%	0.487	S	S	*	.	S	Bend	trans	-66.3	15.9	-175.9	78	-22	0	0	0	117	E131	N129-E131 VanDerWaalsContact C-N 3.28Å; N129-E131 PolarHBondContact ND2-OE2 3.07Å; N129-E131 PolarHBondContact O-N 3.3Å; N129-E131 WeakPolarHBondContact OD1-CB 3.38Å; N129-E131 PolarHBondContact OD1-N 3.05Å
130	K	95.1	Very high	95	Very high	132 Å²	132	103.1 Å²	103.1	57%	0.574	50%	0.498	S	S	*	.	S	Bend	trans	68.9	2.8	-171.6	-59.2	177	178.2	174	0	116.8	C126 D128 Y144 C145	C126-K130 HydrophobicContact CB-CG 3.93Å; D128-K130 PolarHBondContact O-N 3.32Å; K130-Y144 HydrophobicContact CB-CD1 4.48Å; K130-Y144 HydrophobicContact CB-CE1 3.89Å; K130-Y144 HydrophobicContact CD-CE1 3.84Å; K130-Y144 HydrophobicContact CG-CD1 4.28Å; K130-Y144 HydrophobicContact CG-CE1 3.64Å; K130-C145 PolarHBondContact O-SG 2.71Å
131	E	95.9	Very high	95.4	Very high	149 Å²	149	104.5 Å²	104.5	70%	0.696	50%	0.499	S	S	*	.			trans	-104.8	16.7	-178.3	-54.7	-175.7	126.6	0	0	114.5	N129 L133	N129-E131 VanDerWaalsContact C-N 3.28Å; N129-E131 PolarHBondContact ND2-OE2 3.07Å; N129-E131 PolarHBondContact O-N 3.3Å; N129-E131 WeakPolarHBondContact OD1-CB 3.38Å; N129-E131 PolarHBondContact OD1-N 3.05Å; E131-L133 PolarHBondContact O-N 3.15Å
132	C	96.9	Very high	95.9	Very high	21 Å²	21	100.3 Å²	100.3	14%	0.142	48%	0.478	C	S	.	.			trans	-52.1	126.2	-175.3	-44.2	0	0	0	0	112.4	C126 D128 V134 C142 C145	C126-C132 PolarHBondContact SG-SG 2.93Å; D128-C132 PolarHBondContact OD2-SG 3.03Å; C132-V134 WeakPolarHBondContact O-CG2 3.28Å; C132-C142 HydrophobicContact CB-CB 3.73Å; C132-C145 HydrophobicContact CB-CB 3.86Å; C132-C145 PolarHBondContact SG-SG 3.09Å
133	L	96.1	Very high	96.1	Very high	129 Å²	129	102.2 Å²	102.2	68%	0.675	49%	0.485	S	S	*	.			trans	-58.5	137.8	-179.6	-65.6	175.2	0	0	0	112.3	E131 Q138	E131-L133 PolarHBondContact O-N 3.15Å; L133-Q138 WeakPolarHBondContact O-CG 3.31Å
134	V	97.5	Very high	96.3	Very high	15 Å²	15	99.2 Å²	99.2	9%	0.091	46%	0.456	C	S	.	.			trans	-122.2	95.7	-178.6	-172.7	0	0	0	0	109.6	I92 C93 C132 R139 C145 R146 K149	I92-V134 HydrophobicContact CG2-CG1 4.07Å; I92-V134 WeakPolarHBondContact O-CG1 3.5Å; I92-V134 VanDerWaalsContact O-O 3.11Å; C93-V134 HydrophobicContact CB-CG1 4.28Å; C132-V134 WeakPolarHBondContact O-CG2 3.28Å; V134-R139 HydrophobicContact CG1-CB 3.96Å; V134-C145 HydrophobicContact CG2-CB 4.38Å; V134-R146 HydrophobicContact CG1-CB 4.3Å; V134-R146 HydrophobicContact CG1-CG 4.06Å; V134-R146 HydrophobicContact CG2-CB 4.46Å; V134-K149 HydrophobicContact CB-CD 3.75Å; V134-K149 HydrophobicContact CG1-CD 4.23Å; V134-K149 HydrophobicContact CG2-CD 4.11Å; V134-K149 PolarHBondContact O-NZ 2.9Å; V134-K149 VanDerWaalsContact O-NZ 3.1Å
135	D	96.5	Very high	96.4	Very high	54 Å²	54	97.9 Å²	97.9	29%	0.289	45%	0.452	S	S	.	.			trans	-127	177.4	175.2	69.6	54.3	0	0	0	111.9	C93 R137 Q138 R139	C93-D135 CarbonylContact O-C 3.57Å; C93-D135 WeakPolarHBondContact O-CA 3.2Å; D135-R137 VanDerWaalsContact C-N 3.26Å; D135-R137 PolarHBondContact O-N 3.14Å; D135-R137 WeakPolarHBondContact OD1-CA 3.45Å; D135-R137 WeakPolarHBondContact OD1-CB 3.3Å; D135-R137 PolarHBondContact OD1-N 3.03Å; D135-Q138 PolarHBondContact O-N 3.4Å; D135-Q138 PolarHBondContact OD1-N 3.47Å; D135-Q138 WeakPolarHBondContact OD2-CG 3.25Å; D135-Q138 PolarHBondContact OD2-NE2 3.32Å; D135-R139 WeakPolarHBondContact O-CA 3.16Å; D135-R139 WeakPolarHBondContact O-CB 3.33Å; D135-R139 WeakPolarHBondContact O-CG 3.44Å; D135-R139 PolarHBondContact O-N 2.91Å
136	K	95.3	Very high	96.5	Very high	122 Å²	122	92.6 Å²	92.6	53%	0.53	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-36.8	-177.3	178.7	172.6	-179	151.5	0	113.8	C93 D95	C93-K136 PolarHBondContact O-N 3.33Å; D95-K136 HydrophobicContact CB-CB 4.22Å; D95-K136 HydrophobicContact CB-CD 4.09Å; D95-K136 HydrophobicContact CB-CG 4.08Å; D95-K136 VanDerWaalsContact OD1-CD 3.32Å; D95-K136 WeakPolarHBondContact OD1-CD 3.25Å; D95-K136 WeakPolarHBondContact OD1-CE 3.48Å; D95-K136 IonicContact OD1-NZ 2.71Å; D95-K136 PolarHBondContact OD1-NZ 3.36Å
137	R	95.7	Very high	96.6	Very high	239 Å²	239	92.2 Å²	92.2	90%	0.902	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-50	-177.2	-59.5	-178.2	179.1	-171.2	-0.2	110.6	D135	D135-R137 VanDerWaalsContact C-N 3.26Å; D135-R137 PolarHBondContact O-N 3.14Å; D135-R137 WeakPolarHBondContact OD1-CA 3.45Å; D135-R137 WeakPolarHBondContact OD1-CB 3.3Å; D135-R137 PolarHBondContact OD1-N 3.03Å
138	Q	94.8	Very high	96.6	Very high	82 Å²	82	84.2 Å²	84.2	38%	0.383	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	6.1	-169.9	76.7	-169.4	-50.7	0	0	116.4	L133 D135 N140 R141	L133-Q138 WeakPolarHBondContact O-CG 3.31Å; D135-Q138 PolarHBondContact O-N 3.4Å; D135-Q138 PolarHBondContact OD1-N 3.47Å; D135-Q138 WeakPolarHBondContact OD2-CG 3.25Å; D135-Q138 PolarHBondContact OD2-NE2 3.32Å; Q138-N140 PolarHBondContact O-N 2.75Å; Q138-R141 HydrophobicContact CB-CB 4.45Å; Q138-R141 WeakPolarHBondContact O-CB 3.36Å; Q138-R141 PolarHBondContact O-N 3.25Å
139	R	96.4	Very high	96.8	Very high	42 Å²	42	83.7 Å²	83.7	16%	0.158	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-13.8	173.6	59	-176.2	-178.6	-158.6	-4.7	116.3	C93 D95 C107 V134 D135 R146	C93-R139 HydrophobicContact CB-CB 4.28Å; C93-R139 PolarHBondContact SG-NH1 3.3Å; D95-R139 IonicContact OD2-CZ 3.3Å; D95-R139 VanDerWaalsContact OD2-CZ 3.3Å; D95-R139 IonicContact OD2-NH1 2.71Å; D95-R139 PolarHBondContact OD2-NH1 3.37Å; D95-R139 IonicContact OD2-NH2 2.99Å; D95-R139 PolarHBondContact OD2-NH2 3.22Å; C107-R139 PolarHBondContact SG-NH1 3.23Å; V134-R139 HydrophobicContact CG1-CB 3.96Å; D135-R139 WeakPolarHBondContact O-CA 3.16Å; D135-R139 WeakPolarHBondContact O-CB 3.33Å; D135-R139 WeakPolarHBondContact O-CG 3.44Å; D135-R139 PolarHBondContact O-N 2.91Å; R139-R146 VanDerWaalsContact O-CD 3.3Å; R139-R146 WeakPolarHBondContact O-CD 3.43Å; R139-R146 PolarHBondContact O-NH1 2.96Å
140	N	96.6	Very high	96.9	Very high	123 Å²	123	78.4 Å²	78.4	66%	0.658	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-10.5	175.3	-67	-6.5	0	0	0	113.4	Q138 R146	Q138-N140 PolarHBondContact O-N 2.75Å; N140-R146 PolarHBondContact OD1-NH1 3.3Å
141	R	96.6	Very high	97	Very high	190 Å²	190	74.9 Å²	74.9	72%	0.717	34%	0.34	S	S	*	.	S	Bend	trans	-64.9	-42.2	-175.2	176.4	62.1	179.8	-158.1	-1	113.2	Q138	Q138-R141 HydrophobicContact CB-CB 4.45Å; Q138-R141 WeakPolarHBondContact O-CB 3.36Å; Q138-R141 PolarHBondContact O-N 3.25Å
142	C	97.9	Very high	97.1	Very high	15 Å²	15	71.6 Å²	71.6	10%	0.101	34%	0.338	C	S	.	.			trans	-134.8	114.7	176.7	-177	0	0	0	0	110.8	C132 C145 R146	C132-C142 HydrophobicContact CB-CB 3.73Å; C142-C145 HydrophobicContact CB-CB 4.26Å; C142-R146 WeakPolarHBondContact O-CB 3.29Å; C142-R146 PolarHBondContact O-N 2.87Å
143	Q	97.9	Very high	97	Very high	103 Å²	103	74.9 Å²	74.9	48%	0.481	35%	0.353	S	S	.	.	H	α-helix	trans	-69.7	-36.7	178.9	-66.2	172.7	-53	0	0	111.8	F113 Y124 Y147	F113-Q143 HydrophobicContact CE2-CB 4.15Å; F113-Q143 HydrophobicContact CE2-CG 4.17Å; F113-Q143 HydrophobicContact CZ-CB 4.24Å; F113-Q143 WeakPolarHBondContact CZ-O 3.29Å; Y124-Q143 HydrophobicContact CD1-CB 3.76Å; Y124-Q143 HydrophobicContact CD2-CB 3.77Å; Y124-Q143 HydrophobicContact CE1-CB 3.95Å; Y124-Q143 HydrophobicContact CE1-CG 4.39Å; Y124-Q143 HydrophobicContact CE2-CB 3.94Å; Y124-Q143 HydrophobicContact CG-CB 3.68Å; Q143-Y147 WeakPolarHBondContact O-CB 3.27Å; Q143-Y147 PolarHBondContact O-N 3.38Å
144	Y	98.3	Very high	96.9	Very high	51 Å²	51	70.6 Å²	70.6	20%	0.2	34%	0.34	C	S	.	.	H	α-helix	trans	-59.1	-58.2	176.8	177.3	-96.6	0	0	0	111.7	Y124 C126 K130 R146 Y147 Q148	Y124-Y144 WeakPolarHBondContact O-CD2 3.39Å; C126-Y144 HydrophobicContact CB-CD1 3.73Å; C126-Y144 HydrophobicContact CB-CE1 4.41Å; C126-Y144 HydrophobicContact CB-CG 4.17Å; K130-Y144 HydrophobicContact CB-CD1 4.48Å; K130-Y144 HydrophobicContact CB-CE1 3.89Å; K130-Y144 HydrophobicContact CD-CE1 3.84Å; K130-Y144 HydrophobicContact CG-CD1 4.28Å; K130-Y144 HydrophobicContact CG-CE1 3.64Å; Y144-R146 VanDerWaalsContact C-N 3.28Å; Y144-R146 PolarHBondContact O-N 3.47Å; Y144-Y147 PolarHBondContact O-N 2.9Å; Y144-Q148 HydrophobicContact CD1-CG 4.06Å; Y144-Q148 HydrophobicContact CD2-CG 4.24Å; Y144-Q148 HydrophobicContact CE1-CG 3.71Å; Y144-Q148 HydrophobicContact CE2-CG 3.93Å; Y144-Q148 VanDerWaalsContact CE2-NE2 3.31Å; Y144-Q148 HydrophobicContact CG-CG 4.34Å; Y144-Q148 WeakPolarHBondContact O-CG 3.49Å; Y144-Q148 PolarHBondContact O-N 3.49Å
145	C	98.1	Very high	96.8	Very high	8 Å²	8	70.2 Å²	70.2	5%	0.054	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-36.2	-177.4	-59.3	0	0	0	0	112.2	C126 K130 C132 V134 C142 K149	C126-C145 VanDerWaalsContact SG-SG 3.65Å; K130-C145 PolarHBondContact O-SG 2.71Å; C132-C145 HydrophobicContact CB-CB 3.86Å; C132-C145 PolarHBondContact SG-SG 3.09Å; V134-C145 HydrophobicContact CG2-CB 4.38Å; C142-C145 HydrophobicContact CB-CB 4.26Å; C145-K149 VanDerWaalsContact O-CB 3.28Å; C145-K149 WeakPolarHBondContact O-CB 3.2Å; C145-K149 PolarHBondContact O-N 2.84Å
146	R	98.4	Very high	96.6	Very high	13 Å²	13	72.9 Å²	72.9	5%	0.049	35%	0.346	C	S	.	.	H	α-helix	trans	-61.4	-43.5	171.5	-171.6	-165.9	-167.6	146	-10.6	112.3	I92 G109 F113 V134 R139 N140 C142 Y144 K149 C150	I92-R146 HydrophobicContact CG2-CG 4.47Å; G109-R146 PolarHBondContact O-NH2 2.58Å; F113-R146 HydrophobicContact CD1-CG 4.04Å; F113-R146 HydrophobicContact CE1-CB 4.14Å; F113-R146 HydrophobicContact CE1-CG 3.84Å; F113-R146 HydrophobicContact CZ-CB 4.3Å; F113-R146 HydrophobicContact CZ-CG 4.35Å; V134-R146 HydrophobicContact CG1-CB 4.3Å; V134-R146 HydrophobicContact CG1-CG 4.06Å; V134-R146 HydrophobicContact CG2-CB 4.46Å; R139-R146 VanDerWaalsContact O-CD 3.3Å; R139-R146 WeakPolarHBondContact O-CD 3.43Å; R139-R146 PolarHBondContact O-NH1 2.96Å; N140-R146 PolarHBondContact OD1-NH1 3.3Å; C142-R146 WeakPolarHBondContact O-CB 3.29Å; C142-R146 PolarHBondContact O-N 2.87Å; Y144-R146 VanDerWaalsContact C-N 3.28Å; Y144-R146 PolarHBondContact O-N 3.47Å; R146-K149 PolarHBondContact O-N 3.1Å; R146-C150 PolarHBondContact O-N 3.08Å; R146-C150 PolarHBondContact O-SG 3.17Å; R146-C150 VanDerWaalsContact O-SG 3.41Å
147	Y	98.1	Very high	96.2	Very high	11 Å²	11	71.9 Å²	71.9	4%	0.043	34%	0.339	C	S	.	.	H	α-helix	trans	-72	-42.2	-179.2	-171.9	-129	0	0	0	112.5	F113 F114 T117 V118 Q143 Y144 K149 C150 L151 R157	F113-Y147 HydrophobicContact CE1-CD2 4.15Å; F113-Y147 HydrophobicContact CE1-CG 4.42Å; F114-Y147 AromaticContact CD2-CD2 3.91Å; F114-Y147 HydrophobicContact CD2-CD2 3.91Å; F114-Y147 AromaticContact CD2-CE2 3.56Å; F114-Y147 HydrophobicContact CD2-CE2 3.56Å; F114-Y147 HydrophobicContact CE2-CD2 4.16Å; F114-Y147 AromaticContact CE2-CE2 3.53Å; F114-Y147 HydrophobicContact CE2-CE2 3.53Å; F114-Y147 HydrophobicContact CZ-CE2 4.49Å; T117-Y147 HydrophobicContact CG2-CD1 3.92Å; T117-Y147 HydrophobicContact CG2-CD2 3.69Å; T117-Y147 HydrophobicContact CG2-CE1 3.7Å; T117-Y147 HydrophobicContact CG2-CE2 3.47Å; T117-Y147 VanDerWaalsContact CG2-CE2 3.47Å; T117-Y147 HydrophobicContact CG2-CG 3.91Å; T117-Y147 VanDerWaalsContact CG2-CZ 3.47Å; V118-Y147 HydrophobicContact CG2-CE2 4.4Å; Q143-Y147 WeakPolarHBondContact O-CB 3.27Å; Q143-Y147 PolarHBondContact O-N 3.38Å; Y144-Y147 PolarHBondContact O-N 2.9Å; Y147-K149 VanDerWaalsContact C-N 3.28Å; Y147-K149 PolarHBondContact O-N 2.89Å; Y147-C150 VanDerWaalsContact O-CB 3.31Å; Y147-C150 WeakPolarHBondContact O-CB 3.34Å; Y147-C150 PolarHBondContact O-N 3.19Å; Y147-C150 VanDerWaalsContact O-N 3.09Å; Y147-L151 HydrophobicContact CD1-CD1 4.29Å; Y147-L151 HydrophobicContact CE1-CD1 4.06Å; Y147-L151 WeakPolarHBondContact O-CG 3.46Å; Y147-L151 PolarHBondContact O-N 3.26Å; Y147-R157 PolarHBondContact OH-NE 2.88Å; Y147-R157 PolarHBondContact OH-NH2 2.63Å
148	Q	97.9	Very high	95.5	Very high	77 Å²	77	64.9 Å²	64.9	36%	0.36	32%	0.316	S	S	.	.	H	α-helix	trans	-59.2	-40.8	171.4	-62.7	-55.6	-22.8	0	0	111.1	Y144 C150 L151 A152	Y144-Q148 HydrophobicContact CD1-CG 4.06Å; Y144-Q148 HydrophobicContact CD2-CG 4.24Å; Y144-Q148 HydrophobicContact CE1-CG 3.71Å; Y144-Q148 HydrophobicContact CE2-CG 3.93Å; Y144-Q148 VanDerWaalsContact CE2-NE2 3.31Å; Y144-Q148 HydrophobicContact CG-CG 4.34Å; Y144-Q148 WeakPolarHBondContact O-CG 3.49Å; Y144-Q148 PolarHBondContact O-N 3.49Å; Q148-C150 PolarHBondContact O-N 3.03Å; Q148-L151 PolarHBondContact O-N 3.13Å; Q148-A152 VanDerWaalsContact O-CB 3.28Å; Q148-A152 WeakPolarHBondContact O-CB 3.49Å; Q148-A152 PolarHBondContact O-N 2.85Å
149	K	97.8	Very high	94.4	Very high	71 Å²	71	61.6 Å²	61.6	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-68	-31.7	173.9	-165.5	177.5	-178.7	-172.9	0	113.5	I92 V134 C145 R146 Y147 M153	I92-K149 HydrophobicContact CG2-CB 4.48Å; I92-K149 HydrophobicContact CG2-CD 4.41Å; I92-K149 HydrophobicContact CG2-CG 4.39Å; I92-K149 VanDerWaalsContact O-CD 3.31Å; I92-K149 WeakPolarHBondContact O-CD 3.37Å; I92-K149 WeakPolarHBondContact O-CE 3.5Å; I92-K149 PolarHBondContact O-NZ 3.44Å; V134-K149 HydrophobicContact CB-CD 3.75Å; V134-K149 HydrophobicContact CG1-CD 4.23Å; V134-K149 HydrophobicContact CG2-CD 4.11Å; V134-K149 PolarHBondContact O-NZ 2.9Å; V134-K149 VanDerWaalsContact O-NZ 3.1Å; C145-K149 VanDerWaalsContact O-CB 3.28Å; C145-K149 WeakPolarHBondContact O-CB 3.2Å; C145-K149 PolarHBondContact O-N 2.84Å; R146-K149 PolarHBondContact O-N 3.1Å; Y147-K149 VanDerWaalsContact C-N 3.28Å; Y147-K149 PolarHBondContact O-N 2.89Å; K149-M153 HydrophobicContact CG-CG 4.11Å; K149-M153 VanDerWaalsContact O-CB 3.3Å; K149-M153 WeakPolarHBondContact O-CB 3.31Å; K149-M153 WeakPolarHBondContact O-CG 3.39Å; K149-M153 PolarHBondContact O-N 3Å; K149-M153 VanDerWaalsContact O-N 3.1Å
150	C	97.5	Very high	93.3	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.4	-50.8	168.9	-76.5	0	0	0	0	110.9	F114 R146 Y147 Q148 M153 G154 M155	F114-C150 HydrophobicContact CD2-CB 3.6Å; F114-C150 HydrophobicContact CE2-CB 4.02Å; R146-C150 PolarHBondContact O-N 3.08Å; R146-C150 PolarHBondContact O-SG 3.17Å; R146-C150 VanDerWaalsContact O-SG 3.41Å; Y147-C150 VanDerWaalsContact O-CB 3.31Å; Y147-C150 WeakPolarHBondContact O-CB 3.34Å; Y147-C150 PolarHBondContact O-N 3.19Å; Y147-C150 VanDerWaalsContact O-N 3.09Å; Q148-C150 PolarHBondContact O-N 3.03Å; C150-M153 PolarHBondContact O-N 3.03Å; C150-G154 PolarHBondContact O-N 3.19Å; C150-M155 HydrophobicContact CB-CB 4.16Å; C150-M155 HydrophobicContact CB-CG 4.16Å; C150-M155 HydrophobicContact CB-SD 3.62Å; C150-M155 VanDerWaalsContact O-CB 3.25Å; C150-M155 WeakPolarHBondContact O-CB 3.33Å; C150-M155 WeakPolarHBondContact O-CG 3.39Å; C150-M155 PolarHBondContact O-N 2.73Å
151	L	96.9	Very high	92	Very high	58 Å²	58	58 Å²	58	30%	0.304	29%	0.287	S	S	.	.	H	α-helix	trans	-63.9	-49.3	-179.8	-64.1	169.8	0	0	0	111.7	F114 Y147 Q148 M153 G154 R157	F114-L151 HydrophobicContact CE2-CD2 3.86Å; F114-L151 HydrophobicContact CE2-CG 4.43Å; F114-L151 HydrophobicContact CZ-CD2 4.17Å; Y147-L151 HydrophobicContact CD1-CD1 4.29Å; Y147-L151 HydrophobicContact CE1-CD1 4.06Å; Y147-L151 WeakPolarHBondContact O-CG 3.46Å; Y147-L151 PolarHBondContact O-N 3.26Å; Q148-L151 PolarHBondContact O-N 3.13Å; L151-M153 VanDerWaalsContact C-N 3.26Å; L151-M153 PolarHBondContact O-N 3.46Å; L151-G154 WeakPolarHBondContact O-CA 3.35Å; L151-G154 PolarHBondContact O-N 3.31Å; L151-R157 HydrophobicContact CD2-CG 4.26Å
152	A	96.9	Very high	90.3	Very high	79 Å²	79	52.1 Å²	52.1	65%	0.653	27%	0.273	S	S	*	.	H	α-helix	trans	-64.1	-25.6	-179.4	0	0	0	0	0	114	Q148 G154	Q148-A152 VanDerWaalsContact O-CB 3.28Å; Q148-A152 WeakPolarHBondContact O-CB 3.49Å; Q148-A152 PolarHBondContact O-N 2.85Å; A152-G154 VanDerWaalsContact C-N 3.31Å
153	M	96.5	Very high	88.8	Confident	91 Å²	91	53.7 Å²	53.7	45%	0.448	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-1.9	171.9	-64.2	-70.3	94.1	0	0	113.4	V91 V104 K149 C150 L151	V91-M153 HydrophobicContact CB-SD 4.35Å; V91-M153 HydrophobicContact CG2-CB 3.81Å; V91-M153 HydrophobicContact CG2-CG 4.13Å; V91-M153 HydrophobicContact CG2-SD 4.47Å; V104-M153 WeakPolarHBondContact CG1-O 3.38Å; K149-M153 HydrophobicContact CG-CG 4.11Å; K149-M153 VanDerWaalsContact O-CB 3.3Å; K149-M153 WeakPolarHBondContact O-CB 3.31Å; K149-M153 WeakPolarHBondContact O-CG 3.39Å; K149-M153 PolarHBondContact O-N 3Å; K149-M153 VanDerWaalsContact O-N 3.1Å; C150-M153 PolarHBondContact O-N 3.03Å; L151-M153 VanDerWaalsContact C-N 3.26Å; L151-M153 PolarHBondContact O-N 3.46Å
154	G	94.1	Very high	87.2	Confident	39 Å²	39	54.5 Å²	54.5	40%	0.402	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.1	20.5	175.2	0	0	0	0	0	116.2	V104 C150 L151 A152 K156	V104-G154 WeakPolarHBondContact CG1-O 3.35Å; C150-G154 PolarHBondContact O-N 3.19Å; L151-G154 WeakPolarHBondContact O-CA 3.35Å; L151-G154 PolarHBondContact O-N 3.31Å; A152-G154 VanDerWaalsContact C-N 3.31Å; G154-K156 PolarHBondContact O-N 3.18Å
155	M	95.7	Very high	85.3	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.03	28%	0.282	C	S	.	.			trans	-71.1	114.7	173.8	-72.5	-168.3	145.5	0	0	111.9	I92 Y102 V104 S106 F114 C150	I92-M155 HydrophobicContact CD1-CE 3.86Å; I92-M155 HydrophobicContact CD1-SD 4.23Å; Y102-M155 HydrophobicContact CD2-CE 4.29Å; Y102-M155 WeakPolarHBondContact O-CA 3.35Å; V104-M155 HydrophobicContact CG1-CG 4.24Å; V104-M155 HydrophobicContact CG2-CE 3.62Å; V104-M155 HydrophobicContact CG2-CG 3.51Å; V104-M155 HydrophobicContact CG2-SD 4.31Å; S106-M155 VanDerWaalsContact OG-CE 3.25Å; S106-M155 WeakPolarHBondContact OG-CE 3.37Å; F114-M155 HydrophobicContact CB-SD 3.86Å; F114-M155 HydrophobicContact CD1-CB 4.32Å; F114-M155 HydrophobicContact CD1-SD 4.35Å; F114-M155 HydrophobicContact CD2-CB 3.86Å; F114-M155 HydrophobicContact CD2-CG 4.47Å; F114-M155 HydrophobicContact CD2-SD 3.81Å; F114-M155 HydrophobicContact CE1-CB 4.01Å; F114-M155 HydrophobicContact CE2-CB 3.51Å; F114-M155 HydrophobicContact CE2-SD 4.46Å; F114-M155 HydrophobicContact CG-CB 4.25Å; F114-M155 HydrophobicContact CG-SD 3.75Å; F114-M155 HydrophobicContact CZ-CB 3.6Å; F114-M155 VanDerWaalsContact CZ-O 3.29Å; F114-M155 WeakPolarHBondContact CZ-O 3.1Å; C150-M155 HydrophobicContact CB-CB 4.16Å; C150-M155 HydrophobicContact CB-CG 4.16Å; C150-M155 HydrophobicContact CB-SD 3.62Å; C150-M155 VanDerWaalsContact O-CB 3.25Å; C150-M155 WeakPolarHBondContact O-CB 3.33Å; C150-M155 WeakPolarHBondContact O-CG 3.39Å; C150-M155 PolarHBondContact O-N 2.73Å
156	K	90.4	Very high	84	Confident	110 Å²	110	60.1 Å²	60.1	48%	0.478	31%	0.305	S	S	.	.			trans	-76.3	118.4	-178.3	-79.9	177.7	157.8	-81.8	0	112.5	Y102 F114 G154 E158 A159	Y102-K156 PolarHBondContact O-N 3.26Å; F114-K156 WeakPolarHBondContact CE1-O 3.17Å; G154-K156 PolarHBondContact O-N 3.18Å; K156-E158 VanDerWaalsContact C-OE2 3.27Å; K156-E158 WeakPolarHBondContact CA-OE2 3.23Å; K156-E158 WeakPolarHBondContact CB-OE1 3.28Å; K156-E158 VanDerWaalsContact CB-OE2 3.31Å; K156-E158 WeakPolarHBondContact CB-OE2 3.17Å; K156-E158 VanDerWaalsContact CD-OE1 3.23Å; K156-E158 WeakPolarHBondContact CD-OE1 3.39Å; K156-E158 WeakPolarHBondContact CE-OE1 3.47Å; K156-E158 WeakPolarHBondContact CG-OE1 3.37Å; K156-E158 IonicContact NZ-OE1 3.59Å; K156-E158 PolarHBondContact NZ-OE1 3.45Å; K156-A159 HydrophobicContact CB-CB 3.98Å
157	R	88.3	Confident	82.5	Confident	102 Å²	102	60.6 Å²	60.6	39%	0.385	31%	0.309	S	S	.	.	S	Bend	trans	-63.4	-45.8	177.4	-85.1	-171	170.6	-114.7	10.1	111.2	F114 V118 D121 Y147 L151 A159 V160	F114-R157 HydrophobicContact CZ-CG 4.28Å; V118-R157 HydrophobicContact CG1-CB 4.4Å; V118-R157 HydrophobicContact CG1-CG 4.48Å; V118-R157 HydrophobicContact CG2-CG 4Å; D121-R157 IonicContact OD1-CZ 2.7Å; D121-R157 IonicContact OD1-NH1 3.05Å; D121-R157 PolarHBondContact OD1-NH1 3.06Å; D121-R157 IonicContact OD1-NH2 3.38Å; Y147-R157 PolarHBondContact OH-NE 2.88Å; Y147-R157 PolarHBondContact OH-NH2 2.63Å; L151-R157 HydrophobicContact CD2-CG 4.26Å; R157-A159 PolarHBondContact O-N 2.98Å; R157-V160 WeakPolarHBondContact O-CB 3.31Å; R157-V160 PolarHBondContact O-N 2.94Å
158	E	79.9	Confident	80.6	Confident	92 Å²	92	69.4 Å²	69.4	43%	0.43	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-57.1	-31.9	-177.6	70.4	-78.1	-166.1	0	0	112.4	K156 V160 N161	K156-E158 VanDerWaalsContact C-OE2 3.27Å; K156-E158 WeakPolarHBondContact CA-OE2 3.23Å; K156-E158 WeakPolarHBondContact CB-OE1 3.28Å; K156-E158 VanDerWaalsContact CB-OE2 3.31Å; K156-E158 WeakPolarHBondContact CB-OE2 3.17Å; K156-E158 VanDerWaalsContact CD-OE1 3.23Å; K156-E158 WeakPolarHBondContact CD-OE1 3.39Å; K156-E158 WeakPolarHBondContact CE-OE1 3.47Å; K156-E158 WeakPolarHBondContact CG-OE1 3.37Å; K156-E158 IonicContact NZ-OE1 3.59Å; K156-E158 PolarHBondContact NZ-OE1 3.45Å; E158-V160 PolarHBondContact O-N 2.75Å; E158-V160 VanDerWaalsContact O-N 3.11Å; E158-N161 WeakPolarHBondContact O-CB 3.46Å; E158-N161 PolarHBondContact O-N 3.18Å
159	A	72.8	Confident	79.3	Confident	13 Å²	13	71 Å²	71	11%	0.107	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-71.3	-1.2	177.4	0	0	0	0	0	114.4	Y102 K156 R157 Q179	Y102-A159 HydrophobicContact CD1-CB 4.05Å; K156-A159 HydrophobicContact CB-CB 3.98Å; R157-A159 PolarHBondContact O-N 2.98Å; A159-Q179 HydrophobicContact CB-CG 4.03Å
160	V	71.8	Confident	77.5	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-100.7	-17.2	174.8	-171.9	0	0	0	0	112.4	Y102 F114 K115 V118 R119 R157 E158 T177	Y102-V160 HydrophobicContact CD1-CG2 3.61Å; Y102-V160 HydrophobicContact CE1-CB 4.43Å; Y102-V160 HydrophobicContact CE1-CG2 3.65Å; Y102-V160 HydrophobicContact CG-CG2 4.15Å; F114-V160 HydrophobicContact CD1-CG2 3.68Å; F114-V160 HydrophobicContact CE1-CG2 3.57Å; K115-V160 HydrophobicContact CG-CG1 4.49Å; V118-V160 HydrophobicContact CB-CB 4.06Å; V118-V160 HydrophobicContact CB-CG1 3.98Å; V118-V160 HydrophobicContact CB-CG2 4.16Å; V118-V160 HydrophobicContact CG1-CB 3.96Å; V118-V160 HydrophobicContact CG1-CG1 4.24Å; V118-V160 HydrophobicContact CG1-CG2 4.39Å; V118-V160 HydrophobicContact CG2-CG2 4.16Å; R119-V160 HydrophobicContact CG-CG1 3.7Å; R119-V160 PolarHBondContact NE-O 2.92Å; R157-V160 WeakPolarHBondContact O-CB 3.31Å; R157-V160 PolarHBondContact O-N 2.94Å; E158-V160 PolarHBondContact O-N 2.75Å; E158-V160 VanDerWaalsContact O-N 3.11Å; V160-T177 WeakPolarHBondContact O-CG2 3.22Å
161	N	69.6	Low	75.7	Confident	90 Å²	90	76 Å²	76	48%	0.481	39%	0.393	S	S	.	.	S	Bend	trans	-62.2	135.9	-176.8	-70.3	-5.1	0	0	0	110.4	E158	E158-N161 WeakPolarHBondContact O-CB 3.46Å; E158-N161 PolarHBondContact O-N 3.18Å
162	P	61.1	Low	74.1	Confident	65 Å²	65	77.1 Å²	77.1	42%	0.422	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.4	178.3	32.8	-32.7	0	0	0	110.5	W175 M176	P162-W175 HydrophobicContact CB-CB 4.37Å; P162-W175 HydrophobicContact CB-CE3 3.94Å; P162-W175 HydrophobicContact CG-CE3 4.45Å; P162-M176 CarbonylContact C-O 3.26Å; P162-M176 VanDerWaalsContact CA-O 3.3Å; P162-M176 WeakPolarHBondContact CA-O 3.38Å
163	I	66.2	Low	72.2	Confident	48 Å²	48	79 Å²	79	25%	0.246	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	149.1	166.2	52.7	172	0	0	0	109.1	M176 V178 E181	I163-M176 HydrophobicContact CD1-CG 4.27Å; I163-M176 HydrophobicContact CG1-CG 4Å; I163-M176 VanDerWaalsContact CG1-O 3.3Å; I163-M176 WeakPolarHBondContact CG1-O 3.45Å; I163-M176 PolarHBondContact N-O 2.8Å; I163-M176 PolarHBondContact O-N 3.48Å; I163-M176 VanDerWaalsContact O-N 3.13Å; I163-V178 HydrophobicContact CG2-CG2 3.91Å; I163-E181 HydrophobicContact CD1-CB 3.98Å; I163-E181 VanDerWaalsContact CD1-CD 3.4Å; I163-E181 HydrophobicContact CD1-CG 4.32Å; I163-E181 WeakPolarHBondContact CD1-OE1 3.39Å; I163-E181 WeakPolarHBondContact CD1-OE2 3.35Å
164	K	65.6	Low	70.6	Confident	121 Å²	121	76 Å²	76	53%	0.526	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	127.5	166.2	-77.1	-170.3	164.1	-158.1	0	108.5	D172 W175	K164-D172 WeakPolarHBondContact CD-OD2 3.33Å; K164-D172 WeakPolarHBondContact CE-OD2 3.49Å; K164-D172 IonicContact NZ-OD2 3.23Å; K164-D172 PolarHBondContact NZ-OD2 2.66Å; K164-W175 HydrophobicContact CB-CZ3 4.48Å; K164-W175 HydrophobicContact CD-CH2 4.42Å; K164-W175 HydrophobicContact CG-CE3 3.98Å; K164-W175 HydrophobicContact CG-CH2 3.67Å; K164-W175 HydrophobicContact CG-CZ2 4.19Å; K164-W175 HydrophobicContact CG-CZ3 3.54Å
165	W	58.8	Low	68.9	Low	52 Å²	52	82.7 Å²	82.7	20%	0.197	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	133	170.8	175.9	57.4	0	0	0	110.9	N167 E173 G174 M176	W165-N167 HydrophobicContact CH2-CB 4.07Å; W165-N167 HydrophobicContact CZ2-CB 4.16Å; W165-E173 HydrophobicContact CE3-CB 3.69Å; W165-E173 HydrophobicContact CH2-CB 4.16Å; W165-E173 WeakPolarHBondContact CH2-OE2 3.45Å; W165-E173 HydrophobicContact CZ3-CB 3.41Å; W165-E173 VanDerWaalsContact CZ3-CB 3.41Å; W165-E173 HydrophobicContact CZ3-CG 4.3Å; W165-E173 WeakPolarHBondContact CZ3-OE2 3.36Å; W165-E173 PolarHBondContact O-N 3.11Å; W165-G174 PolarHBondContact N-O 3.02Å; W165-M176 HydrophobicContact CB-CE 3.57Å; W165-M176 HydrophobicContact CB-CG 3.96Å; W165-M176 HydrophobicContact CB-SD 3.92Å; W165-M176 HydrophobicContact CD2-CE 3.64Å; W165-M176 HydrophobicContact CE3-CE 3.9Å; W165-M176 HydrophobicContact CG-CE 3.41Å; W165-M176 VanDerWaalsContact CG-CE 3.41Å; W165-M176 HydrophobicContact CG-SD 4.02Å
166	K	69.9	Low	67.5	Low	124 Å²	124	83.8 Å²	83.8	54%	0.539	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	137.5	174.6	-70.8	179.3	174.5	-175.2	0	111.3	G170 K171 D172	K166-G170 WeakPolarHBondContact CD-O 3.37Å; K166-K171 CarbonylContact C-O 3.59Å; K166-K171 VanDerWaalsContact CA-O 3.27Å; K166-K171 WeakPolarHBondContact CA-O 3.31Å; K166-D172 VanDerWaalsContact CE-OD1 3.29Å; K166-D172 WeakPolarHBondContact CE-OD1 3.36Å; K166-D172 WeakPolarHBondContact CG-OD1 3.3Å
167	N	66.1	Low	66.5	Low	24 Å²	24	78.6 Å²	78.6	13%	0.128	38%	0.384	C	S	.	.			trans	-70.9	178.1	174.1	79.2	1.8	0	0	0	111.9	W165 D169 G170 K171 E173	W165-N167 HydrophobicContact CH2-CB 4.07Å; W165-N167 HydrophobicContact CZ2-CB 4.16Å; N167-D169 PolarHBondContact O-N 3.06Å; N167-D169 VanDerWaalsContact O-N 3.14Å; N167-D169 WeakPolarHBondContact OD1-CA 3.49Å; N167-D169 WeakPolarHBondContact OD1-CB 3.2Å; N167-D169 PolarHBondContact OD1-N 3.07Å; N167-G170 PolarHBondContact O-N 2.95Å; N167-G170 PolarHBondContact OD1-N 2.94Å; N167-K171 PolarHBondContact N-O 3.25Å; N167-K171 PolarHBondContact OD1-N 3.07Å; N167-E173 HydrophobicContact CB-CG 4.04Å; N167-E173 VanDerWaalsContact CB-OE1 3.32Å; N167-E173 WeakPolarHBondContact CB-OE1 3.29Å; N167-E173 PolarHBondContact ND2-OE1 3.13Å
168	K	58.3	Low	65.4	Low	196 Å²	196	75.4 Å²	75.4	85%	0.852	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.3	179.2	-76.9	-166.9	173.9	-169.7	0	113.4	G170	K168-G170 VanDerWaalsContact C-N 3.33Å
169	D	72.1	Confident	64.7	Low	111 Å²	111	73.4 Å²	73.4	59%	0.594	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	12.4	179	-39.4	-29.1	0	0	0	112.3	N167 K171	N167-D169 PolarHBondContact O-N 3.06Å; N167-D169 VanDerWaalsContact O-N 3.14Å; N167-D169 WeakPolarHBondContact OD1-CA 3.49Å; N167-D169 WeakPolarHBondContact OD1-CB 3.2Å; N167-D169 PolarHBondContact OD1-N 3.07Å; D169-K171 VanDerWaalsContact C-N 3.28Å; D169-K171 HydrophobicContact CB-CD 4.31Å; D169-K171 HydrophobicContact CB-CG 4.49Å; D169-K171 PolarHBondContact O-N 2.87Å; D169-K171 IonicContact OD2-NZ 2.69Å; D169-K171 PolarHBondContact OD2-NZ 3.16Å
170	G	59.3	Low	64.5	Low	45 Å²	45	76.2 Å²	76.2	46%	0.464	38%	0.377	S	S	.	.	S	Bend	trans	75.5	4	178.7	0	0	0	0	0	115.9	K166 N167 K168	K166-G170 WeakPolarHBondContact CD-O 3.37Å; N167-G170 PolarHBondContact O-N 2.95Å; N167-G170 PolarHBondContact OD1-N 2.94Å; K168-G170 VanDerWaalsContact C-N 3.33Å
171	K	58.9	Low	64.2	Low	129 Å²	129	79.3 Å²	79.3	56%	0.561	39%	0.391	S	S	*	.			trans	-84.7	136.8	-176.8	-60.6	165.6	-170.3	154.7	0	111	K166 N167 D169 E173	K166-K171 CarbonylContact C-O 3.59Å; K166-K171 VanDerWaalsContact CA-O 3.27Å; K166-K171 WeakPolarHBondContact CA-O 3.31Å; N167-K171 PolarHBondContact N-O 3.25Å; N167-K171 PolarHBondContact OD1-N 3.07Å; D169-K171 VanDerWaalsContact C-N 3.28Å; D169-K171 HydrophobicContact CB-CD 4.31Å; D169-K171 HydrophobicContact CB-CG 4.49Å; D169-K171 PolarHBondContact O-N 2.87Å; D169-K171 IonicContact OD2-NZ 2.69Å; D169-K171 PolarHBondContact OD2-NZ 3.16Å; K171-E173 PolarHBondContact O-N 3.4Å; K171-E173 VanDerWaalsContact O-N 3.16Å
172	D	64.4	Low	64.1	Low	83 Å²	83	83.6 Å²	83.6	44%	0.444	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	109.9	175.2	-78.7	9.3	0	0	0	110.5	K164 K166	K164-D172 WeakPolarHBondContact CD-OD2 3.33Å; K164-D172 WeakPolarHBondContact CE-OD2 3.49Å; K164-D172 IonicContact NZ-OD2 3.23Å; K164-D172 PolarHBondContact NZ-OD2 2.66Å; K166-D172 VanDerWaalsContact CE-OD1 3.29Å; K166-D172 WeakPolarHBondContact CE-OD1 3.36Å; K166-D172 WeakPolarHBondContact CG-OD1 3.3Å
173	E	57.4	Low	64.2	Low	117 Å²	117	85.8 Å²	85.8	55%	0.547	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	21.5	175.2	-82.1	-172.5	-161.9	0	0	112.5	W165 N167 K171	W165-E173 HydrophobicContact CE3-CB 3.69Å; W165-E173 HydrophobicContact CH2-CB 4.16Å; W165-E173 WeakPolarHBondContact CH2-OE2 3.45Å; W165-E173 HydrophobicContact CZ3-CB 3.41Å; W165-E173 VanDerWaalsContact CZ3-CB 3.41Å; W165-E173 HydrophobicContact CZ3-CG 4.3Å; W165-E173 WeakPolarHBondContact CZ3-OE2 3.36Å; W165-E173 PolarHBondContact O-N 3.11Å; N167-E173 HydrophobicContact CB-CG 4.04Å; N167-E173 VanDerWaalsContact CB-OE1 3.32Å; N167-E173 WeakPolarHBondContact CB-OE1 3.29Å; N167-E173 PolarHBondContact ND2-OE1 3.13Å; K171-E173 PolarHBondContact O-N 3.4Å; K171-E173 VanDerWaalsContact O-N 3.16Å
174	G	61.7	Low	64.2	Low	30 Å²	30	87 Å²	87	31%	0.309	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	112.5	-156.1	164.7	0	0	0	0	0	115.3	W165	W165-G174 PolarHBondContact N-O 3.02Å
175	W	58.9	Low	64	Low	179 Å²	179	84.4 Å²	84.4	68%	0.678	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	121.7	-169.4	-62.4	101.6	0	0	0	112	P162 K164	P162-W175 HydrophobicContact CB-CB 4.37Å; P162-W175 HydrophobicContact CB-CE3 3.94Å; P162-W175 HydrophobicContact CG-CE3 4.45Å; K164-W175 HydrophobicContact CB-CZ3 4.48Å; K164-W175 HydrophobicContact CD-CH2 4.42Å; K164-W175 HydrophobicContact CG-CE3 3.98Å; K164-W175 HydrophobicContact CG-CH2 3.67Å; K164-W175 HydrophobicContact CG-CZ2 4.19Å; K164-W175 HydrophobicContact CG-CZ3 3.54Å
176	M	67.2	Low	63.9	Low	28 Å²	28	90.4 Å²	90.4	14%	0.138	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	166.1	171.1	66.1	176.7	55.6	0	0	111	P162 I163 W165 E180 E181	P162-M176 CarbonylContact C-O 3.26Å; P162-M176 VanDerWaalsContact CA-O 3.3Å; P162-M176 WeakPolarHBondContact CA-O 3.38Å; I163-M176 HydrophobicContact CD1-CG 4.27Å; I163-M176 HydrophobicContact CG1-CG 4Å; I163-M176 VanDerWaalsContact CG1-O 3.3Å; I163-M176 WeakPolarHBondContact CG1-O 3.45Å; I163-M176 PolarHBondContact N-O 2.8Å; I163-M176 PolarHBondContact O-N 3.48Å; I163-M176 VanDerWaalsContact O-N 3.13Å; W165-M176 HydrophobicContact CB-CE 3.57Å; W165-M176 HydrophobicContact CB-CG 3.96Å; W165-M176 HydrophobicContact CB-SD 3.92Å; W165-M176 HydrophobicContact CD2-CE 3.64Å; W165-M176 HydrophobicContact CE3-CE 3.9Å; W165-M176 HydrophobicContact CG-CE 3.41Å; W165-M176 VanDerWaalsContact CG-CE 3.41Å; W165-M176 HydrophobicContact CG-SD 4.02Å; M176-E180 HydrophobicContact CB-CB 4.25Å; M176-E181 HydrophobicContact SD-CB 3.83Å
177	T	68.6	Low	63.3	Low	1 Å²	1	89.9 Å²	89.9	1%	0.006	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	156.5	168.5	55.3	0	0	0	0	112.2	V160 Q179 E180 E181	V160-T177 WeakPolarHBondContact O-CG2 3.22Å; T177-Q179 PolarHBondContact O-N 2.84Å; T177-E180 WeakPolarHBondContact CB-OE2 3.49Å; T177-E180 WeakPolarHBondContact CG2-OE2 3.16Å; T177-E180 PolarHBondContact N-OE2 3.23Å; T177-E180 PolarHBondContact O-N 3.2Å; T177-E180 WeakPolarHBondContact OG1-CB 3.3Å; T177-E180 WeakPolarHBondContact OG1-CG 3.19Å; T177-E180 PolarHBondContact OG1-N 3.28Å; T177-E180 PolarHBondContact OG1-OE2 3.15Å; T177-E181 PolarHBondContact O-N 2.75Å
178	V	65.6	Low	62.9	Low	35 Å²	35	94.3 Å²	94.3	21%	0.212	44%	0.436	C	S	.	.	H	α-helix	trans	-52	-25.3	165.6	-174.5	0	0	0	0	112.4	I163 R182	I163-V178 HydrophobicContact CG2-CG2 3.91Å; V178-R182 VanDerWaalsContact O-CB 3.3Å; V178-R182 WeakPolarHBondContact O-CB 3.49Å; V178-R182 WeakPolarHBondContact O-CD 3.47Å; V178-R182 WeakPolarHBondContact O-CG 3.42Å; V178-R182 PolarHBondContact O-N 3.05Å; V178-R182 VanDerWaalsContact O-N 3.13Å
179	Q	64.9	Low	62.4	Low	50 Å²	50	90.2 Å²	90.2	23%	0.234	42%	0.42	C	S	.	.	H	α-helix	trans	-76.6	-43.8	171.1	-81.9	-128.7	-76.7	0	0	114	Y102 A159 T177 E181 R182 Q183	Y102-Q179 HydrophobicContact CD1-CG 4.14Å; Y102-Q179 HydrophobicContact CE1-CG 4.21Å; Y102-Q179 VanDerWaalsContact N-CD 3.34Å; A159-Q179 HydrophobicContact CB-CG 4.03Å; T177-Q179 PolarHBondContact O-N 2.84Å; Q179-E181 VanDerWaalsContact C-N 3.29Å; Q179-R182 PolarHBondContact O-N 2.81Å; Q179-Q183 WeakPolarHBondContact O-CB 3.42Å; Q179-Q183 PolarHBondContact O-N 3.44Å
180	E	67.8	Low	61.1	Low	73 Å²	73	88.1 Å²	88.1	34%	0.341	43%	0.425	S	S	.	.	H	α-helix	trans	-66.7	-35	179.4	-73.7	145.7	171.4	0	0	109.9	K115 M176 T177 R184	K115-E180 IonicContact NZ-OE1 3.58Å; K115-E180 PolarHBondContact NZ-OE1 3.39Å; M176-E180 HydrophobicContact CB-CB 4.25Å; T177-E180 WeakPolarHBondContact CB-OE2 3.49Å; T177-E180 WeakPolarHBondContact CG2-OE2 3.16Å; T177-E180 PolarHBondContact N-OE2 3.23Å; T177-E180 PolarHBondContact O-N 3.2Å; T177-E180 WeakPolarHBondContact OG1-CB 3.3Å; T177-E180 WeakPolarHBondContact OG1-CG 3.19Å; T177-E180 PolarHBondContact OG1-N 3.28Å; T177-E180 PolarHBondContact OG1-OE2 3.15Å; E180-R184 WeakPolarHBondContact O-CB 3.3Å; E180-R184 PolarHBondContact O-N 3.09Å; E180-R184 VanDerWaalsContact O-N 3.07Å
181	E	66.3	Low	60.4	Low	64 Å²	64	94.3 Å²	94.3	30%	0.299	44%	0.441	S	S	.	.	H	α-helix	trans	-64.6	-53.7	168.3	-179.9	178.8	-115.8	0	0	112.9	I163 M176 T177 Q179 Q183 R184 N185	I163-E181 HydrophobicContact CD1-CB 3.98Å; I163-E181 VanDerWaalsContact CD1-CD 3.4Å; I163-E181 HydrophobicContact CD1-CG 4.32Å; I163-E181 WeakPolarHBondContact CD1-OE1 3.39Å; I163-E181 WeakPolarHBondContact CD1-OE2 3.35Å; M176-E181 HydrophobicContact SD-CB 3.83Å; T177-E181 PolarHBondContact O-N 2.75Å; Q179-E181 VanDerWaalsContact C-N 3.29Å; E181-Q183 PolarHBondContact O-N 2.88Å; E181-R184 CarbonylContact O-C 3.58Å; E181-R184 WeakPolarHBondContact O-CB 3.5Å; E181-R184 PolarHBondContact O-N 2.84Å; E181-N185 PolarHBondContact O-N 2.67Å
182	R	66.2	Low	59.8	Low	181 Å²	181	94.4 Å²	94.4	68%	0.683	45%	0.447	S	S	*	.	H	α-helix	trans	-63	-27.9	179.3	-75.7	175	176.6	-178.7	-2.4	113.3	V178 Q179 R186	V178-R182 VanDerWaalsContact O-CB 3.3Å; V178-R182 WeakPolarHBondContact O-CB 3.49Å; V178-R182 WeakPolarHBondContact O-CD 3.47Å; V178-R182 WeakPolarHBondContact O-CG 3.42Å; V178-R182 PolarHBondContact O-N 3.05Å; V178-R182 VanDerWaalsContact O-N 3.13Å; Q179-R182 PolarHBondContact O-N 2.81Å; R182-R186 VanDerWaalsContact O-CB 3.31Å; R182-R186 WeakPolarHBondContact O-CB 3.26Å; R182-R186 PolarHBondContact O-N 2.93Å; R182-R186 VanDerWaalsContact O-N 3.16Å
183	Q	64.6	Low	58.8	Low	110 Å²	110	99.7 Å²	99.7	51%	0.514	47%	0.469	S	S	.	.	H	α-helix	trans	-70.1	-45.7	170.2	-179.2	173.8	-24.7	0	0	110.9	Q179 E181 N185 R186 E187	Q179-Q183 WeakPolarHBondContact O-CB 3.42Å; Q179-Q183 PolarHBondContact O-N 3.44Å; E181-Q183 PolarHBondContact O-N 2.88Å; Q183-N185 PolarHBondContact O-N 3.46Å; Q183-R186 CarbonylContact O-C 3.55Å; Q183-R186 WeakPolarHBondContact O-CB 3.44Å; Q183-R186 PolarHBondContact O-N 3.15Å; Q183-E187 HydrophobicContact CG-CG 4.46Å; Q183-E187 VanDerWaalsContact CG-OE1 3.29Å; Q183-E187 WeakPolarHBondContact CG-OE1 3.49Å; Q183-E187 PolarHBondContact NE2-OE1 3.13Å; Q183-E187 WeakPolarHBondContact O-CG 3.35Å; Q183-E187 PolarHBondContact O-N 2.82Å
184	R	65.8	Low	57.8	Low	73 Å²	73	103.1 Å²	103.1	28%	0.275	48%	0.483	S	S	.	.	H	α-helix	trans	-65.4	-35.7	178.7	-178.2	175.7	177.8	-132.8	20.5	113.6	E180 E181 E187 R188	E180-R184 WeakPolarHBondContact O-CB 3.3Å; E180-R184 PolarHBondContact O-N 3.09Å; E180-R184 VanDerWaalsContact O-N 3.07Å; E181-R184 CarbonylContact O-C 3.58Å; E181-R184 WeakPolarHBondContact O-CB 3.5Å; E181-R184 PolarHBondContact O-N 2.84Å; R184-E187 PolarHBondContact O-N 3.43Å; R184-R188 WeakPolarHBondContact O-CG 3.39Å; R184-R188 PolarHBondContact O-N 3.09Å; R184-R188 VanDerWaalsContact O-N 3.09Å
185	N	60.4	Low	56.9	Low	68 Å²	68	106.1 Å²	106.1	36%	0.364	50%	0.499	S	S	.	.	H	α-helix	trans	-67	-44.5	171.1	-79.2	4.7	0	0	0	110.6	E181 Q183 E187 R188 E189	E181-N185 PolarHBondContact O-N 2.67Å; Q183-N185 PolarHBondContact O-N 3.46Å; N185-E187 VanDerWaalsContact C-N 3.26Å; N185-E187 PolarHBondContact O-N 3.22Å; N185-R188 CarbonylContact O-C 3.56Å; N185-R188 WeakPolarHBondContact O-CA 3.48Å; N185-R188 WeakPolarHBondContact O-CB 3.28Å; N185-R188 PolarHBondContact O-N 2.78Å; N185-E189 VanDerWaalsContact O-CG 3.26Å; N185-E189 WeakPolarHBondContact O-CG 3.49Å; N185-E189 PolarHBondContact O-N 3.06Å
186	R	58.3	Low	56.1	Low	178 Å²	178	102.6 Å²	102.6	67%	0.672	50%	0.502	S	S	*	.	H	α-helix	trans	-59.2	-33.4	172.3	173	167.8	-74.4	-97	-12.5	114.1	R182 Q183 E189 G190	R182-R186 VanDerWaalsContact O-CB 3.31Å; R182-R186 WeakPolarHBondContact O-CB 3.26Å; R182-R186 PolarHBondContact O-N 2.93Å; R182-R186 VanDerWaalsContact O-N 3.16Å; Q183-R186 CarbonylContact O-C 3.55Å; Q183-R186 WeakPolarHBondContact O-CB 3.44Å; Q183-R186 PolarHBondContact O-N 3.15Å; R186-E189 WeakPolarHBondContact CA-OE2 3.47Å; R186-G190 PolarHBondContact O-N 3.02Å; R186-G190 VanDerWaalsContact O-N 3.09Å
187	E	56.9	Low	55	Low	112 Å²	112	104.5 Å²	104.5	52%	0.523	53%	0.528	S	S	.	.	H	α-helix	trans	-72.7	-29.7	175.1	-74.8	164.6	-179.3	0	0	112	Q183 R184 N185	Q183-E187 HydrophobicContact CG-CG 4.46Å; Q183-E187 VanDerWaalsContact CG-OE1 3.29Å; Q183-E187 WeakPolarHBondContact CG-OE1 3.49Å; Q183-E187 PolarHBondContact NE2-OE1 3.13Å; Q183-E187 WeakPolarHBondContact O-CG 3.35Å; Q183-E187 PolarHBondContact O-N 2.82Å; R184-E187 PolarHBondContact O-N 3.43Å; N185-E187 VanDerWaalsContact C-N 3.26Å; N185-E187 PolarHBondContact O-N 3.22Å
188	R	58.3	Low	54.2	Low	117 Å²	117	109.4 Å²	109.4	44%	0.442	56%	0.558	S	S	.	*	H	α-helix	trans	-75.4	-42	168.7	-71.9	172.4	166.1	-178.2	-4.9	113.1	R184 N185 G190 E191	R184-R188 WeakPolarHBondContact O-CG 3.39Å; R184-R188 PolarHBondContact O-N 3.09Å; R184-R188 VanDerWaalsContact O-N 3.09Å; N185-R188 CarbonylContact O-C 3.56Å; N185-R188 WeakPolarHBondContact O-CA 3.48Å; N185-R188 WeakPolarHBondContact O-CB 3.28Å; N185-R188 PolarHBondContact O-N 2.78Å; R188-G190 PolarHBondContact O-N 3.33Å; R188-E191 PolarHBondContact O-N 2.91Å
189	E	46.3	Very low	53.4	Low	111 Å²	111	111.2 Å²	111.2	52%	0.519	57%	0.567	S	S	.	*	H	α-helix	trans	-57.4	-36.8	175.6	-71.5	156.7	-154.7	0	0	110.9	N185 R186 E191 L192	N185-E189 VanDerWaalsContact O-CG 3.26Å; N185-E189 WeakPolarHBondContact O-CG 3.49Å; N185-E189 PolarHBondContact O-N 3.06Å; R186-E189 WeakPolarHBondContact CA-OE2 3.47Å; E189-E191 PolarHBondContact O-N 3.27Å; E189-L192 PolarHBondContact O-N 2.93Å; E189-L192 VanDerWaalsContact O-N 3.15Å
190	G	45	Very low	53.2	Low	67 Å²	67	115.6 Å²	115.6	69%	0.691	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-12.1	179.8	0	0	0	0	0	116.1	R186 R188	R186-G190 PolarHBondContact O-N 3.02Å; R186-G190 VanDerWaalsContact O-N 3.09Å; R188-G190 PolarHBondContact O-N 3.33Å
191	E	44.3	Very low	53.4	Low	174 Å²	174	117.5 Å²	117.5	81%	0.813	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	2.6	174.6	-63.7	-172.2	146.5	0	0	112.6	R188 E189	R188-E191 PolarHBondContact O-N 2.91Å; E189-E191 PolarHBondContact O-N 3.27Å
192	L	46.3	Very low	54.6	Low	131 Å²	131	114.5 Å²	114.5	69%	0.686	59%	0.587	S	S	*	*			trans	-126.8	41.6	-168.6	-73.4	172.3	0	0	0	114.4	E189 F194	E189-L192 PolarHBondContact O-N 2.93Å; E189-L192 VanDerWaalsContact O-N 3.15Å; L192-F194 PolarHBondContact O-N 2.96Å
193	E	44.4	Very low	55.9	Low	195 Å²	195	106.6 Å²	106.6	91%	0.911	56%	0.559	S	S	*	*			trans	-73.3	48.8	161.6	-73.4	-162.5	135.6	0	0	112.4
194	F	36.3	Very low	57.3	Low	188 Å²	188	101.6 Å²	101.6	83%	0.825	54%	0.536	S	S	*	.	S	Bend	trans	-152.2	94.9	167	-150.1	-101.8	0	0	0	114.6	L192	L192-F194 PolarHBondContact O-N 2.96Å
195	S	42.9	Very low	58.6	Low	93 Å²	93	103.1 Å²	103.1	65%	0.65	55%	0.546	S	S	*	.	S	Bend	trans	75.5	144.3	155.6	-162.9	0	0	0	0	121.4	G197	S195-G197 PolarHBondContact O-N 3.04Å
196	S	42.7	Very low	60.3	Low	105 Å²	105	105 Å²	105	73%	0.734	55%	0.551	S	S	*	*			trans	60.5	-1	147.3	45.8	0	0	0	0	122.4	V198	S196-V198 PolarHBondContact O-N 3.44Å
197	G	43.5	Very low	62.1	Low	68 Å²	68	96.6 Å²	96.6	70%	0.701	52%	0.519	S	S	*	.			trans	-70.2	-19.9	-171.3	0	0	0	0	0	119.2	S195	S195-G197 PolarHBondContact O-N 3.04Å
198	V	50.6	Low	63.9	Low	105 Å²	105	93.7 Å²	93.7	64%	0.636	51%	0.507	S	S	*	.	S	Bend	trans	-98.2	-29	-165.2	-174.7	0	0	0	0	114.4	S196 D200	S196-V198 PolarHBondContact O-N 3.44Å; V198-D200 PolarHBondContact O-N 3.07Å
199	N	50.2	Low	65.7	Low	73 Å²	73	94.1 Å²	94.1	39%	0.39	51%	0.514	S	S	.	.	S	Bend	trans	-79.2	-15.4	-175.5	-75.3	13	0	0	0	114	E201 M202 P203	N199-E201 PolarHBondContact O-N 3.47Å; N199-M202 CarbonylContact O-C 3.41Å; N199-M202 PolarHBondContact O-N 3.36Å; N199-P203 WeakPolarHBondContact O-CA 3.42Å
200	D	60.4	Low	68	Low	142 Å²	142	88.9 Å²	88.9	76%	0.759	49%	0.49	S	S	*	.	S	Bend	trans	-73.3	-29.1	-166.9	-156.3	43	0	0	0	113.4	V198	V198-D200 PolarHBondContact O-N 3.07Å
201	E	72.3	Confident	70.2	Confident	112 Å²	112	85.8 Å²	85.8	52%	0.523	46%	0.457	S	S	.	.	S	Bend	trans	-77.9	-34.1	175.9	-65.5	-166.7	100.2	0	0	113.2	N199 P203 H258 K377	N199-E201 PolarHBondContact O-N 3.47Å; E201-P203 VanDerWaalsContact C-CD 3.49Å; E201-H258 PolarHBondContact O-CD2 2.94Å; E201-H258 PolarHBondContact O-NE2 2.85Å; E201-H258 VanDerWaalsContact O-NE2 3.1Å; E201-K377 HydrophobicContact CB-CD 4.16Å; E201-K377 VanDerWaalsContact CD-CE 3.42Å; E201-K377 WeakPolarHBondContact OE1-CE 3.37Å; E201-K377 IonicContact OE1-NZ 2.69Å; E201-K377 PolarHBondContact OE1-NZ 3.41Å; E201-K377 WeakPolarHBondContact OE2-CE 3.47Å; E201-K377 IonicContact OE2-NZ 2.71Å; E201-K377 PolarHBondContact OE2-NZ 2.82Å
202	M	90.9	Very high	72.4	Confident	1 Å²	1	82.6 Å²	82.6	1%	0.005	44%	0.444	C	S	.	.	S	Bend	trans	-133.1	67.7	-178.7	-171.9	59.1	68.4	0	0	110.8	N199 V204 I207 P257 F358 L374 K377 V378 S381	N199-M202 CarbonylContact O-C 3.41Å; N199-M202 PolarHBondContact O-N 3.36Å; M202-V204 PolarHBondContact O-N 3.39Å; M202-I207 HydrophobicContact CG-CD1 4.33Å; M202-I207 HydrophobicContact SD-CD1 4Å; M202-P257 HydrophobicContact CE-CB 4.18Å; M202-P257 HydrophobicContact SD-CB 3.82Å; M202-P257 HydrophobicContact SD-CG 3.9Å; M202-F358 HydrophobicContact CE-CE2 4.1Å; M202-L374 HydrophobicContact CE-CD2 4.33Å; M202-K377 HydrophobicContact CB-CB 3.84Å; M202-K377 HydrophobicContact CE-CB 4.49Å; M202-K377 HydrophobicContact CG-CB 4.21Å; M202-V378 HydrophobicContact CE-CG2 3.96Å; M202-V378 HydrophobicContact CG-CB 4.48Å; M202-V378 HydrophobicContact CG-CG2 3.75Å; M202-V378 HydrophobicContact SD-CG2 3.76Å; M202-S381 WeakPolarHBondContact O-CB 3.33Å; M202-S381 PolarHBondContact O-OG 3.22Å
203	P	92.6	Very high	74.3	Confident	15 Å²	15	78.1 Å²	78.1	10%	0.097	43%	0.425	C	S	.	.			trans	-69.8	126	-176.3	27.6	-35.5	0	0	0	111.1	N199 E201 E205 K206 I207 P257	N199-P203 WeakPolarHBondContact O-CA 3.42Å; E201-P203 VanDerWaalsContact C-CD 3.49Å; P203-E205 WeakPolarHBondContact CB-OE2 3.39Å; P203-E205 PolarHBondContact O-N 3.45Å; P203-K206 HydrophobicContact CG-CB 4.2Å; P203-K206 HydrophobicContact CG-CD 3.69Å; P203-K206 HydrophobicContact CG-CG 3.84Å; P203-K206 PolarHBondContact O-N 2.95Å; P203-I207 PolarHBondContact O-N 3.02Å; P203-P257 HydrophobicContact CG-CG 4.35Å
204	V	94.6	Very high	75.9	Confident	6 Å²	6	69.3 Å²	69.3	4%	0.036	39%	0.385	C	S	.	.	H	α-helix	trans	-67.1	-20.7	179.8	-61.2	0	0	0	0	112.3	M202 I207 L208 T347 Y385	M202-V204 PolarHBondContact O-N 3.39Å; V204-I207 PolarHBondContact O-N 2.77Å; V204-L208 PolarHBondContact O-N 3.27Å; V204-T347 HydrophobicContact CB-CG2 3.71Å; V204-T347 HydrophobicContact CG2-CG2 4.24Å; V204-Y385 HydrophobicContact CB-CD2 4.44Å; V204-Y385 HydrophobicContact CG2-CD2 3.8Å; V204-Y385 HydrophobicContact CG2-CE2 4.29Å
205	E	94	Very high	77.5	Confident	104 Å²	104	61.8 Å²	61.8	49%	0.486	35%	0.353	S	S	.	.	H	α-helix	trans	-63.2	-47.9	174.6	-62.6	69.1	-153.6	0	0	110.7	P203 I207 L208 E209	P203-E205 WeakPolarHBondContact CB-OE2 3.39Å; P203-E205 PolarHBondContact O-N 3.45Å; E205-I207 VanDerWaalsContact C-N 3.3Å; E205-I207 PolarHBondContact O-N 2.93Å; E205-L208 WeakPolarHBondContact O-CB 3.37Å; E205-L208 PolarHBondContact O-N 3.29Å; E205-E209 WeakPolarHBondContact O-CG 3.18Å; E205-E209 PolarHBondContact O-N 3.46Å
206	K	94.9	Very high	77.7	Confident	109 Å²	109	63.6 Å²	63.6	47%	0.474	35%	0.353	S	S	.	.	H	α-helix	trans	-66.4	-33.1	175.9	-66.5	-175	-172.6	166.7	0	112.1	P203 E209 A210 P257	P203-K206 HydrophobicContact CG-CB 4.2Å; P203-K206 HydrophobicContact CG-CD 3.69Å; P203-K206 HydrophobicContact CG-CG 3.84Å; P203-K206 PolarHBondContact O-N 2.95Å; K206-E209 PolarHBondContact O-N 3.46Å; K206-A210 WeakPolarHBondContact O-CB 3.45Å; K206-A210 PolarHBondContact O-N 3.43Å; K206-P257 HydrophobicContact CB-CG 3.92Å; K206-P257 HydrophobicContact CD-CG 4.19Å
207	I	96.3	Very high	78	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-65.6	-41.9	174.1	-63.3	175.7	0	0	0	110.4	M202 P203 V204 E205 A210 E211 I256	M202-I207 HydrophobicContact CG-CD1 4.33Å; M202-I207 HydrophobicContact SD-CD1 4Å; P203-I207 PolarHBondContact O-N 3.02Å; V204-I207 PolarHBondContact O-N 2.77Å; E205-I207 VanDerWaalsContact C-N 3.3Å; E205-I207 PolarHBondContact O-N 2.93Å; I207-A210 PolarHBondContact O-N 3.08Å; I207-E211 PolarHBondContact O-N 3.49Å; I207-I256 HydrophobicContact CG1-CD1 4.46Å; I207-I256 HydrophobicContact CG2-CD1 4.44Å
208	L	95.9	Very high	78.4	Confident	52 Å²	52	62.5 Å²	62.5	27%	0.272	32%	0.317	S	S	.	.	H	α-helix	trans	-66	-42.1	174	177.1	61.9	0	0	0	112.3	V204 E205 A210 E211 M212 K346 T347	V204-L208 PolarHBondContact O-N 3.27Å; E205-L208 WeakPolarHBondContact O-CB 3.37Å; E205-L208 PolarHBondContact O-N 3.29Å; L208-A210 VanDerWaalsContact C-N 3.3Å; L208-A210 PolarHBondContact O-N 3.3Å; L208-E211 PolarHBondContact O-N 2.96Å; L208-M212 HydrophobicContact CD1-CG 4.19Å; L208-M212 HydrophobicContact CD1-SD 4.03Å; L208-M212 HydrophobicContact CG-SD 3.99Å; L208-M212 WeakPolarHBondContact O-CG 3.15Å; L208-M212 PolarHBondContact O-N 2.94Å; L208-K346 HydrophobicContact CD1-CB 3.69Å; L208-T347 HydrophobicContact CB-CG2 4.37Å
209	E	94.3	Very high	78	Confident	126 Å²	126	63.2 Å²	63.2	59%	0.589	32%	0.317	S	S	*	.	H	α-helix	trans	-59	-40.1	173.4	-72.9	170.9	-178.2	0	0	111.8	E205 K206 M212 A213	E205-E209 WeakPolarHBondContact O-CG 3.18Å; E205-E209 PolarHBondContact O-N 3.46Å; K206-E209 PolarHBondContact O-N 3.46Å; E209-M212 PolarHBondContact O-N 3.19Å; E209-A213 VanDerWaalsContact O-CB 3.23Å; E209-A213 WeakPolarHBondContact O-CB 3.21Å; E209-A213 PolarHBondContact O-N 2.95Å
210	A	94.8	Very high	77.3	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.008	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-41.3	176.7	0	0	0	0	0	112.8	K206 I207 L208 V214 R255 I256	K206-A210 WeakPolarHBondContact O-CB 3.45Å; K206-A210 PolarHBondContact O-N 3.43Å; I207-A210 PolarHBondContact O-N 3.08Å; L208-A210 VanDerWaalsContact C-N 3.3Å; L208-A210 PolarHBondContact O-N 3.3Å; A210-V214 WeakPolarHBondContact O-CG2 3.4Å; A210-R255 HydrophobicContact CB-CB 3.62Å; A210-I256 HydrophobicContact CB-CD1 3.81Å
211	E	92.4	Very high	76.5	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.009	33%	0.33	C	S	.	.	H	α-helix	trans	-63.4	-51.3	171.9	-65	-66.6	136.8	0	0	111.2	I207 L208 A213 V214 D215 W252 L349 G350 R353	I207-E211 PolarHBondContact O-N 3.49Å; L208-E211 PolarHBondContact O-N 2.96Å; E211-A213 PolarHBondContact O-N 2.66Å; E211-V214 PolarHBondContact O-N 2.79Å; E211-V214 VanDerWaalsContact O-N 3.11Å; E211-D215 PolarHBondContact O-N 3.23Å; E211-W252 PolarHBondContact OE1-NE1 2.91Å; E211-L349 WeakPolarHBondContact OE2-CD2 3.48Å; E211-G350 VanDerWaalsContact OE1-CA 3.25Å; E211-G350 WeakPolarHBondContact OE1-CA 3.44Å; E211-R353 WeakPolarHBondContact OE1-CD 3.37Å; E211-R353 IonicContact OE1-CZ 3.35Å; E211-R353 IonicContact OE1-NE 2.7Å; E211-R353 IonicContact OE1-NH1 2.64Å; E211-R353 PolarHBondContact OE1-NH1 2.92Å; E211-R353 IonicContact OE2-CZ 2.69Å; E211-R353 IonicContact OE2-NH1 2.69Å; E211-R353 PolarHBondContact OE2-NH1 3.46Å
212	M	89.6	Confident	75	Confident	107 Å²	107	64.8 Å²	64.8	53%	0.527	33%	0.328	S	S	.	.	H	α-helix	trans	-64.7	-35.3	-175	-71.3	-178.5	62.4	0	0	113.4	L208 E209 V214	L208-M212 HydrophobicContact CD1-CG 4.19Å; L208-M212 HydrophobicContact CD1-SD 4.03Å; L208-M212 HydrophobicContact CG-SD 3.99Å; L208-M212 WeakPolarHBondContact O-CG 3.15Å; L208-M212 PolarHBondContact O-N 2.94Å; E209-M212 PolarHBondContact O-N 3.19Å; M212-V214 PolarHBondContact O-N 3.04Å
213	A	86.9	Confident	72.2	Confident	36 Å²	36	71.6 Å²	71.6	30%	0.298	37%	0.365	S	S	.	.	H	α-helix	trans	-69	-17	177.1	0	0	0	0	0	113.7	E209 E211	E209-A213 VanDerWaalsContact O-CB 3.23Å; E209-A213 WeakPolarHBondContact O-CB 3.21Å; E209-A213 PolarHBondContact O-N 2.95Å; E211-A213 PolarHBondContact O-N 2.66Å
214	V	78.5	Confident	69.6	Low	10 Å²	10	82 Å²	82	6%	0.061	40%	0.402	C	S	.	.	H	α-helix	trans	-97.6	-44.4	-175.2	171.2	0	0	0	0	110.8	A210 E211 M212 M216 R217 A248 W252	A210-V214 WeakPolarHBondContact O-CG2 3.4Å; E211-V214 PolarHBondContact O-N 2.79Å; E211-V214 VanDerWaalsContact O-N 3.11Å; M212-V214 PolarHBondContact O-N 3.04Å; V214-M216 VanDerWaalsContact C-N 3.31Å; V214-M216 PolarHBondContact O-N 3.26Å; V214-R217 PolarHBondContact O-N 3.21Å; V214-R217 VanDerWaalsContact O-N 3.13Å; V214-A248 HydrophobicContact CG1-CB 4.18Å; V214-W252 HydrophobicContact CG2-CB 3.71Å; V214-W252 HydrophobicContact CG2-CG 4.37Å
215	D	68.4	Low	66.7	Low	30 Å²	30	84.1 Å²	84.1	16%	0.16	43%	0.425	C	S	.	.	H	α-helix	trans	-54	-47.6	173.6	-77	-35.2	0	0	0	111.9	E211 R217 V218 K346	E211-D215 PolarHBondContact O-N 3.23Å; D215-R217 PolarHBondContact O-N 3.47Å; D215-V218 WeakPolarHBondContact O-CB 3.2Å; D215-V218 PolarHBondContact O-N 2.86Å; D215-K346 WeakPolarHBondContact OD2-CE 3.26Å; D215-K346 IonicContact OD2-NZ 2.7Å; D215-K346 PolarHBondContact OD2-NZ 3.18Å
216	M	48.3	Very low	64.2	Low	131 Å²	131	85.4 Å²	85.4	65%	0.645	45%	0.446	S	S	*	.	H	α-helix	trans	-67	-9.8	-176.7	-170.4	152.4	54.6	0	0	114	V214 L220	V214-M216 VanDerWaalsContact C-N 3.31Å; V214-M216 PolarHBondContact O-N 3.26Å; M216-L220 WeakPolarHBondContact O-CD1 3.48Å; M216-L220 WeakPolarHBondContact O-CG 3.37Å
217	R	49.7	Very low	61.5	Low	105 Å²	105	84.4 Å²	84.4	40%	0.396	46%	0.458	S	S	.	.	H	α-helix	trans	-86.2	-24.6	169.1	-74	177.5	165.8	176.8	-6	112.7	V214 D215 H221 E251	V214-R217 PolarHBondContact O-N 3.21Å; V214-R217 VanDerWaalsContact O-N 3.13Å; D215-R217 PolarHBondContact O-N 3.47Å; R217-H221 PolarHBondContact O-ND1 3.41Å; R217-E251 IonicContact CZ-OE2 3.68Å; R217-E251 IonicContact NH1-OE2 2.81Å; R217-E251 PolarHBondContact NH1-OE2 2.82Å; R217-E251 IonicContact NH2-OE2 3.62Å
218	V	50.4	Low	58.5	Low	45 Å²	45	87.7 Å²	87.7	27%	0.273	49%	0.492	S	S	.	.	H	α-helix	trans	-72.2	-44	-179.2	-173.2	0	0	0	0	110.7	D215 L220 H221	D215-V218 WeakPolarHBondContact O-CB 3.2Å; D215-V218 PolarHBondContact O-N 2.86Å; V218-L220 PolarHBondContact O-N 2.92Å; V218-H221 PolarHBondContact O-N 2.84Å
219	D	42.2	Very low	55.9	Low	120 Å²	120	92.1 Å²	92.1	64%	0.642	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.3	179.5	-65.5	-44.1	0	0	0	113.9
220	L	36.9	Very low	53.4	Low	137 Å²	137	88.8 Å²	88.8	72%	0.717	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-5.9	-176.7	-67.8	177	0	0	0	115	M216 V218	M216-L220 WeakPolarHBondContact O-CD1 3.48Å; M216-L220 WeakPolarHBondContact O-CG 3.37Å; V218-L220 PolarHBondContact O-N 2.92Å
221	H	41.7	Very low	51	Low	152 Å²	152	92.9 Å²	92.9	70%	0.704	53%	0.533	S	S	*	.			trans	-117.6	11.6	-175.4	-68.9	87.3	0	0	0	114.4	R217 V218 D223	R217-H221 PolarHBondContact O-ND1 3.41Å; V218-H221 PolarHBondContact O-N 2.84Å; H221-D223 PolarHBondContact O-N 3.33Å
222	S	40.9	Very low	48.7	Very low	71 Å²	71	100.4 Å²	100.4	50%	0.497	57%	0.568	S	S	.	*			trans	-77.2	78.9	166.5	-177.7	0	0	0	0	109.2	D303	S222-D303 PolarHBondContact OG-OD1 3.16Å
223	D	32.1	Very low	47.2	Very low	145 Å²	145	98.2 Å²	98.2	78%	0.775	56%	0.558	S	S	*	*			trans	-78.1	146.1	167.2	-170.3	18.9	0	0	0	110.2	H221 G225	H221-D223 PolarHBondContact O-N 3.33Å; D223-G225 VanDerWaalsContact C-N 3.27Å; D223-G225 PolarHBondContact O-N 2.88Å
224	R	39.1	Very low	45.8	Very low	232 Å²	232	98.8 Å²	98.8	88%	0.875	56%	0.563	S	S	*	*			trans	-85.3	59.1	-155.4	-165.9	174.4	168.8	-83	0.6	113
225	G	32.4	Very low	45.1	Very low	51 Å²	51	99.8 Å²	99.8	53%	0.526	57%	0.569	S	S	.	*			trans	-73.8	129.7	177	0	0	0	0	0	113.2	D223	D223-G225 VanDerWaalsContact C-N 3.27Å; D223-G225 PolarHBondContact O-N 2.88Å
226	S	41.9	Very low	44.9	Very low	132 Å²	132	98.8 Å²	98.8	92%	0.923	56%	0.564	S	S	*	*			trans	-90.8	115.1	178.6	-174.5	0	0	0	0	110.9
227	A	37.8	Very low	45.7	Very low	88 Å²	88	95.7 Å²	95.7	73%	0.727	55%	0.551	S	S	*	*			trans	-117.4	150.7	178.6	0	0	0	0	0	112.3
228	G	34.6	Very low	46.6	Very low	69 Å²	69	94.1 Å²	94.1	71%	0.711	55%	0.549	S	S	*	.			trans	-85.6	158.3	-178.4	0	0	0	0	0	113.6
229	N	41.4	Very low	47.5	Very low	145 Å²	145	92.2 Å²	92.2	78%	0.775	54%	0.538	S	S	*	.			trans	-87.9	113.2	177.4	-71	-20.2	0	0	0	111.4
230	S	41.9	Very low	48.8	Very low	55 Å²	55	90 Å²	90	39%	0.385	52%	0.524	S	S	.	.			trans	-139.8	149.9	155.1	103.1	0	0	0	0	111.5	H232 D233	S230-H232 VanDerWaalsContact C-N 3.27Å; S230-H232 PolarHBondContact O-N 2.94Å; S230-H232 PolarHBondContact OG-N 3.36Å; S230-D233 WeakPolarHBondContact CB-OD2 3.5Å; S230-D233 PolarHBondContact O-N 3.26Å; S230-D233 PolarHBondContact OG-OD2 2.99Å
231	P	44.3	Very low	50.4	Low	87 Å²	87	86 Å²	86	57%	0.565	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-22.4	175.9	-21.4	34.3	0	0	0	114.1	D233 A234	P231-D233 PolarHBondContact O-N 3.49Å; P231-A234 WeakPolarHBondContact O-CB 3.44Å; P231-A234 PolarHBondContact O-N 3.29Å
232	H	43.1	Very low	51.9	Low	160 Å²	160	79.7 Å²	79.7	74%	0.741	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-28.3	177.5	-105.9	-94.6	0	0	0	112	S230 A234	S230-H232 VanDerWaalsContact C-N 3.27Å; S230-H232 PolarHBondContact O-N 2.94Å; S230-H232 PolarHBondContact OG-N 3.36Å; H232-A234 VanDerWaalsContact C-N 3.25Å; H232-A234 PolarHBondContact O-N 3.02Å
233	D	58	Low	53.5	Low	62 Å²	62	77.2 Å²	77.2	33%	0.332	46%	0.46	S	S	.	.	H	α-helix	trans	-73.2	-14.2	-179.5	-59.6	-63.5	0	0	0	113.2	S230 P231 V235 S236 N237	S230-D233 WeakPolarHBondContact CB-OD2 3.5Å; S230-D233 PolarHBondContact O-N 3.26Å; S230-D233 PolarHBondContact OG-OD2 2.99Å; P231-D233 PolarHBondContact O-N 3.49Å; D233-V235 PolarHBondContact O-N 3.03Å; D233-S236 PolarHBondContact O-N 3.5Å; D233-S236 VanDerWaalsContact O-N 3.1Å; D233-N237 WeakPolarHBondContact O-CB 3.41Å; D233-N237 PolarHBondContact O-N 3.31Å; D233-N237 PolarHBondContact O-ND2 3.02Å
234	A	57.5	Low	55.6	Low	48 Å²	48	76.6 Å²	76.6	40%	0.397	45%	0.451	S	S	.	.	H	α-helix	trans	-58.8	-42.6	-174.9	0	0	0	0	0	113.2	P231 H232 I238	P231-A234 WeakPolarHBondContact O-CB 3.44Å; P231-A234 PolarHBondContact O-N 3.29Å; H232-A234 VanDerWaalsContact C-N 3.25Å; H232-A234 PolarHBondContact O-N 3.02Å; A234-I238 WeakPolarHBondContact O-CD1 3.45Å; A234-I238 VanDerWaalsContact O-CG1 3.28Å; A234-I238 WeakPolarHBondContact O-CG1 3.44Å; A234-I238 PolarHBondContact O-N 3.21Å
235	V	63.4	Low	57.6	Low	30 Å²	30	67 Å²	67	18%	0.182	42%	0.416	C	S	.	.	H	α-helix	trans	-73	-37.2	176.3	-179.9	0	0	0	0	111	D233 I238 C239 V324 F421 T427	D233-V235 PolarHBondContact O-N 3.03Å; V235-I238 PolarHBondContact O-N 3.08Å; V235-C239 PolarHBondContact O-N 3.28Å; V235-C239 PolarHBondContact O-SG 2.88Å; V235-V324 HydrophobicContact CG2-CG2 4.5Å; V235-F421 HydrophobicContact CG1-CD2 4.04Å; V235-F421 HydrophobicContact CG1-CE2 4.01Å; V235-F421 HydrophobicContact CG1-CG 4.49Å; V235-F421 HydrophobicContact CG1-CZ 4.42Å; V235-F421 HydrophobicContact CG2-CE2 4.38Å; V235-F421 HydrophobicContact CG2-CZ 4.2Å; V235-T427 HydrophobicContact CG1-CG2 4.43Å
236	S	65.8	Low	60	Low	9 Å²	9	64.8 Å²	64.8	6%	0.063	39%	0.392	C	S	.	.	H	α-helix	trans	-62.8	-46.1	176.3	-167.9	0	0	0	0	111.5	D233 I238 C239 Q240	D233-S236 PolarHBondContact O-N 3.5Å; D233-S236 VanDerWaalsContact O-N 3.1Å; S236-I238 VanDerWaalsContact C-N 3.35Å; S236-I238 PolarHBondContact O-N 2.94Å; S236-C239 WeakPolarHBondContact O-CB 3.44Å; S236-C239 PolarHBondContact O-N 3.48Å; S236-C239 VanDerWaalsContact O-N 3.08Å; S236-Q240 WeakPolarHBondContact O-CG 3.34Å; S236-Q240 PolarHBondContact O-N 2.93Å; S236-Q240 PolarHBondContact OG-NE2 3.22Å; S236-Q240 VanDerWaalsContact OG-NE2 3.15Å
237	N	64.3	Low	62	Low	67 Å²	67	64.2 Å²	64.2	36%	0.358	37%	0.373	S	S	.	.	H	α-helix	trans	-60.8	-41.9	176.7	-66.6	-17	0	0	0	111.5	D233 C239 T241	D233-N237 WeakPolarHBondContact O-CB 3.41Å; D233-N237 PolarHBondContact O-N 3.31Å; D233-N237 PolarHBondContact O-ND2 3.02Å; N237-C239 VanDerWaalsContact C-N 3.33Å; N237-C239 PolarHBondContact O-N 3.34Å; N237-T241 VanDerWaalsContact O-CB 3.28Å; N237-T241 WeakPolarHBondContact O-CB 3.28Å; N237-T241 PolarHBondContact O-N 2.96Å; N237-T241 PolarHBondContact O-OG1 3.45Å
238	I	68.2	Low	64.4	Low	71 Å²	71	60.9 Å²	60.9	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-60.3	-42.6	173.2	-70.3	164.7	0	0	0	111.1	A234 V235 S236 A242 L300	A234-I238 WeakPolarHBondContact O-CD1 3.45Å; A234-I238 VanDerWaalsContact O-CG1 3.28Å; A234-I238 WeakPolarHBondContact O-CG1 3.44Å; A234-I238 PolarHBondContact O-N 3.21Å; V235-I238 PolarHBondContact O-N 3.08Å; S236-I238 VanDerWaalsContact C-N 3.35Å; S236-I238 PolarHBondContact O-N 2.94Å; I238-A242 WeakPolarHBondContact O-CB 3.35Å; I238-A242 PolarHBondContact O-N 2.96Å; I238-L300 HydrophobicContact CD1-CD1 3.97Å; I238-L300 HydrophobicContact CG1-CD1 3.73Å; I238-L300 HydrophobicContact CG1-CD2 3.8Å; I238-L300 HydrophobicContact CG1-CG 4.42Å
239	C	68.9	Low	67.1	Low	5 Å²	5	57.8 Å²	57.8	3%	0.034	31%	0.313	C	S	.	.	H	α-helix	trans	-67.2	-47.3	179.1	-64.7	0	0	0	0	112.3	V235 S236 N237 T241 A242 D243 L433	V235-C239 PolarHBondContact O-N 3.28Å; V235-C239 PolarHBondContact O-SG 2.88Å; S236-C239 WeakPolarHBondContact O-CB 3.44Å; S236-C239 PolarHBondContact O-N 3.48Å; S236-C239 VanDerWaalsContact O-N 3.08Å; N237-C239 VanDerWaalsContact C-N 3.33Å; N237-C239 PolarHBondContact O-N 3.34Å; C239-T241 VanDerWaalsContact C-N 3.33Å; C239-T241 PolarHBondContact O-N 2.97Å; C239-A242 WeakPolarHBondContact O-CB 3.4Å; C239-A242 PolarHBondContact O-N 3.33Å; C239-A242 VanDerWaalsContact O-N 3.15Å; C239-D243 PolarHBondContact O-N 3.41Å; C239-L433 HydrophobicContact CB-CD2 3.96Å
240	Q	71.3	Confident	69.5	Low	75 Å²	75	53 Å²	53	35%	0.35	29%	0.289	S	S	.	.	H	α-helix	trans	-62.5	-38.7	176.2	-67.7	175	33.4	0	0	111.9	S236 K244	S236-Q240 WeakPolarHBondContact O-CG 3.34Å; S236-Q240 PolarHBondContact O-N 2.93Å; S236-Q240 PolarHBondContact OG-NE2 3.22Å; S236-Q240 VanDerWaalsContact OG-NE2 3.15Å; Q240-K244 VanDerWaalsContact O-CG 3.31Å; Q240-K244 WeakPolarHBondContact O-CG 2.97Å; Q240-K244 PolarHBondContact O-N 3.48Å; Q240-K244 VanDerWaalsContact O-N 3.11Å
241	T	69.4	Low	71.8	Confident	52 Å²	52	52.6 Å²	52.6	32%	0.319	28%	0.28	S	S	.	.	H	α-helix	trans	-66.1	-41.7	172.9	-64	0	0	0	0	111.1	N237 C239 Q245	N237-T241 VanDerWaalsContact O-CB 3.28Å; N237-T241 WeakPolarHBondContact O-CB 3.28Å; N237-T241 PolarHBondContact O-N 2.96Å; N237-T241 PolarHBondContact O-OG1 3.45Å; C239-T241 VanDerWaalsContact C-N 3.33Å; C239-T241 PolarHBondContact O-N 2.97Å; T241-Q245 HydrophobicContact CG2-CG 4.31Å; T241-Q245 WeakPolarHBondContact O-CB 3.43Å; T241-Q245 WeakPolarHBondContact O-CG 3.33Å; T241-Q245 PolarHBondContact O-N 2.93Å
242	A	73.8	Confident	74.3	Confident	19 Å²	19	48.4 Å²	48.4	16%	0.157	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-45.2	176.3	0	0	0	0	0	111.7	I238 C239 Q245 L246 L279 L433	I238-A242 WeakPolarHBondContact O-CB 3.35Å; I238-A242 PolarHBondContact O-N 2.96Å; C239-A242 WeakPolarHBondContact O-CB 3.4Å; C239-A242 PolarHBondContact O-N 3.33Å; C239-A242 VanDerWaalsContact O-N 3.15Å; A242-Q245 CarbonylContact O-C 3.47Å; A242-Q245 WeakPolarHBondContact O-CA 3.31Å; A242-Q245 PolarHBondContact O-N 2.89Å; A242-Q245 VanDerWaalsContact O-N 3.09Å; A242-L246 WeakPolarHBondContact O-CG 3.5Å; A242-L246 PolarHBondContact O-N 3.28Å; A242-L279 HydrophobicContact CB-CD1 4.11Å; A242-L433 HydrophobicContact CB-CD1 3.99Å
243	D	74.1	Confident	76.8	Confident	20 Å²	20	40.8 Å²	40.8	11%	0.107	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-50.4	178	-163.4	94.4	0	0	0	111.7	C239 Q245 L246 F247 D430 F432 L433	C239-D243 PolarHBondContact O-N 3.41Å; D243-Q245 PolarHBondContact O-N 3.34Å; D243-L246 WeakPolarHBondContact O-CB 3.35Å; D243-L246 PolarHBondContact O-N 3.33Å; D243-F247 WeakPolarHBondContact O-CD2 3.46Å; D243-D430 HydrophobicContact CB-CB 4.29Å; D243-F432 WeakPolarHBondContact OD1-CB 3.28Å; D243-L433 PolarHBondContact OD1-N 2.88Å
244	K	75.6	Confident	78.6	Confident	132 Å²	132	42.5 Å²	42.5	57%	0.574	22%	0.223	S	C	*	.	H	α-helix	trans	-53.8	-37.6	171.5	-71	171.5	-176.2	176.1	0	112.8	Q240	Q240-K244 VanDerWaalsContact O-CG 3.31Å; Q240-K244 WeakPolarHBondContact O-CG 2.97Å; Q240-K244 PolarHBondContact O-N 3.48Å; Q240-K244 VanDerWaalsContact O-N 3.11Å
245	Q	81.6	Confident	80.4	Confident	31 Å²	31	44.4 Å²	44.4	15%	0.145	22%	0.22	C	C	.	.	H	α-helix	trans	-81.2	-18.5	178.6	-62.1	-75.9	-96.4	0	0	113.4	T241 A242 D243 A248 L249 L279 R286	T241-Q245 HydrophobicContact CG2-CG 4.31Å; T241-Q245 WeakPolarHBondContact O-CB 3.43Å; T241-Q245 WeakPolarHBondContact O-CG 3.33Å; T241-Q245 PolarHBondContact O-N 2.93Å; A242-Q245 CarbonylContact O-C 3.47Å; A242-Q245 WeakPolarHBondContact O-CA 3.31Å; A242-Q245 PolarHBondContact O-N 2.89Å; A242-Q245 VanDerWaalsContact O-N 3.09Å; D243-Q245 PolarHBondContact O-N 3.34Å; Q245-A248 CarbonylContact O-C 3.36Å; Q245-A248 WeakPolarHBondContact O-CB 3.34Å; Q245-A248 PolarHBondContact O-N 3.08Å; Q245-L249 WeakPolarHBondContact O-CB 3.43Å; Q245-L249 PolarHBondContact O-N 3.4Å; Q245-L279 HydrophobicContact CB-CD1 4.38Å; Q245-L279 HydrophobicContact CB-CD2 3.67Å; Q245-R286 VanDerWaalsContact OE1-NH1 3.08Å
246	L	83.8	Confident	82	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-42.5	175.2	-77.8	177.6	0	0	0	111.8	A242 D243 A248 L249 V250 W275 L279 F432 L433 M436	A242-L246 WeakPolarHBondContact O-CG 3.5Å; A242-L246 PolarHBondContact O-N 3.28Å; D243-L246 WeakPolarHBondContact O-CB 3.35Å; D243-L246 PolarHBondContact O-N 3.33Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 3.32Å; L246-L249 HydrophobicContact CD2-CD2 4.41Å; L246-L249 WeakPolarHBondContact O-CA 3.39Å; L246-L249 WeakPolarHBondContact O-CB 3.3Å; L246-L249 PolarHBondContact O-N 2.95Å; L246-V250 PolarHBondContact O-N 3.2Å; L246-W275 HydrophobicContact CD2-CB 3.81Å; L246-W275 HydrophobicContact CD2-CD2 4.1Å; L246-W275 HydrophobicContact CD2-CE3 3.8Å; L246-W275 HydrophobicContact CD2-CG 4.15Å; L246-L279 HydrophobicContact CD2-CD1 4.18Å; L246-L279 HydrophobicContact CG-CD1 4.44Å; L246-F432 HydrophobicContact CB-CD1 3.9Å; L246-F432 HydrophobicContact CB-CE1 3.73Å; L246-F432 HydrophobicContact CD1-CD1 3.88Å; L246-F432 HydrophobicContact CD1-CE1 4.2Å; L246-L433 HydrophobicContact CD1-CD1 3.98Å; L246-M436 HydrophobicContact CD1-CG 4.02Å; L246-M436 HydrophobicContact CD2-CE 4.34Å
247	F	84.1	Confident	83.4	Confident	119 Å²	119	43.4 Å²	43.4	52%	0.522	21%	0.213	S	C	.	.	H	α-helix	trans	-60.2	-40.4	173.6	-66.1	-82.1	0	0	0	111.8	D243 L249 V250 E251 F432	D243-F247 WeakPolarHBondContact O-CD2 3.46Å; F247-L249 VanDerWaalsContact C-N 3.3Å; F247-L249 PolarHBondContact O-N 3.4Å; F247-V250 PolarHBondContact O-N 3.35Å; F247-E251 PolarHBondContact O-N 3.5Å; F247-E251 VanDerWaalsContact O-N 3.16Å; F247-F432 HydrophobicContact CD2-CD1 4.45Å; F247-F432 HydrophobicContact CE1-CD1 4.29Å; F247-F432 HydrophobicContact CE1-CE1 4.33Å; F247-F432 AromaticContact CE2-CD1 3.91Å; F247-F432 HydrophobicContact CE2-CD1 3.91Å; F247-F432 HydrophobicContact CZ-CB 4.47Å; F247-F432 AromaticContact CZ-CD1 3.81Å; F247-F432 HydrophobicContact CZ-CD1 3.81Å; F247-F432 HydrophobicContact CZ-CE1 4.3Å; F247-F432 HydrophobicContact CZ-CG 4.26Å
248	A	86.7	Confident	84.9	Confident	19 Å²	19	42.2 Å²	42.2	16%	0.157	21%	0.205	C	C	.	.	H	α-helix	trans	-66.9	-30.7	174.3	0	0	0	0	0	112.4	V214 Q245 L246 W252	V214-A248 HydrophobicContact CG1-CB 4.18Å; Q245-A248 CarbonylContact O-C 3.36Å; Q245-A248 WeakPolarHBondContact O-CB 3.34Å; Q245-A248 PolarHBondContact O-N 3.08Å; L246-A248 VanDerWaalsContact C-N 3.28Å; L246-A248 PolarHBondContact O-N 3.32Å; A248-W252 WeakPolarHBondContact O-CB 3.39Å; A248-W252 PolarHBondContact O-N 2.91Å
249	L	91.2	Very high	86.3	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-73.3	-38.6	175.9	-176.1	67	0	0	0	113	Q245 L246 F247 E251 W252 A253 L271 W275 L278 L279	Q245-L249 WeakPolarHBondContact O-CB 3.43Å; Q245-L249 PolarHBondContact O-N 3.4Å; L246-L249 HydrophobicContact CD2-CD2 4.41Å; L246-L249 WeakPolarHBondContact O-CA 3.39Å; L246-L249 WeakPolarHBondContact O-CB 3.3Å; L246-L249 PolarHBondContact O-N 2.95Å; F247-L249 VanDerWaalsContact C-N 3.3Å; F247-L249 PolarHBondContact O-N 3.4Å; L249-E251 VanDerWaalsContact C-N 3.3Å; L249-W252 HydrophobicContact CD1-CD2 4.21Å; L249-W252 HydrophobicContact CD1-CE3 3.55Å; L249-W252 HydrophobicContact CD1-CZ3 4.12Å; L249-W252 WeakPolarHBondContact O-CB 3.35Å; L249-W252 PolarHBondContact O-N 2.71Å; L249-A253 WeakPolarHBondContact O-CB 3.42Å; L249-A253 PolarHBondContact O-N 3.34Å; L249-L271 HydrophobicContact CG-CD2 4.36Å; L249-W275 HydrophobicContact CD2-CB 3.94Å; L249-L278 HydrophobicContact CD1-CB 3.72Å; L249-L278 HydrophobicContact CD1-CD1 4.12Å; L249-L278 HydrophobicContact CD1-CG 4.42Å; L249-L278 HydrophobicContact CD2-CB 3.95Å; L249-L278 HydrophobicContact CD2-CD1 4.08Å; L249-L278 HydrophobicContact CG-CB 4.5Å; L249-L279 HydrophobicContact CB-CD2 4.33Å; L249-L279 HydrophobicContact CD2-CD2 4.37Å; L249-L279 HydrophobicContact CD2-CG 4.4Å
250	V	92	Very high	87.5	Confident	44 Å²	44	41.8 Å²	41.8	27%	0.267	21%	0.208	S	C	.	.	H	α-helix	trans	-61.7	-42.7	171.5	173.7	0	0	0	0	110.1	L246 F247 A253 K254 L271	L246-V250 PolarHBondContact O-N 3.2Å; F247-V250 PolarHBondContact O-N 3.35Å; V250-A253 PolarHBondContact O-N 2.69Å; V250-K254 WeakPolarHBondContact O-CG 3.43Å; V250-K254 PolarHBondContact O-N 2.76Å; V250-L271 HydrophobicContact CG2-CD1 4.28Å
251	E	91.1	Very high	88.6	Confident	46 Å²	46	44.8 Å²	44.8	22%	0.215	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-37.3	174.9	-80.2	-70.3	107.2	0	0	113.1	R217 F247 L249 K254 R255	R217-E251 IonicContact CZ-OE2 3.68Å; R217-E251 IonicContact NH1-OE2 2.81Å; R217-E251 PolarHBondContact NH1-OE2 2.82Å; R217-E251 IonicContact NH2-OE2 3.62Å; F247-E251 PolarHBondContact O-N 3.5Å; F247-E251 VanDerWaalsContact O-N 3.16Å; L249-E251 VanDerWaalsContact C-N 3.3Å; E251-K254 IonicContact OE1-NZ 3.3Å; E251-K254 PolarHBondContact OE1-NZ 3.32Å; E251-R255 PolarHBondContact O-NH1 3.49Å; E251-R255 IonicContact OE2-CZ 2.63Å; E251-R255 IonicContact OE2-NH1 3.46Å; E251-R255 PolarHBondContact OE2-NH1 2.86Å; E251-R255 IonicContact OE2-NH2 3.8Å; E251-R255 PolarHBondContact OE2-NH2 3.36Å; E251-R255 VanDerWaalsContact OE2-NH2 3.16Å
252	W	95.6	Very high	89.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.3	-52.7	171.1	173.7	81.4	0	0	0	111.4	E211 V214 A248 L249 K254 R255 I256 L278 R353 L357	E211-W252 PolarHBondContact OE1-NE1 2.91Å; V214-W252 HydrophobicContact CG2-CB 3.71Å; V214-W252 HydrophobicContact CG2-CG 4.37Å; A248-W252 WeakPolarHBondContact O-CB 3.39Å; A248-W252 PolarHBondContact O-N 2.91Å; L249-W252 HydrophobicContact CD1-CD2 4.21Å; L249-W252 HydrophobicContact CD1-CE3 3.55Å; L249-W252 HydrophobicContact CD1-CZ3 4.12Å; L249-W252 WeakPolarHBondContact O-CB 3.35Å; L249-W252 PolarHBondContact O-N 2.71Å; W252-K254 PolarHBondContact O-N 2.88Å; W252-R255 WeakPolarHBondContact O-CB 3.32Å; W252-R255 PolarHBondContact O-N 3.36Å; W252-I256 HydrophobicContact CD2-CG1 4.34Å; W252-I256 HydrophobicContact CH2-CD1 4.32Å; W252-I256 HydrophobicContact CH2-CG1 4.11Å; W252-I256 HydrophobicContact CZ2-CD1 3.68Å; W252-I256 HydrophobicContact CZ2-CG1 3.93Å; W252-I256 HydrophobicContact CZ3-CG1 4.42Å; W252-I256 PolarHBondContact O-N 3.08Å; W252-L278 HydrophobicContact CH2-CD2 3.82Å; W252-L278 HydrophobicContact CZ3-CD1 4.21Å; W252-L278 HydrophobicContact CZ3-CD2 3.83Å; W252-R353 HydrophobicContact CH2-CB 3.62Å; W252-R353 HydrophobicContact CZ2-CB 3.44Å; W252-R353 VanDerWaalsContact CZ2-CB 3.44Å; W252-L357 HydrophobicContact CH2-CB 4.16Å; W252-L357 HydrophobicContact CH2-CD2 4.04Å; W252-L357 HydrophobicContact CZ3-CB 4.16Å; W252-L357 HydrophobicContact CZ3-CD1 4.24Å; W252-L357 HydrophobicContact CZ3-CD2 3.74Å; W252-L357 HydrophobicContact CZ3-CG 4.27Å
253	A	96.9	Very high	90.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.1	-41.3	-174.5	0	0	0	0	0	112.5	L249 V250 R255 I256 F259 L271 L357	L249-A253 WeakPolarHBondContact O-CB 3.42Å; L249-A253 PolarHBondContact O-N 3.34Å; V250-A253 PolarHBondContact O-N 2.69Å; A253-R255 PolarHBondContact O-N 3.26Å; A253-R255 VanDerWaalsContact O-N 3.08Å; A253-I256 WeakPolarHBondContact O-CB 3.29Å; A253-I256 PolarHBondContact O-N 2.88Å; A253-F259 VanDerWaalsContact C-CD1 3.49Å; A253-F259 HydrophobicContact CB-CD1 3.89Å; A253-F259 HydrophobicContact CB-CE1 3.68Å; A253-F259 HydrophobicContact CB-CE2 4.41Å; A253-F259 HydrophobicContact CB-CG 4.34Å; A253-F259 HydrophobicContact CB-CZ 3.96Å; A253-F259 WeakPolarHBondContact O-CB 3.48Å; A253-F259 VanDerWaalsContact O-CD1 3.29Å; A253-F259 WeakPolarHBondContact O-CD1 3.47Å; A253-F259 WeakPolarHBondContact O-CG 3.38Å; A253-L271 HydrophobicContact CB-CD2 3.88Å; A253-L357 HydrophobicContact CB-CD1 4.27Å; A253-L357 HydrophobicContact CB-CD2 4.12Å
254	K	95.3	Very high	91.7	Very high	98 Å²	98	49.5 Å²	49.5	43%	0.426	25%	0.245	S	C	.	.	H	α-helix	trans	-56.7	-24.7	174.8	-70.8	172.7	-167.5	165	0	114.5	V250 E251 W252 S260	V250-K254 WeakPolarHBondContact O-CG 3.43Å; V250-K254 PolarHBondContact O-N 2.76Å; E251-K254 IonicContact OE1-NZ 3.3Å; E251-K254 PolarHBondContact OE1-NZ 3.32Å; W252-K254 PolarHBondContact O-N 2.88Å; K254-S260 WeakPolarHBondContact CA-OG 3.39Å; K254-S260 PolarHBondContact O-OG 3.16Å
255	R	95.6	Very high	92.5	Very high	87 Å²	87	48.8 Å²	48.8	33%	0.328	25%	0.248	S	C	.	.	H	α-helix	trans	-89.9	-13.9	-180	-67.1	167.9	172.1	70.8	0.7	112.9	A210 E251 W252 A253	A210-R255 HydrophobicContact CB-CB 3.62Å; E251-R255 PolarHBondContact O-NH1 3.49Å; E251-R255 IonicContact OE2-CZ 2.63Å; E251-R255 IonicContact OE2-NH1 3.46Å; E251-R255 PolarHBondContact OE2-NH1 2.86Å; E251-R255 IonicContact OE2-NH2 3.8Å; E251-R255 PolarHBondContact OE2-NH2 3.36Å; E251-R255 VanDerWaalsContact OE2-NH2 3.16Å; W252-R255 WeakPolarHBondContact O-CB 3.32Å; W252-R255 PolarHBondContact O-N 3.36Å; A253-R255 PolarHBondContact O-N 3.26Å; A253-R255 VanDerWaalsContact O-N 3.08Å
256	I	97.4	Very high	93.2	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.021	24%	0.241	C	C	.	.	S	Bend	trans	-70.3	134	172.9	-59.1	-59.6	0	0	0	109.1	I207 A210 W252 A253 F259 A354 L357 F358	I207-I256 HydrophobicContact CG1-CD1 4.46Å; I207-I256 HydrophobicContact CG2-CD1 4.44Å; A210-I256 HydrophobicContact CB-CD1 3.81Å; W252-I256 HydrophobicContact CD2-CG1 4.34Å; W252-I256 HydrophobicContact CH2-CD1 4.32Å; W252-I256 HydrophobicContact CH2-CG1 4.11Å; W252-I256 HydrophobicContact CZ2-CD1 3.68Å; W252-I256 HydrophobicContact CZ2-CG1 3.93Å; W252-I256 HydrophobicContact CZ3-CG1 4.42Å; W252-I256 PolarHBondContact O-N 3.08Å; A253-I256 WeakPolarHBondContact O-CB 3.29Å; A253-I256 PolarHBondContact O-N 2.88Å; I256-F259 HydrophobicContact CB-CB 4.32Å; I256-F259 PolarHBondContact O-N 3.41Å; I256-A354 HydrophobicContact CG2-CB 4.3Å; I256-L357 HydrophobicContact CB-CD2 4.4Å; I256-L357 HydrophobicContact CG1-CD2 4.26Å; I256-L357 HydrophobicContact CG2-CD2 4.43Å; I256-F358 HydrophobicContact CG2-CE2 3.74Å; I256-F358 HydrophobicContact CG2-CZ 3.84Å
257	P	95.6	Very high	93.8	Very high	14 Å²	14	48.3 Å²	48.3	9%	0.091	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	142.2	179.8	-25.8	34.1	0	0	0	112.7	M202 P203 K206 F259	M202-P257 HydrophobicContact CE-CB 4.18Å; M202-P257 HydrophobicContact SD-CB 3.82Å; M202-P257 HydrophobicContact SD-CG 3.9Å; P203-P257 HydrophobicContact CG-CG 4.35Å; K206-P257 HydrophobicContact CB-CG 3.92Å; K206-P257 HydrophobicContact CD-CG 4.19Å; P257-F259 PolarHBondContact O-N 2.97Å
258	H	95.1	Very high	94.3	Very high	42 Å²	42	46.3 Å²	46.3	19%	0.194	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	-10.8	-177.8	-55.2	-58.4	0	0	0	117.8	E201 S260 E261 L374 K377	E201-H258 PolarHBondContact O-CD2 2.94Å; E201-H258 PolarHBondContact O-NE2 2.85Å; E201-H258 VanDerWaalsContact O-NE2 3.1Å; H258-S260 PolarHBondContact O-N 3.31Å; H258-E261 WeakPolarHBondContact CA-OE1 3.43Å; H258-E261 IonicContact CE1-OE2 2.67Å; H258-E261 IonicContact CG-OE2 3.46Å; H258-E261 IonicContact ND1-OE1 3.57Å; H258-E261 PolarHBondContact ND1-OE1 3.42Å; H258-E261 IonicContact ND1-OE2 3.81Å; H258-E261 PolarHBondContact ND1-OE2 2.72Å; H258-E261 WeakPolarHBondContact O-CB 3.38Å; H258-E261 PolarHBondContact O-N 2.95Å; H258-E261 VanDerWaalsContact O-N 3.08Å; H258-L374 HydrophobicContact CB-CD1 4.03Å; H258-L374 HydrophobicContact CB-CD2 3.6Å; H258-L374 HydrophobicContact CB-CG 4.5Å; H258-K377 PolarHBondContact NE2-NZ 2.89Å
259	F	96.9	Very high	94.6	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.009	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-61	-44.9	-179.9	179.7	-93.6	0	0	0	112.1	A253 I256 P257 E261 L262 Q267 L270 L271 L357 F358	A253-F259 VanDerWaalsContact C-CD1 3.49Å; A253-F259 HydrophobicContact CB-CD1 3.89Å; A253-F259 HydrophobicContact CB-CE1 3.68Å; A253-F259 HydrophobicContact CB-CE2 4.41Å; A253-F259 HydrophobicContact CB-CG 4.34Å; A253-F259 HydrophobicContact CB-CZ 3.96Å; A253-F259 WeakPolarHBondContact O-CB 3.48Å; A253-F259 VanDerWaalsContact O-CD1 3.29Å; A253-F259 WeakPolarHBondContact O-CD1 3.47Å; A253-F259 WeakPolarHBondContact O-CG 3.38Å; I256-F259 HydrophobicContact CB-CB 4.32Å; I256-F259 PolarHBondContact O-N 3.41Å; P257-F259 PolarHBondContact O-N 2.97Å; F259-E261 PolarHBondContact O-N 3.27Å; F259-L262 HydrophobicContact CD2-CD1 4.47Å; F259-L262 WeakPolarHBondContact O-CB 3.42Å; F259-L262 PolarHBondContact O-N 2.84Å; F259-Q267 HydrophobicContact CD1-CG 4.27Å; F259-Q267 HydrophobicContact CE1-CB 3.91Å; F259-Q267 HydrophobicContact CE1-CG 3.78Å; F259-Q267 HydrophobicContact CE2-CB 4.29Å; F259-Q267 HydrophobicContact CE2-CG 4.26Å; F259-Q267 HydrophobicContact CZ-CB 3.59Å; F259-Q267 HydrophobicContact CZ-CG 3.78Å; F259-Q267 WeakPolarHBondContact O-CG 3.28Å; F259-Q267 PolarHBondContact O-NE2 2.81Å; F259-L270 HydrophobicContact CE2-CB 4.35Å; F259-L270 HydrophobicContact CE2-CD1 4.29Å; F259-L271 HydrophobicContact CE1-CD1 4.37Å; F259-L271 HydrophobicContact CZ-CD1 3.9Å; F259-L271 HydrophobicContact CZ-CG 3.98Å; F259-L357 HydrophobicContact CD2-CD1 4.23Å; F259-L357 HydrophobicContact CD2-CD2 3.62Å; F259-L357 HydrophobicContact CD2-CG 4Å; F259-L357 HydrophobicContact CE2-CD1 3.77Å; F259-L357 HydrophobicContact CE2-CD2 4.05Å; F259-L357 HydrophobicContact CE2-CG 4.03Å; F259-L357 HydrophobicContact CG-CD2 4.19Å; F259-L357 HydrophobicContact CZ-CD1 4.43Å; F259-F358 HydrophobicContact CB-CE1 4.19Å; F259-F358 HydrophobicContact CB-CZ 4.14Å; F259-F358 HydrophobicContact CD2-CE1 4.04Å
260	S	95.4	Very high	94.9	Very high	65 Å²	65	47.1 Å²	47.1	46%	0.455	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-70.5	-6.1	177.7	-60.5	0	0	0	0	114.3	K254 H258	K254-S260 WeakPolarHBondContact CA-OG 3.39Å; K254-S260 PolarHBondContact O-OG 3.16Å; H258-S260 PolarHBondContact O-N 3.31Å
261	E	93.3	Very high	95.1	Very high	139 Å²	139	45.9 Å²	45.9	65%	0.65	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-93.9	-17.9	177.8	-65.3	158.6	-134.1	0	0	112.2	H258 F259	H258-E261 WeakPolarHBondContact CA-OE1 3.43Å; H258-E261 IonicContact CE1-OE2 2.67Å; H258-E261 IonicContact CG-OE2 3.46Å; H258-E261 IonicContact ND1-OE1 3.57Å; H258-E261 PolarHBondContact ND1-OE1 3.42Å; H258-E261 IonicContact ND1-OE2 3.81Å; H258-E261 PolarHBondContact ND1-OE2 2.72Å; H258-E261 WeakPolarHBondContact O-CB 3.38Å; H258-E261 PolarHBondContact O-N 2.95Å; H258-E261 VanDerWaalsContact O-N 3.08Å; F259-E261 PolarHBondContact O-N 3.27Å
262	L	94	Very high	95	Very high	9 Å²	9	46.3 Å²	46.3	5%	0.047	24%	0.236	C	C	.	.	S	Bend	trans	-67.8	157.9	174.6	-66.3	174.5	0	0	0	111.8	F259 Q267 L270 F358 E370 L374	F259-L262 HydrophobicContact CD2-CD1 4.47Å; F259-L262 WeakPolarHBondContact O-CB 3.42Å; F259-L262 PolarHBondContact O-N 2.84Å; L262-Q267 HydrophobicContact CB-CG 4.05Å; L262-Q267 PolarHBondContact O-NE2 3.02Å; L262-L270 HydrophobicContact CD1-CD1 3.77Å; L262-F358 HydrophobicContact CD1-CD1 4.4Å; L262-F358 HydrophobicContact CD1-CE1 4.1Å; L262-E370 HydrophobicContact CD2-CG 4.09Å; L262-L374 HydrophobicContact CD1-CD1 4.06Å; L262-L374 HydrophobicContact CD2-CD1 3.97Å; L262-L374 HydrophobicContact CG-CD1 4.17Å
263	P	94.8	Very high	94.9	Very high	52 Å²	52	48 Å²	48	34%	0.338	25%	0.25	S	C	.	.			trans	-51.8	142.6	169.8	-25	34	0	0	0	112.2	D265 D266 Q267	P263-D265 VanDerWaalsContact C-N 3.26Å; P263-D265 PolarHBondContact O-N 3.04Å; P263-D266 HydrophobicContact CB-CB 4.17Å; P263-D266 HydrophobicContact CG-CB 4.43Å; P263-D266 PolarHBondContact O-N 3.18Å; P263-D266 VanDerWaalsContact O-N 3.14Å; P263-Q267 WeakPolarHBondContact O-CG 3.31Å; P263-Q267 PolarHBondContact O-N 2.78Å
264	L	94.2	Very high	94.8	Very high	129 Å²	129	48.2 Å²	48.2	68%	0.675	25%	0.252	S	S	*	.	H	α-helix	trans	-60.4	-36.3	-178.9	-74.1	171.6	0	0	0	112.4	Q267 V268	L264-Q267 PolarHBondContact O-N 3.32Å; L264-V268 WeakPolarHBondContact O-CG2 3.16Å; L264-V268 PolarHBondContact O-N 2.69Å
265	D	93.1	Very high	94.7	Very high	117 Å²	117	44.1 Å²	44.1	63%	0.626	23%	0.234	S	C	*	.	H	α-helix	trans	-63.8	-45.7	175.5	-54.3	-67	0	0	0	111.2	P263 V268 I269	P263-D265 VanDerWaalsContact C-N 3.26Å; P263-D265 PolarHBondContact O-N 3.04Å; D265-V268 PolarHBondContact O-N 3.16Å; D265-I269 WeakPolarHBondContact O-CB 3.25Å; D265-I269 WeakPolarHBondContact O-CD1 3.5Å; D265-I269 WeakPolarHBondContact O-CG1 3.25Å; D265-I269 PolarHBondContact O-N 3.23Å
266	D	94.6	Very high	94.5	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-43.3	174.3	-74.3	43.6	0	0	0	111.2	P263 V268 I269 L270 L365 S366 S367	P263-D266 HydrophobicContact CB-CB 4.17Å; P263-D266 HydrophobicContact CG-CB 4.43Å; P263-D266 PolarHBondContact O-N 3.18Å; P263-D266 VanDerWaalsContact O-N 3.14Å; D266-V268 VanDerWaalsContact C-N 3.33Å; D266-V268 PolarHBondContact O-N 2.9Å; D266-I269 PolarHBondContact O-N 2.92Å; D266-L270 WeakPolarHBondContact O-CB 3.25Å; D266-L270 VanDerWaalsContact O-CG 3.23Å; D266-L270 WeakPolarHBondContact O-CG 3.39Å; D266-L270 PolarHBondContact O-N 3.17Å; D266-L365 HydrophobicContact CB-CD2 3.88Å; D266-S366 VanDerWaalsContact CG-N 3.29Å; D266-S366 WeakPolarHBondContact OD1-CB 3.48Å; D266-S366 PolarHBondContact OD1-N 2.88Å; D266-S366 PolarHBondContact OD1-OG 3.18Å; D266-S366 PolarHBondContact OD2-N 3.11Å; D266-S367 PolarHBondContact OD2-N 2.61Å
267	Q	96.4	Very high	94.4	Very high	24 Å²	24	40.8 Å²	40.8	11%	0.112	22%	0.222	C	C	.	.	H	α-helix	trans	-56.7	-45.4	174.6	-70.6	-179.1	43.2	0	0	111.9	F259 L262 P263 L264 L271	F259-Q267 HydrophobicContact CD1-CG 4.27Å; F259-Q267 HydrophobicContact CE1-CB 3.91Å; F259-Q267 HydrophobicContact CE1-CG 3.78Å; F259-Q267 HydrophobicContact CE2-CB 4.29Å; F259-Q267 HydrophobicContact CE2-CG 4.26Å; F259-Q267 HydrophobicContact CZ-CB 3.59Å; F259-Q267 HydrophobicContact CZ-CG 3.78Å; F259-Q267 WeakPolarHBondContact O-CG 3.28Å; F259-Q267 PolarHBondContact O-NE2 2.81Å; L262-Q267 HydrophobicContact CB-CG 4.05Å; L262-Q267 PolarHBondContact O-NE2 3.02Å; P263-Q267 WeakPolarHBondContact O-CG 3.31Å; P263-Q267 PolarHBondContact O-N 2.78Å; L264-Q267 PolarHBondContact O-N 3.32Å; Q267-L271 WeakPolarHBondContact O-CG 3.47Å; Q267-L271 PolarHBondContact O-N 3.29Å; Q267-L271 VanDerWaalsContact O-N 3.12Å
268	V	94.4	Very high	94.4	Very high	77 Å²	77	40.1 Å²	40.1	47%	0.467	22%	0.218	S	C	.	.	H	α-helix	trans	-67	-41.5	178.1	167.3	0	0	0	0	111.4	L264 D265 D266 L271 R272	L264-V268 WeakPolarHBondContact O-CG2 3.16Å; L264-V268 PolarHBondContact O-N 2.69Å; D265-V268 PolarHBondContact O-N 3.16Å; D266-V268 VanDerWaalsContact C-N 3.33Å; D266-V268 PolarHBondContact O-N 2.9Å; V268-L271 PolarHBondContact O-N 2.74Å; V268-R272 HydrophobicContact CG1-CG 4.45Å; V268-R272 VanDerWaalsContact O-CB 3.3Å; V268-R272 WeakPolarHBondContact O-CB 3.27Å; V268-R272 VanDerWaalsContact O-CG 3.26Å; V268-R272 WeakPolarHBondContact O-CG 3.32Å; V268-R272 PolarHBondContact O-N 3.01Å
269	I	94.7	Very high	94.2	Very high	39 Å²	39	39.3 Å²	39.3	20%	0.2	22%	0.215	C	C	.	.	H	α-helix	trans	-62.4	-44.8	176.4	-72.9	164.7	0	0	0	111.4	D265 D266 R272 A273 A362 G364 L365	D265-I269 WeakPolarHBondContact O-CB 3.25Å; D265-I269 WeakPolarHBondContact O-CD1 3.5Å; D265-I269 WeakPolarHBondContact O-CG1 3.25Å; D265-I269 PolarHBondContact O-N 3.23Å; D266-I269 PolarHBondContact O-N 2.92Å; I269-R272 PolarHBondContact O-N 3.04Å; I269-A273 VanDerWaalsContact O-CB 3.26Å; I269-A273 WeakPolarHBondContact O-CB 3.44Å; I269-A273 PolarHBondContact O-N 3.14Å; I269-A362 HydrophobicContact CG2-CB 3.77Å; I269-G364 WeakPolarHBondContact CD1-O 3.43Å; I269-L365 HydrophobicContact CB-CD2 4.2Å; I269-L365 HydrophobicContact CG2-CD2 3.73Å; I269-L365 HydrophobicContact CG2-CG 4.14Å
270	L	96.5	Very high	93.9	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-43.6	179.3	-68.7	176.7	0	0	0	112.1	F259 L262 D266 A273 G274 L357 F358 N359 A362 L365 V371	F259-L270 HydrophobicContact CE2-CB 4.35Å; F259-L270 HydrophobicContact CE2-CD1 4.29Å; L262-L270 HydrophobicContact CD1-CD1 3.77Å; D266-L270 WeakPolarHBondContact O-CB 3.25Å; D266-L270 VanDerWaalsContact O-CG 3.23Å; D266-L270 WeakPolarHBondContact O-CG 3.39Å; D266-L270 PolarHBondContact O-N 3.17Å; L270-A273 PolarHBondContact O-N 3.26Å; L270-G274 PolarHBondContact O-N 2.92Å; L270-L357 WeakPolarHBondContact CD2-O 3.44Å; L270-F358 HydrophobicContact CD1-CD1 4.44Å; L270-N359 HydrophobicContact CD2-CB 4.36Å; L270-N359 WeakPolarHBondContact CD2-O 3.47Å; L270-A362 HydrophobicContact CD2-CB 4.24Å; L270-L365 HydrophobicContact CD2-CD1 4.22Å; L270-L365 HydrophobicContact CD2-CD2 3.87Å; L270-L365 HydrophobicContact CG-CD2 3.97Å; L270-V371 HydrophobicContact CD1-CG1 4.23Å; L270-V371 HydrophobicContact CD1-CG2 4.15Å; L270-V371 HydrophobicContact CD2-CG1 3.85Å; L270-V371 HydrophobicContact CD2-CG2 4.49Å
271	L	95.4	Very high	93.8	Very high	18 Å²	18	37.6 Å²	37.6	9%	0.094	20%	0.201	C	C	.	.	H	α-helix	trans	-62.5	-47.2	174.4	-75.8	165.3	0	0	0	111.5	L249 V250 A253 F259 Q267 V268 A273 G274 W275 L357	L249-L271 HydrophobicContact CG-CD2 4.36Å; V250-L271 HydrophobicContact CG2-CD1 4.28Å; A253-L271 HydrophobicContact CB-CD2 3.88Å; F259-L271 HydrophobicContact CE1-CD1 4.37Å; F259-L271 HydrophobicContact CZ-CD1 3.9Å; F259-L271 HydrophobicContact CZ-CG 3.98Å; Q267-L271 WeakPolarHBondContact O-CG 3.47Å; Q267-L271 PolarHBondContact O-N 3.29Å; Q267-L271 VanDerWaalsContact O-N 3.12Å; V268-L271 PolarHBondContact O-N 2.74Å; L271-A273 VanDerWaalsContact C-N 3.27Å; L271-A273 PolarHBondContact O-N 3.07Å; L271-G274 PolarHBondContact O-N 3.48Å; L271-W275 WeakPolarHBondContact O-CB 3.29Å; L271-W275 PolarHBondContact O-N 3.02Å; L271-L357 HydrophobicContact CD2-CD1 4.08Å; L271-L357 HydrophobicContact CG-CD1 4.45Å
272	R	90.8	Very high	93.7	Very high	55 Å²	55	31.5 Å²	31.5	21%	0.208	17%	0.174	C	C	.	.	H	α-helix	trans	-61.1	-32.8	176	-76.9	170.1	163.5	-81	-4	113.2	V268 I269 E435 M436 E438	V268-R272 HydrophobicContact CG1-CG 4.45Å; V268-R272 VanDerWaalsContact O-CB 3.3Å; V268-R272 WeakPolarHBondContact O-CB 3.27Å; V268-R272 VanDerWaalsContact O-CG 3.26Å; V268-R272 WeakPolarHBondContact O-CG 3.32Å; V268-R272 PolarHBondContact O-N 3.01Å; I269-R272 PolarHBondContact O-N 3.04Å; R272-E435 VanDerWaalsContact CZ-O 3.25Å; R272-E435 IonicContact CZ-OE1 2.82Å; R272-E435 PolarHBondContact NH1-O 3.37Å; R272-E435 PolarHBondContact NH2-O 2.54Å; R272-E435 IonicContact NH2-OE1 1.92Å; R272-E435 PolarHBondContact NH2-OE1 2.8Å; R272-M436 HydrophobicContact CG-CE 4.06Å; R272-M436 HydrophobicContact CG-SD 3.61Å; R272-E438 PolarHBondContact NH1-O 2.72Å; R272-E438 VanDerWaalsContact NH1-O 3.15Å
273	A	93.1	Very high	93.3	Very high	36 Å²	36	32.9 Å²	32.9	30%	0.298	18%	0.179	S	C	.	.	H	α-helix	trans	-78	-21.3	179.9	0	0	0	0	0	114.7	I269 L270 L271 A362	I269-A273 VanDerWaalsContact O-CB 3.26Å; I269-A273 WeakPolarHBondContact O-CB 3.44Å; I269-A273 PolarHBondContact O-N 3.14Å; L270-A273 PolarHBondContact O-N 3.26Å; L271-A273 VanDerWaalsContact C-N 3.27Å; L271-A273 PolarHBondContact O-N 3.07Å; A273-A362 HydrophobicContact CB-CB 3.84Å
274	G	94.5	Very high	93	Very high	4 Å²	4	30.4 Å²	30.4	4%	0.041	16%	0.163	C	C	.	.	H	α-helix	trans	-129.5	-4.7	-170.1	0	0	0	0	0	117.2	L270 L271 N276 E277 L278	L270-G274 PolarHBondContact O-N 2.92Å; L271-G274 PolarHBondContact O-N 3.48Å; G274-N276 VanDerWaalsContact C-N 3.31Å; G274-N276 PolarHBondContact O-N 2.94Å; G274-E277 PolarHBondContact O-N 2.69Å; G274-E277 VanDerWaalsContact O-N 3.13Å; G274-L278 VanDerWaalsContact O-CG 3.26Å; G274-L278 WeakPolarHBondContact O-CG 3.44Å; G274-L278 PolarHBondContact O-N 2.99Å
275	W	93.5	Very high	92.9	Very high	11 Å²	11	25.4 Å²	25.4	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-52.5	-43.3	-170.9	69.6	-88.3	0	0	0	114.6	L246 L249 L271 L278 L279 L415 L418 L433 M436 L437	L246-W275 HydrophobicContact CD2-CB 3.81Å; L246-W275 HydrophobicContact CD2-CD2 4.1Å; L246-W275 HydrophobicContact CD2-CE3 3.8Å; L246-W275 HydrophobicContact CD2-CG 4.15Å; L249-W275 HydrophobicContact CD2-CB 3.94Å; L271-W275 WeakPolarHBondContact O-CB 3.29Å; L271-W275 PolarHBondContact O-N 3.02Å; W275-L278 PolarHBondContact O-N 3.38Å; W275-L279 HydrophobicContact CE3-CD1 4.01Å; W275-L279 HydrophobicContact CZ3-CD1 4.32Å; W275-L279 WeakPolarHBondContact O-CG 3.34Å; W275-L279 PolarHBondContact O-N 3.42Å; W275-L415 HydrophobicContact CZ2-CD2 3.82Å; W275-L418 HydrophobicContact CH2-CD1 3.86Å; W275-L418 HydrophobicContact CZ2-CD1 4.49Å; W275-L433 HydrophobicContact CH2-CD1 3.64Å; W275-L433 HydrophobicContact CH2-CG 4.38Å; W275-L433 HydrophobicContact CZ2-CD1 4.48Å; W275-L433 HydrophobicContact CZ3-CD1 3.68Å; W275-M436 HydrophobicContact CB-CE 3.69Å; W275-M436 HydrophobicContact CG-CE 3.66Å; W275-L437 HydrophobicContact CZ2-CD2 4.07Å; W275-L437 HydrophobicContact CZ2-CG 4.4Å
276	N	91.6	Very high	92.5	Very high	7 Å²	7	22.7 Å²	22.7	4%	0.037	12%	0.117	C	C	.	.	H	α-helix	trans	-62.5	-47.6	-179.6	62.8	-41	0	0	0	111.2	G274 L279 I280 G411 L415	G274-N276 VanDerWaalsContact C-N 3.31Å; G274-N276 PolarHBondContact O-N 2.94Å; N276-L279 PolarHBondContact O-N 2.95Å; N276-I280 WeakPolarHBondContact O-CB 3.49Å; N276-I280 WeakPolarHBondContact O-CD1 3.16Å; N276-I280 WeakPolarHBondContact O-CG1 3.45Å; N276-I280 PolarHBondContact O-N 3.45Å; N276-G411 VanDerWaalsContact ND2-C 3.27Å; N276-G411 PolarHBondContact ND2-O 3.37Å; N276-L415 HydrophobicContact CB-CD2 4.3Å; N276-L415 HydrophobicContact CB-CG 4.35Å; N276-L415 VanDerWaalsContact ND2-CD1 3.31Å; N276-L415 WeakPolarHBondContact ND2-CD1 3.43Å; N276-L415 WeakPolarHBondContact ND2-CG 3.37Å
277	E	95.4	Very high	91.8	Very high	14 Å²	14	22.7 Å²	22.7	7%	0.065	12%	0.118	C	C	.	.	H	α-helix	trans	-68.8	-35.8	178.9	-72.1	175.1	-130.4	0	0	111.6	G274 A281 V356 L407 R408	G274-E277 PolarHBondContact O-N 2.69Å; G274-E277 VanDerWaalsContact O-N 3.13Å; E277-A281 VanDerWaalsContact O-CB 3.25Å; E277-A281 WeakPolarHBondContact O-CB 3.26Å; E277-A281 PolarHBondContact O-N 3.35Å; E277-V356 HydrophobicContact CB-CG1 3.86Å; E277-L407 HydrophobicContact CB-CD2 4.21Å; E277-L407 HydrophobicContact CB-CG 4.08Å; E277-L407 HydrophobicContact CG-CG 4.25Å; E277-R408 WeakPolarHBondContact OE1-CD 3.29Å; E277-R408 IonicContact OE1-CZ 2.88Å; E277-R408 IonicContact OE1-NE 2.94Å; E277-R408 IonicContact OE1-NH1 3.57Å; E277-R408 PolarHBondContact OE1-NH1 2.99Å; E277-R408 WeakPolarHBondContact OE2-CA 3.5Å; E277-R408 WeakPolarHBondContact OE2-CD 3.36Å
278	L	95.8	Very high	91.2	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-65.5	-43.1	175.2	-67.8	166.1	0	0	0	112.4	L249 W252 G274 W275 S282 R353 V356 L357	L249-L278 HydrophobicContact CD1-CB 3.72Å; L249-L278 HydrophobicContact CD1-CD1 4.12Å; L249-L278 HydrophobicContact CD1-CG 4.42Å; L249-L278 HydrophobicContact CD2-CB 3.95Å; L249-L278 HydrophobicContact CD2-CD1 4.08Å; L249-L278 HydrophobicContact CG-CB 4.5Å; W252-L278 HydrophobicContact CH2-CD2 3.82Å; W252-L278 HydrophobicContact CZ3-CD1 4.21Å; W252-L278 HydrophobicContact CZ3-CD2 3.83Å; G274-L278 VanDerWaalsContact O-CG 3.26Å; G274-L278 WeakPolarHBondContact O-CG 3.44Å; G274-L278 PolarHBondContact O-N 2.99Å; W275-L278 PolarHBondContact O-N 3.38Å; L278-S282 WeakPolarHBondContact O-CB 3.41Å; L278-S282 PolarHBondContact O-N 2.93Å; L278-S282 VanDerWaalsContact O-N 3.16Å; L278-R353 HydrophobicContact CD2-CB 3.79Å; L278-R353 HydrophobicContact CD2-CG 4.26Å; L278-R353 WeakPolarHBondContact CD2-O 3.42Å; L278-V356 HydrophobicContact CD2-CB 4.01Å; L278-V356 HydrophobicContact CD2-CG1 3.96Å; L278-V356 HydrophobicContact CG-CG1 3.93Å; L278-L357 HydrophobicContact CD1-CD1 4.12Å; L278-L357 HydrophobicContact CD2-CB 4.44Å
279	L	90.4	Very high	90.3	Very high	26 Å²	26	24.2 Å²	24.2	14%	0.136	13%	0.129	C	C	.	.	H	α-helix	trans	-69	-44.7	175.5	-69.5	-172.6	0	0	0	111.9	A242 Q245 L246 L249 W275 N276 A281 S282 F283	A242-L279 HydrophobicContact CB-CD1 4.11Å; Q245-L279 HydrophobicContact CB-CD1 4.38Å; Q245-L279 HydrophobicContact CB-CD2 3.67Å; L246-L279 HydrophobicContact CD2-CD1 4.18Å; L246-L279 HydrophobicContact CG-CD1 4.44Å; L249-L279 HydrophobicContact CB-CD2 4.33Å; L249-L279 HydrophobicContact CD2-CD2 4.37Å; L249-L279 HydrophobicContact CD2-CG 4.4Å; W275-L279 HydrophobicContact CE3-CD1 4.01Å; W275-L279 HydrophobicContact CZ3-CD1 4.32Å; W275-L279 WeakPolarHBondContact O-CG 3.34Å; W275-L279 PolarHBondContact O-N 3.42Å; N276-L279 PolarHBondContact O-N 2.95Å; L279-A281 VanDerWaalsContact C-N 3.32Å; L279-A281 PolarHBondContact O-N 2.69Å; L279-S282 PolarHBondContact O-N 3.1Å; L279-F283 WeakPolarHBondContact O-CB 3.45Å; L279-F283 PolarHBondContact O-N 3.43Å
280	I	90.2	Very high	88.9	Confident	25 Å²	25	23.9 Å²	23.9	13%	0.128	13%	0.127	C	C	.	.	H	α-helix	trans	-62	-40	178.3	-68.8	162.9	0	0	0	110.9	N276 S284 V331 L335 L407 I410 C414	N276-I280 WeakPolarHBondContact O-CB 3.49Å; N276-I280 WeakPolarHBondContact O-CD1 3.16Å; N276-I280 WeakPolarHBondContact O-CG1 3.45Å; N276-I280 PolarHBondContact O-N 3.45Å; I280-S284 VanDerWaalsContact O-CB 3.24Å; I280-S284 WeakPolarHBondContact O-CB 3.41Å; I280-S284 PolarHBondContact O-N 3.01Å; I280-S284 PolarHBondContact O-OG 3.33Å; I280-V331 HydrophobicContact CG2-CG2 4.48Å; I280-L335 HydrophobicContact CG2-CD1 3.62Å; I280-L407 HydrophobicContact CB-CD1 4.03Å; I280-L407 HydrophobicContact CG2-CD1 3.67Å; I280-I410 HydrophobicContact CG2-CG2 4.4Å; I280-C414 HydrophobicContact CD1-CB 4.14Å
281	A	94.1	Very high	86.8	Confident	6 Å²	6	32 Å²	32	5%	0.05	16%	0.163	C	C	.	.	H	α-helix	trans	-64	-46.9	175.7	0	0	0	0	0	112.3	E277 L279 S284 H285 L349 R353 L407	E277-A281 VanDerWaalsContact O-CB 3.25Å; E277-A281 WeakPolarHBondContact O-CB 3.26Å; E277-A281 PolarHBondContact O-N 3.35Å; L279-A281 VanDerWaalsContact C-N 3.32Å; L279-A281 PolarHBondContact O-N 2.69Å; A281-S284 PolarHBondContact O-N 3.46Å; A281-H285 PolarHBondContact O-N 2.64Å; A281-H285 VanDerWaalsContact O-N 3.12Å; A281-L349 HydrophobicContact CB-CD1 4.33Å; A281-R353 HydrophobicContact CB-CG 4.08Å; A281-L407 HydrophobicContact CB-CD1 4.19Å; A281-L407 HydrophobicContact CB-CD2 3.96Å
282	S	90.4	Very high	84.7	Confident	10 Å²	10	37 Å²	37	7%	0.07	19%	0.189	C	C	.	.	H	α-helix	trans	-60.5	-49.5	178	179.2	0	0	0	0	112	L278 L279 S284 H285 R286	L278-S282 WeakPolarHBondContact O-CB 3.41Å; L278-S282 PolarHBondContact O-N 2.93Å; L278-S282 VanDerWaalsContact O-N 3.16Å; L279-S282 PolarHBondContact O-N 3.1Å; S282-S284 PolarHBondContact O-N 3.04Å; S282-H285 PolarHBondContact O-N 2.44Å; S282-R286 PolarHBondContact O-N 2.7Å
283	F	85.8	Confident	82.4	Confident	39 Å²	39	35.6 Å²	35.6	17%	0.171	19%	0.192	C	C	.	.	H	α-helix	trans	-57.8	-48.8	174.7	177.8	-104.8	0	0	0	111.8	L279 H285 R286 S287 L296 E299	L279-F283 WeakPolarHBondContact O-CB 3.45Å; L279-F283 PolarHBondContact O-N 3.43Å; F283-H285 PolarHBondContact O-N 3.2Å; F283-R286 PolarHBondContact O-N 3.42Å; F283-S287 PolarHBondContact O-N 2.94Å; F283-S287 VanDerWaalsContact O-N 3.12Å; F283-S287 PolarHBondContact O-OG 3.35Å; F283-L296 HydrophobicContact CE1-CD2 3.55Å; F283-L296 HydrophobicContact CE2-CD2 4.47Å; F283-L296 HydrophobicContact CZ-CD2 3.52Å; F283-E299 HydrophobicContact CE2-CG 4.38Å
284	S	89.3	Confident	79.9	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60	-32.2	-178.5	-60.4	0	0	0	0	113.4	I280 A281 S282 L335	I280-S284 VanDerWaalsContact O-CB 3.24Å; I280-S284 WeakPolarHBondContact O-CB 3.41Å; I280-S284 PolarHBondContact O-N 3.01Å; I280-S284 PolarHBondContact O-OG 3.33Å; A281-S284 PolarHBondContact O-N 3.46Å; S282-S284 PolarHBondContact O-N 3.04Å; S284-L335 WeakPolarHBondContact OG-CD1 3.24Å
285	H	90.4	Very high	77.5	Confident	23 Å²	23	40.4 Å²	40.4	11%	0.106	22%	0.221	C	C	.	.	H	α-helix	trans	-78.1	-44.7	176.3	-169.5	-85.9	0	0	0	112.2	A281 S282 F283 S287 I288 M339 M344 L349	A281-H285 PolarHBondContact O-N 2.64Å; A281-H285 VanDerWaalsContact O-N 3.12Å; S282-H285 PolarHBondContact O-N 2.44Å; F283-H285 PolarHBondContact O-N 3.2Å; H285-S287 PolarHBondContact O-N 3.08Å; H285-S287 VanDerWaalsContact O-N 3.16Å; H285-I288 HydrophobicContact CB-CD1 4.3Å; H285-I288 WeakPolarHBondContact CD2-CD1 3.36Å; H285-I288 VanDerWaalsContact O-CB 3.28Å; H285-I288 WeakPolarHBondContact O-CB 3.26Å; H285-I288 WeakPolarHBondContact O-CD1 3.44Å; H285-I288 VanDerWaalsContact O-CG1 3.24Å; H285-I288 WeakPolarHBondContact O-CG1 3.13Å; H285-I288 PolarHBondContact O-N 3.3Å; H285-M339 HydrophobicContact CB-SD 4.26Å; H285-M344 PolarHBondContact NE2-O 3Å; H285-L349 HydrophobicContact CB-CD1 3.84Å; H285-L349 HydrophobicContact CB-CD2 3.58Å; H285-L349 HydrophobicContact CB-CG 4.24Å
286	R	84.8	Confident	75.1	Confident	61 Å²	61	40.2 Å²	40.2	23%	0.23	22%	0.22	C	C	.	.	H	α-helix	trans	-56.2	-32.9	177.9	-172.8	164	64.1	-146.1	6	112.8	Q245 S282 F283 P289	Q245-R286 VanDerWaalsContact OE1-NH1 3.08Å; S282-R286 PolarHBondContact O-N 2.7Å; F283-R286 PolarHBondContact O-N 3.42Å; R286-P289 WeakPolarHBondContact O-CD 2.99Å
287	S	81.6	Confident	72.7	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.007	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-2.2	178.6	-48.7	0	0	0	0	115.7	F283 H285 L290 L296 E299	F283-S287 PolarHBondContact O-N 2.94Å; F283-S287 VanDerWaalsContact O-N 3.12Å; F283-S287 PolarHBondContact O-OG 3.35Å; H285-S287 PolarHBondContact O-N 3.08Å; H285-S287 VanDerWaalsContact O-N 3.16Å; S287-L290 WeakPolarHBondContact O-CB 3.49Å; S287-L290 PolarHBondContact O-N 3.16Å; S287-L290 VanDerWaalsContact O-N 3.07Å; S287-L296 VanDerWaalsContact CB-CD2 3.42Å; S287-L296 VanDerWaalsContact OG-CD2 3.22Å; S287-L296 WeakPolarHBondContact OG-CD2 3.47Å; S287-E299 WeakPolarHBondContact CA-OE2 3.35Å; S287-E299 WeakPolarHBondContact CB-OE2 3.44Å; S287-E299 PolarHBondContact N-OE2 3.47Å; S287-E299 PolarHBondContact OG-OE2 2.84Å
288	I	83.8	Confident	70.1	Confident	31 Å²	31	42.1 Å²	42.1	16%	0.159	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-48.7	173.8	-71.6	168	0	0	0	114.3	H285 L290 M339 R340	H285-I288 HydrophobicContact CB-CD1 4.3Å; H285-I288 WeakPolarHBondContact CD2-CD1 3.36Å; H285-I288 VanDerWaalsContact O-CB 3.28Å; H285-I288 WeakPolarHBondContact O-CB 3.26Å; H285-I288 WeakPolarHBondContact O-CD1 3.44Å; H285-I288 VanDerWaalsContact O-CG1 3.24Å; H285-I288 WeakPolarHBondContact O-CG1 3.13Å; H285-I288 PolarHBondContact O-N 3.3Å; I288-L290 PolarHBondContact O-N 3.11Å; I288-M339 HydrophobicContact CD1-CB 3.54Å; I288-M339 HydrophobicContact CG1-CB 4.04Å; I288-R340 HydrophobicContact CG2-CB 3.98Å; I288-R340 HydrophobicContact CG2-CG 4.35Å; I288-R340 PolarHBondContact O-NH1 3.41Å
289	P	75	Confident	67.6	Low	102 Å²	102	43.2 Å²	43.2	66%	0.662	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-13.9	-179.8	26.6	-36.8	0	0	0	114.1	R286 K291	R286-P289 WeakPolarHBondContact O-CD 2.99Å; P289-K291 PolarHBondContact O-N 2.93Å
290	L	65.2	Low	65.4	Low	31 Å²	31	44.4 Å²	44.4	16%	0.162	25%	0.248	C	C	.	.	S	Bend	trans	-78.4	113.7	179.9	-54.6	-178.1	0	0	0	109.9	S287 I288 D292 L295 E299 R340	S287-L290 WeakPolarHBondContact O-CB 3.49Å; S287-L290 PolarHBondContact O-N 3.16Å; S287-L290 VanDerWaalsContact O-N 3.07Å; I288-L290 PolarHBondContact O-N 3.11Å; L290-D292 PolarHBondContact O-N 3.45Å; L290-L295 HydrophobicContact CB-CB 3.87Å; L290-L295 HydrophobicContact CB-CD1 4.49Å; L290-L295 HydrophobicContact CD1-CB 4.17Å; L290-L295 HydrophobicContact CD2-CB 4.3Å; L290-L295 HydrophobicContact CD2-CD1 4.39Å; L290-L295 HydrophobicContact CG-CB 4.34Å; L290-E299 HydrophobicContact CD1-CB 4.06Å; L290-R340 PolarHBondContact O-NH1 2.9Å
291	K	51.3	Low	63	Low	172 Å²	172	46.4 Å²	46.4	75%	0.748	26%	0.257	S	S	*	.			trans	-75.1	122.2	174	-73.6	-173.2	175.5	-177.4	0	109.9	P289	P289-K291 PolarHBondContact O-N 2.93Å
292	D	51.4	Low	60.4	Low	123 Å²	123	53.3 Å²	53.3	66%	0.658	28%	0.282	S	S	*	.	S	Bend	trans	60.4	153.6	176.4	-53	-46.6	0	0	0	116.5	L290 A294 L295	L290-D292 PolarHBondContact O-N 3.45Å; D292-A294 PolarHBondContact O-N 2.81Å; D292-L295 PolarHBondContact O-N 2.68Å
293	G	43.7	Very low	57.9	Low	25 Å²	25	57.4 Å²	57.4	26%	0.258	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.5	-164.7	0	0	0	0	0	115.6	L295 L296	G293-L295 PolarHBondContact O-N 3.35Å; G293-L295 VanDerWaalsContact O-N 3.12Å; G293-L296 PolarHBondContact O-N 3.27Å; G293-L296 VanDerWaalsContact O-N 3.12Å
294	A	41	Very low	55.5	Low	67 Å²	67	59.4 Å²	59.4	55%	0.554	32%	0.322	S	S	*	.	H	α-helix	trans	-55.7	-27.6	175.5	0	0	0	0	0	113.4	D292	D292-A294 PolarHBondContact O-N 2.81Å
295	L	42.3	Very low	52.8	Low	75 Å²	75	63.6 Å²	63.6	39%	0.393	36%	0.357	S	S	.	.	H	α-helix	trans	-94.5	-16.9	178.6	-72.5	175.8	0	0	0	114.6	L290 D292 G293 A297 S298 E299	L290-L295 HydrophobicContact CB-CB 3.87Å; L290-L295 HydrophobicContact CB-CD1 4.49Å; L290-L295 HydrophobicContact CD1-CB 4.17Å; L290-L295 HydrophobicContact CD2-CB 4.3Å; L290-L295 HydrophobicContact CD2-CD1 4.39Å; L290-L295 HydrophobicContact CG-CB 4.34Å; D292-L295 PolarHBondContact O-N 2.68Å; G293-L295 PolarHBondContact O-N 3.35Å; G293-L295 VanDerWaalsContact O-N 3.12Å; L295-A297 VanDerWaalsContact C-N 3.32Å; L295-S298 CarbonylContact O-C 3.58Å; L295-S298 WeakPolarHBondContact O-CA 3.47Å; L295-S298 VanDerWaalsContact O-CB 3.29Å; L295-S298 WeakPolarHBondContact O-CB 3.18Å; L295-S298 PolarHBondContact O-N 2.7Å; L295-E299 PolarHBondContact O-N 1.92Å
296	L	43.4	Very low	50	Low	6 Å²	6	71 Å²	71	3%	0.031	39%	0.391	C	S	.	.	H	α-helix	trans	-65.3	-38.7	171.9	-96.4	154.2	0	0	0	111.2	F283 S287 G293 S298 E299 L300 F328 L332	F283-L296 HydrophobicContact CE1-CD2 3.55Å; F283-L296 HydrophobicContact CE2-CD2 4.47Å; F283-L296 HydrophobicContact CZ-CD2 3.52Å; S287-L296 VanDerWaalsContact CB-CD2 3.42Å; S287-L296 VanDerWaalsContact OG-CD2 3.22Å; S287-L296 WeakPolarHBondContact OG-CD2 3.47Å; G293-L296 PolarHBondContact O-N 3.27Å; G293-L296 VanDerWaalsContact O-N 3.12Å; L296-S298 VanDerWaalsContact C-N 3.32Å; L296-E299 WeakPolarHBondContact O-CB 3.46Å; L296-E299 PolarHBondContact O-N 3.42Å; L296-E299 VanDerWaalsContact O-N 3.16Å; L296-L300 PolarHBondContact O-N 2.87Å; L296-F328 HydrophobicContact CB-CE1 4.36Å; L296-F328 HydrophobicContact CB-CE2 4.01Å; L296-F328 HydrophobicContact CB-CZ 3.46Å; L296-F328 VanDerWaalsContact CB-CZ 3.46Å; L296-F328 HydrophobicContact CD1-CZ 4.41Å; L296-F328 HydrophobicContact CG-CZ 4.43Å; L296-L332 HydrophobicContact CD1-CB 4.26Å; L296-L332 HydrophobicContact CD1-CD1 3.82Å; L296-L332 HydrophobicContact CD1-CD2 4.33Å; L296-L332 HydrophobicContact CD1-CG 4.35Å
297	A	42.1	Very low	47.5	Very low	16 Å²	16	76.2 Å²	76.2	13%	0.132	42%	0.42	C	S	.	.	H	α-helix	trans	-64.9	-37.9	168.2	0	0	0	0	0	111.6	L295 E299 L300 Q301 V310	L295-A297 VanDerWaalsContact C-N 3.32Å; A297-E299 PolarHBondContact O-N 3.47Å; A297-L300 CarbonylContact O-C 3.47Å; A297-L300 WeakPolarHBondContact O-CA 3.04Å; A297-L300 WeakPolarHBondContact O-CB 3.03Å; A297-L300 PolarHBondContact O-N 3.33Å; A297-Q301 VanDerWaalsContact O-CB 3.23Å; A297-Q301 WeakPolarHBondContact O-CB 3.31Å; A297-Q301 PolarHBondContact O-N 3.47Å; A297-Q301 VanDerWaalsContact O-N 3.11Å; A297-V310 HydrophobicContact CB-CB 4.17Å; A297-V310 HydrophobicContact CB-CG1 3.27Å; A297-V310 HydrophobicContact CB-CG2 4.14Å
298	S	40.9	Very low	45.1	Very low	45 Å²	45	81 Å²	81	32%	0.315	46%	0.46	S	S	.	.	H	α-helix	trans	-63.8	-16	172.4	-166.3	0	0	0	0	113.8	L295 L296 Q301 R302	L295-S298 CarbonylContact O-C 3.58Å; L295-S298 WeakPolarHBondContact O-CA 3.47Å; L295-S298 VanDerWaalsContact O-CB 3.29Å; L295-S298 WeakPolarHBondContact O-CB 3.18Å; L295-S298 PolarHBondContact O-N 2.7Å; L296-S298 VanDerWaalsContact C-N 3.32Å; S298-Q301 CarbonylContact O-C 3.56Å; S298-Q301 VanDerWaalsContact O-C 3.26Å; S298-Q301 PolarHBondContact O-N 3.32Å; S298-R302 WeakPolarHBondContact O-CG 3.41Å; S298-R302 PolarHBondContact O-N 3.1Å
299	E	41.8	Very low	42.6	Very low	23 Å²	23	81.2 Å²	81.2	11%	0.107	47%	0.469	C	S	.	.	H	α-helix	trans	-88.3	-20.6	173.4	-163.3	140.1	-95.1	0	0	112.9	F283 S287 L290 L295 L296 A297 R302	F283-E299 HydrophobicContact CE2-CG 4.38Å; S287-E299 WeakPolarHBondContact CA-OE2 3.35Å; S287-E299 WeakPolarHBondContact CB-OE2 3.44Å; S287-E299 PolarHBondContact N-OE2 3.47Å; S287-E299 PolarHBondContact OG-OE2 2.84Å; L290-E299 HydrophobicContact CD1-CB 4.06Å; L295-E299 PolarHBondContact O-N 1.92Å; L296-E299 WeakPolarHBondContact O-CB 3.46Å; L296-E299 PolarHBondContact O-N 3.42Å; L296-E299 VanDerWaalsContact O-N 3.16Å; A297-E299 PolarHBondContact O-N 3.47Å; E299-R302 IonicContact OE1-CZ 3.32Å; E299-R302 IonicContact OE1-NE 3.16Å; E299-R302 IonicContact OE1-NH2 3.1Å; E299-R302 PolarHBondContact OE1-NH2 2.82Å
300	L	44	Very low	40.7	Very low	52 Å²	52	78.1 Å²	78.1	27%	0.272	45%	0.448	S	S	.	.	S	Bend	trans	-81.7	-1.4	159.7	-65.7	170.9	0	0	0	112.5	I238 L296 A297	I238-L300 HydrophobicContact CD1-CD1 3.97Å; I238-L300 HydrophobicContact CG1-CD1 3.73Å; I238-L300 HydrophobicContact CG1-CD2 3.8Å; I238-L300 HydrophobicContact CG1-CG 4.42Å; L296-L300 PolarHBondContact O-N 2.87Å; A297-L300 CarbonylContact O-C 3.47Å; A297-L300 WeakPolarHBondContact O-CA 3.04Å; A297-L300 WeakPolarHBondContact O-CB 3.03Å; A297-L300 PolarHBondContact O-N 3.33Å
301	Q	40.2	Very low	39.2	Very low	67 Å²	67	80.8 Å²	80.8	31%	0.313	48%	0.484	S	S	.	.			trans	-141.2	24.1	-169	-152.2	168.7	17.9	0	0	113.1	A297 S298 D303 S304	A297-Q301 VanDerWaalsContact O-CB 3.23Å; A297-Q301 WeakPolarHBondContact O-CB 3.31Å; A297-Q301 PolarHBondContact O-N 3.47Å; A297-Q301 VanDerWaalsContact O-N 3.11Å; S298-Q301 CarbonylContact O-C 3.56Å; S298-Q301 VanDerWaalsContact O-C 3.26Å; S298-Q301 PolarHBondContact O-N 3.32Å; Q301-D303 PolarHBondContact O-N 2.81Å; Q301-S304 PolarHBondContact O-N 3.46Å
302	R	40.5	Very low	38.3	Very low	150 Å²	150	76.2 Å²	76.2	57%	0.566	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.1	173.9	-77	-161.5	-166.2	-173.2	8.5	113.4	S298 E299 S304	S298-R302 WeakPolarHBondContact O-CG 3.41Å; S298-R302 PolarHBondContact O-N 3.1Å; E299-R302 IonicContact OE1-CZ 3.32Å; E299-R302 IonicContact OE1-NE 3.16Å; E299-R302 IonicContact OE1-NH2 3.1Å; E299-R302 PolarHBondContact OE1-NH2 2.82Å; R302-S304 PolarHBondContact O-N 2.96Å
303	D	37.1	Very low	37.6	Very low	97 Å²	97	73.5 Å²	73.5	52%	0.519	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	9.9	173.7	-65.9	-25.2	0	0	0	113.4	S222 Q301	S222-D303 PolarHBondContact OG-OD1 3.16Å; Q301-D303 PolarHBondContact O-N 2.81Å
304	S	35.2	Very low	37.5	Very low	81 Å²	81	77.8 Å²	77.8	57%	0.566	47%	0.474	S	S	*	.			trans	-142.2	131	169.1	-166.2	0	0	0	0	114.2	Q301 R302	Q301-S304 PolarHBondContact O-N 3.46Å; R302-S304 PolarHBondContact O-N 2.96Å
305	A	32.5	Very low	37.2	Very low	88 Å²	88	81 Å²	81	73%	0.727	48%	0.482	S	S	*	.			trans	-98.3	141.5	176	0	0	0	0	0	111.1
306	H	32.8	Very low	37.1	Very low	179 Å²	179	87.4 Å²	87.4	83%	0.829	50%	0.501	S	S	*	.			trans	60.5	102.3	-176.9	-83.9	-116.8	0	0	0	115.7
307	M	31	Very low	36.9	Very low	170 Å²	170	96 Å²	96	84%	0.837	54%	0.541	S	S	*	.				-172.5	156	109	-97.6	-66.5	-83.9	0	0	110.8	G309	M307-G309 PolarHBondContact O-N 3.37Å
308	A	31.2	Very low	37	Very low	102 Å²	102	97.7 Å²	97.7	84%	0.843	55%	0.552	S	S	*	*			trans	-71.2	116.6	168.4	0	0	0	0	0	108.8
309	G	32.2	Very low	37.2	Very low	35 Å²	35	101.3 Å²	101.3	36%	0.361	57%	0.572	S	S	.	*			trans	-158.6	-35.2	-171.5	0	0	0	0	0	117.7	M307 G311 A312 I313	M307-G309 PolarHBondContact O-N 3.37Å; G309-G311 VanDerWaalsContact C-N 3.26Å; G309-G311 PolarHBondContact O-N 3.45Å; G309-A312 CarbonylContact O-C 3.57Å; G309-A312 WeakPolarHBondContact O-CA 3.28Å; G309-A312 WeakPolarHBondContact O-CB 3.26Å; G309-A312 PolarHBondContact O-N 2.91Å; G309-I313 PolarHBondContact O-N 3.15Å
310	V	34.6	Very low	37.5	Very low	36 Å²	36	104 Å²	104	22%	0.218	58%	0.584	C	S	.	*	G	3₁₀ helix	trans	-74.5	-14.3	-172.5	-154	0	0	0	0	114.2	A297 A312 I313	A297-V310 HydrophobicContact CB-CB 4.17Å; A297-V310 HydrophobicContact CB-CG1 3.27Å; A297-V310 HydrophobicContact CB-CG2 4.14Å; V310-A312 PolarHBondContact O-N 3.13Å; V310-A312 VanDerWaalsContact O-N 3.14Å; V310-I313 HydrophobicContact CB-CD1 4.43Å; V310-I313 HydrophobicContact CG1-CB 4.32Å; V310-I313 HydrophobicContact CG1-CD1 4.27Å; V310-I313 HydrophobicContact CG2-CD1 4.3Å
311	G	33.3	Very low	38	Very low	88 Å²	88	103.5 Å²	103.5	91%	0.907	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-65.3	-5	163.4	0	0	0	0	0	114.1	G309	G309-G311 VanDerWaalsContact C-N 3.26Å; G309-G311 PolarHBondContact O-N 3.45Å
312	A	33	Very low	38.9	Very low	75 Å²	75	102.5 Å²	102.5	62%	0.62	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-133.6	5.7	-177.1	0	0	0	0	0	114.2	G309 V310	G309-A312 CarbonylContact O-C 3.57Å; G309-A312 WeakPolarHBondContact O-CA 3.28Å; G309-A312 WeakPolarHBondContact O-CB 3.26Å; G309-A312 PolarHBondContact O-N 2.91Å; V310-A312 PolarHBondContact O-N 3.13Å; V310-A312 VanDerWaalsContact O-N 3.14Å
313	I	37.7	Very low	40	Very low	67 Å²	67	99.2 Å²	99.2	34%	0.344	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.7	-22.5	176.9	-72.6	172.9	0	0	0	112.1	G309 V310	G309-I313 PolarHBondContact O-N 3.15Å; V310-I313 HydrophobicContact CB-CD1 4.43Å; V310-I313 HydrophobicContact CG1-CB 4.32Å; V310-I313 HydrophobicContact CG1-CD1 4.27Å; V310-I313 HydrophobicContact CG2-CD1 4.3Å
314	F	40.6	Very low	41.4	Very low	114 Å²	114	96.2 Å²	96.2	50%	0.5	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.6	47.3	169.7	-72.4	-79	0	0	0	112
315	D	34.3	Very low	43.2	Very low	136 Å²	136	93 Å²	93	73%	0.727	54%	0.544	S	S	*	.			trans	-67.6	137.8	160.2	-153	-13.1	0	0	0	109.4	E317	D315-E317 PolarHBondContact O-N 3.43Å; D315-E317 VanDerWaalsContact O-N 3.11Å
316	R	40.7	Very low	45.5	Very low	209 Å²	209	91.2 Å²	91.2	79%	0.789	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	36.4	-136.7	-151.7	-175.6	179.5	-83.2	-1.1	114.9
317	E	38.3	Very low	47.8	Very low	187 Å²	187	83.6 Å²	83.6	87%	0.874	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-12.9	-167.4	-57.5	-160.3	125.6	0	0	115.4	D315	D315-E317 PolarHBondContact O-N 3.43Å; D315-E317 VanDerWaalsContact O-N 3.11Å
318	S	45.1	Very low	50	Low	51 Å²	51	77.8 Å²	77.8	36%	0.357	47%	0.465	S	S	.	.			trans	-104	126.5	-178.8	164.1	0	0	0	0	112.9	Q320 S321 A322	S318-Q320 PolarHBondContact OG-N 3.31Å; S318-S321 VanDerWaalsContact CB-OG 3.31Å; S318-S321 WeakPolarHBondContact CB-OG 2.84Å; S318-S321 PolarHBondContact O-N 3.09Å; S318-S321 PolarHBondContact OG-N 3.21Å; S318-S321 VanDerWaalsContact OG-N 3.11Å; S318-S321 PolarHBondContact OG-OG 3.46Å; S318-A322 PolarHBondContact O-N 3.48Å; S318-A322 VanDerWaalsContact O-N 3.1Å
319	V	44.4	Very low	52.4	Low	121 Å²	121	77.5 Å²	77.5	73%	0.733	45%	0.449	S	S	*	.	H	α-helix	trans	-67	-40.3	176	-179.1	0	0	0	0	111.5	S321 A322 E323	V319-S321 VanDerWaalsContact C-N 3.33Å; V319-S321 PolarHBondContact O-N 3.14Å; V319-A322 PolarHBondContact O-N 3.33Å; V319-E323 PolarHBondContact O-N 3.13Å; V319-E323 VanDerWaalsContact O-N 3.15Å
320	Q	49.9	Very low	55.1	Low	78 Å²	78	79.2 Å²	79.2	36%	0.364	45%	0.445	S	S	.	.	H	α-helix	trans	-60.7	-43.7	176.4	-125.9	64.6	48	0	0	111.3	S318 A322 E323 V324 F420 F421	S318-Q320 PolarHBondContact OG-N 3.31Å; Q320-A322 VanDerWaalsContact C-N 3.3Å; Q320-A322 PolarHBondContact O-N 3.41Å; Q320-E323 PolarHBondContact O-N 3.22Å; Q320-V324 WeakPolarHBondContact O-CG2 3.25Å; Q320-V324 PolarHBondContact O-N 3.18Å; Q320-F420 VanDerWaalsContact NE2-CE1 3.34Å; Q320-F421 HydrophobicContact CG-CE1 3.95Å; Q320-F421 HydrophobicContact CG-CZ 4.19Å
321	S	54.3	Low	57.6	Low	43 Å²	43	78.1 Å²	78.1	30%	0.301	44%	0.438	S	S	.	.	H	α-helix	trans	-66.9	-32.6	178.1	-53.7	0	0	0	0	112.1	S318 V319 G325	S318-S321 VanDerWaalsContact CB-OG 3.31Å; S318-S321 WeakPolarHBondContact CB-OG 2.84Å; S318-S321 PolarHBondContact O-N 3.09Å; S318-S321 PolarHBondContact OG-N 3.21Å; S318-S321 VanDerWaalsContact OG-N 3.11Å; S318-S321 PolarHBondContact OG-OG 3.46Å; V319-S321 VanDerWaalsContact C-N 3.33Å; V319-S321 PolarHBondContact O-N 3.14Å; S321-G325 PolarHBondContact O-N 2.88Å
322	A	58.2	Low	60	Low	46 Å²	46	75.1 Å²	75.1	38%	0.38	40%	0.401	S	S	.	.	H	α-helix	trans	-69.4	-39.5	177.1	0	0	0	0	0	113.1	S318 V319 Q320 G325 A326	S318-A322 PolarHBondContact O-N 3.48Å; S318-A322 VanDerWaalsContact O-N 3.1Å; V319-A322 PolarHBondContact O-N 3.33Å; Q320-A322 VanDerWaalsContact C-N 3.3Å; Q320-A322 PolarHBondContact O-N 3.41Å; A322-G325 PolarHBondContact O-N 3.27Å; A322-A326 PolarHBondContact O-N 2.98Å; A322-A326 VanDerWaalsContact O-N 3.09Å
323	E	63.5	Low	62.6	Low	81 Å²	81	75.2 Å²	75.2	38%	0.379	39%	0.394	S	S	.	.	H	α-helix	trans	-74.5	-37.5	179.1	-156.5	-172.4	162.3	0	0	112.3	V319 Q320 G325 A326 I327 K413 H417	V319-E323 PolarHBondContact O-N 3.13Å; V319-E323 VanDerWaalsContact O-N 3.15Å; Q320-E323 PolarHBondContact O-N 3.22Å; E323-G325 VanDerWaalsContact C-N 3.33Å; E323-A326 PolarHBondContact O-N 2.96Å; E323-I327 PolarHBondContact O-N 3.43Å; E323-K413 VanDerWaalsContact OE1-CE 3.28Å; E323-K413 WeakPolarHBondContact OE1-CE 3.37Å; E323-K413 IonicContact OE1-NZ 3.41Å; E323-K413 PolarHBondContact OE1-NZ 3.45Å; E323-H417 WeakPolarHBondContact CB-CE1 3.39Å; E323-H417 WeakPolarHBondContact CG-CE1 3.38Å; E323-H417 VanDerWaalsContact CG-NE2 3.26Å; E323-H417 WeakPolarHBondContact CG-NE2 3.47Å; E323-H417 IonicContact OE1-CE1 3.61Å; E323-H417 PolarHBondContact OE1-CE1 3.44Å; E323-H417 IonicContact OE1-NE2 2.65Å; E323-H417 PolarHBondContact OE1-NE2 3.11Å; E323-H417 IonicContact OE2-CE1 3.26Å; E323-H417 PolarHBondContact OE2-CE1 2.99Å; E323-H417 IonicContact OE2-NE2 3.5Å; E323-H417 PolarHBondContact OE2-NE2 2.97Å; E323-H417 VanDerWaalsContact OE2-NE2 3.1Å
324	V	67.7	Low	65.2	Low	34 Å²	34	74.7 Å²	74.7	21%	0.206	39%	0.39	C	S	.	.	H	α-helix	trans	-63.8	-40	171.1	175.9	0	0	0	0	111	V235 Q320 A326 I327 F328 F421	V235-V324 HydrophobicContact CG2-CG2 4.5Å; Q320-V324 WeakPolarHBondContact O-CG2 3.25Å; Q320-V324 PolarHBondContact O-N 3.18Å; V324-A326 VanDerWaalsContact C-N 3.32Å; V324-A326 PolarHBondContact O-N 3.31Å; V324-I327 PolarHBondContact O-N 3.21Å; V324-I327 VanDerWaalsContact O-N 3.14Å; V324-F328 PolarHBondContact O-N 2.66Å; V324-F328 VanDerWaalsContact O-N 3.13Å; V324-F421 HydrophobicContact CG2-CE2 4.26Å; V324-F421 HydrophobicContact CG2-CZ 4.11Å
325	G	71.3	Confident	67.7	Low	12 Å²	12	69.3 Å²	69.3	12%	0.124	37%	0.366	C	S	.	.	H	α-helix	trans	-56.8	-42.8	172.6	0	0	0	0	0	112.9	S321 A322 E323 I327 F328 D329	S321-G325 PolarHBondContact O-N 2.88Å; A322-G325 PolarHBondContact O-N 3.27Å; E323-G325 VanDerWaalsContact C-N 3.33Å; G325-I327 VanDerWaalsContact C-N 3.28Å; G325-I327 PolarHBondContact O-N 2.94Å; G325-F328 WeakPolarHBondContact O-CB 3.46Å; G325-F328 PolarHBondContact O-N 2.75Å; G325-F328 VanDerWaalsContact O-N 3.11Å; G325-D329 PolarHBondContact O-N 3.38Å
326	A	80.9	Confident	70.3	Confident	51 Å²	51	62.9 Å²	62.9	42%	0.421	33%	0.332	S	S	.	.	H	α-helix	trans	-63.2	-30.5	177	0	0	0	0	0	113.5	A322 E323 V324 R330	A322-A326 PolarHBondContact O-N 2.98Å; A322-A326 VanDerWaalsContact O-N 3.09Å; E323-A326 PolarHBondContact O-N 2.96Å; V324-A326 VanDerWaalsContact C-N 3.32Å; V324-A326 PolarHBondContact O-N 3.31Å; A326-R330 WeakPolarHBondContact O-CG 3.46Å; A326-R330 PolarHBondContact O-N 3.01Å
327	I	82	Confident	72.6	Confident	19 Å²	19	55 Å²	55	10%	0.097	31%	0.306	C	S	.	.	H	α-helix	trans	-71	-42.3	173	-61.3	172.4	0	0	0	110.4	E323 V324 G325 R330 V331 I410 K413 H417	E323-I327 PolarHBondContact O-N 3.43Å; V324-I327 PolarHBondContact O-N 3.21Å; V324-I327 VanDerWaalsContact O-N 3.14Å; G325-I327 VanDerWaalsContact C-N 3.28Å; G325-I327 PolarHBondContact O-N 2.94Å; I327-R330 WeakPolarHBondContact O-CB 3.47Å; I327-R330 PolarHBondContact O-N 2.84Å; I327-V331 PolarHBondContact O-N 2.82Å; I327-I410 HydrophobicContact CG2-CG2 4.42Å; I327-K413 HydrophobicContact CD1-CG 3.85Å; I327-K413 HydrophobicContact CG1-CG 3.93Å; I327-H417 HydrophobicContact CD1-CB 4.43Å
328	F	77.9	Confident	75.3	Confident	49 Å²	49	50.3 Å²	50.3	22%	0.215	28%	0.282	C	S	.	.	H	α-helix	trans	-64.4	-41.6	178.7	-177.1	-92.8	0	0	0	112.3	L296 V324 G325 R330 V331 L332	L296-F328 HydrophobicContact CB-CE1 4.36Å; L296-F328 HydrophobicContact CB-CE2 4.01Å; L296-F328 HydrophobicContact CB-CZ 3.46Å; L296-F328 VanDerWaalsContact CB-CZ 3.46Å; L296-F328 HydrophobicContact CD1-CZ 4.41Å; L296-F328 HydrophobicContact CG-CZ 4.43Å; V324-F328 PolarHBondContact O-N 2.66Å; V324-F328 VanDerWaalsContact O-N 3.13Å; G325-F328 WeakPolarHBondContact O-CB 3.46Å; G325-F328 PolarHBondContact O-N 2.75Å; G325-F328 VanDerWaalsContact O-N 3.11Å; F328-R330 VanDerWaalsContact C-N 3.27Å; F328-R330 PolarHBondContact O-N 2.63Å; F328-V331 WeakPolarHBondContact O-CB 3.28Å; F328-V331 PolarHBondContact O-N 3.46Å; F328-L332 PolarHBondContact O-N 2.89Å
329	D	80.6	Confident	77.7	Confident	96 Å²	96	48.1 Å²	48.1	51%	0.513	27%	0.267	S	S	.	.	H	α-helix	trans	-59.9	-36.2	172.7	-77.2	-24.7	0	0	0	112.2	G325 T333	G325-D329 PolarHBondContact O-N 3.38Å; D329-T333 WeakPolarHBondContact O-CB 3.45Å; D329-T333 PolarHBondContact O-N 2.93Å; D329-T333 PolarHBondContact O-OG1 2.94Å
330	R	88.8	Confident	80	Confident	71 Å²	71	45.3 Å²	45.3	27%	0.268	24%	0.243	S	C	.	.	H	α-helix	trans	-69.5	-42	173.5	-70.3	-177.3	69.5	-149.1	-7.2	112.5	A326 I327 F328 L332 T333 E334 S409 I410	A326-R330 WeakPolarHBondContact O-CG 3.46Å; A326-R330 PolarHBondContact O-N 3.01Å; I327-R330 WeakPolarHBondContact O-CB 3.47Å; I327-R330 PolarHBondContact O-N 2.84Å; F328-R330 VanDerWaalsContact C-N 3.27Å; F328-R330 PolarHBondContact O-N 2.63Å; R330-L332 PolarHBondContact O-N 2.87Å; R330-T333 PolarHBondContact O-N 3.43Å; R330-E334 IonicContact CZ-OE1 2.63Å; R330-E334 VanDerWaalsContact CZ-OE1 3.23Å; R330-E334 IonicContact NE-OE1 2.66Å; R330-E334 PolarHBondContact NE-OE1 2.76Å; R330-E334 IonicContact NH2-OE1 2.75Å; R330-E334 PolarHBondContact NH2-OE1 3.44Å; R330-E334 IonicContact NH2-OE2 2.67Å; R330-E334 VanDerWaalsContact O-CB 3.29Å; R330-E334 WeakPolarHBondContact O-CB 3.09Å; R330-E334 PolarHBondContact O-N 3.35Å; R330-S409 PolarHBondContact NH1-OG 2.84Å; R330-S409 PolarHBondContact NH2-OG 3.25Å; R330-I410 HydrophobicContact CB-CD1 4.11Å; R330-I410 HydrophobicContact CB-CG1 4.18Å
331	V	86.4	Confident	82.1	Confident	12 Å²	12	46.7 Å²	46.7	7%	0.073	25%	0.253	C	S	.	.	I	π-helix	trans	-56.5	-50.6	172.5	170.2	0	0	0	0	110.3	I280 I327 F328 L335 V336 I410	I280-V331 HydrophobicContact CG2-CG2 4.48Å; I327-V331 PolarHBondContact O-N 2.82Å; F328-V331 WeakPolarHBondContact O-CB 3.28Å; F328-V331 PolarHBondContact O-N 3.46Å; V331-L335 WeakPolarHBondContact O-CA 3.44Å; V331-L335 VanDerWaalsContact O-CB 3.28Å; V331-L335 WeakPolarHBondContact O-CB 3.38Å; V331-L335 PolarHBondContact O-N 2.88Å; V331-L335 VanDerWaalsContact O-N 3.08Å; V331-V336 HydrophobicContact CG1-CG2 4.2Å; V331-V336 PolarHBondContact O-N 3.29Å; V331-I410 HydrophobicContact CG2-CG2 3.67Å
332	L	84.2	Confident	84	Confident	25 Å²	25	46 Å²	46	13%	0.131	25%	0.245	C	C	.	.	I	π-helix	trans	-61.6	-46.2	178.3	174.9	52.2	0	0	0	112	L296 F328 R330 V336 N337	L296-L332 HydrophobicContact CD1-CB 4.26Å; L296-L332 HydrophobicContact CD1-CD1 3.82Å; L296-L332 HydrophobicContact CD1-CD2 4.33Å; L296-L332 HydrophobicContact CD1-CG 4.35Å; F328-L332 PolarHBondContact O-N 2.89Å; R330-L332 PolarHBondContact O-N 2.87Å; L332-V336 HydrophobicContact CD1-CB 4.13Å; L332-V336 HydrophobicContact CD1-CG1 4.32Å; L332-N337 VanDerWaalsContact O-CB 3.25Å; L332-N337 WeakPolarHBondContact O-CB 3.24Å; L332-N337 PolarHBondContact O-N 3.41Å; L332-N337 PolarHBondContact O-ND2 2.64Å
333	T	87.1	Confident	85.7	Confident	77 Å²	77	51.3 Å²	51.3	47%	0.472	26%	0.262	S	S	.	.	I	π-helix	trans	-81.1	-41.5	-171.2	-56	0	0	0	0	113.9	D329 R330	D329-T333 WeakPolarHBondContact O-CB 3.45Å; D329-T333 PolarHBondContact O-N 2.93Å; D329-T333 PolarHBondContact O-OG1 2.94Å; R330-T333 PolarHBondContact O-N 3.43Å
334	E	93.1	Very high	87.3	Confident	57 Å²	57	47.9 Å²	47.9	27%	0.266	25%	0.246	S	C	.	.	I	π-helix	trans	-91.2	-30.1	-175.6	-58.1	-175	-125.6	0	0	112.9	R330 K338 R403 A406 I410	R330-E334 IonicContact CZ-OE1 2.63Å; R330-E334 VanDerWaalsContact CZ-OE1 3.23Å; R330-E334 IonicContact NE-OE1 2.66Å; R330-E334 PolarHBondContact NE-OE1 2.76Å; R330-E334 IonicContact NH2-OE1 2.75Å; R330-E334 PolarHBondContact NH2-OE1 3.44Å; R330-E334 IonicContact NH2-OE2 2.67Å; R330-E334 VanDerWaalsContact O-CB 3.29Å; R330-E334 WeakPolarHBondContact O-CB 3.09Å; R330-E334 PolarHBondContact O-N 3.35Å; E334-K338 WeakPolarHBondContact O-CB 3.38Å; E334-K338 WeakPolarHBondContact O-CG 3.33Å; E334-R403 PolarHBondContact O-NH1 3.09Å; E334-A406 HydrophobicContact CB-CB 4.09Å; E334-A406 WeakPolarHBondContact OE2-CB 3.47Å; E334-I410 HydrophobicContact CB-CD1 4.15Å
335	L	92.8	Very high	88.6	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	24%	0.243	C	C	.	.	I	π-helix	trans	-105.4	-74.6	-179.1	-50.4	178	0	0	0	111.2	I280 S284 V331 N337 K338 M339 A406 L407 I410	I280-L335 HydrophobicContact CG2-CD1 3.62Å; S284-L335 WeakPolarHBondContact OG-CD1 3.24Å; V331-L335 WeakPolarHBondContact O-CA 3.44Å; V331-L335 VanDerWaalsContact O-CB 3.28Å; V331-L335 WeakPolarHBondContact O-CB 3.38Å; V331-L335 PolarHBondContact O-N 2.88Å; V331-L335 VanDerWaalsContact O-N 3.08Å; L335-N337 PolarHBondContact O-N 3.29Å; L335-K338 PolarHBondContact O-N 3.33Å; L335-M339 HydrophobicContact CB-CE 4.47Å; L335-M339 VanDerWaalsContact O-CG 3.31Å; L335-M339 WeakPolarHBondContact O-CG 3.43Å; L335-M339 PolarHBondContact O-N 3.41Å; L335-A406 HydrophobicContact CD2-CB 4.16Å; L335-L407 HydrophobicContact CD1-CD1 3.86Å; L335-L407 HydrophobicContact CD2-CB 4.18Å; L335-I410 HydrophobicContact CD1-CD1 3.91Å; L335-I410 HydrophobicContact CD2-CD1 4.43Å; L335-I410 HydrophobicContact CG-CD1 3.88Å
336	V	89.7	Confident	89.7	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	25%	0.253	C	S	.	.	I	π-helix	trans	-54.6	-52.3	-169.6	-174.9	0	0	0	0	111.6	V331 L332 K338 M339 R340	V331-V336 HydrophobicContact CG1-CG2 4.2Å; V331-V336 PolarHBondContact O-N 3.29Å; L332-V336 HydrophobicContact CD1-CB 4.13Å; L332-V336 HydrophobicContact CD1-CG1 4.32Å; V336-K338 VanDerWaalsContact C-N 3.31Å; V336-K338 PolarHBondContact O-N 3.39Å; V336-M339 PolarHBondContact O-N 2.89Å; V336-R340 VanDerWaalsContact O-CB 3.28Å; V336-R340 WeakPolarHBondContact O-CB 3.43Å; V336-R340 PolarHBondContact O-N 2.89Å
337	N	89.3	Confident	90.5	Very high	44 Å²	44	48.5 Å²	48.5	24%	0.235	23%	0.234	C	C	.	.	H	α-helix	trans	-60.3	-39.2	178.1	-78.3	-22.6	0	0	0	112	L332 L335 R340 D341	L332-N337 VanDerWaalsContact O-CB 3.25Å; L332-N337 WeakPolarHBondContact O-CB 3.24Å; L332-N337 PolarHBondContact O-N 3.41Å; L332-N337 PolarHBondContact O-ND2 2.64Å; L335-N337 PolarHBondContact O-N 3.29Å; N337-R340 WeakPolarHBondContact O-CB 3.46Å; N337-R340 PolarHBondContact O-N 3.14Å; N337-R340 PolarHBondContact OD1-NH2 3.34Å; N337-D341 WeakPolarHBondContact O-CB 3.25Å; N337-D341 PolarHBondContact O-N 3.23Å
338	K	94.6	Very high	91.3	Very high	87 Å²	87	47.6 Å²	47.6	38%	0.378	23%	0.23	S	C	.	.	H	α-helix	trans	-78	-32.3	-177.1	-59.5	-65.5	146.5	-146.8	0	113.1	E334 L335 V336 D341 M342	E334-K338 WeakPolarHBondContact O-CB 3.38Å; E334-K338 WeakPolarHBondContact O-CG 3.33Å; L335-K338 PolarHBondContact O-N 3.33Å; V336-K338 VanDerWaalsContact C-N 3.31Å; V336-K338 PolarHBondContact O-N 3.39Å; K338-D341 IonicContact NZ-OD2 2.73Å; K338-D341 PolarHBondContact NZ-OD2 3.1Å; K338-M342 VanDerWaalsContact O-CG 3.25Å; K338-M342 WeakPolarHBondContact O-CG 3.17Å; K338-M342 PolarHBondContact O-N 2.92Å
339	M	94.9	Very high	92.2	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.03	22%	0.221	C	C	.	.	H	α-helix	trans	-66.6	-39.2	169.5	-62.7	173	167.9	0	0	111.1	H285 I288 L335 V336 Q343 M344	H285-M339 HydrophobicContact CB-SD 4.26Å; I288-M339 HydrophobicContact CD1-CB 3.54Å; I288-M339 HydrophobicContact CG1-CB 4.04Å; L335-M339 HydrophobicContact CB-CE 4.47Å; L335-M339 VanDerWaalsContact O-CG 3.31Å; L335-M339 WeakPolarHBondContact O-CG 3.43Å; L335-M339 PolarHBondContact O-N 3.41Å; V336-M339 PolarHBondContact O-N 2.89Å; M339-Q343 PolarHBondContact O-N 3.3Å; M339-Q343 VanDerWaalsContact O-N 3.16Å; M339-M344 HydrophobicContact CB-CB 4.14Å; M339-M344 HydrophobicContact CB-CE 4.44Å; M339-M344 HydrophobicContact CB-SD 4.27Å; M339-M344 HydrophobicContact CE-CE 4.35Å; M339-M344 HydrophobicContact CE-SD 4.16Å; M339-M344 HydrophobicContact CG-CE 3.75Å; M339-M344 HydrophobicContact CG-SD 3.79Å; M339-M344 PolarHBondContact O-N 3.4Å; M339-M344 HydrophobicContact SD-SD 4.17Å
340	R	93.1	Very high	93	Very high	62 Å²	62	40.9 Å²	40.9	23%	0.234	20%	0.196	C	C	.	.	H	α-helix	trans	-64.4	-51.8	173	174.6	156.1	56	-154.5	5.7	112.6	I288 L290 V336 N337 M342 Q343	I288-R340 HydrophobicContact CG2-CB 3.98Å; I288-R340 HydrophobicContact CG2-CG 4.35Å; I288-R340 PolarHBondContact O-NH1 3.41Å; L290-R340 PolarHBondContact O-NH1 2.9Å; V336-R340 VanDerWaalsContact O-CB 3.28Å; V336-R340 WeakPolarHBondContact O-CB 3.43Å; V336-R340 PolarHBondContact O-N 2.89Å; N337-R340 WeakPolarHBondContact O-CB 3.46Å; N337-R340 PolarHBondContact O-N 3.14Å; N337-R340 PolarHBondContact OD1-NH2 3.34Å; R340-M342 PolarHBondContact O-N 3.19Å; R340-Q343 PolarHBondContact O-N 3.03Å
341	D	92.9	Very high	93.5	Very high	107 Å²	107	37.5 Å²	37.5	57%	0.572	18%	0.184	S	C	*	.	H	α-helix	trans	-54.7	-38.5	179.9	-70.5	-19.2	0	0	0	112.3	N337 K338	N337-D341 WeakPolarHBondContact O-CB 3.25Å; N337-D341 PolarHBondContact O-N 3.23Å; K338-D341 IonicContact NZ-OD2 2.73Å; K338-D341 PolarHBondContact NZ-OD2 3.1Å
342	M	94.1	Very high	94.1	Very high	29 Å²	29	37.4 Å²	37.4	14%	0.143	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-2.4	-179.7	77.1	-169.6	-62.7	0	0	114.3	K338 R340 M344 R396 K399 L400 R403	K338-M342 VanDerWaalsContact O-CG 3.25Å; K338-M342 WeakPolarHBondContact O-CG 3.17Å; K338-M342 PolarHBondContact O-N 2.92Å; R340-M342 PolarHBondContact O-N 3.19Å; M342-M344 HydrophobicContact CG-CB 4.14Å; M342-M344 HydrophobicContact SD-CE 4.09Å; M342-R396 PolarHBondContact O-NH1 3.37Å; M342-R396 PolarHBondContact O-NH2 3.38Å; M342-K399 HydrophobicContact CE-CB 3.87Å; M342-L400 HydrophobicContact CE-CD2 3.4Å; M342-L400 HydrophobicContact CE-CG 3.69Å; M342-L400 HydrophobicContact SD-CD2 4.1Å; M342-R403 HydrophobicContact SD-CG 4.49Å
343	Q	94.9	Very high	94.8	Very high	156 Å²	156	36.5 Å²	36.5	73%	0.729	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	59.5	-171.9	-60.3	178.6	-9.2	0	0	111.4	M339 R340 R396	M339-Q343 PolarHBondContact O-N 3.3Å; M339-Q343 VanDerWaalsContact O-N 3.16Å; R340-Q343 PolarHBondContact O-N 3.03Å; Q343-R396 PolarHBondContact O-NH2 2.98Å
344	M	96.6	Very high	95.3	Very high	10 Å²	10	32.8 Å²	32.8	5%	0.049	16%	0.155	C	C	.	.			trans	-64.2	130.4	176.4	-179.7	-176.4	-74.1	0	0	110.4	H285 M339 M342 E348 L349 L352 L400 R403	H285-M344 PolarHBondContact NE2-O 3Å; M339-M344 HydrophobicContact CB-CB 4.14Å; M339-M344 HydrophobicContact CB-CE 4.44Å; M339-M344 HydrophobicContact CB-SD 4.27Å; M339-M344 HydrophobicContact CE-CE 4.35Å; M339-M344 HydrophobicContact CE-SD 4.16Å; M339-M344 HydrophobicContact CG-CE 3.75Å; M339-M344 HydrophobicContact CG-SD 3.79Å; M339-M344 PolarHBondContact O-N 3.4Å; M339-M344 HydrophobicContact SD-SD 4.17Å; M342-M344 HydrophobicContact CG-CB 4.14Å; M342-M344 HydrophobicContact SD-CE 4.09Å; M344-E348 WeakPolarHBondContact CA-OE2 3.24Å; M344-E348 HydrophobicContact CG-CB 4.05Å; M344-L349 HydrophobicContact SD-CB 4.36Å; M344-L349 HydrophobicContact SD-CD1 4.46Å; M344-L352 HydrophobicContact CE-CD1 3.51Å; M344-L352 HydrophobicContact SD-CD1 4.29Å; M344-L400 HydrophobicContact CE-CD2 3.66Å; M344-L400 HydrophobicContact CG-CD2 4.27Å; M344-R403 HydrophobicContact CE-CG 4.12Å
345	D	95.4	Very high	95.6	Very high	25 Å²	25	30.2 Å²	30.2	13%	0.134	14%	0.143	C	C	.	.			trans	-95.4	171.7	175.4	76.6	69.6	0	0	0	113.4	T347 E348 L349 Y385 K389 Y390	D345-T347 VanDerWaalsContact C-N 3.33Å; D345-T347 PolarHBondContact O-N 2.92Å; D345-T347 WeakPolarHBondContact OD1-CA 3.48Å; D345-T347 WeakPolarHBondContact OD1-CB 3.23Å; D345-T347 PolarHBondContact OD1-N 2.93Å; D345-T347 PolarHBondContact OD1-OG1 3.38Å; D345-E348 PolarHBondContact N-OE2 3.45Å; D345-E348 PolarHBondContact O-N 3.31Å; D345-E348 PolarHBondContact OD1-N 2.94Å; D345-L349 PolarHBondContact O-N 2.7Å; D345-Y385 PolarHBondContact OD1-OH 3.37Å; D345-Y385 WeakPolarHBondContact OD2-CE1 3.25Å; D345-Y385 PolarHBondContact OD2-OH 3.13Å; D345-K389 IonicContact OD1-NZ 3.69Å; D345-K389 IonicContact OD2-NZ 2.72Å; D345-K389 PolarHBondContact OD2-NZ 3Å; D345-Y390 PolarHBondContact OD2-OH 2.88Å
346	K	95.2	Very high	95.8	Very high	80 Å²	80	30.9 Å²	30.9	35%	0.348	15%	0.147	S	C	.	.	H	α-helix	trans	-67.5	-28.7	-177	-67.3	-167.4	179.6	-170.5	0	113.9	L208 D215 G350	L208-K346 HydrophobicContact CD1-CB 3.69Å; D215-K346 WeakPolarHBondContact OD2-CE 3.26Å; D215-K346 IonicContact OD2-NZ 2.7Å; D215-K346 PolarHBondContact OD2-NZ 3.18Å; K346-G350 PolarHBondContact O-N 3.05Å
347	T	97.3	Very high	96.2	Very high	4 Å²	4	30.9 Å²	30.9	3%	0.025	15%	0.147	C	C	.	.	H	α-helix	trans	-67.6	-43.3	175.1	-33.6	0	0	0	0	110	V204 L208 D345 G350 C351 Y385	V204-T347 HydrophobicContact CB-CG2 3.71Å; V204-T347 HydrophobicContact CG2-CG2 4.24Å; L208-T347 HydrophobicContact CB-CG2 4.37Å; D345-T347 VanDerWaalsContact C-N 3.33Å; D345-T347 PolarHBondContact O-N 2.92Å; D345-T347 WeakPolarHBondContact OD1-CA 3.48Å; D345-T347 WeakPolarHBondContact OD1-CB 3.23Å; D345-T347 PolarHBondContact OD1-N 2.93Å; D345-T347 PolarHBondContact OD1-OG1 3.38Å; T347-G350 PolarHBondContact O-N 3.16Å; T347-C351 WeakPolarHBondContact O-CB 3.46Å; T347-C351 PolarHBondContact O-N 2.7Å; T347-C351 PolarHBondContact O-SG 3.42Å; T347-Y385 VanDerWaalsContact CB-CZ 3.5Å; T347-Y385 WeakPolarHBondContact CB-OH 3.42Å; T347-Y385 HydrophobicContact CG2-CD2 4.18Å; T347-Y385 HydrophobicContact CG2-CE1 4.19Å; T347-Y385 HydrophobicContact CG2-CE2 3.74Å; T347-Y385 PolarHBondContact OG1-OH 2.95Å
348	E	98.1	Very high	96.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.1	-41.6	177.3	-61.8	177	140.7	0	0	111.7	M344 D345 C351 L352 L382 Y385 Y390 R396 L400	M344-E348 WeakPolarHBondContact CA-OE2 3.24Å; M344-E348 HydrophobicContact CG-CB 4.05Å; D345-E348 PolarHBondContact N-OE2 3.45Å; D345-E348 PolarHBondContact O-N 3.31Å; D345-E348 PolarHBondContact OD1-N 2.94Å; E348-C351 PolarHBondContact O-N 3.37Å; E348-L352 WeakPolarHBondContact O-CG 3.07Å; E348-L352 PolarHBondContact O-N 3.36Å; E348-L382 HydrophobicContact CG-CD1 4.28Å; E348-Y385 HydrophobicContact CG-CD1 4.16Å; E348-Y385 HydrophobicContact CG-CE1 3.91Å; E348-Y390 WeakPolarHBondContact OE1-CE2 3.38Å; E348-R396 IonicContact OE1-CZ 3.78Å; E348-R396 IonicContact OE1-NE 2.79Å; E348-R396 PolarHBondContact OE1-NE 3.42Å; E348-R396 IonicContact OE1-NH2 2.62Å; E348-R396 PolarHBondContact OE1-NH2 2.93Å; E348-R396 IonicContact OE2-CZ 3.83Å; E348-R396 IonicContact OE2-NE 3.42Å; E348-R396 IonicContact OE2-NH2 3.7Å; E348-R396 PolarHBondContact OE2-NH2 3.3Å; E348-L400 HydrophobicContact CB-CD1 4.13Å; E348-L400 HydrophobicContact CB-CD2 4Å; E348-L400 HydrophobicContact CG-CD1 3.99Å; E348-L400 HydrophobicContact CG-CD2 4.49Å
349	L	97.7	Very high	96.8	Very high	5 Å²	5	25.8 Å²	25.8	3%	0.026	12%	0.124	C	C	.	.	H	α-helix	trans	-56.1	-53.5	170	176.7	68.7	0	0	0	111	E211 A281 H285 M344 D345 C351 L352 R353	E211-L349 WeakPolarHBondContact OE2-CD2 3.48Å; A281-L349 HydrophobicContact CB-CD1 4.33Å; H285-L349 HydrophobicContact CB-CD1 3.84Å; H285-L349 HydrophobicContact CB-CD2 3.58Å; H285-L349 HydrophobicContact CB-CG 4.24Å; M344-L349 HydrophobicContact SD-CB 4.36Å; M344-L349 HydrophobicContact SD-CD1 4.46Å; D345-L349 PolarHBondContact O-N 2.7Å; L349-C351 VanDerWaalsContact C-N 3.3Å; L349-C351 PolarHBondContact O-N 3.2Å; L349-L352 PolarHBondContact O-N 3.48Å; L349-L352 VanDerWaalsContact O-N 3.16Å; L349-R353 HydrophobicContact CD1-CG 4.23Å; L349-R353 HydrophobicContact CG-CG 4.36Å; L349-R353 WeakPolarHBondContact O-CB 3.14Å; L349-R353 WeakPolarHBondContact O-CG 3.31Å; L349-R353 PolarHBondContact O-N 3.27Å
350	G	97.8	Very high	96.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62	-36.6	-178	0	0	0	0	0	112.8	E211 K346 T347 R353 A354	E211-G350 VanDerWaalsContact OE1-CA 3.25Å; E211-G350 WeakPolarHBondContact OE1-CA 3.44Å; K346-G350 PolarHBondContact O-N 3.05Å; T347-G350 PolarHBondContact O-N 3.16Å; G350-R353 PolarHBondContact O-N 3.26Å; G350-A354 VanDerWaalsContact O-CB 3.31Å; G350-A354 WeakPolarHBondContact O-CB 3.26Å; G350-A354 PolarHBondContact O-N 2.93Å
351	C	98.4	Very high	96.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-67.9	-42.3	173.5	-66.4	0	0	0	0	112	T347 E348 L349 R353 A354 I355 V378 L382	T347-C351 WeakPolarHBondContact O-CB 3.46Å; T347-C351 PolarHBondContact O-N 2.7Å; T347-C351 PolarHBondContact O-SG 3.42Å; E348-C351 PolarHBondContact O-N 3.37Å; L349-C351 VanDerWaalsContact C-N 3.3Å; L349-C351 PolarHBondContact O-N 3.2Å; C351-R353 VanDerWaalsContact C-N 3.35Å; C351-A354 PolarHBondContact O-N 3.11Å; C351-I355 WeakPolarHBondContact O-CD1 3.33Å; C351-I355 WeakPolarHBondContact O-CG1 3.41Å; C351-I355 PolarHBondContact O-N 3.1Å; C351-V378 HydrophobicContact CB-CG1 4.07Å; C351-V378 WeakPolarHBondContact O-CG1 3.5Å; C351-L382 HydrophobicContact CB-CB 4Å; C351-L382 HydrophobicContact CB-CD1 3.75Å; C351-L382 HydrophobicContact CB-CD2 3.86Å; C351-L382 HydrophobicContact CB-CG 4.06Å
352	L	98.6	Very high	96.9	Very high	10 Å²	10	24.9 Å²	24.9	5%	0.052	13%	0.126	C	C	.	.	H	α-helix	trans	-63.7	-40.1	174.3	-72.1	175.7	0	0	0	111.8	M344 E348 L349 I355 V356 L382 L400 L401 L404	M344-L352 HydrophobicContact CE-CD1 3.51Å; M344-L352 HydrophobicContact SD-CD1 4.29Å; E348-L352 WeakPolarHBondContact O-CG 3.07Å; E348-L352 PolarHBondContact O-N 3.36Å; L349-L352 PolarHBondContact O-N 3.48Å; L349-L352 VanDerWaalsContact O-N 3.16Å; L352-I355 HydrophobicContact CD2-CD1 4.37Å; L352-I355 PolarHBondContact O-N 3.45Å; L352-V356 WeakPolarHBondContact O-CG2 3.36Å; L352-V356 PolarHBondContact O-N 2.92Å; L352-V356 VanDerWaalsContact O-N 3.11Å; L352-L382 HydrophobicContact CD2-CD2 4.37Å; L352-L400 HydrophobicContact CD1-CB 4.2Å; L352-L400 HydrophobicContact CD1-CD2 4.15Å; L352-L400 HydrophobicContact CD2-CB 4.25Å; L352-L401 HydrophobicContact CD2-CD2 4.13Å; L352-L404 HydrophobicContact CB-CD2 4.36Å; L352-L404 HydrophobicContact CD2-CD1 4.21Å; L352-L404 HydrophobicContact CD2-CD2 4.06Å; L352-L404 HydrophobicContact CD2-CG 4.09Å
353	R	98.3	Very high	96.8	Very high	5 Å²	5	33 Å²	33	2%	0.019	16%	0.16	C	C	.	.	H	α-helix	trans	-63.9	-41.6	172.5	-71.2	176.1	64.7	-173.7	-0.2	111.3	E211 W252 L278 A281 L349 G350 C351 I355 V356 L357	E211-R353 WeakPolarHBondContact OE1-CD 3.37Å; E211-R353 IonicContact OE1-CZ 3.35Å; E211-R353 IonicContact OE1-NE 2.7Å; E211-R353 IonicContact OE1-NH1 2.64Å; E211-R353 PolarHBondContact OE1-NH1 2.92Å; E211-R353 IonicContact OE2-CZ 2.69Å; E211-R353 IonicContact OE2-NH1 2.69Å; E211-R353 PolarHBondContact OE2-NH1 3.46Å; W252-R353 HydrophobicContact CH2-CB 3.62Å; W252-R353 HydrophobicContact CZ2-CB 3.44Å; W252-R353 VanDerWaalsContact CZ2-CB 3.44Å; L278-R353 HydrophobicContact CD2-CB 3.79Å; L278-R353 HydrophobicContact CD2-CG 4.26Å; L278-R353 WeakPolarHBondContact CD2-O 3.42Å; A281-R353 HydrophobicContact CB-CG 4.08Å; L349-R353 HydrophobicContact CD1-CG 4.23Å; L349-R353 HydrophobicContact CG-CG 4.36Å; L349-R353 WeakPolarHBondContact O-CB 3.14Å; L349-R353 WeakPolarHBondContact O-CG 3.31Å; L349-R353 PolarHBondContact O-N 3.27Å; G350-R353 PolarHBondContact O-N 3.26Å; C351-R353 VanDerWaalsContact C-N 3.35Å; R353-I355 VanDerWaalsContact C-N 3.34Å; R353-I355 PolarHBondContact O-N 3.44Å; R353-V356 WeakPolarHBondContact O-CB 3.15Å; R353-V356 PolarHBondContact O-N 3.48Å; R353-V356 VanDerWaalsContact O-N 3.16Å; R353-L357 WeakPolarHBondContact O-CB 3.48Å; R353-L357 PolarHBondContact O-N 3.37Å
354	A	98.3	Very high	96.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.3	-34.1	175.7	0	0	0	0	0	112.7	I256 G350 C351 V356 L357 F358 V378	I256-A354 HydrophobicContact CG2-CB 4.3Å; G350-A354 VanDerWaalsContact O-CB 3.31Å; G350-A354 WeakPolarHBondContact O-CB 3.26Å; G350-A354 PolarHBondContact O-N 2.93Å; C351-A354 PolarHBondContact O-N 3.11Å; A354-V356 VanDerWaalsContact C-N 3.35Å; A354-L357 PolarHBondContact O-N 2.91Å; A354-F358 VanDerWaalsContact O-CD2 3.26Å; A354-F358 WeakPolarHBondContact O-CD2 3.39Å; A354-F358 PolarHBondContact O-N 3.3Å; A354-V378 HydrophobicContact CB-CG1 4.05Å; A354-V378 HydrophobicContact CB-CG2 4.03Å
355	I	98.6	Very high	96.3	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.015	16%	0.16	C	C	.	.	H	α-helix	trans	-64.2	-38.6	171.2	-70.1	155.5	0	0	0	111.5	C351 L352 R353 R375 V378 Y379 L382 L401 L404	C351-I355 WeakPolarHBondContact O-CD1 3.33Å; C351-I355 WeakPolarHBondContact O-CG1 3.41Å; C351-I355 PolarHBondContact O-N 3.1Å; L352-I355 HydrophobicContact CD2-CD1 4.37Å; L352-I355 PolarHBondContact O-N 3.45Å; R353-I355 VanDerWaalsContact C-N 3.34Å; R353-I355 PolarHBondContact O-N 3.44Å; I355-R375 HydrophobicContact CG2-CG 4.39Å; I355-R375 PolarHBondContact O-NE 3.3Å; I355-R375 PolarHBondContact O-NH2 3.15Å; I355-V378 HydrophobicContact CD1-CG1 4.12Å; I355-V378 HydrophobicContact CG1-CB 4.18Å; I355-V378 HydrophobicContact CG1-CG1 3.7Å; I355-Y379 HydrophobicContact CB-CE1 4.43Å; I355-Y379 HydrophobicContact CD1-CD1 3.6Å; I355-Y379 HydrophobicContact CD1-CE1 3.61Å; I355-Y379 HydrophobicContact CG1-CD1 3.94Å; I355-Y379 HydrophobicContact CG1-CE1 3.78Å; I355-Y379 HydrophobicContact CG2-CE1 3.73Å; I355-L382 HydrophobicContact CD1-CD2 4.15Å; I355-L401 HydrophobicContact CD1-CD2 3.84Å; I355-L404 HydrophobicContact CG2-CD1 3.7Å
356	V	98.3	Very high	96.2	Very high	15 Å²	15	32 Å²	32	9%	0.091	18%	0.182	C	C	.	.	H	α-helix	trans	-67.6	-43.5	173.3	173.4	0	0	0	0	111.2	E277 L278 L352 R353 A354 L404 L407	E277-V356 HydrophobicContact CB-CG1 3.86Å; L278-V356 HydrophobicContact CD2-CB 4.01Å; L278-V356 HydrophobicContact CD2-CG1 3.96Å; L278-V356 HydrophobicContact CG-CG1 3.93Å; L352-V356 WeakPolarHBondContact O-CG2 3.36Å; L352-V356 PolarHBondContact O-N 2.92Å; L352-V356 VanDerWaalsContact O-N 3.11Å; R353-V356 WeakPolarHBondContact O-CB 3.15Å; R353-V356 PolarHBondContact O-N 3.48Å; R353-V356 VanDerWaalsContact O-N 3.16Å; A354-V356 VanDerWaalsContact C-N 3.35Å; V356-L404 HydrophobicContact CG2-CD2 3.8Å; V356-L407 HydrophobicContact CG2-CD2 4.09Å
357	L	98.3	Very high	96	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.3	-51.3	179.7	-179.6	68	0	0	0	112.1	W252 A253 I256 F259 L270 L271 L278 R353 A354 N359	W252-L357 HydrophobicContact CH2-CB 4.16Å; W252-L357 HydrophobicContact CH2-CD2 4.04Å; W252-L357 HydrophobicContact CZ3-CB 4.16Å; W252-L357 HydrophobicContact CZ3-CD1 4.24Å; W252-L357 HydrophobicContact CZ3-CD2 3.74Å; W252-L357 HydrophobicContact CZ3-CG 4.27Å; A253-L357 HydrophobicContact CB-CD1 4.27Å; A253-L357 HydrophobicContact CB-CD2 4.12Å; I256-L357 HydrophobicContact CB-CD2 4.4Å; I256-L357 HydrophobicContact CG1-CD2 4.26Å; I256-L357 HydrophobicContact CG2-CD2 4.43Å; F259-L357 HydrophobicContact CD2-CD1 4.23Å; F259-L357 HydrophobicContact CD2-CD2 3.62Å; F259-L357 HydrophobicContact CD2-CG 4Å; F259-L357 HydrophobicContact CE2-CD1 3.77Å; F259-L357 HydrophobicContact CE2-CD2 4.05Å; F259-L357 HydrophobicContact CE2-CG 4.03Å; F259-L357 HydrophobicContact CG-CD2 4.19Å; F259-L357 HydrophobicContact CZ-CD1 4.43Å; L270-L357 WeakPolarHBondContact CD2-O 3.44Å; L271-L357 HydrophobicContact CD2-CD1 4.08Å; L271-L357 HydrophobicContact CG-CD1 4.45Å; L278-L357 HydrophobicContact CD1-CD1 4.12Å; L278-L357 HydrophobicContact CD2-CB 4.44Å; R353-L357 WeakPolarHBondContact O-CB 3.48Å; R353-L357 PolarHBondContact O-N 3.37Å; A354-L357 PolarHBondContact O-N 2.91Å; L357-N359 VanDerWaalsContact C-N 3.28Å; L357-N359 PolarHBondContact O-N 3.03Å
358	F	98.3	Very high	95.8	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.197	C	C	.	.	S	Bend	trans	-79.7	75.6	179	-63.9	-57.3	0	0	0	110.7	M202 I256 F259 L262 L270 A354 P360 V371 L374 R375 V378	M202-F358 HydrophobicContact CE-CE2 4.1Å; I256-F358 HydrophobicContact CG2-CE2 3.74Å; I256-F358 HydrophobicContact CG2-CZ 3.84Å; F259-F358 HydrophobicContact CB-CE1 4.19Å; F259-F358 HydrophobicContact CB-CZ 4.14Å; F259-F358 HydrophobicContact CD2-CE1 4.04Å; L262-F358 HydrophobicContact CD1-CD1 4.4Å; L262-F358 HydrophobicContact CD1-CE1 4.1Å; L270-F358 HydrophobicContact CD1-CD1 4.44Å; A354-F358 VanDerWaalsContact O-CD2 3.26Å; A354-F358 WeakPolarHBondContact O-CD2 3.39Å; A354-F358 PolarHBondContact O-N 3.3Å; F358-P360 WeakPolarHBondContact O-CD 3.25Å; F358-V371 VanDerWaalsContact C-CG1 3.42Å; F358-V371 HydrophobicContact CB-CG1 4.04Å; F358-L374 HydrophobicContact CB-CB 4.45Å; F358-L374 HydrophobicContact CD1-CB 3.9Å; F358-L374 HydrophobicContact CD1-CD1 3.9Å; F358-L374 HydrophobicContact CD2-CB 4.08Å; F358-L374 HydrophobicContact CE1-CB 4.11Å; F358-L374 HydrophobicContact CE1-CD1 3.52Å; F358-L374 HydrophobicContact CE1-CG 4.44Å; F358-L374 HydrophobicContact CE2-CB 4.28Å; F358-L374 HydrophobicContact CG-CB 3.89Å; F358-L374 HydrophobicContact CZ-CB 4.29Å; F358-L374 HydrophobicContact CZ-CD1 4.04Å; F358-R375 HydrophobicContact CB-CB 4.08Å; F358-R375 VanDerWaalsContact O-CZ 3.24Å; F358-R375 PolarHBondContact O-NE 3.02Å; F358-R375 PolarHBondContact O-NH2 2.75Å; F358-V378 HydrophobicContact CD2-CG2 4.11Å; F358-V378 HydrophobicContact CE2-CG2 4.22Å
359	N	97.3	Very high	95.6	Very high	25 Å²	25	37.2 Å²	37.2	13%	0.134	23%	0.226	C	C	.	.			trans	-101.2	96.1	-177.2	-167.1	43	0	0	0	113.9	L270 L357 D361 A362 R375	L270-N359 HydrophobicContact CD2-CB 4.36Å; L270-N359 WeakPolarHBondContact CD2-O 3.47Å; L357-N359 VanDerWaalsContact C-N 3.28Å; L357-N359 PolarHBondContact O-N 3.03Å; N359-D361 PolarHBondContact O-N 3.3Å; N359-A362 VanDerWaalsContact O-CB 3.26Å; N359-A362 WeakPolarHBondContact O-CB 3.47Å; N359-A362 PolarHBondContact O-N 3.12Å; N359-R375 PolarHBondContact OD1-NH1 3.45Å; N359-R375 PolarHBondContact OD1-NH2 3.25Å
360	P	96.1	Very high	95.4	Very high	16 Å²	16	41.3 Å²	41.3	10%	0.104	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.2	176.9	26.3	-36	0	0	0	113.6	F358 A362 T368 E372	F358-P360 WeakPolarHBondContact O-CD 3.25Å; P360-A362 PolarHBondContact O-N 3.19Å; P360-T368 HydrophobicContact CB-CG2 3.69Å; P360-T368 WeakPolarHBondContact O-CG2 3.22Å; P360-E372 HydrophobicContact CB-CB 4.06Å; P360-E372 HydrophobicContact CG-CB 4.2Å
361	D	94.6	Very high	95.3	Very high	129 Å²	129	41.3 Å²	41.3	69%	0.69	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-1.5	175.5	-56.6	-68.7	0	0	0	113.6	N359 R375	N359-D361 PolarHBondContact O-N 3.3Å; D361-R375 IonicContact OD2-NH1 3.7Å
362	A	93	Very high	95.2	Very high	11 Å²	11	45.9 Å²	45.9	9%	0.091	27%	0.266	C	S	.	.	S	Bend	trans	-70.4	133.8	176.2	0	0	0	0	0	111.3	I269 L270 A273 N359 P360 L365	I269-A362 HydrophobicContact CG2-CB 3.77Å; L270-A362 HydrophobicContact CD2-CB 4.24Å; A273-A362 HydrophobicContact CB-CB 3.84Å; N359-A362 VanDerWaalsContact O-CB 3.26Å; N359-A362 WeakPolarHBondContact O-CB 3.47Å; N359-A362 PolarHBondContact O-N 3.12Å; P360-A362 PolarHBondContact O-N 3.19Å; A362-L365 HydrophobicContact CB-CD1 4.06Å; A362-L365 HydrophobicContact CB-CG 4.17Å; A362-L365 WeakPolarHBondContact O-CG 3.37Å
363	K	91.5	Very high	95.1	Very high	198 Å²	198	49.6 Å²	49.6	86%	0.861	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	132	-175.5	-64.5	-179.5	-178.6	177.1	0	110.8
364	G	89.8	Confident	95	Very high	64 Å²	64	49.9 Å²	49.9	66%	0.66	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.9	-1.8	175.6	0	0	0	0	0	115.3	I269	I269-G364 WeakPolarHBondContact CD1-O 3.43Å
365	L	92	Very high	95	Very high	21 Å²	21	51.8 Å²	51.8	11%	0.11	30%	0.295	C	S	.	.			trans	-56.9	138.8	176.5	-66.2	174.7	0	0	0	112.2	D266 I269 L270 A362 S367 V371	D266-L365 HydrophobicContact CB-CD2 3.88Å; I269-L365 HydrophobicContact CB-CD2 4.2Å; I269-L365 HydrophobicContact CG2-CD2 3.73Å; I269-L365 HydrophobicContact CG2-CG 4.14Å; L270-L365 HydrophobicContact CD2-CD1 4.22Å; L270-L365 HydrophobicContact CD2-CD2 3.87Å; L270-L365 HydrophobicContact CG-CD2 3.97Å; A362-L365 HydrophobicContact CB-CD1 4.06Å; A362-L365 HydrophobicContact CB-CG 4.17Å; A362-L365 WeakPolarHBondContact O-CG 3.37Å; L365-S367 VanDerWaalsContact C-N 3.34Å; L365-V371 HydrophobicContact CD1-CB 4.35Å; L365-V371 HydrophobicContact CD1-CG2 4.02Å; L365-V371 HydrophobicContact CD2-CG2 4.39Å
366	S	92.9	Very high	94.8	Very high	86 Å²	86	57.3 Å²	57.3	60%	0.601	32%	0.321	S	S	*	.	S	Bend	trans	-67.9	-35.1	173.2	-53.6	0	0	0	0	111.9	D266	D266-S366 VanDerWaalsContact CG-N 3.29Å; D266-S366 WeakPolarHBondContact OD1-CB 3.48Å; D266-S366 PolarHBondContact OD1-N 2.88Å; D266-S366 PolarHBondContact OD1-OG 3.18Å; D266-S366 PolarHBondContact OD2-N 3.11Å
367	S	89.8	Confident	94.7	Very high	39 Å²	39	58.1 Å²	58.1	27%	0.273	32%	0.323	S	S	.	.			trans	-143.6	72.9	-169.2	-165.2	0	0	0	0	112.3	D266 L365 S369 E370 V371	D266-S367 PolarHBondContact OD2-N 2.61Å; L365-S367 VanDerWaalsContact C-N 3.34Å; S367-S369 PolarHBondContact O-N 3.2Å; S367-E370 VanDerWaalsContact CB-OE2 3.25Å; S367-E370 WeakPolarHBondContact CB-OE2 3.37Å; S367-E370 WeakPolarHBondContact O-CB 3.31Å; S367-E370 PolarHBondContact O-N 3.12Å; S367-E370 WeakPolarHBondContact OG-CB 3.45Å; S367-E370 PolarHBondContact OG-OE2 3.16Å; S367-V371 PolarHBondContact O-N 3.44Å
368	T	95.1	Very high	94.7	Very high	66 Å²	66	58.1 Å²	58.1	41%	0.405	32%	0.323	S	S	.	.	H	α-helix	trans	-49	-43.4	178.3	-59	0	0	0	0	113.2	P360 E370 V371 E372	P360-T368 HydrophobicContact CB-CG2 3.69Å; P360-T368 WeakPolarHBondContact O-CG2 3.22Å; T368-E370 VanDerWaalsContact C-N 3.29Å; T368-E370 PolarHBondContact O-N 3.2Å; T368-V371 PolarHBondContact O-N 3.12Å; T368-E372 WeakPolarHBondContact O-CB 3.48Å; T368-E372 PolarHBondContact O-N 3.14Å
369	S	93.1	Very high	94.7	Very high	88 Å²	88	61.9 Å²	61.9	62%	0.615	34%	0.338	S	S	*	.	H	α-helix	trans	-70.5	-20.8	-178	-59	0	0	0	0	114.2	S367 L373	S367-S369 PolarHBondContact O-N 3.2Å; S369-L373 WeakPolarHBondContact O-CB 3.33Å; S369-L373 PolarHBondContact O-N 3.35Å
370	E	93.1	Very high	94.6	Very high	91 Å²	91	62.7 Å²	62.7	43%	0.425	35%	0.348	S	S	.	.	H	α-helix	trans	-80.5	-42.3	176.2	-175.7	167.9	-172.2	0	0	110.6	L262 S367 T368 E372 L373 L374	L262-E370 HydrophobicContact CD2-CG 4.09Å; S367-E370 VanDerWaalsContact CB-OE2 3.25Å; S367-E370 WeakPolarHBondContact CB-OE2 3.37Å; S367-E370 WeakPolarHBondContact O-CB 3.31Å; S367-E370 PolarHBondContact O-N 3.12Å; S367-E370 WeakPolarHBondContact OG-CB 3.45Å; S367-E370 PolarHBondContact OG-OE2 3.16Å; T368-E370 VanDerWaalsContact C-N 3.29Å; T368-E370 PolarHBondContact O-N 3.2Å; E370-E372 VanDerWaalsContact C-N 3.32Å; E370-E372 PolarHBondContact O-N 2.88Å; E370-L373 PolarHBondContact O-N 3.2Å; E370-L374 WeakPolarHBondContact O-CG 3.28Å; E370-L374 PolarHBondContact O-N 3.02Å
371	V	96.8	Very high	94.6	Very high	0 Å²	0	62 Å²	62	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-39.8	169.8	-177.5	0	0	0	0	111.2	L270 F358 L365 S367 T368 L374 R375	L270-V371 HydrophobicContact CD1-CG1 4.23Å; L270-V371 HydrophobicContact CD1-CG2 4.15Å; L270-V371 HydrophobicContact CD2-CG1 3.85Å; L270-V371 HydrophobicContact CD2-CG2 4.49Å; F358-V371 VanDerWaalsContact C-CG1 3.42Å; F358-V371 HydrophobicContact CB-CG1 4.04Å; L365-V371 HydrophobicContact CD1-CB 4.35Å; L365-V371 HydrophobicContact CD1-CG2 4.02Å; L365-V371 HydrophobicContact CD2-CG2 4.39Å; S367-V371 PolarHBondContact O-N 3.44Å; T368-V371 PolarHBondContact O-N 3.12Å; V371-L374 PolarHBondContact O-N 3.12Å; V371-R375 PolarHBondContact O-N 3.07Å
372	E	96.3	Very high	94.7	Very high	96 Å²	96	55.9 Å²	55.9	45%	0.449	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-46	173.1	-171.5	172.9	-151.4	0	0	111.5	P360 T368 E370 L374 R375 E376	P360-E372 HydrophobicContact CB-CB 4.06Å; P360-E372 HydrophobicContact CG-CB 4.2Å; T368-E372 WeakPolarHBondContact O-CB 3.48Å; T368-E372 PolarHBondContact O-N 3.14Å; E370-E372 VanDerWaalsContact C-N 3.32Å; E370-E372 PolarHBondContact O-N 2.88Å; E372-L374 PolarHBondContact O-N 3.23Å; E372-R375 WeakPolarHBondContact O-CB 3.34Å; E372-R375 PolarHBondContact O-N 2.98Å; E372-E376 PolarHBondContact O-N 3.19Å
373	L	95.1	Very high	94.9	Very high	89 Å²	89	58.9 Å²	58.9	47%	0.466	32%	0.323	S	S	.	.	H	α-helix	trans	-62.4	-39.9	176.2	-179.3	64.1	0	0	0	112.6	S369 E370 E376 K377	S369-L373 WeakPolarHBondContact O-CB 3.33Å; S369-L373 PolarHBondContact O-N 3.35Å; E370-L373 PolarHBondContact O-N 3.2Å; L373-E376 PolarHBondContact O-N 2.86Å; L373-K377 WeakPolarHBondContact O-CG 3.22Å; L373-K377 PolarHBondContact O-N 3.27Å
374	L	96.6	Very high	95	Very high	11 Å²	11	51.1 Å²	51.1	6%	0.058	30%	0.295	C	S	.	.	H	α-helix	trans	-64.5	-39.8	174.5	-67.5	-178.6	0	0	0	111.7	M202 H258 L262 F358 E370 V371 E372 K377 V378	M202-L374 HydrophobicContact CE-CD2 4.33Å; H258-L374 HydrophobicContact CB-CD1 4.03Å; H258-L374 HydrophobicContact CB-CD2 3.6Å; H258-L374 HydrophobicContact CB-CG 4.5Å; L262-L374 HydrophobicContact CD1-CD1 4.06Å; L262-L374 HydrophobicContact CD2-CD1 3.97Å; L262-L374 HydrophobicContact CG-CD1 4.17Å; F358-L374 HydrophobicContact CB-CB 4.45Å; F358-L374 HydrophobicContact CD1-CB 3.9Å; F358-L374 HydrophobicContact CD1-CD1 3.9Å; F358-L374 HydrophobicContact CD2-CB 4.08Å; F358-L374 HydrophobicContact CE1-CB 4.11Å; F358-L374 HydrophobicContact CE1-CD1 3.52Å; F358-L374 HydrophobicContact CE1-CG 4.44Å; F358-L374 HydrophobicContact CE2-CB 4.28Å; F358-L374 HydrophobicContact CG-CB 3.89Å; F358-L374 HydrophobicContact CZ-CB 4.29Å; F358-L374 HydrophobicContact CZ-CD1 4.04Å; E370-L374 WeakPolarHBondContact O-CG 3.28Å; E370-L374 PolarHBondContact O-N 3.02Å; V371-L374 PolarHBondContact O-N 3.12Å; E372-L374 PolarHBondContact O-N 3.23Å; L374-K377 HydrophobicContact CD2-CD 4.19Å; L374-K377 PolarHBondContact O-N 2.99Å; L374-V378 WeakPolarHBondContact O-CG2 3.26Å; L374-V378 PolarHBondContact O-N 2.84Å; L374-V378 VanDerWaalsContact O-N 3.1Å
375	R	97.8	Very high	95.3	Very high	39 Å²	39	49.9 Å²	49.9	15%	0.147	27%	0.271	C	S	.	.	H	α-helix	trans	-63.2	-41.8	172.1	-178.1	-178.4	-95.3	176.3	1.4	111.9	I355 F358 N359 D361 V371 E372 V378 Y379	I355-R375 HydrophobicContact CG2-CG 4.39Å; I355-R375 PolarHBondContact O-NE 3.3Å; I355-R375 PolarHBondContact O-NH2 3.15Å; F358-R375 HydrophobicContact CB-CB 4.08Å; F358-R375 VanDerWaalsContact O-CZ 3.24Å; F358-R375 PolarHBondContact O-NE 3.02Å; F358-R375 PolarHBondContact O-NH2 2.75Å; N359-R375 PolarHBondContact OD1-NH1 3.45Å; N359-R375 PolarHBondContact OD1-NH2 3.25Å; D361-R375 IonicContact OD2-NH1 3.7Å; V371-R375 PolarHBondContact O-N 3.07Å; E372-R375 WeakPolarHBondContact O-CB 3.34Å; E372-R375 PolarHBondContact O-N 2.98Å; R375-V378 PolarHBondContact O-N 3.15Å; R375-Y379 HydrophobicContact CG-CD2 4.3Å; R375-Y379 HydrophobicContact CG-CE2 3.71Å; R375-Y379 WeakPolarHBondContact O-CD2 3.3Å; R375-Y379 PolarHBondContact O-N 3.14Å
376	E	96	Very high	95.5	Very high	120 Å²	120	49.2 Å²	49.2	56%	0.561	27%	0.268	S	S	*	.	H	α-helix	trans	-61.5	-41.6	174.4	-74.2	-163.3	147.5	0	0	112.4	E372 L373 V378 Y379 A380	E372-E376 PolarHBondContact O-N 3.19Å; L373-E376 PolarHBondContact O-N 2.86Å; E376-V378 PolarHBondContact O-N 3.5Å; E376-Y379 WeakPolarHBondContact O-CB 3.46Å; E376-Y379 PolarHBondContact O-N 2.93Å; E376-A380 PolarHBondContact O-N 3.39Å
377	K	95.7	Very high	95.6	Very high	31 Å²	31	51 Å²	51	14%	0.135	27%	0.265	C	S	.	.	H	α-helix	trans	-58.7	-45.9	173.4	-73.1	176.5	175.7	-173.6	0	111.8	E201 M202 H258 L373 L374 Y379 A380 S381	E201-K377 HydrophobicContact CB-CD 4.16Å; E201-K377 VanDerWaalsContact CD-CE 3.42Å; E201-K377 WeakPolarHBondContact OE1-CE 3.37Å; E201-K377 IonicContact OE1-NZ 2.69Å; E201-K377 PolarHBondContact OE1-NZ 3.41Å; E201-K377 WeakPolarHBondContact OE2-CE 3.47Å; E201-K377 IonicContact OE2-NZ 2.71Å; E201-K377 PolarHBondContact OE2-NZ 2.82Å; M202-K377 HydrophobicContact CB-CB 3.84Å; M202-K377 HydrophobicContact CE-CB 4.49Å; M202-K377 HydrophobicContact CG-CB 4.21Å; H258-K377 PolarHBondContact NE2-NZ 2.89Å; L373-K377 WeakPolarHBondContact O-CG 3.22Å; L373-K377 PolarHBondContact O-N 3.27Å; L374-K377 HydrophobicContact CD2-CD 4.19Å; L374-K377 PolarHBondContact O-N 2.99Å; K377-Y379 VanDerWaalsContact C-N 3.34Å; K377-Y379 PolarHBondContact O-N 3.2Å; K377-A380 PolarHBondContact O-N 2.79Å; K377-S381 PolarHBondContact O-N 3.36Å; K377-S381 PolarHBondContact O-OG 3.37Å
378	V	97.8	Very high	95.8	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64	-37.8	177.4	-178.2	0	0	0	0	111.8	M202 C351 A354 I355 F358 L374 R375 E376 L382	M202-V378 HydrophobicContact CE-CG2 3.96Å; M202-V378 HydrophobicContact CG-CB 4.48Å; M202-V378 HydrophobicContact CG-CG2 3.75Å; M202-V378 HydrophobicContact SD-CG2 3.76Å; C351-V378 HydrophobicContact CB-CG1 4.07Å; C351-V378 WeakPolarHBondContact O-CG1 3.5Å; A354-V378 HydrophobicContact CB-CG1 4.05Å; A354-V378 HydrophobicContact CB-CG2 4.03Å; I355-V378 HydrophobicContact CD1-CG1 4.12Å; I355-V378 HydrophobicContact CG1-CB 4.18Å; I355-V378 HydrophobicContact CG1-CG1 3.7Å; F358-V378 HydrophobicContact CD2-CG2 4.11Å; F358-V378 HydrophobicContact CE2-CG2 4.22Å; L374-V378 WeakPolarHBondContact O-CG2 3.26Å; L374-V378 PolarHBondContact O-N 2.84Å; L374-V378 VanDerWaalsContact O-N 3.1Å; R375-V378 PolarHBondContact O-N 3.15Å; E376-V378 PolarHBondContact O-N 3.5Å; V378-L382 VanDerWaalsContact O-CB 3.31Å; V378-L382 WeakPolarHBondContact O-CB 3.38Å; V378-L382 PolarHBondContact O-N 3.3Å
379	Y	97.6	Very high	95.7	Very high	80 Å²	80	58.2 Å²	58.2	31%	0.314	29%	0.288	S	S	.	.	H	α-helix	trans	-59.9	-45.7	172.8	-70.4	-42	0	0	0	112	I355 R375 E376 K377 E383 F397 L401	I355-Y379 HydrophobicContact CB-CE1 4.43Å; I355-Y379 HydrophobicContact CD1-CD1 3.6Å; I355-Y379 HydrophobicContact CD1-CE1 3.61Å; I355-Y379 HydrophobicContact CG1-CD1 3.94Å; I355-Y379 HydrophobicContact CG1-CE1 3.78Å; I355-Y379 HydrophobicContact CG2-CE1 3.73Å; R375-Y379 HydrophobicContact CG-CD2 4.3Å; R375-Y379 HydrophobicContact CG-CE2 3.71Å; R375-Y379 WeakPolarHBondContact O-CD2 3.3Å; R375-Y379 PolarHBondContact O-N 3.14Å; E376-Y379 WeakPolarHBondContact O-CB 3.46Å; E376-Y379 PolarHBondContact O-N 2.93Å; K377-Y379 VanDerWaalsContact C-N 3.34Å; K377-Y379 PolarHBondContact O-N 3.2Å; Y379-E383 WeakPolarHBondContact O-CB 3.43Å; Y379-E383 PolarHBondContact O-N 3.08Å; Y379-F397 HydrophobicContact CD1-CZ 4.45Å; Y379-F397 WeakPolarHBondContact O-CE2 3.37Å; Y379-L401 HydrophobicContact CD1-CD1 4.39Å; Y379-L401 HydrophobicContact CD1-CD2 3.98Å; Y379-L401 HydrophobicContact CE1-CD1 4.31Å; Y379-L401 HydrophobicContact CE1-CD2 3.71Å
380	A	95.9	Very high	95.8	Very high	41 Å²	41	56.2 Å²	56.2	34%	0.339	27%	0.268	S	S	.	.	H	α-helix	trans	-62.9	-47.5	178.7	0	0	0	0	0	112	E376 K377 L382 E383 A384	E376-A380 PolarHBondContact O-N 3.39Å; K377-A380 PolarHBondContact O-N 2.79Å; A380-L382 PolarHBondContact O-N 3.37Å; A380-E383 PolarHBondContact O-N 3.01Å; A380-A384 WeakPolarHBondContact O-CB 3.29Å; A380-A384 PolarHBondContact O-N 3.12Å
381	S	96.3	Very high	95.7	Very high	2 Å²	2	56 Å²	56	1%	0.014	27%	0.274	C	S	.	.	H	α-helix	trans	-62	-42.4	178	-66.4	0	0	0	0	112.8	M202 K377 A384 Y385	M202-S381 WeakPolarHBondContact O-CB 3.33Å; M202-S381 PolarHBondContact O-OG 3.22Å; K377-S381 PolarHBondContact O-N 3.36Å; K377-S381 PolarHBondContact O-OG 3.37Å; S381-A384 PolarHBondContact O-N 3.31Å; S381-Y385 WeakPolarHBondContact O-CB 3.33Å; S381-Y385 PolarHBondContact O-N 3.02Å
382	L	97.1	Very high	95.6	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-68.7	-38.3	176.8	-178	58.5	0	0	0	112.1	E348 C351 L352 I355 V378 A380 Y385 C386 F397 L400	E348-L382 HydrophobicContact CG-CD1 4.28Å; C351-L382 HydrophobicContact CB-CB 4Å; C351-L382 HydrophobicContact CB-CD1 3.75Å; C351-L382 HydrophobicContact CB-CD2 3.86Å; C351-L382 HydrophobicContact CB-CG 4.06Å; L352-L382 HydrophobicContact CD2-CD2 4.37Å; I355-L382 HydrophobicContact CD1-CD2 4.15Å; V378-L382 VanDerWaalsContact O-CB 3.31Å; V378-L382 WeakPolarHBondContact O-CB 3.38Å; V378-L382 PolarHBondContact O-N 3.3Å; A380-L382 PolarHBondContact O-N 3.37Å; L382-Y385 PolarHBondContact O-N 3.23Å; L382-C386 PolarHBondContact O-N 2.99Å; L382-C386 PolarHBondContact O-SG 3.47Å; L382-C386 VanDerWaalsContact O-SG 3.32Å; L382-F397 HydrophobicContact CB-CD2 4.39Å; L382-F397 HydrophobicContact CB-CE2 4.13Å; L382-F397 HydrophobicContact CD2-CD2 4.34Å; L382-F397 HydrophobicContact CD2-CE2 4.29Å; L382-F397 HydrophobicContact CG-CD2 4.01Å; L382-F397 HydrophobicContact CG-CE2 4.14Å; L382-L400 HydrophobicContact CD1-CD1 4.09Å; L382-L400 HydrophobicContact CD2-CD1 4.41Å; L382-L400 HydrophobicContact CG-CD1 4.46Å
383	E	95.9	Very high	95.4	Very high	75 Å²	75	64.3 Å²	64.3	35%	0.35	31%	0.313	S	S	.	.	H	α-helix	trans	-64.9	-42.2	175.8	-157.6	-153.4	-173.5	0	0	111.3	Y379 A380 C386 K387 F397	Y379-E383 WeakPolarHBondContact O-CB 3.43Å; Y379-E383 PolarHBondContact O-N 3.08Å; A380-E383 PolarHBondContact O-N 3.01Å; E383-C386 PolarHBondContact O-N 3.18Å; E383-K387 HydrophobicContact CG-CD 4.41Å; E383-K387 WeakPolarHBondContact O-CB 3.37Å; E383-K387 VanDerWaalsContact O-CG 3.28Å; E383-K387 WeakPolarHBondContact O-CG 3.43Å; E383-K387 PolarHBondContact O-N 2.96Å; E383-K387 WeakPolarHBondContact OE1-CE 3.49Å; E383-K387 IonicContact OE1-NZ 3.51Å; E383-K387 PolarHBondContact OE1-NZ 3.21Å; E383-K387 IonicContact OE2-NZ 3.61Å; E383-K387 PolarHBondContact OE2-NZ 3.02Å; E383-F397 HydrophobicContact CB-CD1 4.36Å; E383-F397 HydrophobicContact CB-CD2 3.81Å; E383-F397 HydrophobicContact CB-CE1 4.3Å; E383-F397 HydrophobicContact CB-CE2 3.74Å; E383-F397 HydrophobicContact CB-CG 4.12Å; E383-F397 HydrophobicContact CB-CZ 3.99Å; E383-F397 HydrophobicContact CG-CB 4.34Å; E383-F397 HydrophobicContact CG-CD1 3.85Å; E383-F397 HydrophobicContact CG-CD2 4.07Å; E383-F397 HydrophobicContact CG-CE1 4.09Å; E383-F397 HydrophobicContact CG-CE2 4.3Å; E383-F397 HydrophobicContact CG-CG 3.83Å; E383-F397 HydrophobicContact CG-CZ 4.3Å
384	A	94.6	Very high	95	Very high	34 Å²	34	69 Å²	69	28%	0.281	33%	0.332	S	S	.	.	H	α-helix	trans	-62.2	-44.5	174.3	0	0	0	0	0	111.9	A380 S381 K387 H388	A380-A384 WeakPolarHBondContact O-CB 3.29Å; A380-A384 PolarHBondContact O-N 3.12Å; S381-A384 PolarHBondContact O-N 3.31Å; A384-K387 PolarHBondContact O-N 2.92Å; A384-H388 WeakPolarHBondContact O-CB 3.46Å; A384-H388 PolarHBondContact O-N 3.08Å
385	Y	96.1	Very high	94.8	Very high	38 Å²	38	70.4 Å²	70.4	15%	0.149	35%	0.349	C	S	.	.	H	α-helix	trans	-59.2	-48.4	175.6	-174.2	-99.9	0	0	0	112.2	V204 D345 T347 E348 S381 L382 K387 H388 K389 Y390	V204-Y385 HydrophobicContact CB-CD2 4.44Å; V204-Y385 HydrophobicContact CG2-CD2 3.8Å; V204-Y385 HydrophobicContact CG2-CE2 4.29Å; D345-Y385 PolarHBondContact OD1-OH 3.37Å; D345-Y385 WeakPolarHBondContact OD2-CE1 3.25Å; D345-Y385 PolarHBondContact OD2-OH 3.13Å; T347-Y385 VanDerWaalsContact CB-CZ 3.5Å; T347-Y385 WeakPolarHBondContact CB-OH 3.42Å; T347-Y385 HydrophobicContact CG2-CD2 4.18Å; T347-Y385 HydrophobicContact CG2-CE1 4.19Å; T347-Y385 HydrophobicContact CG2-CE2 3.74Å; T347-Y385 PolarHBondContact OG1-OH 2.95Å; E348-Y385 HydrophobicContact CG-CD1 4.16Å; E348-Y385 HydrophobicContact CG-CE1 3.91Å; S381-Y385 WeakPolarHBondContact O-CB 3.33Å; S381-Y385 PolarHBondContact O-N 3.02Å; L382-Y385 PolarHBondContact O-N 3.23Å; Y385-K387 PolarHBondContact O-N 3.35Å; Y385-H388 PolarHBondContact O-N 3.43Å; Y385-K389 HydrophobicContact CE1-CD 3.63Å; Y385-K389 HydrophobicContact CE2-CD 4.11Å; Y385-K389 WeakPolarHBondContact O-CB 3.36Å; Y385-K389 PolarHBondContact O-N 2.98Å; Y385-K389 VanDerWaalsContact OH-CD 3.25Å; Y385-K389 WeakPolarHBondContact OH-CD 3.39Å; Y385-K389 PolarHBondContact OH-NZ 3.18Å; Y385-Y390 HydrophobicContact CE1-CE2 4.47Å
386	C	95.9	Very high	94.8	Very high	7 Å²	7	68.6 Å²	68.6	5%	0.047	34%	0.342	C	S	.	.	H	α-helix	trans	-59.5	-44	176.4	-70.5	0	0	0	0	112.1	L382 E383 H388 Y390 F397 L400	L382-C386 PolarHBondContact O-N 2.99Å; L382-C386 PolarHBondContact O-SG 3.47Å; L382-C386 VanDerWaalsContact O-SG 3.32Å; E383-C386 PolarHBondContact O-N 3.18Å; C386-H388 PolarHBondContact O-N 3.46Å; C386-Y390 CarbonylContact O-C 3.53Å; C386-Y390 WeakPolarHBondContact O-CA 3.39Å; C386-Y390 PolarHBondContact O-N 3.3Å; C386-F397 HydrophobicContact CB-CB 4.27Å; C386-L400 VanDerWaalsContact SG-CD1 3.53Å
387	K	94.3	Very high	94.8	Very high	123 Å²	123	65 Å²	65	54%	0.535	33%	0.325	S	S	.	.	H	α-helix	trans	-62.9	-39.3	178	-74.6	166.6	179.8	170.2	0	112.6	E383 A384 Y385	E383-K387 HydrophobicContact CG-CD 4.41Å; E383-K387 WeakPolarHBondContact O-CB 3.37Å; E383-K387 VanDerWaalsContact O-CG 3.28Å; E383-K387 WeakPolarHBondContact O-CG 3.43Å; E383-K387 PolarHBondContact O-N 2.96Å; E383-K387 WeakPolarHBondContact OE1-CE 3.49Å; E383-K387 IonicContact OE1-NZ 3.51Å; E383-K387 PolarHBondContact OE1-NZ 3.21Å; E383-K387 IonicContact OE2-NZ 3.61Å; E383-K387 PolarHBondContact OE2-NZ 3.02Å; A384-K387 PolarHBondContact O-N 2.92Å; Y385-K387 PolarHBondContact O-N 3.35Å
388	H	94.1	Very high	94.9	Very high	169 Å²	169	66 Å²	66	78%	0.782	34%	0.339	S	S	*	.	H	α-helix	trans	-77.7	-47.5	-178	-176.2	-100.3	0	0	0	112.8	A384 Y385 C386	A384-H388 WeakPolarHBondContact O-CB 3.46Å; A384-H388 PolarHBondContact O-N 3.08Å; Y385-H388 PolarHBondContact O-N 3.43Å; C386-H388 PolarHBondContact O-N 3.46Å
389	K	94.5	Very high	94.8	Very high	88 Å²	88	72 Å²	72	38%	0.383	37%	0.365	S	S	.	.	H	α-helix	trans	-86.5	-28.9	-173.2	-171.9	177.9	174.7	-164.1	0	113.8	D345 Y385 P391	D345-K389 IonicContact OD1-NZ 3.69Å; D345-K389 IonicContact OD2-NZ 2.72Å; D345-K389 PolarHBondContact OD2-NZ 3Å; Y385-K389 HydrophobicContact CE1-CD 3.63Å; Y385-K389 HydrophobicContact CE2-CD 4.11Å; Y385-K389 WeakPolarHBondContact O-CB 3.36Å; Y385-K389 PolarHBondContact O-N 2.98Å; Y385-K389 VanDerWaalsContact OH-CD 3.25Å; Y385-K389 WeakPolarHBondContact OH-CD 3.39Å; Y385-K389 PolarHBondContact OH-NZ 3.18Å; K389-P391 VanDerWaalsContact C-CD 3.4Å
390	Y	93.7	Very high	94.9	Very high	47 Å²	47	68.2 Å²	68.2	18%	0.184	35%	0.35	C	S	.	.			trans	-128.4	55	-176.4	-59.8	-79.9	0	0	0	112.2	D345 E348 Y385 C386 E392 Q393 R396	D345-Y390 PolarHBondContact OD2-OH 2.88Å; E348-Y390 WeakPolarHBondContact OE1-CE2 3.38Å; Y385-Y390 HydrophobicContact CE1-CE2 4.47Å; C386-Y390 CarbonylContact O-C 3.53Å; C386-Y390 WeakPolarHBondContact O-CA 3.39Å; C386-Y390 PolarHBondContact O-N 3.3Å; Y390-E392 PolarHBondContact O-N 2.93Å; Y390-E392 VanDerWaalsContact O-N 3.15Å; Y390-Q393 PolarHBondContact O-N 3.43Å; Y390-R396 VanDerWaalsContact CD2-CD 3.46Å; Y390-R396 VanDerWaalsContact CD2-NE 3.3Å; Y390-R396 VanDerWaalsContact CG-CD 3.43Å
391	P	92.1	Very high	95	Very high	85 Å²	85	68.3 Å²	68.3	55%	0.552	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-28.8	-172.4	25.1	-35.6	0	0	0	114	K389 Q393	K389-P391 VanDerWaalsContact C-CD 3.4Å; P391-Q393 VanDerWaalsContact C-N 3.28Å; P391-Q393 PolarHBondContact O-N 3.45Å
392	E	93.4	Very high	95	Very high	186 Å²	186	73.5 Å²	73.5	87%	0.869	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-23.1	175	-58.1	-174.5	154	0	0	113	Y390 Q394	Y390-E392 PolarHBondContact O-N 2.93Å; Y390-E392 VanDerWaalsContact O-N 3.15Å; E392-Q394 PolarHBondContact O-N 3.3Å
393	Q	92.3	Very high	95	Very high	86 Å²	86	76 Å²	76	40%	0.402	38%	0.381	S	S	.	.			trans	-102.8	61.4	-173.9	-54.9	-172.4	19.5	0	0	111.4	Y390 P391 G395 R396	Y390-Q393 PolarHBondContact O-N 3.43Å; P391-Q393 VanDerWaalsContact C-N 3.28Å; P391-Q393 PolarHBondContact O-N 3.45Å; Q393-G395 PolarHBondContact O-N 3.2Å; Q393-R396 HydrophobicContact CB-CB 3.91Å; Q393-R396 WeakPolarHBondContact O-CB 3.46Å; Q393-R396 PolarHBondContact O-N 3.11Å
394	Q	86.8	Confident	95.1	Very high	188 Å²	188	74 Å²	74	88%	0.879	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-28.9	-176.7	-63.1	-178.1	-2.4	0	0	114.7	E392	E392-Q394 PolarHBondContact O-N 3.3Å
395	G	93.1	Very high	95.3	Very high	39 Å²	39	76.2 Å²	76.2	40%	0.402	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	4.1	175.8	0	0	0	0	0	116.2	Q393 A398 K399	Q393-G395 PolarHBondContact O-N 3.2Å; G395-A398 PolarHBondContact O-N 3.05Å; G395-K399 WeakPolarHBondContact O-CG 3.39Å; G395-K399 PolarHBondContact O-N 3.2Å
396	R	96.8	Very high	95.2	Very high	2 Å²	2	75 Å²	75	1%	0.008	38%	0.382	C	S	.	.	H	α-helix	trans	-64.5	-46	-170.5	-170.5	172.5	-180	93.4	2	113	M342 Q343 E348 Y390 Q393 A398 K399 L400	M342-R396 PolarHBondContact O-NH1 3.37Å; M342-R396 PolarHBondContact O-NH2 3.38Å; Q343-R396 PolarHBondContact O-NH2 2.98Å; E348-R396 IonicContact OE1-CZ 3.78Å; E348-R396 IonicContact OE1-NE 2.79Å; E348-R396 PolarHBondContact OE1-NE 3.42Å; E348-R396 IonicContact OE1-NH2 2.62Å; E348-R396 PolarHBondContact OE1-NH2 2.93Å; E348-R396 IonicContact OE2-CZ 3.83Å; E348-R396 IonicContact OE2-NE 3.42Å; E348-R396 IonicContact OE2-NH2 3.7Å; E348-R396 PolarHBondContact OE2-NH2 3.3Å; Y390-R396 VanDerWaalsContact CD2-CD 3.46Å; Y390-R396 VanDerWaalsContact CD2-NE 3.3Å; Y390-R396 VanDerWaalsContact CG-CD 3.43Å; Q393-R396 HydrophobicContact CB-CB 3.91Å; Q393-R396 WeakPolarHBondContact O-CB 3.46Å; Q393-R396 PolarHBondContact O-N 3.11Å; R396-A398 VanDerWaalsContact C-N 3.33Å; R396-A398 PolarHBondContact O-N 3.16Å; R396-K399 WeakPolarHBondContact O-CB 3.46Å; R396-K399 PolarHBondContact O-N 3.35Å; R396-K399 VanDerWaalsContact O-N 3.08Å; R396-L400 HydrophobicContact CG-CD1 4.37Å; R396-L400 WeakPolarHBondContact O-CG 3.43Å; R396-L400 PolarHBondContact O-N 3.11Å
397	F	97.6	Very high	95.3	Very high	44 Å²	44	75.1 Å²	75.1	19%	0.193	38%	0.382	C	S	.	.	H	α-helix	trans	-52.8	-49.3	175.3	177.2	-109.6	0	0	0	112	Y379 L382 E383 C386 K399 L400 L401	Y379-F397 HydrophobicContact CD1-CZ 4.45Å; Y379-F397 WeakPolarHBondContact O-CE2 3.37Å; L382-F397 HydrophobicContact CB-CD2 4.39Å; L382-F397 HydrophobicContact CB-CE2 4.13Å; L382-F397 HydrophobicContact CD2-CD2 4.34Å; L382-F397 HydrophobicContact CD2-CE2 4.29Å; L382-F397 HydrophobicContact CG-CD2 4.01Å; L382-F397 HydrophobicContact CG-CE2 4.14Å; E383-F397 HydrophobicContact CB-CD1 4.36Å; E383-F397 HydrophobicContact CB-CD2 3.81Å; E383-F397 HydrophobicContact CB-CE1 4.3Å; E383-F397 HydrophobicContact CB-CE2 3.74Å; E383-F397 HydrophobicContact CB-CG 4.12Å; E383-F397 HydrophobicContact CB-CZ 3.99Å; E383-F397 HydrophobicContact CG-CB 4.34Å; E383-F397 HydrophobicContact CG-CD1 3.85Å; E383-F397 HydrophobicContact CG-CD2 4.07Å; E383-F397 HydrophobicContact CG-CE1 4.09Å; E383-F397 HydrophobicContact CG-CE2 4.3Å; E383-F397 HydrophobicContact CG-CG 3.83Å; E383-F397 HydrophobicContact CG-CZ 4.3Å; C386-F397 HydrophobicContact CB-CB 4.27Å; F397-K399 PolarHBondContact O-N 2.9Å; F397-L400 WeakPolarHBondContact O-CB 3.33Å; F397-L400 PolarHBondContact O-N 3.36Å; F397-L401 HydrophobicContact CD1-CD1 4.3Å; F397-L401 HydrophobicContact CE1-CD1 3.69Å; F397-L401 HydrophobicContact CE2-CD1 4.24Å; F397-L401 HydrophobicContact CE2-CG 4.45Å; F397-L401 HydrophobicContact CZ-CD1 3.67Å; F397-L401 HydrophobicContact CZ-CG 4.35Å; F397-L401 PolarHBondContact O-N 3.17Å
398	A	97.3	Very high	95.4	Very high	53 Å²	53	74.5 Å²	74.5	44%	0.438	38%	0.377	S	S	.	.	H	α-helix	trans	-63.7	-39.7	176.8	0	0	0	0	0	112.7	G395 R396 L400 L401 L402	G395-A398 PolarHBondContact O-N 3.05Å; R396-A398 VanDerWaalsContact C-N 3.33Å; R396-A398 PolarHBondContact O-N 3.16Å; A398-L400 VanDerWaalsContact C-N 3.34Å; A398-L400 PolarHBondContact O-N 2.62Å; A398-L401 PolarHBondContact O-N 2.96Å; A398-L402 WeakPolarHBondContact O-CB 3.23Å; A398-L402 WeakPolarHBondContact O-CG 3.37Å; A398-L402 PolarHBondContact O-N 3.38Å
399	K	96.2	Very high	95.5	Very high	126 Å²	126	69.1 Å²	69.1	55%	0.548	36%	0.358	S	S	.	.	H	α-helix	trans	-63	-37.2	175.7	-73	176.2	178.1	-177.4	0	112.8	M342 G395 R396 F397	M342-K399 HydrophobicContact CE-CB 3.87Å; G395-K399 WeakPolarHBondContact O-CG 3.39Å; G395-K399 PolarHBondContact O-N 3.2Å; R396-K399 WeakPolarHBondContact O-CB 3.46Å; R396-K399 PolarHBondContact O-N 3.35Å; R396-K399 VanDerWaalsContact O-N 3.08Å; F397-K399 PolarHBondContact O-N 2.9Å
400	L	98.1	Very high	95.3	Very high	0 Å²	0	65 Å²	65	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-64.8	-52.4	175	-70.2	169	0	0	0	110.7	M342 M344 E348 L352 L382 C386 R396 F397 A398 L402 R403	M342-L400 HydrophobicContact CE-CD2 3.4Å; M342-L400 HydrophobicContact CE-CG 3.69Å; M342-L400 HydrophobicContact SD-CD2 4.1Å; M344-L400 HydrophobicContact CE-CD2 3.66Å; M344-L400 HydrophobicContact CG-CD2 4.27Å; E348-L400 HydrophobicContact CB-CD1 4.13Å; E348-L400 HydrophobicContact CB-CD2 4Å; E348-L400 HydrophobicContact CG-CD1 3.99Å; E348-L400 HydrophobicContact CG-CD2 4.49Å; L352-L400 HydrophobicContact CD1-CB 4.2Å; L352-L400 HydrophobicContact CD1-CD2 4.15Å; L352-L400 HydrophobicContact CD2-CB 4.25Å; L382-L400 HydrophobicContact CD1-CD1 4.09Å; L382-L400 HydrophobicContact CD2-CD1 4.41Å; L382-L400 HydrophobicContact CG-CD1 4.46Å; C386-L400 VanDerWaalsContact SG-CD1 3.53Å; R396-L400 HydrophobicContact CG-CD1 4.37Å; R396-L400 WeakPolarHBondContact O-CG 3.43Å; R396-L400 PolarHBondContact O-N 3.11Å; F397-L400 WeakPolarHBondContact O-CB 3.33Å; F397-L400 PolarHBondContact O-N 3.36Å; A398-L400 VanDerWaalsContact C-N 3.34Å; A398-L400 PolarHBondContact O-N 2.62Å; L400-L402 PolarHBondContact O-N 3.07Å; L400-R403 VanDerWaalsContact O-CB 3.3Å; L400-R403 WeakPolarHBondContact O-CB 3.16Å; L400-R403 WeakPolarHBondContact O-CG 3.41Å; L400-R403 PolarHBondContact O-N 2.68Å
401	L	98.1	Very high	95.1	Very high	43 Å²	43	62.7 Å²	62.7	23%	0.225	33%	0.331	C	S	.	.	H	α-helix	trans	-59.5	-35.3	177.5	-64.9	-173.7	0	0	0	112.4	L352 I355 Y379 F397 A398 R403 L404 P405	L352-L401 HydrophobicContact CD2-CD2 4.13Å; I355-L401 HydrophobicContact CD1-CD2 3.84Å; Y379-L401 HydrophobicContact CD1-CD1 4.39Å; Y379-L401 HydrophobicContact CD1-CD2 3.98Å; Y379-L401 HydrophobicContact CE1-CD1 4.31Å; Y379-L401 HydrophobicContact CE1-CD2 3.71Å; F397-L401 HydrophobicContact CD1-CD1 4.3Å; F397-L401 HydrophobicContact CE1-CD1 3.69Å; F397-L401 HydrophobicContact CE2-CD1 4.24Å; F397-L401 HydrophobicContact CE2-CG 4.45Å; F397-L401 HydrophobicContact CZ-CD1 3.67Å; F397-L401 HydrophobicContact CZ-CG 4.35Å; F397-L401 PolarHBondContact O-N 3.17Å; A398-L401 PolarHBondContact O-N 2.96Å; L401-R403 PolarHBondContact O-N 3.33Å; L401-L404 HydrophobicContact CD2-CD1 4.09Å; L401-L404 WeakPolarHBondContact O-CB 3.43Å; L401-L404 WeakPolarHBondContact O-CG 3.28Å; L401-L404 PolarHBondContact O-N 2.98Å; L401-P405 WeakPolarHBondContact O-CD 3.49Å
402	L	97.6	Very high	95.1	Very high	110 Å²	110	62.9 Å²	62.9	58%	0.576	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	1.1	173.8	-74.5	170.2	0	0	0	114.4	A398 L400	A398-L402 WeakPolarHBondContact O-CB 3.23Å; A398-L402 WeakPolarHBondContact O-CG 3.37Å; A398-L402 PolarHBondContact O-N 3.38Å; L400-L402 PolarHBondContact O-N 3.07Å
403	R	97.3	Very high	94.8	Very high	52 Å²	52	56.5 Å²	56.5	20%	0.196	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-28.9	166.1	-57.2	-60.4	76.4	-139	-7.1	112.7	E334 M342 M344 L400 L401 A406 L407	E334-R403 PolarHBondContact O-NH1 3.09Å; M342-R403 HydrophobicContact SD-CG 4.49Å; M344-R403 HydrophobicContact CE-CG 4.12Å; L400-R403 VanDerWaalsContact O-CB 3.3Å; L400-R403 WeakPolarHBondContact O-CB 3.16Å; L400-R403 WeakPolarHBondContact O-CG 3.41Å; L400-R403 PolarHBondContact O-N 2.68Å; L401-R403 PolarHBondContact O-N 3.33Å; R403-A406 PolarHBondContact O-N 2.65Å; R403-L407 PolarHBondContact O-N 3.08Å; R403-L407 VanDerWaalsContact O-N 3.08Å
404	L	97.6	Very high	94.4	Very high	33 Å²	33	53.6 Å²	53.6	17%	0.173	29%	0.285	C	S	.	.	H	α-helix	trans	-60.2	-39.8	-176.3	-58.4	173.3	0	0	0	114	L352 I355 V356 L401 A406 L407 R408	L352-L404 HydrophobicContact CB-CD2 4.36Å; L352-L404 HydrophobicContact CD2-CD1 4.21Å; L352-L404 HydrophobicContact CD2-CD2 4.06Å; L352-L404 HydrophobicContact CD2-CG 4.09Å; I355-L404 HydrophobicContact CG2-CD1 3.7Å; V356-L404 HydrophobicContact CG2-CD2 3.8Å; L401-L404 HydrophobicContact CD2-CD1 4.09Å; L401-L404 WeakPolarHBondContact O-CB 3.43Å; L401-L404 WeakPolarHBondContact O-CG 3.28Å; L401-L404 PolarHBondContact O-N 2.98Å; L404-A406 VanDerWaalsContact C-N 3.35Å; L404-A406 PolarHBondContact O-N 2.9Å; L404-L407 HydrophobicContact CD2-CD2 4.46Å; L404-L407 PolarHBondContact O-N 3.34Å; L404-R408 WeakPolarHBondContact O-CB 3.42Å; L404-R408 PolarHBondContact O-N 2.87Å
405	P	97.8	Very high	94.3	Very high	82 Å²	82	46.1 Å²	46.1	53%	0.532	25%	0.251	S	S	.	.	H	α-helix	trans	-64.5	-35.7	178.1	-23.8	35.3	0	0	0	113.9	L401 S409	L401-P405 WeakPolarHBondContact O-CD 3.49Å; P405-S409 WeakPolarHBondContact O-CB 3.5Å; P405-S409 PolarHBondContact O-N 3.2Å
406	A	95.5	Very high	93.8	Very high	12 Å²	12	49.7 Å²	49.7	10%	0.099	26%	0.257	C	S	.	.	H	α-helix	trans	-70.4	-45.4	175.7	0	0	0	0	0	110.8	E334 L335 R403 L404 R408 S409 I410	E334-A406 HydrophobicContact CB-CB 4.09Å; E334-A406 WeakPolarHBondContact OE2-CB 3.47Å; L335-A406 HydrophobicContact CD2-CB 4.16Å; R403-A406 PolarHBondContact O-N 2.65Å; L404-A406 VanDerWaalsContact C-N 3.35Å; L404-A406 PolarHBondContact O-N 2.9Å; A406-R408 VanDerWaalsContact C-N 3.33Å; A406-R408 PolarHBondContact O-N 2.67Å; A406-S409 PolarHBondContact O-N 2.94Å; A406-I410 WeakPolarHBondContact O-CB 3.46Å; A406-I410 WeakPolarHBondContact O-CG1 3.44Å; A406-I410 PolarHBondContact O-N 2.94Å
407	L	96.8	Very high	92.8	Very high	10 Å²	10	50.3 Å²	50.3	5%	0.052	26%	0.26	C	S	.	.	H	α-helix	trans	-55.8	-47.2	174.8	-178.7	64.9	0	0	0	111.4	E277 I280 A281 L335 V356 R403 L404 I410 G411	E277-L407 HydrophobicContact CB-CD2 4.21Å; E277-L407 HydrophobicContact CB-CG 4.08Å; E277-L407 HydrophobicContact CG-CG 4.25Å; I280-L407 HydrophobicContact CB-CD1 4.03Å; I280-L407 HydrophobicContact CG2-CD1 3.67Å; A281-L407 HydrophobicContact CB-CD1 4.19Å; A281-L407 HydrophobicContact CB-CD2 3.96Å; L335-L407 HydrophobicContact CD1-CD1 3.86Å; L335-L407 HydrophobicContact CD2-CB 4.18Å; V356-L407 HydrophobicContact CG2-CD2 4.09Å; R403-L407 PolarHBondContact O-N 3.08Å; R403-L407 VanDerWaalsContact O-N 3.08Å; L404-L407 HydrophobicContact CD2-CD2 4.46Å; L404-L407 PolarHBondContact O-N 3.34Å; L407-I410 PolarHBondContact O-N 3.23Å; L407-G411 PolarHBondContact O-N 2.91Å
408	R	96.1	Very high	91.8	Very high	110 Å²	110	49.5 Å²	49.5	42%	0.415	26%	0.258	S	S	.	.	H	α-helix	trans	-61.2	-44.4	176.4	-176.6	57.3	169.1	172.1	-3.6	112.6	E277 L404 A406 I410 L412	E277-R408 WeakPolarHBondContact OE1-CD 3.29Å; E277-R408 IonicContact OE1-CZ 2.88Å; E277-R408 IonicContact OE1-NE 2.94Å; E277-R408 IonicContact OE1-NH1 3.57Å; E277-R408 PolarHBondContact OE1-NH1 2.99Å; E277-R408 WeakPolarHBondContact OE2-CA 3.5Å; E277-R408 WeakPolarHBondContact OE2-CD 3.36Å; L404-R408 WeakPolarHBondContact O-CB 3.42Å; L404-R408 PolarHBondContact O-N 2.87Å; A406-R408 VanDerWaalsContact C-N 3.33Å; A406-R408 PolarHBondContact O-N 2.67Å; R408-I410 PolarHBondContact O-N 3.35Å; R408-L412 HydrophobicContact CG-CD1 4.2Å; R408-L412 WeakPolarHBondContact O-CB 3.23Å; R408-L412 VanDerWaalsContact O-CG 3.28Å; R408-L412 WeakPolarHBondContact O-CG 3.21Å; R408-L412 PolarHBondContact O-N 3.38Å; R408-L412 VanDerWaalsContact O-N 3.08Å
409	S	96.1	Very high	90.7	Very high	55 Å²	55	51.9 Å²	51.9	39%	0.385	26%	0.258	S	S	.	.	H	α-helix	trans	-63.3	-39.2	177.3	176.5	0	0	0	0	112.8	R330 P405 A406 K413	R330-S409 PolarHBondContact NH1-OG 2.84Å; R330-S409 PolarHBondContact NH2-OG 3.25Å; P405-S409 WeakPolarHBondContact O-CB 3.5Å; P405-S409 PolarHBondContact O-N 3.2Å; A406-S409 PolarHBondContact O-N 2.94Å; S409-K413 PolarHBondContact O-N 3.39Å
410	I	91.2	Very high	89.7	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-73.3	-49.2	177.8	-69.1	166.3	0	0	0	110	I280 I327 R330 V331 E334 L335 A406 L407 R408 L412 K413 C414	I280-I410 HydrophobicContact CG2-CG2 4.4Å; I327-I410 HydrophobicContact CG2-CG2 4.42Å; R330-I410 HydrophobicContact CB-CD1 4.11Å; R330-I410 HydrophobicContact CB-CG1 4.18Å; V331-I410 HydrophobicContact CG2-CG2 3.67Å; E334-I410 HydrophobicContact CB-CD1 4.15Å; L335-I410 HydrophobicContact CD1-CD1 3.91Å; L335-I410 HydrophobicContact CD2-CD1 4.43Å; L335-I410 HydrophobicContact CG-CD1 3.88Å; A406-I410 WeakPolarHBondContact O-CB 3.46Å; A406-I410 WeakPolarHBondContact O-CG1 3.44Å; A406-I410 PolarHBondContact O-N 2.94Å; L407-I410 PolarHBondContact O-N 3.23Å; R408-I410 PolarHBondContact O-N 3.35Å; I410-L412 VanDerWaalsContact C-N 3.31Å; I410-L412 PolarHBondContact O-N 3.48Å; I410-K413 PolarHBondContact O-N 2.72Å; I410-C414 PolarHBondContact O-N 3.37Å; I410-C414 PolarHBondContact O-SG 3.28Å; I410-C414 VanDerWaalsContact O-SG 3.33Å
411	G	90.3	Very high	88.4	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.2	-38.8	-179.3	0	0	0	0	0	113.6	N276 L407 C414 L415	N276-G411 VanDerWaalsContact ND2-C 3.27Å; N276-G411 PolarHBondContact ND2-O 3.37Å; L407-G411 PolarHBondContact O-N 2.91Å; G411-C414 PolarHBondContact O-N 3.47Å; G411-L415 WeakPolarHBondContact O-CG 3.44Å; G411-L415 PolarHBondContact O-N 2.95Å; G411-L415 VanDerWaalsContact O-N 3.08Å
412	L	90.6	Very high	86.9	Confident	88 Å²	88	52.7 Å²	52.7	46%	0.461	26%	0.26	S	S	.	.	H	α-helix	trans	-65.5	-40	173.2	-72.3	170.2	0	0	0	112.5	R408 I410 L415 E416	R408-L412 HydrophobicContact CG-CD1 4.2Å; R408-L412 WeakPolarHBondContact O-CB 3.23Å; R408-L412 VanDerWaalsContact O-CG 3.28Å; R408-L412 WeakPolarHBondContact O-CG 3.21Å; R408-L412 PolarHBondContact O-N 3.38Å; R408-L412 VanDerWaalsContact O-N 3.08Å; I410-L412 VanDerWaalsContact C-N 3.31Å; I410-L412 PolarHBondContact O-N 3.48Å; L412-L415 PolarHBondContact O-N 3.16Å; L412-E416 PolarHBondContact O-N 3.05Å
413	K	87.1	Confident	85.5	Confident	52 Å²	52	54.7 Å²	54.7	23%	0.226	27%	0.271	C	S	.	.	H	α-helix	trans	-70.5	-34.7	176.7	-175.3	53	174.3	165.9	0	112.1	E323 I327 S409 I410 E416 H417	E323-K413 VanDerWaalsContact OE1-CE 3.28Å; E323-K413 WeakPolarHBondContact OE1-CE 3.37Å; E323-K413 IonicContact OE1-NZ 3.41Å; E323-K413 PolarHBondContact OE1-NZ 3.45Å; I327-K413 HydrophobicContact CD1-CG 3.85Å; I327-K413 HydrophobicContact CG1-CG 3.93Å; S409-K413 PolarHBondContact O-N 3.39Å; I410-K413 PolarHBondContact O-N 2.72Å; K413-E416 WeakPolarHBondContact CD-OE2 3.47Å; K413-E416 WeakPolarHBondContact CE-OE2 3.46Å; K413-E416 IonicContact NZ-OE2 2.68Å; K413-E416 PolarHBondContact NZ-OE2 2.91Å; K413-E416 PolarHBondContact O-N 3.15Å; K413-H417 WeakPolarHBondContact CE-NE2 3.48Å; K413-H417 PolarHBondContact NZ-NE2 3.08Å; K413-H417 PolarHBondContact O-CD2 3.02Å; K413-H417 PolarHBondContact O-N 2.86Å
414	C	84.8	Confident	84	Confident	26 Å²	26	56.4 Å²	56.4	18%	0.176	28%	0.283	C	S	.	.	H	α-helix	trans	-60.3	-43.4	169.8	-66	0	0	0	0	111.8	I280 I410 G411 H417 L418	I280-C414 HydrophobicContact CD1-CB 4.14Å; I410-C414 PolarHBondContact O-N 3.37Å; I410-C414 PolarHBondContact O-SG 3.28Å; I410-C414 VanDerWaalsContact O-SG 3.33Å; G411-C414 PolarHBondContact O-N 3.47Å; C414-H417 PolarHBondContact O-N 3.15Å; C414-L418 WeakPolarHBondContact O-CG 3.35Å; C414-L418 PolarHBondContact O-N 2.86Å
415	L	83.4	Confident	82	Confident	31 Å²	31	57.5 Å²	57.5	16%	0.162	30%	0.302	C	S	.	.	H	α-helix	trans	-65.4	-42.4	176.7	-73.7	173.8	0	0	0	112.4	W275 N276 G411 L412 H417 L418 F419 L437	W275-L415 HydrophobicContact CZ2-CD2 3.82Å; N276-L415 HydrophobicContact CB-CD2 4.3Å; N276-L415 HydrophobicContact CB-CG 4.35Å; N276-L415 VanDerWaalsContact ND2-CD1 3.31Å; N276-L415 WeakPolarHBondContact ND2-CD1 3.43Å; N276-L415 WeakPolarHBondContact ND2-CG 3.37Å; G411-L415 WeakPolarHBondContact O-CG 3.44Å; G411-L415 PolarHBondContact O-N 2.95Å; G411-L415 VanDerWaalsContact O-N 3.08Å; L412-L415 PolarHBondContact O-N 3.16Å; L415-H417 VanDerWaalsContact C-N 3.25Å; L415-H417 PolarHBondContact O-N 3Å; L415-L418 PolarHBondContact O-N 2.85Å; L415-F419 HydrophobicContact CB-CD2 4.45Å; L415-F419 HydrophobicContact CB-CE2 4.38Å; L415-F419 WeakPolarHBondContact O-CD2 3.41Å; L415-F419 PolarHBondContact O-N 3.25Å; L415-L437 HydrophobicContact CD2-CD2 3.92Å
416	E	83.6	Confident	80	Confident	114 Å²	114	59.6 Å²	59.6	53%	0.533	31%	0.309	S	S	.	.	H	α-helix	trans	-53.7	-44.3	174.7	-176.3	-178.6	-138.7	0	0	111.4	L412 K413 F420	L412-E416 PolarHBondContact O-N 3.05Å; K413-E416 WeakPolarHBondContact CD-OE2 3.47Å; K413-E416 WeakPolarHBondContact CE-OE2 3.46Å; K413-E416 IonicContact NZ-OE2 2.68Å; K413-E416 PolarHBondContact NZ-OE2 2.91Å; K413-E416 PolarHBondContact O-N 3.15Å; E416-F420 WeakPolarHBondContact O-CB 3.14Å; E416-F420 PolarHBondContact O-N 2.86Å
417	H	76.8	Confident	78.2	Confident	14 Å²	14	60.1 Å²	60.1	7%	0.065	31%	0.311	C	S	.	.	H	α-helix	trans	-67.3	-44	176.4	-86.7	-104.9	0	0	0	113	E323 I327 K413 C414 L415 F419 F420 F421	E323-H417 WeakPolarHBondContact CB-CE1 3.39Å; E323-H417 WeakPolarHBondContact CG-CE1 3.38Å; E323-H417 VanDerWaalsContact CG-NE2 3.26Å; E323-H417 WeakPolarHBondContact CG-NE2 3.47Å; E323-H417 IonicContact OE1-CE1 3.61Å; E323-H417 PolarHBondContact OE1-CE1 3.44Å; E323-H417 IonicContact OE1-NE2 2.65Å; E323-H417 PolarHBondContact OE1-NE2 3.11Å; E323-H417 IonicContact OE2-CE1 3.26Å; E323-H417 PolarHBondContact OE2-CE1 2.99Å; E323-H417 IonicContact OE2-NE2 3.5Å; E323-H417 PolarHBondContact OE2-NE2 2.97Å; E323-H417 VanDerWaalsContact OE2-NE2 3.1Å; I327-H417 HydrophobicContact CD1-CB 4.43Å; K413-H417 WeakPolarHBondContact CE-NE2 3.48Å; K413-H417 PolarHBondContact NZ-NE2 3.08Å; K413-H417 PolarHBondContact O-CD2 3.02Å; K413-H417 PolarHBondContact O-N 2.86Å; C414-H417 PolarHBondContact O-N 3.15Å; L415-H417 VanDerWaalsContact C-N 3.25Å; L415-H417 PolarHBondContact O-N 3Å; H417-F419 VanDerWaalsContact C-N 3.32Å; H417-F419 PolarHBondContact O-N 3.18Å; H417-F420 WeakPolarHBondContact O-CB 3.45Å; H417-F420 PolarHBondContact O-N 3.16Å; H417-F420 VanDerWaalsContact O-N 3.14Å; H417-F421 HydrophobicContact CB-CE2 4.26Å; H417-F421 WeakPolarHBondContact O-CD2 3.27Å; H417-F421 PolarHBondContact O-N 3.11Å
418	L	75.3	Confident	76.2	Confident	28 Å²	28	64.3 Å²	64.3	15%	0.147	34%	0.339	C	S	.	.	H	α-helix	trans	-62.2	-38	176.5	-71.6	170.6	0	0	0	112.4	W275 C414 L415 K422 L437	W275-L418 HydrophobicContact CH2-CD1 3.86Å; W275-L418 HydrophobicContact CZ2-CD1 4.49Å; C414-L418 WeakPolarHBondContact O-CG 3.35Å; C414-L418 PolarHBondContact O-N 2.86Å; L415-L418 PolarHBondContact O-N 2.85Å; L418-K422 WeakPolarHBondContact O-CB 3.31Å; L418-K422 PolarHBondContact O-N 3.33Å; L418-L437 HydrophobicContact CB-CD1 4.36Å; L418-L437 HydrophobicContact CB-CD2 4.1Å; L418-L437 HydrophobicContact CD1-CD2 4.48Å
419	F	75	Confident	74.5	Confident	103 Å²	103	60 Å²	60	45%	0.452	32%	0.324	S	S	.	.	H	α-helix	trans	-66.3	-38.8	172.4	-78.1	-61.5	0	0	0	112.5	L415 H417 K422 L423 L437	L415-F419 HydrophobicContact CB-CD2 4.45Å; L415-F419 HydrophobicContact CB-CE2 4.38Å; L415-F419 WeakPolarHBondContact O-CD2 3.41Å; L415-F419 PolarHBondContact O-N 3.25Å; H417-F419 VanDerWaalsContact C-N 3.32Å; H417-F419 PolarHBondContact O-N 3.18Å; F419-K422 PolarHBondContact O-N 3.09Å; F419-L423 WeakPolarHBondContact O-CB 3.5Å; F419-L423 PolarHBondContact O-N 3.1Å; F419-L437 HydrophobicContact CE1-CB 4.31Å; F419-L437 HydrophobicContact CE1-CD2 4.35Å; F419-L437 VanDerWaalsContact CE1-O 3.24Å; F419-L437 WeakPolarHBondContact CE1-O 3.49Å; F419-L437 HydrophobicContact CE2-CD2 4.45Å; F419-L437 HydrophobicContact CZ-CD2 4.19Å; F419-L437 WeakPolarHBondContact CZ-O 3.48Å
420	F	74.8	Confident	72.9	Confident	96 Å²	96	60.9 Å²	60.9	42%	0.421	32%	0.324	S	S	.	.	H	α-helix	trans	-63.6	-47.6	176	-175.4	-93.7	0	0	0	111.9	Q320 E416 H417 L423 I424	Q320-F420 VanDerWaalsContact NE2-CE1 3.34Å; E416-F420 WeakPolarHBondContact O-CB 3.14Å; E416-F420 PolarHBondContact O-N 2.86Å; H417-F420 WeakPolarHBondContact O-CB 3.45Å; H417-F420 PolarHBondContact O-N 3.16Å; H417-F420 VanDerWaalsContact O-N 3.14Å; F420-L423 PolarHBondContact O-N 3.38Å; F420-I424 HydrophobicContact CD1-CD1 3.82Å; F420-I424 HydrophobicContact CD2-CD1 4.45Å; F420-I424 HydrophobicContact CE1-CD1 3.29Å; F420-I424 HydrophobicContact CE2-CD1 4.01Å; F420-I424 HydrophobicContact CG-CD1 4.37Å; F420-I424 HydrophobicContact CZ-CD1 3.42Å; F420-I424 VanDerWaalsContact CZ-CD1 3.42Å; F420-I424 PolarHBondContact O-N 2.78Å
421	F	70	Confident	71.5	Confident	29 Å²	29	66.9 Å²	66.9	13%	0.127	36%	0.361	C	S	.	.	H	α-helix	trans	-62.4	-42.4	175.2	-69.7	-60.3	0	0	0	112.2	V235 Q320 V324 H417 L423 I424 G425	V235-F421 HydrophobicContact CG1-CD2 4.04Å; V235-F421 HydrophobicContact CG1-CE2 4.01Å; V235-F421 HydrophobicContact CG1-CG 4.49Å; V235-F421 HydrophobicContact CG1-CZ 4.42Å; V235-F421 HydrophobicContact CG2-CE2 4.38Å; V235-F421 HydrophobicContact CG2-CZ 4.2Å; Q320-F421 HydrophobicContact CG-CE1 3.95Å; Q320-F421 HydrophobicContact CG-CZ 4.19Å; V324-F421 HydrophobicContact CG2-CE2 4.26Å; V324-F421 HydrophobicContact CG2-CZ 4.11Å; H417-F421 HydrophobicContact CB-CE2 4.26Å; H417-F421 WeakPolarHBondContact O-CD2 3.27Å; H417-F421 PolarHBondContact O-N 3.11Å; F421-L423 VanDerWaalsContact C-N 3.3Å; F421-L423 PolarHBondContact O-N 3.37Å; F421-I424 PolarHBondContact O-N 3.41Å; F421-G425 PolarHBondContact O-N 2.78Å
422	K	68	Low	70	Confident	60 Å²	60	69 Å²	69	26%	0.261	37%	0.37	S	S	.	.	H	α-helix	trans	-58.4	-39.3	173.7	176.7	171.3	177.7	161.1	0	112.8	L418 F419 I429 M434 E438	L418-K422 WeakPolarHBondContact O-CB 3.31Å; L418-K422 PolarHBondContact O-N 3.33Å; F419-K422 PolarHBondContact O-N 3.09Å; K422-I429 HydrophobicContact CB-CD1 3.91Å; K422-M434 HydrophobicContact CD-SD 3.64Å; K422-M434 WeakPolarHBondContact CE-SD 3.46Å; K422-M434 HydrophobicContact CG-SD 4.26Å; K422-M434 PolarHBondContact NZ-SD 3.32Å; K422-E438 IonicContact NZ-OE1 2.78Å; K422-E438 PolarHBondContact NZ-OE1 3Å
423	L	66.8	Low	68.8	Low	153 Å²	153	64.9 Å²	64.9	80%	0.801	35%	0.349	S	S	*	.	H	α-helix	trans	-74.6	-27.4	-176	-168.6	66.3	0	0	0	113.1	F419 F420 F421	F419-L423 WeakPolarHBondContact O-CB 3.5Å; F419-L423 PolarHBondContact O-N 3.1Å; F420-L423 PolarHBondContact O-N 3.38Å; F421-L423 VanDerWaalsContact C-N 3.3Å; F421-L423 PolarHBondContact O-N 3.37Å
424	I	65.9	Low	67.7	Low	88 Å²	88	64.9 Å²	64.9	45%	0.451	35%	0.35	S	S	.	.	H	α-helix	trans	-88.4	-33.7	179.4	-66.7	173.2	0	0	0	111.6	F420 F421 D426	F420-I424 HydrophobicContact CD1-CD1 3.82Å; F420-I424 HydrophobicContact CD2-CD1 4.45Å; F420-I424 HydrophobicContact CE1-CD1 3.29Å; F420-I424 HydrophobicContact CE2-CD1 4.01Å; F420-I424 HydrophobicContact CG-CD1 4.37Å; F420-I424 HydrophobicContact CZ-CD1 3.42Å; F420-I424 VanDerWaalsContact CZ-CD1 3.42Å; F420-I424 PolarHBondContact O-N 2.78Å; F421-I424 PolarHBondContact O-N 3.41Å; I424-D426 HydrophobicContact CG2-CB 4.48Å; I424-D426 VanDerWaalsContact CG2-OD2 3.25Å; I424-D426 WeakPolarHBondContact CG2-OD2 3.38Å
425	G	55.4	Low	67	Low	56 Å²	56	68.2 Å²	68.2	58%	0.577	36%	0.363	S	S	*	.			trans	88.3	1.8	172.1	0	0	0	0	0	115.9	F421 T427	F421-G425 PolarHBondContact O-N 2.78Å; G425-T427 PolarHBondContact O-N 3.42Å
426	D	55.9	Low	66.3	Low	126 Å²	126	67.8 Å²	67.8	67%	0.674	36%	0.361	S	S	*	.			trans	-70.5	-9.7	-178.8	-71.7	-30.7	0	0	0	114.5	I424	I424-D426 HydrophobicContact CG2-CB 4.48Å; I424-D426 VanDerWaalsContact CG2-OD2 3.25Å; I424-D426 WeakPolarHBondContact CG2-OD2 3.38Å
427	T	58	Low	65.3	Low	22 Å²	22	62.8 Å²	62.8	14%	0.135	34%	0.337	C	S	.	.	S	Bend	trans	-125.7	125.3	-179	-12.5	0	0	0	0	110.7	V235 G425 I429	V235-T427 HydrophobicContact CG1-CG2 4.43Å; G425-T427 PolarHBondContact O-N 3.42Å; T427-I429 PolarHBondContact O-N 3.42Å
428	P	55	Low	64.7	Low	98 Å²	98	66.2 Å²	66.2	64%	0.636	35%	0.353	S	S	*	.			trans	-67.2	122.8	171.8	28.1	-32.8	0	0	0	109.2
429	I	60.6	Low	63.6	Low	20 Å²	20	68.7 Å²	68.7	10%	0.103	38%	0.378	C	S	.	.			trans	-107.8	123.2	174.8	-71.3	170.5	0	0	0	107.5	K422 T427 L433 M434 L437	K422-I429 HydrophobicContact CB-CD1 3.91Å; T427-I429 PolarHBondContact O-N 3.42Å; I429-L433 HydrophobicContact CG2-CB 4.04Å; I429-L433 HydrophobicContact CG2-CD2 3.95Å; I429-L433 HydrophobicContact CG2-CG 4.36Å; I429-M434 HydrophobicContact CB-CE 3.73Å; I429-M434 HydrophobicContact CB-SD 4.48Å; I429-M434 HydrophobicContact CG2-CB 4.17Å; I429-M434 HydrophobicContact CG2-CE 3.84Å; I429-M434 HydrophobicContact CG2-SD 4.06Å; I429-L437 HydrophobicContact CD1-CD1 4.45Å; I429-L437 HydrophobicContact CG2-CD1 4.45Å
430	D	62.3	Low	62.3	Low	73 Å²	73	68.8 Å²	68.8	39%	0.39	39%	0.389	S	S	.	.			trans	-61.6	153.5	179.4	-72.4	-59	0	0	0	112.4	D243 F432 L433 M434	D243-D430 HydrophobicContact CB-CB 4.29Å; D430-F432 VanDerWaalsContact C-N 3.28Å; D430-F432 PolarHBondContact O-N 2.97Å; D430-L433 PolarHBondContact O-N 2.88Å; D430-M434 WeakPolarHBondContact O-CB 3.42Å; D430-M434 PolarHBondContact O-N 3.13Å
431	T	62.1	Low	60.6	Low	127 Å²	127	71.7 Å²	71.7	78%	0.779	40%	0.404	S	S	*	.	H	α-helix	trans	-63.3	-28.8	-167.3	50.1	0	0	0	0	114.1	M434 E435	T431-M434 WeakPolarHBondContact O-CB 3.46Å; T431-E435 WeakPolarHBondContact O-CB 3.4Å; T431-E435 PolarHBondContact O-N 3.3Å
432	F	59.5	Low	58.8	Low	45 Å²	45	79.4 Å²	79.4	20%	0.197	44%	0.44	C	S	.	.	H	α-helix	trans	-83.1	-41.7	-179.5	-168.1	-130.7	0	0	0	111.9	D243 L246 F247 D430 M434 E435 M436	D243-F432 WeakPolarHBondContact OD1-CB 3.28Å; L246-F432 HydrophobicContact CB-CD1 3.9Å; L246-F432 HydrophobicContact CB-CE1 3.73Å; L246-F432 HydrophobicContact CD1-CD1 3.88Å; L246-F432 HydrophobicContact CD1-CE1 4.2Å; F247-F432 HydrophobicContact CD2-CD1 4.45Å; F247-F432 HydrophobicContact CE1-CD1 4.29Å; F247-F432 HydrophobicContact CE1-CE1 4.33Å; F247-F432 AromaticContact CE2-CD1 3.91Å; F247-F432 HydrophobicContact CE2-CD1 3.91Å; F247-F432 HydrophobicContact CZ-CB 4.47Å; F247-F432 AromaticContact CZ-CD1 3.81Å; F247-F432 HydrophobicContact CZ-CD1 3.81Å; F247-F432 HydrophobicContact CZ-CE1 4.3Å; F247-F432 HydrophobicContact CZ-CG 4.26Å; D430-F432 VanDerWaalsContact C-N 3.28Å; D430-F432 PolarHBondContact O-N 2.97Å; F432-M434 PolarHBondContact O-N 3.04Å; F432-E435 WeakPolarHBondContact O-CB 3.39Å; F432-E435 PolarHBondContact O-N 3.41Å; F432-M436 VanDerWaalsContact O-CG 3.27Å; F432-M436 WeakPolarHBondContact O-CG 3.21Å; F432-M436 PolarHBondContact O-N 3.26Å
433	L	64.1	Low	56.8	Low	1 Å²	1	84.8 Å²	84.8	1%	0.005	47%	0.471	C	S	.	.	H	α-helix	trans	-56.9	-38.3	165.2	-158.7	83	0	0	0	111.6	C239 A242 D243 L246 W275 I429 D430 M436 L437	C239-L433 HydrophobicContact CB-CD2 3.96Å; A242-L433 HydrophobicContact CB-CD1 3.99Å; D243-L433 PolarHBondContact OD1-N 2.88Å; L246-L433 HydrophobicContact CD1-CD1 3.98Å; W275-L433 HydrophobicContact CH2-CD1 3.64Å; W275-L433 HydrophobicContact CH2-CG 4.38Å; W275-L433 HydrophobicContact CZ2-CD1 4.48Å; W275-L433 HydrophobicContact CZ3-CD1 3.68Å; I429-L433 HydrophobicContact CG2-CB 4.04Å; I429-L433 HydrophobicContact CG2-CD2 3.95Å; I429-L433 HydrophobicContact CG2-CG 4.36Å; D430-L433 PolarHBondContact O-N 2.88Å; L433-M436 PolarHBondContact O-N 3.21Å; L433-L437 HydrophobicContact CG-CD1 4.45Å; L433-L437 WeakPolarHBondContact O-CG 3.39Å; L433-L437 PolarHBondContact O-N 3.2Å
434	M	65.2	Low	55	Low	52 Å²	52	86.4 Å²	86.4	26%	0.256	50%	0.495	S	S	.	.	H	α-helix	trans	-62.1	-48	174.4	-162.6	73	79.1	0	0	111.7	K422 I429 D430 T431 F432 M436 L437 E438	K422-M434 HydrophobicContact CD-SD 3.64Å; K422-M434 WeakPolarHBondContact CE-SD 3.46Å; K422-M434 HydrophobicContact CG-SD 4.26Å; K422-M434 PolarHBondContact NZ-SD 3.32Å; I429-M434 HydrophobicContact CB-CE 3.73Å; I429-M434 HydrophobicContact CB-SD 4.48Å; I429-M434 HydrophobicContact CG2-CB 4.17Å; I429-M434 HydrophobicContact CG2-CE 3.84Å; I429-M434 HydrophobicContact CG2-SD 4.06Å; D430-M434 WeakPolarHBondContact O-CB 3.42Å; D430-M434 PolarHBondContact O-N 3.13Å; T431-M434 WeakPolarHBondContact O-CB 3.46Å; F432-M434 PolarHBondContact O-N 3.04Å; M434-M436 VanDerWaalsContact C-N 3.26Å; M434-M436 PolarHBondContact O-N 3.36Å; M434-L437 PolarHBondContact O-N 2.82Å; M434-E438 WeakPolarHBondContact O-CG 3.48Å; M434-E438 PolarHBondContact O-N 2.81Å
435	E	70.2	Confident	54.5	Low	97 Å²	97	86.4 Å²	86.4	45%	0.453	50%	0.497	S	S	.	.	H	α-helix	trans	-58.2	-38.9	177.4	-151.9	-150.6	119.3	0	0	111.5	R272 T431 F432 E438	R272-E435 VanDerWaalsContact CZ-O 3.25Å; R272-E435 IonicContact CZ-OE1 2.82Å; R272-E435 PolarHBondContact NH1-O 3.37Å; R272-E435 PolarHBondContact NH2-O 2.54Å; R272-E435 IonicContact NH2-OE1 1.92Å; R272-E435 PolarHBondContact NH2-OE1 2.8Å; T431-E435 WeakPolarHBondContact O-CB 3.4Å; T431-E435 PolarHBondContact O-N 3.3Å; F432-E435 WeakPolarHBondContact O-CB 3.39Å; F432-E435 PolarHBondContact O-N 3.41Å; E435-E438 PolarHBondContact O-N 2.79Å
436	M	67.2	Low	54.4	Low	22 Å²	22	87.9 Å²	87.9	11%	0.108	49%	0.493	C	S	.	.	H	α-helix	trans	-76.8	-23.5	179.6	-67.1	-69.1	-76.1	0	0	113.9	L246 R272 W275 F432 L433 M434	L246-M436 HydrophobicContact CD1-CG 4.02Å; L246-M436 HydrophobicContact CD2-CE 4.34Å; R272-M436 HydrophobicContact CG-CE 4.06Å; R272-M436 HydrophobicContact CG-SD 3.61Å; W275-M436 HydrophobicContact CB-CE 3.69Å; W275-M436 HydrophobicContact CG-CE 3.66Å; F432-M436 VanDerWaalsContact O-CG 3.27Å; F432-M436 WeakPolarHBondContact O-CG 3.21Å; F432-M436 PolarHBondContact O-N 3.26Å; L433-M436 PolarHBondContact O-N 3.21Å; M434-M436 VanDerWaalsContact C-N 3.26Å; M434-M436 PolarHBondContact O-N 3.36Å
437	L	62.5	Low	54.4	Low	8 Å²	8	85.8 Å²	85.8	4%	0.042	48%	0.483	C	S	.	.	H	α-helix	trans	-83.5	-21.8	171.3	-73.7	168.2	0	0	0	112.4	W275 L415 L418 F419 I429 L433 M434	W275-L437 HydrophobicContact CZ2-CD2 4.07Å; W275-L437 HydrophobicContact CZ2-CG 4.4Å; L415-L437 HydrophobicContact CD2-CD2 3.92Å; L418-L437 HydrophobicContact CB-CD1 4.36Å; L418-L437 HydrophobicContact CB-CD2 4.1Å; L418-L437 HydrophobicContact CD1-CD2 4.48Å; F419-L437 HydrophobicContact CE1-CB 4.31Å; F419-L437 HydrophobicContact CE1-CD2 4.35Å; F419-L437 VanDerWaalsContact CE1-O 3.24Å; F419-L437 WeakPolarHBondContact CE1-O 3.49Å; F419-L437 HydrophobicContact CE2-CD2 4.45Å; F419-L437 HydrophobicContact CZ-CD2 4.19Å; F419-L437 WeakPolarHBondContact CZ-O 3.48Å; I429-L437 HydrophobicContact CD1-CD1 4.45Å; I429-L437 HydrophobicContact CG2-CD1 4.45Å; L433-L437 HydrophobicContact CG-CD1 4.45Å; L433-L437 WeakPolarHBondContact O-CG 3.39Å; L433-L437 PolarHBondContact O-N 3.2Å; M434-L437 PolarHBondContact O-N 2.82Å
438	E	65.5	Low	54.1	Low	86 Å²	86	89.6 Å²	89.6	40%	0.402	50%	0.503	S	S	.	.	S	Bend	trans	-80.6	123.1	178.3	-74.7	177.1	-176.9	0	0	111.6	R272 K422 M434 E435	R272-E438 PolarHBondContact NH1-O 2.72Å; R272-E438 VanDerWaalsContact NH1-O 3.15Å; K422-E438 IonicContact NZ-OE1 2.78Å; K422-E438 PolarHBondContact NZ-OE1 3Å; M434-E438 WeakPolarHBondContact O-CG 3.48Å; M434-E438 PolarHBondContact O-N 2.81Å; E435-E438 PolarHBondContact O-N 2.79Å
439	A	52	Low	54.1	Low	81 Å²	81	89.1 Å²	89.1	67%	0.669	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-61.6	130.8	168.3	0	0	0	0	0	108.3	H441	A439-H441 PolarHBondContact O-N 3.4Å; A439-H441 VanDerWaalsContact O-N 3.15Å
440	P	46.3	Very low	53.7	Low	105 Å²	105	93.7 Å²	93.7	68%	0.682	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-56.3	125.8	-176.6	22.9	-33.4	0	0	0	109.3	Q442	P440-Q442 PolarHBondContact O-N 3.28Å
441	H	40.7	Very low	53	Low	157 Å²	157	95.1 Å²	95.1	73%	0.727	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-55.5	126.1	174.6	-69.2	-3.2	0	0	0	108.6	A439 L443	A439-H441 PolarHBondContact O-N 3.4Å; A439-H441 VanDerWaalsContact O-N 3.15Å; H441-L443 PolarHBondContact O-N 3.18Å
442	Q	31.5	Very low	52.3	Low	190 Å²	190	92.7 Å²	92.7	89%	0.888	51%	0.511	S	S	*	.			trans	-70	88.5	171	-70.2	-176.4	-13.9	0	0	107.9	P440 S444	P440-Q442 PolarHBondContact O-N 3.28Å; Q442-S444 PolarHBondContact O-N 2.85Å; Q442-S444 VanDerWaalsContact O-N 3.09Å
443	L	27.1	Very low	51.7	Low	174 Å²	174	96.7 Å²	96.7	91%	0.911	54%	0.538	S	S	*	.			trans	-63.1	106.6	164	-77.9	164.2	0	0	0	107.1	H441	H441-L443 PolarHBondContact O-N 3.18Å
444	S	28.6	Very low	50.6	Low	187 Å²	187	105.4 Å²	105.4	100%	1.308	59%	0.586	S	S	*	*			trans	-73.4	0	-175	59.2	0	0	0	0	113.5	Q442	Q442-S444 PolarHBondContact O-N 2.85Å; Q442-S444 VanDerWaalsContact O-N 3.09Å

Retrieved 444 of 444 residues in 834.3 ms (Link to these results)

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