A0A096NDH4_PAPAN Loading...

Spermatogenesis-associated protein 16

Essential for spermiogenesis and male fertility. Involved in the formation of sperm acrosome during spermatogenesis.

AlphaFold DB (A0A2K5NCX4), UniProt , Accession A0A096NDH4, Species PAPAN (Papio anubis, Olive baboon), Gene SPATA16, Length 569 aa.

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.9	Very low	30	Very low	228 Å²	228	143.8 Å²	143.8	100%	1.123	82%	0.82	S	S	*	*				0	75.9	0	-58.5	-165.7	-167.4	0	0	105.4
2	D	29.6	Very low	29.8	Very low	160 Å²	160	139.3 Å²	139.3	86%	0.856	81%	0.813	S	S	*	*				77.5	138.4	92	-68	-31.7	0	0	0	110.6
3	A	32.8	Very low	29.5	Very low	99 Å²	99	138 Å²	138	82%	0.818	81%	0.808	S	S	*	*			cis	178.1	155.2	-17.5	0	0	0	0	0	105.2
4	G	27.6	Very low	29.3	Very low	71 Å²	71	138 Å²	138	73%	0.732	80%	0.803	S	S	*	*			trans	126.1	91.6	161.2	0	0	0	0	0	114
5	S	34.2	Very low	29.2	Very low	118 Å²	118	144.3 Å²	144.3	83%	0.825	81%	0.808	S	S	*	*				66.4	133.8	63.3	-166.3	0	0	0	0	111.9
6	S	33.3	Very low	29	Very low	97 Å²	97	144.8 Å²	144.8	68%	0.678	81%	0.806	S	S	*	*			cis	-175.3	162.2	6.8	38.3	0	0	0	0	109.9
7	R	29.2	Very low	28.7	Very low	233 Å²	233	149.4 Å²	149.4	88%	0.879	81%	0.81	S	S	*	*			trans	151.5	109.8	135.2	-87	-179.5	175.4	-179.3	-0.8	108.8
8	S	30.1	Very low	28.6	Very low	98 Å²	98	151.2 Å²	151.2	69%	0.685	81%	0.812	S	S	*	*			cis	79.3	111.7	43	83.7	0	0	0	0	115.9
9	L	28.3	Very low	28.4	Very low	167 Å²	167	150.1 Å²	150.1	87%	0.874	81%	0.806	S	S	*	*			trans	-168.1	104	139.5	-131.8	105.3	0	0	0	105.5
10	E	27.8	Very low	28.3	Very low	167 Å²	167	150.7 Å²	150.7	78%	0.78	80%	0.804	S	S	*	*				63.4	113.1	60.6	-97.9	-175.9	-179.3	0	0	116.7
11	N	26.3	Very low	28.2	Very low	144 Å²	144	151.8 Å²	151.8	77%	0.77	81%	0.809	S	S	*	*				168	101.8	127.2	-79.2	-23.2	0	0	0	108.5
12	A	27.4	Very low	28.2	Very low	89 Å²	89	146.7 Å²	146.7	74%	0.736	79%	0.79	S	S	*	*				55.4	124.8	82.8	0	0	0	0	0	112.9
13	V	26.4	Very low	28.1	Very low	123 Å²	123	145 Å²	145	75%	0.745	79%	0.788	S	S	*	*				-176.3	135.7	81.8	155.7	0	0	0	0	112.3
14	N	26.1	Very low	27.8	Very low	138 Å²	138	149.2 Å²	149.2	74%	0.738	79%	0.788	S	S	*	*			trans	40.8	122.6	146.4	-58.6	-26.8	0	0	0	122.9
15	R	28.5	Very low	27.8	Very low	232 Å²	232	152.4 Å²	152.4	88%	0.875	79%	0.786	S	S	*	*				60.9	118.5	75.4	-119.5	-172.3	-166.5	-177.1	4.2	114.6
16	I	25.3	Very low	27.3	Very low	153 Å²	153	153.4 Å²	153.4	79%	0.785	78%	0.783	S	S	*	*			trans	-160.8	126.8	140.4	-86.9	139.1	0	0	0	109
17	Y	24.2	Very low	26.9	Very low	223 Å²	223	154.6 Å²	154.6	88%	0.875	79%	0.786	S	S	*	*			trans	-90.8	142.3	162	-111.5	-98.4	0	0	0	107.7
18	H	26.2	Very low	26.7	Very low	182 Å²	182	149 Å²	149	84%	0.843	78%	0.783	S	S	*	*			trans	-140.5	137.9	156	-99.5	-59.6	0	0	0	111.4
19	D	25.4	Very low	26.6	Very low	130 Å²	130	153.8 Å²	153.8	70%	0.695	79%	0.791	S	S	*	*			trans	-107	152.3	-169.7	-148.1	7.4	0	0	0	110
20	Q	26.7	Very low	26.4	Very low	162 Å²	162	154.7 Å²	154.7	76%	0.757	79%	0.788	S	S	*	*			trans	59.3	127.3	159.3	-64.4	178.3	23.7	0	0	121.6
21	L	25.3	Very low	26.3	Very low	174 Å²	174	155.4 Å²	155.4	91%	0.911	79%	0.793	S	S	*	*			trans	-163.3	124.1	130.2	-101.9	160.7	0	0	0	111.2
22	V	30.7	Very low	26.2	Very low	121 Å²	121	153.1 Å²	153.1	73%	0.733	79%	0.789	S	S	*	*			trans	-78.6	150.5	168.6	174.9	0	0	0	0	109.5
23	P	29.1	Very low	26.1	Very low	124 Å²	124	154.5 Å²	154.5	81%	0.805	79%	0.788	S	S	*	*				-138.1	146.3	128.1	17.3	4.3	0	0	0	115.4
24	K	25.3	Very low	26	Very low	188 Å²	188	155.7 Å²	155.7	82%	0.817	79%	0.789	S	S	*	*			trans	-83.1	132.9	171.5	-82.7	174.4	171	174.4	0	111.9
25	I	28	Very low	26	Very low	138 Å²	138	153 Å²	153	71%	0.708	79%	0.787	S	S	*	*			trans	42.2	115.4	132	-53.3	169.6	0	0	0	119.8
26	N	23.6	Very low	25.9	Very low	139 Å²	139	150.2 Å²	150.2	74%	0.743	78%	0.783	S	S	*	*				177.4	133.2	107.8	-105.2	-26.8	0	0	0	116
27	T	25.9	Very low	26.1	Very low	122 Å²	122	148.3 Å²	148.3	75%	0.748	78%	0.781	S	S	*	*			trans	32.8	121.7	145.6	59.1	0	0	0	0	123.2
28	S	25.1	Very low	26.4	Very low	116 Å²	116	143.8 Å²	143.8	81%	0.811	78%	0.779	S	S	*	*				179.3	124.7	113.8	62.9	0	0	0	0	115.1
29	K	26.8	Very low	26.4	Very low	198 Å²	198	143.1 Å²	143.1	86%	0.861	78%	0.782	S	S	*	*			trans	36.2	128.1	140.9	-79.5	175.1	175.4	171.8	0	123.6
30	K	24.7	Very low	26.4	Very low	185 Å²	185	144.4 Å²	144.4	80%	0.804	79%	0.787	S	S	*	*			trans	96.4	112.5	135.4	-85.6	-174.1	172.6	-175.2	0	120.9
31	M	24.7	Very low	26.5	Very low	182 Å²	182	144.3 Å²	144.3	90%	0.897	79%	0.79	S	S	*	*			trans	42.4	136.7	132.4	-67.5	-179.3	167.4	0	0	119.3
32	S	24	Very low	26.4	Very low	97 Å²	97	145.6 Å²	145.6	68%	0.678	79%	0.792	S	S	*	*			cis	-165.1	154.9	47.3	69.1	0	0	0	0	115
33	T	25.8	Very low	26.1	Very low	118 Å²	118	147.4 Å²	147.4	72%	0.724	79%	0.794	S	S	*	*			trans	54	138.6	142.5	50.3	0	0	0	0	120.1
34	L	24.6	Very low	25.9	Very low	147 Å²	147	147.2 Å²	147.2	77%	0.77	79%	0.793	S	S	*	*			cis	-167	139.6	8.1	-136	103.6	0	0	0	102.5
35	A	26.6	Very low	25.9	Very low	83 Å²	83	146.4 Å²	146.4	69%	0.686	79%	0.792	S	S	*	*				178.5	131.8	76.2	0	0	0	0	0	110.3
36	H	26.8	Very low	25.8	Very low	173 Å²	173	148.1 Å²	148.1	80%	0.801	80%	0.797	S	S	*	*			trans	35.5	114.5	154.7	-57	-65.6	0	0	0	123.5
37	P	29.3	Very low	25.9	Very low	112 Å²	112	149.6 Å²	149.6	73%	0.727	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-92.7	156.7	153.9	34.9	-28.4	0	0	0	112.6
38	P	29.8	Very low	25.9	Very low	128 Å²	128	152.3 Å²	152.3	83%	0.831	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-79.8	139.6	174.9	30.5	-30.5	0	0	0	112.5
39	N	25.5	Very low	25.9	Very low	169 Å²	169	155 Å²	155	90%	0.904	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-68.2	139.1	-173.4	-78.1	-32.7	0	0	0	114
40	I	27.1	Very low	25.7	Very low	156 Å²	156	153.8 Å²	153.8	80%	0.8	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-96.4	130.5	169.8	-73.2	171.3	0	0	0	108.4
41	L	27.1	Very low	25.5	Very low	160 Å²	160	150.7 Å²	150.7	84%	0.838	81%	0.805	S	S	*	*			trans	51.7	96	150.6	-135.6	90.6	0	0	0	117.8
42	E	25	Very low	25.4	Very low	201 Å²	201	145.9 Å²	145.9	94%	0.939	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-84.4	119	161.9	-82.3	-175.7	161.1	0	0	110.9
43	M	23.2	Very low	25.4	Very low	159 Å²	159	144.8 Å²	144.8	78%	0.783	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-102.7	130.6	165.2	-130.5	-84.3	163.1	0	0	106.7
44	P	25.1	Very low	25.4	Very low	120 Å²	120	148.9 Å²	148.9	78%	0.779	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-84.6	121.5	-177.5	29	-27.6	0	0	0	111.2
45	Q	25.1	Very low	25.3	Very low	172 Å²	172	150.8 Å²	150.8	80%	0.804	82%	0.819	S	S	*	*			trans	-120.8	117.2	162.5	-87.1	-163.1	-20.2	0	0	112.4
46	E	25.5	Very low	25.3	Very low	173 Å²	173	152.3 Å²	152.3	81%	0.808	82%	0.819	S	S	*	*			trans	54	119.1	137.7	-63.8	-173.4	167.4	0	0	122
47	I	27.1	Very low	25.1	Very low	170 Å²	170	151.7 Å²	151.7	87%	0.872	82%	0.817	S	S	*	*			trans	-114.5	101.3	143.9	-66.3	175.7	0	0	0	109.6
48	K	25	Very low	24.9	Very low	179 Å²	179	153.1 Å²	153.1	78%	0.778	82%	0.817	S	S	*	*			trans	38.7	116.6	139.8	-76.5	177.5	178	172.3	0	122.5
49	K	26.2	Very low	24.6	Very low	174 Å²	174	153 Å²	153	76%	0.757	81%	0.814	S	S	*	*				56.9	117.5	119.3	-71.6	-174.1	175.1	-176.7	0	120
50	N	21.1	Very low	24.5	Very low	171 Å²	171	152.2 Å²	152.2	91%	0.914	81%	0.809	S	S	*	*				-147.5	139.7	109.7	-99	-21.3	0	0	0	112
51	C	21.3	Very low	24.4	Very low	121 Å²	121	153.4 Å²	153.4	82%	0.818	81%	0.811	S	S	*	*			trans	-78.2	152.9	-170.4	-64.3	0	0	0	0	113.6
52	G	22.8	Very low	24.3	Very low	81 Å²	81	156.3 Å²	156.3	84%	0.835	81%	0.811	S	S	*	*			trans	173.9	62.7	163.7	0	0	0	0	0	118.7
53	G	22.9	Very low	24.4	Very low	74 Å²	74	153.7 Å²	153.7	76%	0.763	80%	0.802	S	S	*	*			trans	93.1	120.8	134.5	0	0	0	0	0	122.2
54	K	26.2	Very low	24.6	Very low	203 Å²	203	156 Å²	156	88%	0.883	81%	0.807	S	S	*	*			trans	84.1	96	150.7	-57.5	-179.1	179.5	-179.5	0	116.9
55	Q	23.3	Very low	24.7	Very low	188 Å²	188	158.5 Å²	158.5	88%	0.879	81%	0.811	S	S	*	*				48	120.8	92.8	-77.5	-161.4	4	0	0	112.7
56	V	25.6	Very low	24.7	Very low	115 Å²	115	157 Å²	157	70%	0.697	81%	0.814	S	S	*	*				-170.1	121	73.9	163.1	0	0	0	0	107.4
57	E	23.2	Very low	24.8	Very low	160 Å²	160	157.6 Å²	157.6	75%	0.748	81%	0.814	S	S	*	*				66.8	106.6	108.1	-140.7	169.2	-158.9	0	0	116.3
58	I	24.3	Very low	24.7	Very low	142 Å²	142	155.4 Å²	155.4	73%	0.728	81%	0.813	S	S	*	*				45.8	124.5	114	-44.2	168.2	0	0	0	112.6
59	T	23.1	Very low	24.8	Very low	124 Å²	124	154.2 Å²	154.2	76%	0.761	81%	0.814	S	S	*	*				177.7	147.5	82.8	-36	0	0	0	0	111.8
60	L	25.3	Very low	24.7	Very low	154 Å²	154	154.1 Å²	154.1	81%	0.806	81%	0.813	S	S	*	*			trans	-54.6	138.2	156.1	176.8	89.7	0	0	0	113.6
61	E	23.5	Very low	24.8	Very low	180 Å²	180	152.2 Å²	152.2	84%	0.841	80%	0.799	S	S	*	*			trans	-179.3	111.4	147.9	-105.8	171.6	-166.8	0	0	110.3
62	R	24.9	Very low	25	Very low	222 Å²	222	153.2 Å²	153.2	84%	0.838	79%	0.789	S	S	*	*				62.3	98.3	79.9	-149.9	-178.8	-155	165.4	7	116
63	I	28.4	Very low	25.2	Very low	146 Å²	146	157.4 Å²	157.4	75%	0.749	79%	0.787	S	S	*	*			trans	38	121.5	136.6	-50.2	169.1	0	0	0	118.1
64	K	26.3	Very low	25.3	Very low	207 Å²	207	158.6 Å²	158.6	90%	0.9	78%	0.784	S	S	*	*			trans	-138.7	130.1	140.7	-95.4	-179.2	-177.5	172.3	0	111.7
65	M	27.1	Very low	25.1	Very low	172 Å²	172	155.8 Å²	155.8	85%	0.847	78%	0.779	S	S	*	*			trans	-102.7	136.6	172.4	-155.8	-175.9	-159.3	0	0	106.6
66	T	25.5	Very low	25.2	Very low	142 Å²	142	153.6 Å²	153.6	87%	0.871	77%	0.773	S	S	*	*			trans	-145.1	127.3	162.1	-4	0	0	0	0	110
67	K	27.8	Very low	25.2	Very low	185 Å²	185	154.8 Å²	154.8	80%	0.804	78%	0.775	S	S	*	*			trans	-77.3	149	175.1	-68.3	173.3	171.8	178.9	0	110.6
68	S	25.3	Very low	25.3	Very low	124 Å²	124	153.2 Å²	153.2	87%	0.867	77%	0.768	S	S	*	*			trans	-155.3	144.4	135.7	58.1	0	0	0	0	110.7
69	I	26.5	Very low	25.4	Very low	154 Å²	154	154.6 Å²	154.6	79%	0.79	77%	0.768	S	S	*	*			trans	-111.8	139	-174.3	-67.9	163.3	0	0	0	107.2
70	K	24.3	Very low	25.5	Very low	171 Å²	171	152.8 Å²	152.8	74%	0.743	77%	0.766	S	S	*	*			trans	161.7	121.4	134.2	-95.8	-172.3	169.7	-174.7	0	110.8
71	E	23.8	Very low	25.4	Very low	131 Å²	131	149.6 Å²	149.6	61%	0.612	76%	0.762	S	S	*	*				64.7	136.4	105.5	-75.3	-171.6	119.7	0	0	113.1
72	K	26.1	Very low	25.5	Very low	142 Å²	142	151.4 Å²	151.4	62%	0.617	77%	0.767	S	S	*	*			cis	-176.4	148.6	3.8	-120.1	173	-179.8	152.1	0	105.8
73	Q	25.6	Very low	25.6	Very low	169 Å²	169	150.3 Å²	150.3	79%	0.79	77%	0.769	S	S	*	*			trans	57	146.1	144.2	-66.5	171.1	-19.5	0	0	118.2
74	S	24.7	Very low	25.6	Very low	100 Å²	100	155.4 Å²	155.4	70%	0.699	78%	0.778	S	S	*	*			cis	-170.4	138.6	41.8	50.8	0	0	0	0	112.2
75	N	23.1	Very low	25.5	Very low	144 Å²	144	155.6 Å²	155.6	77%	0.77	78%	0.779	S	S	*	*				45	126.5	126.2	-63.8	-5.6	0	0	0	122.9
76	D	24.2	Very low	25.4	Very low	142 Å²	142	152.2 Å²	152.2	76%	0.759	78%	0.779	S	S	*	*				-177.1	119.7	109.9	-94	-16.9	0	0	0	108.1
77	L	26.7	Very low	25.3	Very low	139 Å²	139	155.2 Å²	155.2	73%	0.728	78%	0.783	S	S	*	*				54.5	129.8	81.5	-71.1	165.7	0	0	0	111.4
78	E	24.8	Very low	25.1	Very low	128 Å²	128	150 Å²	150	60%	0.598	78%	0.782	S	S	*	*			cis	-173.2	152.5	26.1	-119.8	-176.1	174.2	0	0	110.9
79	K	27	Very low	25	Very low	170 Å²	170	153.6 Å²	153.6	74%	0.739	79%	0.785	S	S	*	*			trans	52.6	154	137.2	-72.1	170.2	-174.8	156.5	0	120.8
80	A	24.3	Very low	24.9	Very low	86 Å²	86	155.4 Å²	155.4	71%	0.711	79%	0.79	S	S	*	*			cis	-171.1	150	-11.1	0	0	0	0	0	107.8
81	A	23.4	Very low	25.2	Very low	87 Å²	87	157 Å²	157	72%	0.719	80%	0.797	S	S	*	*			trans	35.4	129.7	146.7	0	0	0	0	0	121.6
82	F	26	Very low	25.4	Very low	218 Å²	218	156.1 Å²	156.1	96%	0.956	80%	0.802	S	S	*	*				-157.1	134.8	124.8	-99.4	-71.2	0	0	0	112.2
83	K	27	Very low	25.4	Very low	200 Å²	200	155.3 Å²	155.3	87%	0.87	81%	0.81	S	S	*	*			trans	-73.7	148.1	171.1	-73	172.6	171.4	174.2	0	111
84	R	27.4	Very low	25.3	Very low	252 Å²	252	158.4 Å²	158.4	95%	0.951	81%	0.814	S	S	*	*			trans	-152.9	135.5	141.6	-118	-178.4	-113.7	173.6	-1.7	111.6
85	K	24.8	Very low	25.4	Very low	211 Å²	211	162.9 Å²	162.9	92%	0.917	82%	0.821	S	S	*	*			trans	-76.1	147.5	175.2	-68.6	-177.5	170.5	-172.3	0	110.4
86	A	25.9	Very low	25.5	Very low	102 Å²	102	164.8 Å²	164.8	84%	0.843	82%	0.822	S	S	*	*			trans	-146	125.3	147.5	0	0	0	0	0	108.1
87	E	22	Very low	25.5	Very low	205 Å²	205	166.6 Å²	166.6	96%	0.958	83%	0.826	S	S	*	*			trans	-83.1	142.1	173	-124.5	167.3	178.5	0	0	108.7
88	G	24.2	Very low	25.5	Very low	76 Å²	76	164.5 Å²	164.5	78%	0.784	83%	0.829	S	S	*	*			trans	178.1	106.2	174.2	0	0	0	0	0	109.2
89	E	24.1	Very low	25.6	Very low	198 Å²	198	167.4 Å²	167.4	93%	0.925	84%	0.84	S	S	*	*			trans	-61.9	137	-175.7	-64	-177.9	131.2	0	0	113.1
90	E	24.5	Very low	25.8	Very low	192 Å²	192	167.3 Å²	167.3	90%	0.897	85%	0.845	S	S	*	*			trans	-171.8	129.3	130.6	-106.2	-179.2	177.4	0	0	109.6
91	K	28.7	Very low	26	Very low	206 Å²	206	170.3 Å²	170.3	90%	0.896	85%	0.848	S	S	*	*			trans	-65.6	148	172.1	-73.2	173.4	177.3	168	0	109.1
92	P	29.6	Very low	26.1	Very low	111 Å²	111	174.5 Å²	174.5	72%	0.721	85%	0.853	S	S	*	*				-149.9	160.4	97.8	38.8	-21.2	0	0	0	116.5
93	T	25.5	Very low	26.4	Very low	126 Å²	126	171.6 Å²	171.6	77%	0.773	85%	0.846	S	S	*	*			trans	48.1	98.4	149.3	41	0	0	0	0	119.8	K95	T93-K95 PolarHBondContact O-N 3.18Å
94	R	24.1	Very low	26.6	Very low	233 Å²	233	167.5 Å²	167.5	88%	0.879	83%	0.834	S	S	*	*			trans	-61.5	85.6	163	-157	179.8	-163.2	175.5	5.6	110.8	K96	R94-K96 PolarHBondContact O-N 3.26Å
95	K	25.8	Very low	27	Very low	195 Å²	195	162.9 Å²	162.9	85%	0.848	83%	0.828	S	S	*	*			trans	-68.5	106.8	154.9	-82	-179.2	176.8	176.5	0	106.9	T93 E97	T93-K95 PolarHBondContact O-N 3.18Å; K95-E97 VanDerWaalsContact C-N 3.35Å; K95-E97 PolarHBondContact O-N 3.42Å
96	K	26.3	Very low	27.8	Very low	183 Å²	183	160.6 Å²	160.6	80%	0.796	82%	0.821	S	S	*	*			trans	-65.7	100.9	163.4	-85.9	-179.8	174.3	177.3	0	106.7	R94 A98	R94-K96 PolarHBondContact O-N 3.26Å; K96-A98 PolarHBondContact O-N 3.33Å; K96-A98 VanDerWaalsContact O-N 3.11Å
97	E	23.9	Very low	28.8	Very low	180 Å²	180	160 Å²	160	84%	0.841	80%	0.803	S	S	*	*			trans	-51.8	114.7	159.9	-78.1	175	147.4	0	0	108	K95 K99	K95-E97 VanDerWaalsContact C-N 3.35Å; K95-E97 PolarHBondContact O-N 3.42Å; E97-K99 PolarHBondContact O-N 3.21Å
98	A	26	Very low	29.9	Very low	95 Å²	95	155.4 Å²	155.4	79%	0.785	78%	0.784	S	S	*	*			trans	-63.2	102.9	164.7	0	0	0	0	0	106.5	K96 I100	K96-A98 PolarHBondContact O-N 3.33Å; K96-A98 VanDerWaalsContact O-N 3.11Å; A98-I100 PolarHBondContact O-N 3.28Å; A98-I100 VanDerWaalsContact O-N 3.13Å
99	K	26.4	Very low	31.1	Very low	189 Å²	189	154.6 Å²	154.6	82%	0.822	76%	0.764	S	S	*	*			trans	-50.6	120.6	170.2	-79.9	179.7	173.5	-177.5	0	108.3	E97 I101	E97-K99 PolarHBondContact O-N 3.21Å; K99-I101 PolarHBondContact O-N 3.25Å
100	I	31.8	Very low	32.4	Very low	168 Å²	168	152.5 Å²	152.5	86%	0.862	76%	0.756	S	S	*	*			trans	-55.8	104.3	162.6	-64.6	165.5	0	0	0	106	A98 E102	A98-I100 PolarHBondContact O-N 3.28Å; A98-I100 VanDerWaalsContact O-N 3.13Å; I100-E102 PolarHBondContact O-N 3.1Å
101	I	28.6	Very low	34.1	Very low	150 Å²	150	148.6 Å²	148.6	77%	0.769	75%	0.747	S	S	*	*			trans	-79.3	115.1	168.5	-68.1	171	0	0	0	105.9	K99 L103	K99-I101 PolarHBondContact O-N 3.25Å; I101-L103 PolarHBondContact O-N 3.41Å
102	E	25.6	Very low	35.8	Very low	175 Å²	175	140.7 Å²	140.7	82%	0.818	71%	0.714	S	S	*	*			trans	-44.3	108.8	164.3	-113.5	169.7	162.8	0	0	110.2	I100 D104	I100-E102 PolarHBondContact O-N 3.1Å; E102-D104 PolarHBondContact O-N 3.43Å
103	L	33.1	Very low	37.8	Very low	157 Å²	157	139.3 Å²	139.3	82%	0.822	71%	0.705	S	S	*	*			trans	-79.7	56.5	178.8	-165.3	93	0	0	0	110.1	I101	I101-L103 PolarHBondContact O-N 3.41Å
104	D	30.7	Very low	40.4	Very low	114 Å²	114	139.4 Å²	139.4	61%	0.61	70%	0.697	S	S	*	*			trans	-122	6.8	-178.1	-145	25.8	0	0	0	114.9	E102	E102-D104 PolarHBondContact O-N 3.43Å
105	N	35.6	Very low	43.3	Very low	154 Å²	154	128.9 Å²	128.9	82%	0.824	66%	0.658	S	S	*	*	S	Bend	trans	-149.6	129.2	167.1	-85.6	-48.5	0	0	0	111.7
106	Q	42.5	Very low	46.2	Very low	163 Å²	163	122.6 Å²	122.6	76%	0.762	64%	0.637	S	S	*	*			trans	85.9	78.3	177.6	-48.6	-179.6	16.6	0	0	115.4	I108	Q106-I108 HydrophobicContact CB-CD1 4.38Å; Q106-I108 HydrophobicContact CB-CG1 3.71Å; Q106-I108 PolarHBondContact O-N 3.22Å
107	L	45.9	Very low	49.1	Very low	90 Å²	90	118.6 Å²	118.6	47%	0.471	62%	0.624	S	S	.	*			trans	-60.4	86.3	143.9	-74.8	159.3	0	0	0	106.9	T109 T329 V346	L107-T109 PolarHBondContact O-N 2.92Å; L107-T329 HydrophobicContact CD2-CG2 3.54Å; L107-V346 HydrophobicContact CD1-CG2 4.04Å
108	I	45.4	Very low	52.3	Low	108 Å²	108	118.2 Å²	118.2	55%	0.554	62%	0.619	S	S	*	*			trans	-71.7	98.5	177.8	-59.3	175.7	0	0	0	107.1	Q106 M110	Q106-I108 HydrophobicContact CB-CD1 4.38Å; Q106-I108 HydrophobicContact CB-CG1 3.71Å; Q106-I108 PolarHBondContact O-N 3.22Å; I108-M110 HydrophobicContact CG2-CG 3.9Å; I108-M110 PolarHBondContact O-N 3.13Å; I108-M110 VanDerWaalsContact O-N 3.16Å
109	T	49.5	Very low	55.4	Low	60 Å²	60	117 Å²	117	37%	0.368	60%	0.6	S	S	.	*			trans	-69.9	100.8	162.3	-47.6	0	0	0	0	106.8	L107 P111 M327	L107-T109 PolarHBondContact O-N 2.92Å; T109-P111 VanDerWaalsContact O-CD 3.26Å; T109-P111 WeakPolarHBondContact O-CD 3.46Å; T109-M327 HydrophobicContact CG2-CG 4.18Å
110	M	51.8	Low	58.6	Low	153 Å²	153	108.2 Å²	108.2	75%	0.754	56%	0.562	S	S	*	*			trans	-80.8	115.4	167.2	-78.9	-158.8	76.9	0	0	108.2	I108 L112	I108-M110 HydrophobicContact CG2-CG 3.9Å; I108-M110 PolarHBondContact O-N 3.13Å; I108-M110 VanDerWaalsContact O-N 3.16Å; M110-L112 PolarHBondContact O-N 3.42Å
111	P	59.8	Low	61.5	Low	111 Å²	111	105.2 Å²	105.2	72%	0.721	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-59.5	135	164.2	24.3	-29.7	0	0	0	108.4	T109	T109-P111 VanDerWaalsContact O-CD 3.26Å; T109-P111 WeakPolarHBondContact O-CD 3.46Å
112	L	64.4	Low	64.6	Low	39 Å²	39	101.2 Å²	101.2	20%	0.204	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-59.7	124.1	174.9	-73.5	159.9	0	0	0	108.4	M110 H114 Q311 I314 E315 I318	M110-L112 PolarHBondContact O-N 3.42Å; L112-H114 PolarHBondContact O-N 3.15Å; L112-Q311 HydrophobicContact CD2-CG 4.37Å; L112-I314 HydrophobicContact CD1-CG2 3.65Å; L112-E315 VanDerWaalsContact C-OE1 3.28Å; L112-E315 HydrophobicContact CB-CG 3.51Å; L112-E315 WeakPolarHBondContact CB-OE1 3.33Å; L112-E315 HydrophobicContact CD1-CG 4.28Å; L112-E315 HydrophobicContact CG-CG 4.47Å; L112-I318 HydrophobicContact CD1-CD1 4.08Å
113	P	71.4	Confident	67.8	Low	82 Å²	82	92.9 Å²	92.9	53%	0.532	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-71.7	117.6	-172.3	25.6	-33.2	0	0	0	111.6	I115 Q311 E315	P113-I115 PolarHBondContact O-N 3.46Å; P113-Q311 VanDerWaalsContact CD-NE2 3.26Å; P113-Q311 PolarHBondContact O-NE2 3.1Å; P113-E315 VanDerWaalsContact C-OE1 3.29Å
114	H	79.7	Confident	70.8	Confident	129 Å²	129	85.7 Å²	85.7	60%	0.597	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-48.2	120.6	-176.5	-177.8	58.9	0	0	0	113.3	L112 P116 E315	L112-H114 PolarHBondContact O-N 3.15Å; H114-P116 WeakPolarHBondContact O-CD 3.25Å; H114-E315 WeakPolarHBondContact CA-OE2 3.43Å
115	I	86.2	Confident	73.7	Confident	12 Å²	12	85.3 Å²	85.3	6%	0.062	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-91.7	118.8	177	-62.1	170.3	0	0	0	110.3	P113 N119 I120 L308 Q311 A312 E315	P113-I115 PolarHBondContact O-N 3.46Å; I115-N119 HydrophobicContact CG2-CB 3.99Å; I115-I120 HydrophobicContact CG2-CG1 4.16Å; I115-L308 HydrophobicContact CD1-CD1 3.5Å; I115-L308 HydrophobicContact CD1-CG 4.06Å; I115-L308 VanDerWaalsContact CD1-O 3.22Å; I115-L308 WeakPolarHBondContact CD1-O 3.48Å; I115-L308 HydrophobicContact CG1-CD1 4.03Å; I115-L308 HydrophobicContact CG2-CD1 4.18Å; I115-L308 HydrophobicContact CG2-CG 4.28Å; I115-Q311 HydrophobicContact CD1-CB 3.71Å; I115-Q311 HydrophobicContact CD1-CG 3.58Å; I115-A312 HydrophobicContact CB-CB 3.92Å; I115-A312 HydrophobicContact CD1-CB 3.91Å; I115-A312 HydrophobicContact CG1-CB 4.48Å; I115-A312 HydrophobicContact CG2-CB 4.12Å; I115-E315 PolarHBondContact N-OE2 2.99Å
116	P	86.8	Confident	76.5	Confident	62 Å²	62	82.9 Å²	82.9	40%	0.403	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-61	141.9	178.5	-23.3	33	0	0	0	112.8	H114 K118 N119 I120	H114-P116 WeakPolarHBondContact O-CD 3.25Å; P116-K118 PolarHBondContact O-N 3.27Å; P116-N119 WeakPolarHBondContact O-CB 3.31Å; P116-N119 PolarHBondContact O-N 3.42Å; P116-I120 PolarHBondContact O-N 3.49Å
117	L	87.2	Confident	78.8	Confident	100 Å²	100	75.5 Å²	75.5	52%	0.524	39%	0.392	S	S	.	.	H	α-helix	trans	-51.9	-34	177.1	-179.2	62.7	0	0	0	113.3	N119 I120 M121	L117-N119 VanDerWaalsContact C-N 3.25Å; L117-N119 PolarHBondContact O-N 2.9Å; L117-I120 HydrophobicContact CD1-CB 4.47Å; L117-I120 HydrophobicContact CD1-CD1 4.38Å; L117-I120 WeakPolarHBondContact O-CB 3.4Å; L117-I120 PolarHBondContact O-N 3.05Å; L117-I120 VanDerWaalsContact O-N 3.16Å; L117-M121 HydrophobicContact CD1-CG 4.42Å; L117-M121 HydrophobicContact CG-CG 4.35Å; L117-M121 HydrophobicContact CG-SD 4.36Å; L117-M121 WeakPolarHBondContact O-CG 3.3Å; L117-M121 PolarHBondContact O-N 3.47Å
118	K	90.9	Very high	81	Confident	172 Å²	172	71.2 Å²	71.2	75%	0.748	37%	0.37	S	S	*	.	H	α-helix	trans	-56.6	-39.6	176.2	-175.1	-179.1	177.7	-176.4	0	112.2	P116 M121 D122	P116-K118 PolarHBondContact O-N 3.27Å; K118-M121 PolarHBondContact O-N 3.21Å; K118-D122 PolarHBondContact O-N 3.18Å
119	N	90.9	Very high	83.2	Confident	69 Å²	69	67.2 Å²	67.2	37%	0.369	35%	0.348	S	S	.	.	H	α-helix	trans	-71.5	-38.5	179.6	-65.8	-2.8	0	0	0	110.7	I115 P116 L117 D122 V123 L308	I115-N119 HydrophobicContact CG2-CB 3.99Å; P116-N119 WeakPolarHBondContact O-CB 3.31Å; P116-N119 PolarHBondContact O-N 3.42Å; L117-N119 VanDerWaalsContact C-N 3.25Å; L117-N119 PolarHBondContact O-N 2.9Å; N119-D122 WeakPolarHBondContact O-CB 3.49Å; N119-D122 PolarHBondContact O-N 2.98Å; N119-V123 WeakPolarHBondContact O-CG2 3.39Å; N119-V123 PolarHBondContact O-N 3.02Å; N119-L308 HydrophobicContact CB-CD2 4.32Å
120	I	93.3	Very high	84.8	Confident	5 Å²	5	67.1 Å²	67.1	3%	0.026	34%	0.344	C	S	.	.	H	α-helix	trans	-60.6	-47.7	174.4	-55.5	175.5	0	0	0	110	I115 P116 L117 D122 V123 E124 Y309 A312 M313	I115-I120 HydrophobicContact CG2-CG1 4.16Å; P116-I120 PolarHBondContact O-N 3.49Å; L117-I120 HydrophobicContact CD1-CB 4.47Å; L117-I120 HydrophobicContact CD1-CD1 4.38Å; L117-I120 WeakPolarHBondContact O-CB 3.4Å; L117-I120 PolarHBondContact O-N 3.05Å; L117-I120 VanDerWaalsContact O-N 3.16Å; I120-D122 VanDerWaalsContact C-N 3.29Å; I120-D122 PolarHBondContact O-N 3.16Å; I120-V123 WeakPolarHBondContact O-CB 3.48Å; I120-V123 PolarHBondContact O-N 3.14Å; I120-V123 VanDerWaalsContact O-N 3.16Å; I120-E124 WeakPolarHBondContact O-CG 3.44Å; I120-E124 PolarHBondContact O-N 3.35Å; I120-Y309 HydrophobicContact CG2-CD2 3.82Å; I120-Y309 HydrophobicContact CG2-CE2 3.47Å; I120-Y309 VanDerWaalsContact CG2-CE2 3.47Å; I120-A312 HydrophobicContact CD1-CB 3.6Å; I120-A312 HydrophobicContact CG1-CB 3.81Å; I120-M313 HydrophobicContact CD1-CE 4.03Å; I120-M313 HydrophobicContact CG2-CE 4.39Å
121	M	92.3	Very high	85.8	Confident	104 Å²	104	61.4 Å²	61.4	51%	0.512	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-36	177.6	-69	-176.2	71.9	0	0	112.6	L117 K118 E124 M125	L117-M121 HydrophobicContact CD1-CG 4.42Å; L117-M121 HydrophobicContact CG-CG 4.35Å; L117-M121 HydrophobicContact CG-SD 4.36Å; L117-M121 WeakPolarHBondContact O-CG 3.3Å; L117-M121 PolarHBondContact O-N 3.47Å; K118-M121 PolarHBondContact O-N 3.21Å; M121-E124 PolarHBondContact O-N 3.24Å; M121-M125 VanDerWaalsContact O-CG 3.26Å; M121-M125 WeakPolarHBondContact O-CG 3.48Å; M121-M125 PolarHBondContact O-N 3.04Å
122	D	93	Very high	86	Confident	66 Å²	66	57 Å²	57	35%	0.353	29%	0.287	S	S	.	.	H	α-helix	trans	-64.5	-43.2	174.1	-176.1	48.3	0	0	0	111.5	K118 N119 I120 E124 M125 K126	K118-D122 PolarHBondContact O-N 3.18Å; N119-D122 WeakPolarHBondContact O-CB 3.49Å; N119-D122 PolarHBondContact O-N 2.98Å; I120-D122 VanDerWaalsContact C-N 3.29Å; I120-D122 PolarHBondContact O-N 3.16Å; D122-E124 PolarHBondContact O-N 3.35Å; D122-M125 PolarHBondContact O-N 2.98Å; D122-K126 WeakPolarHBondContact O-CB 3.41Å; D122-K126 VanDerWaalsContact O-CG 3.32Å; D122-K126 WeakPolarHBondContact O-CG 3.44Å; D122-K126 PolarHBondContact O-N 2.93Å; D122-K126 WeakPolarHBondContact OD1-CE 3.37Å; D122-K126 IonicContact OD1-NZ 3.91Å; D122-K126 PolarHBondContact OD1-NZ 3.17Å; D122-K126 WeakPolarHBondContact OD2-CE 3.32Å; D122-K126 IonicContact OD2-NZ 3.44Å; D122-K126 PolarHBondContact OD2-NZ 3.31Å
123	V	94.1	Very high	85.1	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-58.8	-46.3	173.2	176.8	0	0	0	0	111.1	N119 I120 M125 K126 L127 L305 L308 Y309	N119-V123 WeakPolarHBondContact O-CG2 3.39Å; N119-V123 PolarHBondContact O-N 3.02Å; I120-V123 WeakPolarHBondContact O-CB 3.48Å; I120-V123 PolarHBondContact O-N 3.14Å; I120-V123 VanDerWaalsContact O-N 3.16Å; V123-M125 PolarHBondContact O-N 3.5Å; V123-K126 PolarHBondContact O-N 2.92Å; V123-L127 HydrophobicContact CG1-CD1 4.05Å; V123-L127 HydrophobicContact CG1-CG 4.49Å; V123-L127 WeakPolarHBondContact O-CB 3.16Å; V123-L127 PolarHBondContact O-N 3.02Å; V123-L305 HydrophobicContact CG1-CB 4.2Å; V123-L305 HydrophobicContact CG2-CB 4.27Å; V123-L305 HydrophobicContact CG2-CD2 3.86Å; V123-L308 HydrophobicContact CG2-CD2 3.99Å; V123-Y309 HydrophobicContact CB-CD2 4.21Å; V123-Y309 HydrophobicContact CG1-CD2 3.97Å; V123-Y309 HydrophobicContact CG1-CG 4.4Å
124	E	94.9	Very high	84.1	Confident	7 Å²	7	58.5 Å²	58.5	3%	0.033	30%	0.304	C	S	.	.	I	π-helix	trans	-61.7	-43.6	178.8	-66.9	179.5	-179.3	0	0	112	I120 M121 D122 K126 V128 Y129 T270 R273 Y309	I120-E124 WeakPolarHBondContact O-CG 3.44Å; I120-E124 PolarHBondContact O-N 3.35Å; M121-E124 PolarHBondContact O-N 3.24Å; D122-E124 PolarHBondContact O-N 3.35Å; E124-K126 VanDerWaalsContact C-N 3.27Å; E124-K126 PolarHBondContact O-N 3.49Å; E124-V128 HydrophobicContact CB-CB 4.27Å; E124-V128 HydrophobicContact CB-CG2 4.23Å; E124-V128 HydrophobicContact CG-CG2 4.26Å; E124-V128 WeakPolarHBondContact O-CA 3.37Å; E124-V128 VanDerWaalsContact O-CB 3.25Å; E124-V128 WeakPolarHBondContact O-CB 3.33Å; E124-V128 PolarHBondContact O-N 3.48Å; E124-Y129 HydrophobicContact CB-CD2 4.1Å; E124-Y129 HydrophobicContact CB-CE2 3.77Å; E124-Y129 WeakPolarHBondContact O-CD2 3.46Å; E124-Y129 PolarHBondContact O-N 2.89Å; E124-T270 HydrophobicContact CG-CG2 4.22Å; E124-R273 IonicContact OE1-CZ 3.77Å; E124-R273 IonicContact OE1-NE 3.51Å; E124-R273 PolarHBondContact OE1-NE 3.09Å; E124-R273 IonicContact OE1-NH2 2.84Å; E124-R273 PolarHBondContact OE1-NH2 2.87Å; E124-R273 IonicContact OE2-NH2 3.09Å; E124-R273 PolarHBondContact OE2-NH2 3.26Å; E124-Y309 HydrophobicContact CG-CD2 4.49Å; E124-Y309 HydrophobicContact CG-CE2 3.71Å; E124-Y309 PolarHBondContact OE1-OH 3.34Å
125	M	92.8	Very high	82.5	Confident	105 Å²	105	54 Å²	54	52%	0.517	29%	0.286	S	S	.	.	I	π-helix	trans	-63.5	-36.2	177.3	-70.5	-67.7	-88.2	0	0	111.8	M121 D122 V123 Y129 R240	M121-M125 VanDerWaalsContact O-CG 3.26Å; M121-M125 WeakPolarHBondContact O-CG 3.48Å; M121-M125 PolarHBondContact O-N 3.04Å; D122-M125 PolarHBondContact O-N 2.98Å; V123-M125 PolarHBondContact O-N 3.5Å; M125-Y129 HydrophobicContact SD-CD2 3.91Å; M125-R240 PolarHBondContact SD-NH1 3Å; M125-R240 PolarHBondContact SD-NH2 3.31Å
126	K	92.6	Very high	80.4	Confident	104 Å²	104	63 Å²	63	45%	0.452	32%	0.319	S	S	.	.	I	π-helix	trans	-79.1	-29.8	-179.6	-75.9	173.7	176.8	167.5	0	114.6	D122 V123 E124 I130 L305	D122-K126 WeakPolarHBondContact O-CB 3.41Å; D122-K126 VanDerWaalsContact O-CG 3.32Å; D122-K126 WeakPolarHBondContact O-CG 3.44Å; D122-K126 PolarHBondContact O-N 2.93Å; D122-K126 WeakPolarHBondContact OD1-CE 3.37Å; D122-K126 IonicContact OD1-NZ 3.91Å; D122-K126 PolarHBondContact OD1-NZ 3.17Å; D122-K126 WeakPolarHBondContact OD2-CE 3.32Å; D122-K126 IonicContact OD2-NZ 3.44Å; D122-K126 PolarHBondContact OD2-NZ 3.31Å; V123-K126 PolarHBondContact O-N 2.92Å; E124-K126 VanDerWaalsContact C-N 3.27Å; E124-K126 PolarHBondContact O-N 3.49Å; K126-I130 WeakPolarHBondContact O-CD1 3.47Å; K126-I130 WeakPolarHBondContact O-CG1 3.09Å; K126-L305 HydrophobicContact CB-CD1 4.36Å; K126-L305 HydrophobicContact CD-CD1 4.12Å
127	L	92.4	Very high	78.7	Confident	7 Å²	7	61.2 Å²	61.2	4%	0.037	30%	0.304	C	S	.	.	I	π-helix	trans	-123.5	-34.7	-171.1	-62.4	-174.2	0	0	0	114.7	V123 L266 I302 L305 I306	V123-L127 HydrophobicContact CG1-CD1 4.05Å; V123-L127 HydrophobicContact CG1-CG 4.49Å; V123-L127 WeakPolarHBondContact O-CB 3.16Å; V123-L127 PolarHBondContact O-N 3.02Å; L127-L266 HydrophobicContact CB-CD2 3.47Å; L127-L266 VanDerWaalsContact CB-CD2 3.47Å; L127-L266 HydrophobicContact CD1-CD2 3.91Å; L127-L266 HydrophobicContact CG-CD2 4.36Å; L127-I302 HydrophobicContact CD1-CG2 4.39Å; L127-I302 HydrophobicContact CD2-CG1 4.25Å; L127-I302 HydrophobicContact CD2-CG2 4.2Å; L127-L305 HydrophobicContact CD1-CB 3.7Å; L127-L305 HydrophobicContact CD1-CD1 4.33Å; L127-L305 HydrophobicContact CD2-CD1 4.34Å; L127-L305 HydrophobicContact CG-CB 4.47Å; L127-L305 HydrophobicContact CG-CD1 4.26Å; L127-I306 HydrophobicContact CD1-CG1 3.75Å
128	V	92.5	Very high	76.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.302	C	S	.	.	I	π-helix	trans	-87.4	-47.5	-173.1	176.2	0	0	0	0	110.8	E124 T236 L239 L266 R267 T270	E124-V128 HydrophobicContact CB-CB 4.27Å; E124-V128 HydrophobicContact CB-CG2 4.23Å; E124-V128 HydrophobicContact CG-CG2 4.26Å; E124-V128 WeakPolarHBondContact O-CA 3.37Å; E124-V128 VanDerWaalsContact O-CB 3.25Å; E124-V128 WeakPolarHBondContact O-CB 3.33Å; E124-V128 PolarHBondContact O-N 3.48Å; V128-T236 WeakPolarHBondContact O-CG2 3.31Å; V128-L239 HydrophobicContact CG1-CD1 4.3Å; V128-L266 HydrophobicContact CG2-CD2 3.98Å; V128-L266 HydrophobicContact CG2-CG 3.84Å; V128-R267 HydrophobicContact CG1-CG 3.84Å; V128-R267 PolarHBondContact O-NE 3.29Å; V128-R267 VanDerWaalsContact O-NE 3.15Å; V128-T270 HydrophobicContact CG1-CG2 4.2Å; V128-T270 VanDerWaalsContact CG2-OG1 3.22Å; V128-T270 WeakPolarHBondContact CG2-OG1 3.29Å
129	Y	90.6	Very high	74.3	Confident	25 Å²	25	57.5 Å²	57.5	10%	0.098	29%	0.286	C	S	.	.	S	Bend	trans	-94.5	11.6	-174	-59.1	-68.7	0	0	0	114.5	E124 M125 D131 L239 R240	E124-Y129 HydrophobicContact CB-CD2 4.1Å; E124-Y129 HydrophobicContact CB-CE2 3.77Å; E124-Y129 WeakPolarHBondContact O-CD2 3.46Å; E124-Y129 PolarHBondContact O-N 2.89Å; M125-Y129 HydrophobicContact SD-CD2 3.91Å; Y129-D131 PolarHBondContact O-N 3.33Å; Y129-L239 HydrophobicContact CE1-CB 3.72Å; Y129-L239 HydrophobicContact CE1-CD1 4.39Å; Y129-R240 HydrophobicContact CD1-CG 3.94Å; Y129-R240 HydrophobicContact CE1-CG 3.99Å
130	I	83.9	Confident	71.9	Confident	57 Å²	57	57.1 Å²	57.1	29%	0.292	29%	0.286	S	S	.	.			trans	-56.8	125.8	174.6	-52.1	179.1	0	0	0	108.4	K126 E132	K126-I130 WeakPolarHBondContact O-CD1 3.47Å; K126-I130 WeakPolarHBondContact O-CG1 3.09Å; I130-E132 PolarHBondContact O-N 3Å
131	D	72.3	Confident	69.1	Low	34 Å²	34	64.7 Å²	64.7	18%	0.182	32%	0.321	C	S	.	.			trans	-80.7	92.7	163.9	-172.7	39.1	0	0	0	108.1	Y129 V133 Y187 R188	Y129-D131 PolarHBondContact O-N 3.33Å; D131-V133 WeakPolarHBondContact O-CG2 3.23Å; D131-V133 PolarHBondContact O-N 3.2Å; D131-Y187 HydrophobicContact CB-CE1 4.3Å; D131-R188 WeakPolarHBondContact OD2-CG 3.21Å; D131-R188 IonicContact OD2-CZ 3.75Å; D131-R188 IonicContact OD2-NE 3.48Å; D131-R188 PolarHBondContact OD2-NE 3.28Å; D131-R188 IonicContact OD2-NH2 2.75Å; D131-R188 PolarHBondContact OD2-NH2 3.41Å
132	E	63.5	Low	66.2	Low	19 Å²	19	62 Å²	62	9%	0.089	31%	0.312	C	S	.	.			trans	-50.9	110.8	169.8	-69.1	138.2	-167.1	0	0	107.9	I130 G134 K233 Y261 R263 R267	I130-E132 PolarHBondContact O-N 3Å; E132-G134 PolarHBondContact O-N 3.44Å; E132-G134 VanDerWaalsContact O-N 3.07Å; E132-K233 WeakPolarHBondContact OE2-CE 3.32Å; E132-K233 IonicContact OE2-NZ 3.2Å; E132-K233 PolarHBondContact OE2-NZ 3.09Å; E132-Y261 PolarHBondContact OE1-OH 3.43Å; E132-Y261 VanDerWaalsContact OE1-OH 3.09Å; E132-R263 VanDerWaalsContact CG-NH1 3.35Å; E132-R263 VanDerWaalsContact OE1-CD 3.25Å; E132-R263 WeakPolarHBondContact OE1-CD 3.49Å; E132-R263 IonicContact OE1-CZ 3.64Å; E132-R263 IonicContact OE1-NE 3.75Å; E132-R263 IonicContact OE1-NH1 2.86Å; E132-R263 PolarHBondContact OE1-NH1 3.07Å; E132-R267 IonicContact OE1-CZ 2.8Å; E132-R267 IonicContact OE1-NH1 3.04Å; E132-R267 IonicContact OE1-NH2 2.96Å; E132-R267 PolarHBondContact OE1-NH2 3.06Å; E132-R267 IonicContact OE2-NH2 2.73Å
133	V	45.8	Very low	63.5	Low	111 Å²	111	66.9 Å²	66.9	67%	0.673	33%	0.331	S	S	*	.	S	Bend	trans	-71.7	109	-167.8	177.8	0	0	0	0	109.2	D131	D131-V133 WeakPolarHBondContact O-CG2 3.23Å; D131-V133 PolarHBondContact O-N 3.2Å
134	G	49.3	Very low	60.3	Low	41 Å²	41	73.5 Å²	73.5	42%	0.423	36%	0.363	S	S	.	.	S	Bend	trans	85.7	162.9	177.5	0	0	0	0	0	112.5	E132 R136	E132-G134 PolarHBondContact O-N 3.44Å; E132-G134 VanDerWaalsContact O-N 3.07Å; G134-R136 PolarHBondContact O-N 2.8Å
135	V	46.2	Very low	57.2	Low	35 Å²	35	79 Å²	79	21%	0.212	40%	0.403	C	S	.	.	S	Bend	trans	-72.4	61.8	171.1	-173	0	0	0	0	108.3	Y137 I172 L180	V135-Y137 HydrophobicContact CG1-CD2 4.08Å; V135-Y137 HydrophobicContact CG1-CE1 4.22Å; V135-Y137 HydrophobicContact CG1-CE2 3.24Å; V135-Y137 WeakPolarHBondContact CG1-OH 3.42Å; V135-I172 HydrophobicContact CG1-CD1 4.36Å; V135-L180 HydrophobicContact CG2-CB 4.41Å
136	R	43.8	Very low	54.1	Low	200 Å²	200	79.3 Å²	79.3	76%	0.755	41%	0.41	S	S	*	.			trans	-101.1	95.7	164.9	-75.9	-171.6	-179.6	-169.9	0.5	105.3	G134 E138	G134-R136 PolarHBondContact O-N 2.8Å; R136-E138 PolarHBondContact O-N 2.98Å; R136-E138 VanDerWaalsContact O-N 3.07Å
137	Y	51.3	Low	51.2	Low	24 Å²	24	78.3 Å²	78.3	9%	0.094	43%	0.43	C	S	.	.			trans	-59.7	111.2	171	-61.5	-76.2	0	0	0	107.7	V135 F139 L169 P170 I172 V226 F229	V135-Y137 HydrophobicContact CG1-CD2 4.08Å; V135-Y137 HydrophobicContact CG1-CE1 4.22Å; V135-Y137 HydrophobicContact CG1-CE2 3.24Å; V135-Y137 WeakPolarHBondContact CG1-OH 3.42Å; Y137-F139 HydrophobicContact CD1-CZ 4.3Å; Y137-F139 HydrophobicContact CD2-CE2 4.19Å; Y137-F139 AromaticContact CD2-CZ 3.88Å; Y137-F139 HydrophobicContact CD2-CZ 3.88Å; Y137-F139 HydrophobicContact CG-CE1 4.1Å; Y137-F139 AromaticContact CG-CE2 3.96Å; Y137-F139 HydrophobicContact CG-CE2 3.96Å; Y137-F139 AromaticContact CG-CZ 3.53Å; Y137-F139 HydrophobicContact CG-CZ 3.53Å; Y137-F139 WeakPolarHBondContact O-CD2 3.43Å; Y137-F139 PolarHBondContact O-N 2.93Å; Y137-L169 HydrophobicContact CD2-CD2 3.64Å; Y137-L169 HydrophobicContact CE2-CD2 4.33Å; Y137-P170 HydrophobicContact CD2-CG 4.28Å; Y137-P170 HydrophobicContact CE2-CG 4.2Å; Y137-I172 HydrophobicContact CE2-CD1 3.38Å; Y137-I172 WeakPolarHBondContact OH-CD1 3.4Å; Y137-V226 HydrophobicContact CE1-CB 4.38Å; Y137-V226 HydrophobicContact CE1-CG2 3.86Å; Y137-V226 HydrophobicContact CE2-CG2 4.48Å; Y137-F229 HydrophobicContact CD1-CB 4.44Å; Y137-F229 HydrophobicContact CE1-CB 4.11Å; Y137-F229 HydrophobicContact CE1-CD1 4.43Å; Y137-F229 HydrophobicContact CE1-CG 4.19Å
138	E	39.8	Very low	48.2	Very low	104 Å²	104	82.7 Å²	82.7	49%	0.486	46%	0.461	S	S	.	.			trans	-76	83.3	168.1	-73.6	176.3	172.9	0	0	106.7	R136 Y261 R263	R136-E138 PolarHBondContact O-N 2.98Å; R136-E138 VanDerWaalsContact O-N 3.07Å; E138-Y261 HydrophobicContact CB-CE2 4.44Å; E138-Y261 PolarHBondContact OE2-OH 2.86Å; E138-R263 IonicContact OE1-NH1 3.4Å; E138-R263 IonicContact OE2-CZ 3.62Å; E138-R263 IonicContact OE2-NH1 3.51Å; E138-R263 PolarHBondContact OE2-NH1 2.96Å; E138-R263 IonicContact OE2-NH2 3.29Å
139	F	45.7	Very low	45.3	Very low	91 Å²	91	90.5 Å²	90.5	40%	0.399	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-75.3	126.8	172.9	-57.1	-73.1	0	0	0	108.8	Y137 P170	Y137-F139 HydrophobicContact CD1-CZ 4.3Å; Y137-F139 HydrophobicContact CD2-CE2 4.19Å; Y137-F139 AromaticContact CD2-CZ 3.88Å; Y137-F139 HydrophobicContact CD2-CZ 3.88Å; Y137-F139 HydrophobicContact CG-CE1 4.1Å; Y137-F139 AromaticContact CG-CE2 3.96Å; Y137-F139 HydrophobicContact CG-CE2 3.96Å; Y137-F139 AromaticContact CG-CZ 3.53Å; Y137-F139 HydrophobicContact CG-CZ 3.53Å; Y137-F139 WeakPolarHBondContact O-CD2 3.43Å; Y137-F139 PolarHBondContact O-N 2.93Å; F139-P170 HydrophobicContact CZ-CG 4.13Å
140	V	39	Very low	42.3	Very low	60 Å²	60	95.8 Å²	95.8	36%	0.364	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-85.2	126.8	155.7	177.1	0	0	0	0	105.2	S142	V140-S142 PolarHBondContact O-N 3.33Å
141	E	34.2	Very low	39.5	Very low	164 Å²	164	97.5 Å²	97.5	77%	0.766	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-55	123.8	174.8	-155	167.3	-159.4	0	0	108.5	F143	E141-F143 PolarHBondContact O-N 3.46Å
142	S	32	Very low	37.5	Very low	48 Å²	48	101.8 Å²	101.8	34%	0.336	58%	0.579	S	S	.	*			trans	-63.4	107.6	175.3	177.8	0	0	0	0	107.9	V140 M144 E221	V140-S142 PolarHBondContact O-N 3.33Å; S142-M144 VanDerWaalsContact C-N 3.29Å; S142-M144 PolarHBondContact O-N 2.94Å; S142-E221 WeakPolarHBondContact CB-OE1 3.41Å
143	F	35.8	Very low	35.7	Very low	168 Å²	168	111.4 Å²	111.4	74%	0.737	62%	0.615	S	S	*	*			trans	-65.1	99.1	167.4	-74.2	-79	0	0	0	107	E141 S145	E141-F143 PolarHBondContact O-N 3.46Å; F143-S145 PolarHBondContact O-N 3.35Å
144	M	27.2	Very low	35.2	Very low	139 Å²	139	113 Å²	113	69%	0.685	62%	0.624	S	S	*	*			trans	-52.3	116.8	161.4	-71.9	-70.5	169.2	0	0	106.5	S142 T146	S142-M144 VanDerWaalsContact C-N 3.29Å; S142-M144 PolarHBondContact O-N 2.94Å; M144-T146 PolarHBondContact O-N 2.96Å; M144-T146 PolarHBondContact O-OG1 3.36Å
145	S	30.5	Very low	34.2	Very low	124 Å²	124	115.2 Å²	115.2	87%	0.867	64%	0.639	S	S	*	*			trans	-68	70.2	169.8	172.9	0	0	0	0	108.9	F143 G147	F143-S145 PolarHBondContact O-N 3.35Å; S145-G147 PolarHBondContact O-N 2.78Å
146	T	26.9	Very low	33.2	Very low	110 Å²	110	122.3 Å²	122.3	68%	0.675	67%	0.67	S	S	*	*			trans	-72.8	108.4	157.7	28	0	0	0	0	106.7	M144 S148	M144-T146 PolarHBondContact O-N 2.96Å; M144-T146 PolarHBondContact O-OG1 3.36Å; T146-S148 VanDerWaalsContact C-N 3.34Å; T146-S148 PolarHBondContact O-N 2.78Å; T146-S148 PolarHBondContact O-OG 2.88Å
147	G	33	Very low	32.9	Very low	83 Å²	83	121.1 Å²	121.1	86%	0.856	68%	0.676	S	S	*	*	S	Bend	trans	-50.7	95.7	175.3	0	0	0	0	0	111.4	S145	S145-G147 PolarHBondContact O-N 2.78Å
148	S	29.3	Very low	31.8	Very low	99 Å²	99	126.5 Å²	126.5	69%	0.692	71%	0.712	S	S	*	*			trans	-166.1	121.8	164.6	42.9	0	0	0	0	107.6	T146	T146-S148 VanDerWaalsContact C-N 3.34Å; T146-S148 PolarHBondContact O-N 2.78Å; T146-S148 PolarHBondContact O-OG 2.88Å
149	Q	30.4	Very low	31	Very low	165 Å²	165	128.2 Å²	128.2	77%	0.771	72%	0.724	S	S	*	*			trans	-47	152.2	178.4	-71	-177.3	-55.1	0	0	112.9	T151	Q149-T151 PolarHBondContact O-N 3.43Å; Q149-T151 PolarHBondContact OE1-OG1 2.96Å
150	P	28.5	Very low	30.3	Very low	135 Å²	135	129.2 Å²	129.2	88%	0.877	74%	0.739	S	S	*	*			trans	-78.5	83.5	150.9	32.6	-26	0	0	0	108	C152	P150-C152 PolarHBondContact O-N 2.88Å
151	T	24.3	Very low	29.9	Very low	93 Å²	93	134.4 Å²	134.4	57%	0.571	76%	0.764	S	S	*	*			trans	-70.7	108.6	162.2	-52.1	0	0	0	0	106.8	Q149 R153	Q149-T151 PolarHBondContact O-N 3.43Å; Q149-T151 PolarHBondContact OE1-OG1 2.96Å; T151-R153 VanDerWaalsContact C-N 3.34Å; T151-R153 PolarHBondContact O-N 3.35Å
152	C	31.6	Very low	29.5	Very low	124 Å²	124	131.9 Å²	131.9	84%	0.838	77%	0.765	S	S	*	*			trans	-58	94.3	171.3	-176.1	0	0	0	0	109.4	P150	P150-C152 PolarHBondContact O-N 2.88Å
153	R	24.7	Very low	29.1	Very low	222 Å²	222	135 Å²	135	84%	0.838	78%	0.782	S	S	*	*			trans	-104.3	116.5	162.1	-82.2	-163.4	174.4	-171.3	0.5	108.8	T151 A155	T151-R153 VanDerWaalsContact C-N 3.34Å; T151-R153 PolarHBondContact O-N 3.35Å; R153-A155 PolarHBondContact O-N 3Å
154	V	36.9	Very low	28.6	Very low	143 Å²	143	132.5 Å²	132.5	87%	0.867	78%	0.782	S	S	*	*			trans	-52.9	119	163	175.9	0	0	0	0	108
155	A	27.2	Very low	28.5	Very low	88 Å²	88	133.4 Å²	133.4	73%	0.727	79%	0.79	S	S	*	*			trans	-146.1	109.1	165.9	0	0	0	0	0	109.7	R153	R153-A155 PolarHBondContact O-N 3Å
156	E	24.7	Very low	28.4	Very low	185 Å²	185	136 Å²	136	86%	0.864	79%	0.786	S	S	*	*			trans	28.1	128.1	144.1	-70.6	171.8	158.7	0	0	120.7	V158	E156-V158 PolarHBondContact O-N 3.38Å
157	I	38.5	Very low	28.9	Very low	175 Å²	175	135.5 Å²	135.5	90%	0.897	79%	0.787	S	S	*	*			trans	-51.3	113.8	167.9	-61.3	158.6	0	0	0	110
158	V	27.7	Very low	29	Very low	137 Å²	137	141.7 Å²	141.7	83%	0.83	79%	0.79	S	S	*	*			trans	-134.5	133	154.6	-175.8	0	0	0	0	108.4	E156	E156-V158 PolarHBondContact O-N 3.38Å
159	D	23.4	Very low	29.8	Very low	139 Å²	139	141.5 Å²	141.5	74%	0.743	78%	0.781	S	S	*	*			trans	-54.9	146.8	-168.2	-135.5	2.1	0	0	0	114.8	L161	D159-L161 PolarHBondContact O-N 3.39Å
160	P	31.5	Very low	30.9	Very low	112 Å²	112	134.4 Å²	134.4	73%	0.727	75%	0.749	S	S	*	*			trans	-90.4	92.3	-172.8	34.5	-27	0	0	0	111.5
161	L	29.8	Very low	32.3	Very low	170 Å²	170	134.8 Å²	134.8	89%	0.89	74%	0.74	S	S	*	*			trans	-133.9	62.8	164.7	-78.7	171.2	0	0	0	110.9	D159	D159-L161 PolarHBondContact O-N 3.39Å
162	S	25.8	Very low	34.2	Very low	110 Å²	110	131.7 Å²	131.7	77%	0.769	72%	0.719	S	S	*	*			trans	-154	99.7	148.2	66.4	0	0	0	0	109.5	P164	S162-P164 WeakPolarHBondContact O-CD 3.32Å
163	V	24.4	Very low	36.3	Very low	114 Å²	114	127.3 Å²	127.3	69%	0.691	69%	0.688	S	S	*	*			trans	-89	114.6	166.4	177.1	0	0	0	0	106.3
164	P	25.5	Very low	38.8	Very low	116 Å²	116	124.7 Å²	124.7	75%	0.753	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-73.7	126.5	161.8	-6.6	24.8	0	0	0	107.9	S162	S162-P164 WeakPolarHBondContact O-CD 3.32Å
165	N	24.9	Very low	40.9	Very low	158 Å²	158	127.1 Å²	127.1	85%	0.845	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-60.6	143.3	-171.9	-79.1	-49.5	0	0	0	114.4
166	F	28.6	Very low	43.5	Very low	178 Å²	178	123 Å²	123	78%	0.781	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-69.8	153.7	174.2	-76.3	-96.7	0	0	0	113.9
167	S	35.5	Very low	46.3	Very low	99 Å²	99	118 Å²	118	69%	0.692	62%	0.618	S	S	*	*			trans	69.3	91.4	149.4	63.8	0	0	0	0	119.2
168	F	35.9	Very low	48.6	Very low	213 Å²	213	113.2 Å²	113.2	93%	0.934	60%	0.597	S	S	*	*			trans	-108	104.8	142.2	-69.6	-79.7	0	0	0	107.5
169	L	47.1	Very low	51.4	Low	96 Å²	96	107.1 Å²	107.1	50%	0.503	56%	0.561	S	S	.	*			trans	-63.8	140.3	168.5	-73.7	155.7	0	0	0	107.6	Y137 Q171	Y137-L169 HydrophobicContact CD2-CD2 3.64Å; Y137-L169 HydrophobicContact CE2-CD2 4.33Å; L169-Q171 PolarHBondContact O-N 2.86Å
170	P	52.9	Low	54.5	Low	15 Å²	15	100.5 Å²	100.5	10%	0.097	53%	0.526	C	S	.	.			trans	-52.2	128.8	169.6	16	-25.8	0	0	0	108.9	Y137 F139 I172 L212 D222 V226	Y137-P170 HydrophobicContact CD2-CG 4.28Å; Y137-P170 HydrophobicContact CE2-CG 4.2Å; F139-P170 HydrophobicContact CZ-CG 4.13Å; P170-I172 HydrophobicContact CG-CD1 4.4Å; P170-I172 WeakPolarHBondContact O-CG1 3.26Å; P170-I172 PolarHBondContact O-N 3.32Å; P170-L212 HydrophobicContact CB-CD2 3.7Å; P170-D222 HydrophobicContact CB-CB 4.19Å; P170-V226 HydrophobicContact CG-CG2 4.47Å
171	Q	56.7	Low	57.2	Low	144 Å²	144	100.7 Å²	100.7	67%	0.673	52%	0.515	S	S	*	.			trans	-70.7	83.5	-178.3	-176.3	175.1	-17.6	0	0	109.6	L169 L212 G213	L169-Q171 PolarHBondContact O-N 2.86Å; Q171-L212 CarbonylContact O-C 3.44Å; Q171-L212 WeakPolarHBondContact O-CA 3.38Å; Q171-L212 VanDerWaalsContact O-CD2 3.31Å; Q171-L212 WeakPolarHBondContact O-CD2 3.44Å; Q171-G213 PolarHBondContact O-N 3.14Å
172	I	64.7	Low	60	Low	27 Å²	27	96.5 Å²	96.5	14%	0.138	49%	0.494	C	S	.	.	B	Isolated β-bridge	trans	-69.3	141.6	-172.3	-72.4	148.4	0	0	0	111.7	V135 Y137 P170 K174 L176 Q177 V211 V226	V135-I172 HydrophobicContact CG1-CD1 4.36Å; Y137-I172 HydrophobicContact CE2-CD1 3.38Å; Y137-I172 WeakPolarHBondContact OH-CD1 3.4Å; P170-I172 HydrophobicContact CG-CD1 4.4Å; P170-I172 WeakPolarHBondContact O-CG1 3.26Å; P170-I172 PolarHBondContact O-N 3.32Å; I172-K174 PolarHBondContact O-N 3Å; I172-L176 HydrophobicContact CG2-CB 3.76Å; I172-L176 HydrophobicContact CG2-CD2 3.69Å; I172-L176 HydrophobicContact CG2-CG 3.68Å; I172-Q177 HydrophobicContact CG2-CB 4.3Å; I172-V211 WeakPolarHBondContact CA-O 3.26Å; I172-V226 HydrophobicContact CD1-CG2 4.32Å; I172-V226 HydrophobicContact CG1-CG2 4.5Å
173	D	75.3	Confident	63.2	Low	33 Å²	33	91.3 Å²	91.3	18%	0.176	46%	0.457	C	S	.	.			trans	-51.3	140.6	173	175.5	-101.1	0	0	0	111.3	W175 L176 Q177 A210 V211	D173-W175 VanDerWaalsContact C-N 3.26Å; D173-W175 PolarHBondContact O-N 3.38Å; D173-W175 WeakPolarHBondContact OD1-CA 3.37Å; D173-W175 WeakPolarHBondContact OD1-CB 3.5Å; D173-W175 PolarHBondContact OD1-N 3.36Å; D173-L176 HydrophobicContact CB-CB 4.31Å; D173-L176 PolarHBondContact O-N 2.88Å; D173-L176 PolarHBondContact OD1-N 2.98Å; D173-Q177 PolarHBondContact O-N 2.95Å; D173-A210 HydrophobicContact CB-CB 4.48Å; D173-A210 WeakPolarHBondContact CB-O 3.3Å; D173-V211 PolarHBondContact N-O 2.98Å; D173-V211 VanDerWaalsContact N-O 3.1Å
174	K	77.9	Confident	66.3	Low	166 Å²	166	86.9 Å²	86.9	72%	0.722	43%	0.431	S	S	*	.	H	α-helix	trans	-61.4	-35.7	-174.6	-68.8	179.6	-177.6	173.1	0	111.9	I172 Q177 V178	I172-K174 PolarHBondContact O-N 3Å; K174-Q177 PolarHBondContact O-N 2.69Å; K174-V178 VanDerWaalsContact O-CG2 3.27Å; K174-V178 WeakPolarHBondContact O-CG2 3.32Å; K174-V178 PolarHBondContact O-N 3.44Å
175	W	80.3	Confident	69.4	Low	195 Å²	195	83.8 Å²	83.8	74%	0.739	41%	0.412	S	S	*	.	H	α-helix	trans	-70.5	-42.7	178.9	-60.4	94.4	0	0	0	111.5	D173 Q177 V178 A179 L205	D173-W175 VanDerWaalsContact C-N 3.26Å; D173-W175 PolarHBondContact O-N 3.38Å; D173-W175 WeakPolarHBondContact OD1-CA 3.37Å; D173-W175 WeakPolarHBondContact OD1-CB 3.5Å; D173-W175 PolarHBondContact OD1-N 3.36Å; W175-Q177 VanDerWaalsContact C-N 3.32Å; W175-Q177 PolarHBondContact O-N 3.22Å; W175-V178 PolarHBondContact O-N 3.36Å; W175-A179 WeakPolarHBondContact O-CB 3.09Å; W175-A179 PolarHBondContact O-N 3.18Å; W175-L205 HydrophobicContact CB-CD1 4.43Å
176	L	83.6	Confident	72.7	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-61.3	-43.3	174.3	179	57	0	0	0	111	I172 D173 V178 A179 L180 A202 L205 C206 A210 V226 I230	I172-L176 HydrophobicContact CG2-CB 3.76Å; I172-L176 HydrophobicContact CG2-CD2 3.69Å; I172-L176 HydrophobicContact CG2-CG 3.68Å; D173-L176 HydrophobicContact CB-CB 4.31Å; D173-L176 PolarHBondContact O-N 2.88Å; D173-L176 PolarHBondContact OD1-N 2.98Å; L176-V178 VanDerWaalsContact C-N 3.35Å; L176-V178 PolarHBondContact O-N 2.96Å; L176-A179 PolarHBondContact O-N 3.47Å; L176-L180 HydrophobicContact CD1-CD1 4.22Å; L176-L180 HydrophobicContact CD1-CG 4.14Å; L176-L180 HydrophobicContact CG-CD1 4.15Å; L176-L180 HydrophobicContact CG-CG 4.5Å; L176-L180 VanDerWaalsContact O-CG 3.26Å; L176-L180 WeakPolarHBondContact O-CG 3.34Å; L176-L180 PolarHBondContact O-N 3.42Å; L176-A202 HydrophobicContact CD1-CB 3.73Å; L176-A202 WeakPolarHBondContact CD1-O 3.37Å; L176-L205 HydrophobicContact CD1-CB 4.38Å; L176-C206 WeakPolarHBondContact CD2-SG 3.4Å; L176-A210 WeakPolarHBondContact CB-O 3.47Å; L176-A210 VanDerWaalsContact CD2-O 3.28Å; L176-A210 WeakPolarHBondContact CD2-O 3.49Å; L176-V226 HydrophobicContact CD2-CG1 4.11Å; L176-I230 HydrophobicContact CD1-CD1 4.22Å
177	Q	83.1	Confident	75.7	Confident	81 Å²	81	69.7 Å²	69.7	38%	0.379	35%	0.346	S	S	.	.	H	α-helix	trans	-61.4	-41.7	177.3	-164	-171.6	36.9	0	0	112.5	I172 D173 K174 W175 K181	I172-Q177 HydrophobicContact CG2-CB 4.3Å; D173-Q177 PolarHBondContact O-N 2.95Å; K174-Q177 PolarHBondContact O-N 2.69Å; W175-Q177 VanDerWaalsContact C-N 3.32Å; W175-Q177 PolarHBondContact O-N 3.22Å; Q177-K181 WeakPolarHBondContact O-CG 3.35Å; Q177-K181 PolarHBondContact O-N 3.43Å; Q177-K181 VanDerWaalsContact O-N 3.11Å
178	V	85.4	Confident	78.4	Confident	75 Å²	75	71.5 Å²	71.5	46%	0.455	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-49.3	176	169.7	0	0	0	0	110.5	K174 W175 L176 L180 K181 D182	K174-V178 VanDerWaalsContact O-CG2 3.27Å; K174-V178 WeakPolarHBondContact O-CG2 3.32Å; K174-V178 PolarHBondContact O-N 3.44Å; W175-V178 PolarHBondContact O-N 3.36Å; L176-V178 VanDerWaalsContact C-N 3.35Å; L176-V178 PolarHBondContact O-N 2.96Å; V178-L180 VanDerWaalsContact C-N 3.31Å; V178-L180 PolarHBondContact O-N 3Å; V178-K181 PolarHBondContact O-N 2.89Å; V178-K181 VanDerWaalsContact O-N 3.13Å; V178-D182 PolarHBondContact O-N 2.93Å
179	A	87.8	Confident	81.1	Confident	9 Å²	9	66.2 Å²	66.2	7%	0.074	32%	0.316	C	S	.	.	H	α-helix	trans	-58	-41.7	179.2	0	0	0	0	0	112.4	W175 L176 D182 A183 A202 L205	W175-A179 WeakPolarHBondContact O-CB 3.09Å; W175-A179 PolarHBondContact O-N 3.18Å; L176-A179 PolarHBondContact O-N 3.47Å; A179-D182 PolarHBondContact O-N 3.4Å; A179-A183 VanDerWaalsContact O-CB 3.27Å; A179-A183 WeakPolarHBondContact O-CB 3.36Å; A179-A183 PolarHBondContact O-N 3.25Å; A179-A202 HydrophobicContact CB-CB 4.12Å; A179-L205 HydrophobicContact CB-CD1 4.39Å
180	L	88.7	Confident	83.4	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-66	-39.9	177.1	-68.9	175.1	0	0	0	112.8	V135 L176 V178 S184 F199 A202 F229 I230	V135-L180 HydrophobicContact CG2-CB 4.41Å; L176-L180 HydrophobicContact CD1-CD1 4.22Å; L176-L180 HydrophobicContact CD1-CG 4.14Å; L176-L180 HydrophobicContact CG-CD1 4.15Å; L176-L180 HydrophobicContact CG-CG 4.5Å; L176-L180 VanDerWaalsContact O-CG 3.26Å; L176-L180 WeakPolarHBondContact O-CG 3.34Å; L176-L180 PolarHBondContact O-N 3.42Å; V178-L180 VanDerWaalsContact C-N 3.31Å; V178-L180 PolarHBondContact O-N 3Å; L180-S184 WeakPolarHBondContact O-CB 3.47Å; L180-S184 PolarHBondContact O-N 3.19Å; L180-S184 PolarHBondContact O-OG 3.08Å; L180-F199 HydrophobicContact CD2-CD1 4.2Å; L180-F199 HydrophobicContact CD2-CE1 4.21Å; L180-A202 HydrophobicContact CD2-CB 3.83Å; L180-A202 HydrophobicContact CG-CB 4.34Å; L180-F229 HydrophobicContact CD2-CE1 4.42Å; L180-I230 HydrophobicContact CD2-CD1 4.04Å; L180-I230 HydrophobicContact CD2-CG1 3.68Å
181	K	88	Confident	85.4	Confident	116 Å²	116	73.2 Å²	73.2	50%	0.504	34%	0.34	S	S	.	.	H	α-helix	trans	-65.5	-44.9	176	-77	176.1	179.6	172.6	0	111.2	Q177 V178 S184 S185	Q177-K181 WeakPolarHBondContact O-CG 3.35Å; Q177-K181 PolarHBondContact O-N 3.43Å; Q177-K181 VanDerWaalsContact O-N 3.11Å; V178-K181 PolarHBondContact O-N 2.89Å; V178-K181 VanDerWaalsContact O-N 3.13Å; K181-S184 PolarHBondContact O-N 3.36Å; K181-S185 WeakPolarHBondContact O-CB 3.42Å; K181-S185 PolarHBondContact O-N 2.74Å
182	D	89	Confident	87.3	Confident	82 Å²	82	68.5 Å²	68.5	44%	0.439	32%	0.317	S	S	.	.	H	α-helix	trans	-64.4	-43.2	178.6	-73	-12.7	0	0	0	111.6	V178 A179 S184 S185 C186	V178-D182 PolarHBondContact O-N 2.93Å; A179-D182 PolarHBondContact O-N 3.4Å; D182-S184 PolarHBondContact O-N 3.1Å; D182-S185 PolarHBondContact O-N 3.28Å; D182-C186 WeakPolarHBondContact O-CB 3.46Å; D182-C186 PolarHBondContact O-N 3.39Å; D182-C186 PolarHBondContact O-SG 2.9Å
183	A	92	Very high	88.9	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-59.6	-46.2	174.6	0	0	0	0	0	111.9	A179 C186 Y187 A195 Q198 F199	A179-A183 VanDerWaalsContact O-CB 3.27Å; A179-A183 WeakPolarHBondContact O-CB 3.36Å; A179-A183 PolarHBondContact O-N 3.25Å; A183-C186 WeakPolarHBondContact O-CB 3.44Å; A183-C186 PolarHBondContact O-N 2.93Å; A183-Y187 PolarHBondContact O-N 2.87Å; A183-A195 WeakPolarHBondContact O-CB 3.36Å; A183-Q198 HydrophobicContact CB-CB 3.57Å; A183-F199 HydrophobicContact CB-CD1 3.58Å; A183-F199 HydrophobicContact CB-CD2 3.84Å; A183-F199 HydrophobicContact CB-CE1 3.49Å; A183-F199 VanDerWaalsContact CB-CE1 3.49Å; A183-F199 HydrophobicContact CB-CE2 3.75Å; A183-F199 HydrophobicContact CB-CG 3.74Å; A183-F199 HydrophobicContact CB-CZ 3.56Å
184	S	90.4	Very high	89.9	Confident	21 Å²	21	73.8 Å²	73.8	15%	0.147	35%	0.354	C	S	.	.	H	α-helix	trans	-64.9	-40.4	178.5	-57.6	0	0	0	0	111.9	L180 K181 D182 Y187 R188	L180-S184 WeakPolarHBondContact O-CB 3.47Å; L180-S184 PolarHBondContact O-N 3.19Å; L180-S184 PolarHBondContact O-OG 3.08Å; K181-S184 PolarHBondContact O-N 3.36Å; D182-S184 PolarHBondContact O-N 3.1Å; S184-Y187 WeakPolarHBondContact O-CB 3.47Å; S184-Y187 PolarHBondContact O-N 2.9Å; S184-R188 WeakPolarHBondContact O-CG 3.45Å; S184-R188 PolarHBondContact O-N 2.8Å
185	S	90.6	Very high	90.7	Very high	52 Å²	52	65.9 Å²	65.9	36%	0.364	32%	0.319	S	S	.	.	H	α-helix	trans	-60.8	-46.8	173.7	-176.3	0	0	0	0	111.4	K181 D182 Y187 R188 Q189	K181-S185 WeakPolarHBondContact O-CB 3.42Å; K181-S185 PolarHBondContact O-N 2.74Å; D182-S185 PolarHBondContact O-N 3.28Å; S185-Y187 VanDerWaalsContact C-N 3.31Å; S185-Y187 PolarHBondContact O-N 2.89Å; S185-R188 PolarHBondContact O-N 2.87Å; S185-Q189 VanDerWaalsContact O-CG 3.31Å; S185-Q189 WeakPolarHBondContact O-CG 3.35Å; S185-Q189 PolarHBondContact O-N 2.96Å; S185-Q189 PolarHBondContact OG-NE2 3.22Å
186	C	93.1	Very high	91.5	Very high	24 Å²	24	56.7 Å²	56.7	16%	0.162	29%	0.285	C	S	.	.	H	α-helix	trans	-59.4	-41.7	174.7	-69.1	0	0	0	0	111.9	D182 A183 Q189 K190 K191 L194 A195	D182-C186 WeakPolarHBondContact O-CB 3.46Å; D182-C186 PolarHBondContact O-N 3.39Å; D182-C186 PolarHBondContact O-SG 2.9Å; A183-C186 WeakPolarHBondContact O-CB 3.44Å; A183-C186 PolarHBondContact O-N 2.93Å; C186-Q189 CarbonylContact O-C 3.59Å; C186-Q189 PolarHBondContact O-N 3.3Å; C186-K190 PolarHBondContact O-N 3.46Å; C186-K191 HydrophobicContact CB-CB 4.38Å; C186-K191 WeakPolarHBondContact O-CA 3.33Å; C186-K191 WeakPolarHBondContact O-CB 3.4Å; C186-K191 PolarHBondContact O-N 2.94Å; C186-L194 HydrophobicContact CB-CB 4.42Å; C186-A195 HydrophobicContact CB-CB 3.84Å
187	Y	92.2	Very high	92.1	Very high	16 Å²	16	58.2 Å²	58.2	6%	0.063	30%	0.301	C	S	.	.	H	α-helix	trans	-61.9	-46.4	177.9	-176.5	-92.2	0	0	0	111.7	D131 A183 S184 S185 Q189 K190 Y192 R240	D131-Y187 HydrophobicContact CB-CE1 4.3Å; A183-Y187 PolarHBondContact O-N 2.87Å; S184-Y187 WeakPolarHBondContact O-CB 3.47Å; S184-Y187 PolarHBondContact O-N 2.9Å; S185-Y187 VanDerWaalsContact C-N 3.31Å; S185-Y187 PolarHBondContact O-N 2.89Å; Y187-Q189 VanDerWaalsContact C-N 3.29Å; Y187-Q189 PolarHBondContact O-N 3.16Å; Y187-K190 WeakPolarHBondContact O-CA 3.49Å; Y187-K190 PolarHBondContact O-N 3.16Å; Y187-Y192 AromaticContact CD2-CD1 3.66Å; Y187-Y192 HydrophobicContact CD2-CD1 3.66Å; Y187-Y192 AromaticContact CD2-CE1 3.87Å; Y187-Y192 HydrophobicContact CD2-CE1 3.87Å; Y187-Y192 AromaticContact CE2-CD1 3.78Å; Y187-Y192 HydrophobicContact CE2-CD1 3.78Å; Y187-Y192 AromaticContact CE2-CE1 3.76Å; Y187-Y192 HydrophobicContact CE2-CE1 3.76Å; Y187-Y192 HydrophobicContact CG-CD1 4.42Å; Y187-Y192 HydrophobicContact CG-CE1 4.37Å; Y187-R240 HydrophobicContact CE2-CG 4.34Å
188	R	91.2	Very high	92.6	Very high	137 Å²	137	57.8 Å²	57.8	52%	0.517	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-36.1	176.1	-71.1	178.4	-173.5	-159.8	-6.1	112.8	D131 S184 S185 K190	D131-R188 WeakPolarHBondContact OD2-CG 3.21Å; D131-R188 IonicContact OD2-CZ 3.75Å; D131-R188 IonicContact OD2-NE 3.48Å; D131-R188 PolarHBondContact OD2-NE 3.28Å; D131-R188 IonicContact OD2-NH2 2.75Å; D131-R188 PolarHBondContact OD2-NH2 3.41Å; S184-R188 WeakPolarHBondContact O-CG 3.45Å; S184-R188 PolarHBondContact O-N 2.8Å; S185-R188 PolarHBondContact O-N 2.87Å; R188-K190 PolarHBondContact O-N 3.28Å; R188-K190 VanDerWaalsContact O-N 3.17Å
189	Q	93.6	Very high	93.1	Very high	102 Å²	102	54.2 Å²	54.2	48%	0.477	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	5.7	173.3	-66.7	175.6	30.3	0	0	113.4	S185 C186 Y187 K191	S185-Q189 VanDerWaalsContact O-CG 3.31Å; S185-Q189 WeakPolarHBondContact O-CG 3.35Å; S185-Q189 PolarHBondContact O-N 2.96Å; S185-Q189 PolarHBondContact OG-NE2 3.22Å; C186-Q189 CarbonylContact O-C 3.59Å; C186-Q189 PolarHBondContact O-N 3.3Å; Y187-Q189 VanDerWaalsContact C-N 3.29Å; Y187-Q189 PolarHBondContact O-N 3.16Å; Q189-K191 HydrophobicContact CB-CD 4.15Å; Q189-K191 HydrophobicContact CB-CG 4.21Å; Q189-K191 PolarHBondContact O-N 3Å
190	K	94.6	Very high	93.4	Very high	156 Å²	156	59 Å²	59	68%	0.678	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	18.6	-175.9	-51.7	-180	-179.9	174.6	0	113.8	C186 Y187 R188 Y192	C186-K190 PolarHBondContact O-N 3.46Å; Y187-K190 WeakPolarHBondContact O-CA 3.49Å; Y187-K190 PolarHBondContact O-N 3.16Å; R188-K190 PolarHBondContact O-N 3.28Å; R188-K190 VanDerWaalsContact O-N 3.17Å; K190-Y192 HydrophobicContact CB-CE2 4.02Å; K190-Y192 WeakPolarHBondContact O-CD2 3.06Å; K190-Y192 PolarHBondContact O-N 3.14Å; K190-Y192 VanDerWaalsContact O-N 3.09Å
191	K	96.3	Very high	93.6	Very high	101 Å²	101	62 Å²	62	44%	0.439	31%	0.312	S	S	.	.			trans	-86.7	61.4	175.5	-66.4	172.5	177.5	168.9	0	109.9	C186 Q189 A193 L194 A195	C186-K191 HydrophobicContact CB-CB 4.38Å; C186-K191 WeakPolarHBondContact O-CA 3.33Å; C186-K191 WeakPolarHBondContact O-CB 3.4Å; C186-K191 PolarHBondContact O-N 2.94Å; Q189-K191 HydrophobicContact CB-CD 4.15Å; Q189-K191 HydrophobicContact CB-CG 4.21Å; Q189-K191 PolarHBondContact O-N 3Å; K191-A193 VanDerWaalsContact C-N 3.32Å; K191-A193 PolarHBondContact O-N 2.84Å; K191-L194 HydrophobicContact CB-CB 4.27Å; K191-L194 HydrophobicContact CB-CD1 4.19Å; K191-L194 HydrophobicContact CD-CD1 4.08Å; K191-L194 HydrophobicContact CG-CD1 4.5Å; K191-L194 PolarHBondContact O-N 2.99Å; K191-L194 VanDerWaalsContact O-N 3.13Å; K191-A195 PolarHBondContact O-N 3.31Å
192	Y	96.1	Very high	93.7	Very high	45 Å²	45	56.5 Å²	56.5	18%	0.176	29%	0.288	C	S	.	.	H	α-helix	trans	-61.5	-34.1	-168.8	-55.7	-57.9	0	0	0	114.4	Y187 K190 A195 A196 R240	Y187-Y192 AromaticContact CD2-CD1 3.66Å; Y187-Y192 HydrophobicContact CD2-CD1 3.66Å; Y187-Y192 AromaticContact CD2-CE1 3.87Å; Y187-Y192 HydrophobicContact CD2-CE1 3.87Å; Y187-Y192 AromaticContact CE2-CD1 3.78Å; Y187-Y192 HydrophobicContact CE2-CD1 3.78Å; Y187-Y192 AromaticContact CE2-CE1 3.76Å; Y187-Y192 HydrophobicContact CE2-CE1 3.76Å; Y187-Y192 HydrophobicContact CG-CD1 4.42Å; Y187-Y192 HydrophobicContact CG-CE1 4.37Å; K190-Y192 HydrophobicContact CB-CE2 4.02Å; K190-Y192 WeakPolarHBondContact O-CD2 3.06Å; K190-Y192 PolarHBondContact O-N 3.14Å; K190-Y192 VanDerWaalsContact O-N 3.09Å; Y192-A195 PolarHBondContact O-N 3.21Å; Y192-A196 WeakPolarHBondContact O-CB 3.46Å; Y192-A196 PolarHBondContact O-N 3.09Å; Y192-R240 HydrophobicContact CD1-CB 3.86Å; Y192-R240 HydrophobicContact CD1-CG 4.13Å; Y192-R240 HydrophobicContact CD2-CB 3.67Å; Y192-R240 HydrophobicContact CE1-CB 3.97Å; Y192-R240 HydrophobicContact CE1-CG 3.83Å; Y192-R240 HydrophobicContact CE2-CB 3.77Å; Y192-R240 HydrophobicContact CE2-CG 4.22Å; Y192-R240 HydrophobicContact CG-CB 3.71Å; Y192-R240 HydrophobicContact CG-CG 4.47Å
193	A	97	Very high	93.8	Very high	66 Å²	66	53.4 Å²	53.4	55%	0.545	27%	0.271	S	S	.	.	H	α-helix	trans	-66.5	-41.8	176.3	0	0	0	0	0	112.1	K191 A196 G197 M241	K191-A193 VanDerWaalsContact C-N 3.32Å; K191-A193 PolarHBondContact O-N 2.84Å; A193-A196 PolarHBondContact O-N 3.06Å; A193-G197 PolarHBondContact O-N 3.45Å; A193-G197 VanDerWaalsContact O-N 3.07Å; A193-M241 HydrophobicContact CB-CE 3.87Å; A193-M241 HydrophobicContact CB-SD 4.26Å
194	L	96.8	Very high	93.7	Very high	105 Å²	105	58.6 Å²	58.6	55%	0.55	30%	0.295	S	S	.	.	H	α-helix	trans	-68.6	-42.2	175.7	-69	173.9	0	0	0	110.9	C186 K191 A196 G197 Q198	C186-L194 HydrophobicContact CB-CB 4.42Å; K191-L194 HydrophobicContact CB-CB 4.27Å; K191-L194 HydrophobicContact CB-CD1 4.19Å; K191-L194 HydrophobicContact CD-CD1 4.08Å; K191-L194 HydrophobicContact CG-CD1 4.5Å; K191-L194 PolarHBondContact O-N 2.99Å; K191-L194 VanDerWaalsContact O-N 3.13Å; L194-A196 VanDerWaalsContact C-N 3.34Å; L194-A196 PolarHBondContact O-N 3.13Å; L194-G197 PolarHBondContact O-N 2.76Å; L194-G197 VanDerWaalsContact O-N 3.17Å; L194-Q198 WeakPolarHBondContact O-CG 3.3Å; L194-Q198 PolarHBondContact O-N 2.84Å
195	A	95.7	Very high	93.4	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.5	-46.3	174.3	0	0	0	0	0	111.6	A183 C186 K191 Y192 G197 Q198 F199	A183-A195 WeakPolarHBondContact O-CB 3.36Å; C186-A195 HydrophobicContact CB-CB 3.84Å; K191-A195 PolarHBondContact O-N 3.31Å; Y192-A195 PolarHBondContact O-N 3.21Å; A195-G197 VanDerWaalsContact C-N 3.32Å; A195-G197 PolarHBondContact O-N 3.26Å; A195-Q198 PolarHBondContact O-N 3.48Å; A195-F199 HydrophobicContact CB-CD2 4.44Å; A195-F199 HydrophobicContact CB-CE2 4.33Å; A195-F199 WeakPolarHBondContact O-CD2 3.32Å; A195-F199 PolarHBondContact O-N 2.88Å
196	A	96.4	Very high	93	Very high	3 Å²	3	57.7 Å²	57.7	3%	0.025	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-38.5	176.4	0	0	0	0	0	112.6	Y192 A193 L194 R200 L234 C237 Y238	Y192-A196 WeakPolarHBondContact O-CB 3.46Å; Y192-A196 PolarHBondContact O-N 3.09Å; A193-A196 PolarHBondContact O-N 3.06Å; L194-A196 VanDerWaalsContact C-N 3.34Å; L194-A196 PolarHBondContact O-N 3.13Å; A196-R200 WeakPolarHBondContact O-CG 3.29Å; A196-R200 PolarHBondContact O-N 2.72Å; A196-L234 HydrophobicContact CB-CD2 4.26Å; A196-L234 WeakPolarHBondContact O-CD2 3.14Å; A196-C237 HydrophobicContact CB-CB 3.92Å; A196-Y238 HydrophobicContact CB-CE1 4.09Å
197	G	96.2	Very high	92.3	Very high	31 Å²	31	61 Å²	61	32%	0.32	31%	0.309	S	S	.	.	H	α-helix	trans	-59.5	-49.8	172.8	0	0	0	0	0	112	A193 L194 A195 R200 T201	A193-G197 PolarHBondContact O-N 3.45Å; A193-G197 VanDerWaalsContact O-N 3.07Å; L194-G197 PolarHBondContact O-N 2.76Å; L194-G197 VanDerWaalsContact O-N 3.17Å; A195-G197 VanDerWaalsContact C-N 3.32Å; A195-G197 PolarHBondContact O-N 3.26Å; G197-R200 WeakPolarHBondContact O-CB 3.38Å; G197-R200 PolarHBondContact O-N 2.93Å; G197-T201 PolarHBondContact O-N 2.64Å; G197-T201 PolarHBondContact O-OG1 2.83Å
198	Q	94.4	Very high	91.5	Very high	72 Å²	72	68.2 Å²	68.2	34%	0.336	34%	0.34	S	S	.	.	H	α-helix	trans	-66.5	-39	179.7	-65.4	-62.4	-15.7	0	0	112.8	A183 L194 A195 R200 T201 A202	A183-Q198 HydrophobicContact CB-CB 3.57Å; L194-Q198 WeakPolarHBondContact O-CG 3.3Å; L194-Q198 PolarHBondContact O-N 2.84Å; A195-Q198 PolarHBondContact O-N 3.48Å; Q198-R200 VanDerWaalsContact C-N 3.33Å; Q198-R200 PolarHBondContact O-N 2.95Å; Q198-T201 PolarHBondContact O-N 3.49Å; Q198-A202 PolarHBondContact O-N 3.34Å
199	F	94.8	Very high	90.2	Very high	1 Å²	1	64 Å²	64	0%	0.004	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-34.8	173.5	-76.6	-55.5	0	0	0	112.4	L180 A183 A195 A202 L203 I230 K233 L234	L180-F199 HydrophobicContact CD2-CD1 4.2Å; L180-F199 HydrophobicContact CD2-CE1 4.21Å; A183-F199 HydrophobicContact CB-CD1 3.58Å; A183-F199 HydrophobicContact CB-CD2 3.84Å; A183-F199 HydrophobicContact CB-CE1 3.49Å; A183-F199 VanDerWaalsContact CB-CE1 3.49Å; A183-F199 HydrophobicContact CB-CE2 3.75Å; A183-F199 HydrophobicContact CB-CG 3.74Å; A183-F199 HydrophobicContact CB-CZ 3.56Å; A195-F199 HydrophobicContact CB-CD2 4.44Å; A195-F199 HydrophobicContact CB-CE2 4.33Å; A195-F199 WeakPolarHBondContact O-CD2 3.32Å; A195-F199 PolarHBondContact O-N 2.88Å; F199-A202 PolarHBondContact O-N 3.29Å; F199-L203 PolarHBondContact O-N 2.95Å; F199-I230 HydrophobicContact CB-CG2 4.21Å; F199-I230 HydrophobicContact CD1-CG2 4.45Å; F199-I230 WeakPolarHBondContact O-CG2 3.3Å; F199-K233 HydrophobicContact CD1-CB 4.05Å; F199-K233 HydrophobicContact CD2-CB 3.99Å; F199-K233 HydrophobicContact CE1-CB 3.79Å; F199-K233 HydrophobicContact CE1-CG 4.02Å; F199-K233 HydrophobicContact CE2-CB 3.73Å; F199-K233 HydrophobicContact CE2-CG 4.48Å; F199-K233 HydrophobicContact CG-CB 4.17Å; F199-K233 HydrophobicContact CZ-CB 3.63Å; F199-K233 HydrophobicContact CZ-CD 4.42Å; F199-K233 HydrophobicContact CZ-CG 3.93Å; F199-L234 HydrophobicContact CB-CD2 3.54Å; F199-L234 HydrophobicContact CB-CG 3.84Å
200	R	94.9	Very high	88.5	Confident	110 Å²	110	60.3 Å²	60.3	42%	0.415	33%	0.327	S	S	.	.	H	α-helix	trans	-64.7	-43.1	172	-77.2	176.2	174.8	154.9	-4.2	111.7	A196 G197 Q198 A202 L203 E204 L234 Y238	A196-R200 WeakPolarHBondContact O-CG 3.29Å; A196-R200 PolarHBondContact O-N 2.72Å; G197-R200 WeakPolarHBondContact O-CB 3.38Å; G197-R200 PolarHBondContact O-N 2.93Å; Q198-R200 VanDerWaalsContact C-N 3.33Å; Q198-R200 PolarHBondContact O-N 2.95Å; R200-A202 VanDerWaalsContact C-N 3.31Å; R200-A202 PolarHBondContact O-N 2.73Å; R200-L203 WeakPolarHBondContact O-CB 3.34Å; R200-L203 PolarHBondContact O-N 3.25Å; R200-L203 VanDerWaalsContact O-N 3.15Å; R200-E204 WeakPolarHBondContact O-CG 3.46Å; R200-E204 PolarHBondContact O-N 2.95Å; R200-L234 HydrophobicContact CG-CD1 4.28Å; R200-L234 HydrophobicContact CG-CD2 3.91Å; R200-Y238 PolarHBondContact NE-OH 3.35Å; R200-Y238 PolarHBondContact NH2-OH 2.89Å
201	T	92.3	Very high	86.7	Confident	63 Å²	63	53 Å²	53	39%	0.387	30%	0.295	S	S	.	.	H	α-helix	trans	-60.2	-42.9	174.2	-57	0	0	0	0	111.3	G197 Q198 L203 E204 L205	G197-T201 PolarHBondContact O-N 2.64Å; G197-T201 PolarHBondContact O-OG1 2.83Å; Q198-T201 PolarHBondContact O-N 3.49Å; T201-L203 VanDerWaalsContact C-N 3.33Å; T201-L203 PolarHBondContact O-N 3.46Å; T201-E204 PolarHBondContact O-N 3.38Å; T201-L205 WeakPolarHBondContact O-CG 3.32Å; T201-L205 PolarHBondContact O-N 2.96Å
202	A	91	Very high	85	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.9	-42.1	173.6	0	0	0	0	0	112	L176 A179 L180 Q198 F199 R200 L205 C206 I230	L176-A202 HydrophobicContact CD1-CB 3.73Å; L176-A202 WeakPolarHBondContact CD1-O 3.37Å; A179-A202 HydrophobicContact CB-CB 4.12Å; L180-A202 HydrophobicContact CD2-CB 3.83Å; L180-A202 HydrophobicContact CG-CB 4.34Å; Q198-A202 PolarHBondContact O-N 3.34Å; F199-A202 PolarHBondContact O-N 3.29Å; R200-A202 VanDerWaalsContact C-N 3.31Å; R200-A202 PolarHBondContact O-N 2.73Å; A202-L205 WeakPolarHBondContact O-CB 3.2Å; A202-L205 PolarHBondContact O-N 2.96Å; A202-C206 PolarHBondContact O-N 3.46Å; A202-C206 PolarHBondContact O-SG 2.89Å; A202-C206 VanDerWaalsContact O-SG 3.33Å; A202-I230 HydrophobicContact CB-CD1 4.02Å
203	L	91.1	Very high	82.9	Confident	17 Å²	17	49.3 Å²	49.3	9%	0.089	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-42	177.1	-170.8	62.8	0	0	0	112.2	F199 R200 T201 L205 C206 S207 A227 I230 E231 L234	F199-L203 PolarHBondContact O-N 2.95Å; R200-L203 WeakPolarHBondContact O-CB 3.34Å; R200-L203 PolarHBondContact O-N 3.25Å; R200-L203 VanDerWaalsContact O-N 3.15Å; T201-L203 VanDerWaalsContact C-N 3.33Å; T201-L203 PolarHBondContact O-N 3.46Å; L203-L205 VanDerWaalsContact C-N 3.34Å; L203-C206 WeakPolarHBondContact O-CB 3.31Å; L203-C206 PolarHBondContact O-N 3.31Å; L203-S207 PolarHBondContact O-N 3.04Å; L203-S207 PolarHBondContact O-OG 3.16Å; L203-A227 HydrophobicContact CD1-CB 4.46Å; L203-I230 HydrophobicContact CB-CG2 3.77Å; L203-I230 HydrophobicContact CD1-CB 4.33Å; L203-I230 HydrophobicContact CD1-CG2 4.2Å; L203-I230 HydrophobicContact CG-CG2 4.49Å; L203-E231 HydrophobicContact CD1-CG 4.27Å; L203-E231 WeakPolarHBondContact CD2-OE1 3.41Å; L203-L234 HydrophobicContact CD2-CD1 4.16Å
204	E	89.2	Confident	80.9	Confident	108 Å²	108	52.2 Å²	52.2	51%	0.505	30%	0.295	S	S	.	.	H	α-helix	trans	-63.2	-39.8	175.6	-73.2	176.6	-163.7	0	0	112.1	R200 T201 S207 K208	R200-E204 WeakPolarHBondContact O-CG 3.46Å; R200-E204 PolarHBondContact O-N 2.95Å; T201-E204 PolarHBondContact O-N 3.38Å; E204-S207 PolarHBondContact O-N 3.43Å; E204-K208 WeakPolarHBondContact O-CG 3.36Å; E204-K208 PolarHBondContact O-N 3.38Å; E204-K208 VanDerWaalsContact O-N 3.09Å
205	L	84.8	Confident	78.7	Confident	47 Å²	47	51.6 Å²	51.6	25%	0.246	30%	0.298	C	S	.	.	H	α-helix	trans	-60.6	-46.9	172.7	-72.2	173.7	0	0	0	110.5	W175 L176 A179 T201 A202 L203 S207 K208 G209 A210	W175-L205 HydrophobicContact CB-CD1 4.43Å; L176-L205 HydrophobicContact CD1-CB 4.38Å; A179-L205 HydrophobicContact CB-CD1 4.39Å; T201-L205 WeakPolarHBondContact O-CG 3.32Å; T201-L205 PolarHBondContact O-N 2.96Å; A202-L205 WeakPolarHBondContact O-CB 3.2Å; A202-L205 PolarHBondContact O-N 2.96Å; L203-L205 VanDerWaalsContact C-N 3.34Å; L205-S207 PolarHBondContact O-N 2.92Å; L205-K208 PolarHBondContact O-N 3.25Å; L205-G209 PolarHBondContact O-N 2.57Å; L205-A210 HydrophobicContact CB-CB 4.09Å; L205-A210 HydrophobicContact CD2-CB 4.36Å; L205-A210 WeakPolarHBondContact O-CA 3.36Å; L205-A210 VanDerWaalsContact O-CB 3.25Å; L205-A210 WeakPolarHBondContact O-CB 3.43Å; L205-A210 PolarHBondContact O-N 3.31Å
206	C	82.1	Confident	76.5	Confident	7 Å²	7	60.6 Å²	60.6	5%	0.047	34%	0.337	C	S	.	.	H	α-helix	trans	-56.7	-46.8	174.8	-68.2	0	0	0	0	112.5	L176 A202 L203 K208 G209 V211 I230	L176-C206 WeakPolarHBondContact CD2-SG 3.4Å; A202-C206 PolarHBondContact O-N 3.46Å; A202-C206 PolarHBondContact O-SG 2.89Å; A202-C206 VanDerWaalsContact O-SG 3.33Å; L203-C206 WeakPolarHBondContact O-CB 3.31Å; L203-C206 PolarHBondContact O-N 3.31Å; C206-K208 VanDerWaalsContact C-N 3.26Å; C206-K208 PolarHBondContact O-N 3.46Å; C206-G209 PolarHBondContact O-N 2.99Å; C206-G209 VanDerWaalsContact O-N 3.13Å; C206-V211 HydrophobicContact CB-CG2 3.89Å; C206-V211 WeakPolarHBondContact O-CG2 2.98Å; C206-I230 WeakPolarHBondContact SG-CD1 3.39Å
207	S	78.1	Confident	74.5	Confident	95 Å²	95	67 Å²	67	66%	0.664	37%	0.371	S	S	*	.	H	α-helix	trans	-67.2	-24.3	-178.9	-59	0	0	0	0	113.8	L203 E204 L205 G209	L203-S207 PolarHBondContact O-N 3.04Å; L203-S207 PolarHBondContact O-OG 3.16Å; E204-S207 PolarHBondContact O-N 3.43Å; L205-S207 PolarHBondContact O-N 2.92Å; S207-G209 PolarHBondContact O-N 3.45Å
208	K	74.5	Confident	72.7	Confident	167 Å²	167	67 Å²	67	73%	0.726	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	6.8	175.6	-70.9	173.3	-177.9	171.1	0	113.3	E204 L205 C206	E204-K208 WeakPolarHBondContact O-CG 3.36Å; E204-K208 PolarHBondContact O-N 3.38Å; E204-K208 VanDerWaalsContact O-N 3.09Å; L205-K208 PolarHBondContact O-N 3.25Å; C206-K208 VanDerWaalsContact C-N 3.26Å; C206-K208 PolarHBondContact O-N 3.46Å
209	G	65.2	Low	71.6	Confident	49 Å²	49	66 Å²	66	51%	0.505	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	4.6	-179.6	0	0	0	0	0	114.4	L205 C206 S207 V211	L205-G209 PolarHBondContact O-N 2.57Å; C206-G209 PolarHBondContact O-N 2.99Å; C206-G209 VanDerWaalsContact O-N 3.13Å; S207-G209 PolarHBondContact O-N 3.45Å; G209-V211 PolarHBondContact O-N 3.17Å
210	A	57.3	Low	70.8	Confident	24 Å²	24	69.9 Å²	69.9	20%	0.198	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	39.6	175.5	0	0	0	0	0	112.1	D173 L176 L205	D173-A210 HydrophobicContact CB-CB 4.48Å; D173-A210 WeakPolarHBondContact CB-O 3.3Å; L176-A210 WeakPolarHBondContact CB-O 3.47Å; L176-A210 VanDerWaalsContact CD2-O 3.28Å; L176-A210 WeakPolarHBondContact CD2-O 3.49Å; L205-A210 HydrophobicContact CB-CB 4.09Å; L205-A210 HydrophobicContact CD2-CB 4.36Å; L205-A210 WeakPolarHBondContact O-CA 3.36Å; L205-A210 VanDerWaalsContact O-CB 3.25Å; L205-A210 WeakPolarHBondContact O-CB 3.43Å; L205-A210 PolarHBondContact O-N 3.31Å
211	V	56.6	Low	69.9	Low	2 Å²	2	69.4 Å²	69.4	1%	0.012	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-42	177	-176.9	0	0	0	0	110.4	I172 D173 C206 G209 I223 V226	I172-V211 WeakPolarHBondContact CA-O 3.26Å; D173-V211 PolarHBondContact N-O 2.98Å; D173-V211 VanDerWaalsContact N-O 3.1Å; C206-V211 HydrophobicContact CB-CG2 3.89Å; C206-V211 WeakPolarHBondContact O-CG2 2.98Å; G209-V211 PolarHBondContact O-N 3.17Å; V211-I223 HydrophobicContact CB-CG1 4.05Å; V211-I223 HydrophobicContact CG1-CG1 3.92Å; V211-I223 HydrophobicContact CG2-CG1 4.13Å; V211-I223 HydrophobicContact CG2-CG2 4.08Å; V211-V226 HydrophobicContact CG1-CB 4.4Å; V211-V226 HydrophobicContact CG1-CG2 4.22Å
212	L	60.1	Low	69.2	Low	25 Å²	25	68.7 Å²	68.7	13%	0.131	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-125.3	155.4	-177.1	-58.7	-167.6	0	0	0	113.8	P170 Q171 E214 A218	P170-L212 HydrophobicContact CB-CD2 3.7Å; Q171-L212 CarbonylContact O-C 3.44Å; Q171-L212 WeakPolarHBondContact O-CA 3.38Å; Q171-L212 VanDerWaalsContact O-CD2 3.31Å; Q171-L212 WeakPolarHBondContact O-CD2 3.44Å; L212-E214 VanDerWaalsContact C-N 3.26Å; L212-E214 PolarHBondContact O-N 2.81Å; L212-A218 VanDerWaalsContact CD1-CA 3.42Å; L212-A218 HydrophobicContact CD1-CB 3.14Å; L212-A218 HydrophobicContact CG-CB 3.72Å
213	G	52.4	Low	68.6	Low	44 Å²	44	71.8 Å²	71.8	45%	0.454	41%	0.413	S	S	.	.	S	Bend	trans	-68.2	-18.2	175.6	0	0	0	0	0	115.2	Q171	Q171-G213 PolarHBondContact O-N 3.14Å
214	E	54.5	Low	68.4	Low	126 Å²	126	72 Å²	72	59%	0.589	42%	0.418	S	S	*	.	S	Bend	trans	-126.4	106.1	171.6	-72.4	-93.5	164.8	0	0	107.1	L212 F216	L212-E214 VanDerWaalsContact C-N 3.26Å; L212-E214 PolarHBondContact O-N 2.81Å; E214-F216 PolarHBondContact O-N 2.99Å; E214-F216 VanDerWaalsContact O-N 3.12Å
215	P	50.3	Low	68.1	Low	92 Å²	92	67.6 Å²	67.6	60%	0.597	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-5.7	-167.7	22.5	-30.5	0	0	0	115.7
216	F	50.8	Low	68.1	Low	189 Å²	189	65.4 Å²	65.4	83%	0.829	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	-9.1	-172.4	-66.3	-76.7	0	0	0	115.5	E214	E214-F216 PolarHBondContact O-N 2.99Å; E214-F216 VanDerWaalsContact O-N 3.12Å
217	D	54.4	Low	68.5	Low	139 Å²	139	65.6 Å²	65.6	74%	0.743	39%	0.389	S	S	*	.	S	Bend	trans	-111.9	4.7	-174.6	-71.6	-23.7	0	0	0	114.4
218	A	58.8	Low	69.2	Low	30 Å²	30	61.2 Å²	61.2	25%	0.248	36%	0.359	C	S	.	.			trans	-76.1	127.3	-178.5	0	0	0	0	0	112.5	L212 I223	L212-A218 VanDerWaalsContact CD1-CA 3.42Å; L212-A218 HydrophobicContact CD1-CB 3.14Å; L212-A218 HydrophobicContact CG-CB 3.72Å; A218-I223 HydrophobicContact CB-CD1 3.93Å; A218-I223 HydrophobicContact CB-CG1 4.17Å
219	S	70.6	Confident	70	Confident	51 Å²	51	54.1 Å²	54.1	36%	0.357	33%	0.328	S	S	.	.			trans	-68.2	144.5	166.7	81.7	0	0	0	0	110.2	E221 D222 I223	S219-E221 PolarHBondContact O-N 3.2Å; S219-D222 PolarHBondContact O-N 2.99Å; S219-D222 PolarHBondContact OG-N 2.79Å; S219-D222 PolarHBondContact OG-OD2 2.89Å; S219-I223 PolarHBondContact O-N 2.93Å
220	A	77.3	Confident	71.3	Confident	82 Å²	82	51.8 Å²	51.8	68%	0.678	30%	0.304	S	S	*	.	H	α-helix	trans	-59	-26.8	174.5	0	0	0	0	0	112.1	A224	A220-A224 WeakPolarHBondContact O-CB 3.46Å; A220-A224 PolarHBondContact O-N 3.49Å
221	E	77.5	Confident	73.1	Confident	101 Å²	101	50.7 Å²	50.7	47%	0.472	30%	0.295	S	S	.	.	H	α-helix	trans	-71.2	-39.2	178.2	-172.1	167.2	-166.3	0	0	112.5	S142 S219 A224 S225	S142-E221 WeakPolarHBondContact CB-OE1 3.41Å; S219-E221 PolarHBondContact O-N 3.2Å; E221-A224 PolarHBondContact O-N 2.99Å; E221-S225 VanDerWaalsContact O-CB 3.3Å; E221-S225 WeakPolarHBondContact O-CB 3.34Å; E221-S225 PolarHBondContact O-N 3.11Å; E221-S225 PolarHBondContact O-OG 3.02Å
222	D	75.8	Confident	74.9	Confident	48 Å²	48	50.7 Å²	50.7	26%	0.257	29%	0.294	S	S	.	.	H	α-helix	trans	-64.1	-44.8	173.7	-67.5	-47.7	0	0	0	110.9	P170 S219 S225 V226	P170-D222 HydrophobicContact CB-CB 4.19Å; S219-D222 PolarHBondContact O-N 2.99Å; S219-D222 PolarHBondContact OG-N 2.79Å; S219-D222 PolarHBondContact OG-OD2 2.89Å; D222-S225 PolarHBondContact O-N 3.43Å; D222-V226 WeakPolarHBondContact O-CG2 3.37Å; D222-V226 PolarHBondContact O-N 3.25Å
223	I	79.9	Confident	76.6	Confident	65 Å²	65	49.7 Å²	49.7	33%	0.333	29%	0.289	S	S	.	.	H	α-helix	trans	-60.5	-48.1	176.5	-66.2	170.3	0	0	0	110.7	V211 A218 S219 S225 V226 A227	V211-I223 HydrophobicContact CB-CG1 4.05Å; V211-I223 HydrophobicContact CG1-CG1 3.92Å; V211-I223 HydrophobicContact CG2-CG1 4.13Å; V211-I223 HydrophobicContact CG2-CG2 4.08Å; A218-I223 HydrophobicContact CB-CD1 3.93Å; A218-I223 HydrophobicContact CB-CG1 4.17Å; S219-I223 PolarHBondContact O-N 2.93Å; I223-S225 VanDerWaalsContact C-N 3.28Å; I223-S225 PolarHBondContact O-N 2.79Å; I223-V226 PolarHBondContact O-N 3.15Å; I223-A227 WeakPolarHBondContact O-CB 3.45Å; I223-A227 PolarHBondContact O-N 3.16Å
224	A	85.3	Confident	78.7	Confident	22 Å²	22	47.6 Å²	47.6	18%	0.182	27%	0.268	C	S	.	.	H	α-helix	trans	-61.2	-38.8	177.9	0	0	0	0	0	111.7	A220 E221 A227 S228 L257	A220-A224 WeakPolarHBondContact O-CB 3.46Å; A220-A224 PolarHBondContact O-N 3.49Å; E221-A224 PolarHBondContact O-N 2.99Å; A224-A227 PolarHBondContact O-N 3.06Å; A224-S228 VanDerWaalsContact O-CB 3.27Å; A224-S228 WeakPolarHBondContact O-CB 3.47Å; A224-S228 PolarHBondContact O-N 2.81Å; A224-L257 HydrophobicContact CB-CD2 4.24Å
225	S	83.3	Confident	80.7	Confident	15 Å²	15	41.6 Å²	41.6	11%	0.105	24%	0.24	C	C	.	.	H	α-helix	trans	-65.6	-44.8	177.7	-65.1	0	0	0	0	112.6	E221 D222 I223 S228 F229	E221-S225 VanDerWaalsContact O-CB 3.3Å; E221-S225 WeakPolarHBondContact O-CB 3.34Å; E221-S225 PolarHBondContact O-N 3.11Å; E221-S225 PolarHBondContact O-OG 3.02Å; D222-S225 PolarHBondContact O-N 3.43Å; I223-S225 VanDerWaalsContact C-N 3.28Å; I223-S225 PolarHBondContact O-N 2.79Å; S225-S228 PolarHBondContact O-N 3.23Å; S225-F229 WeakPolarHBondContact O-CB 3.35Å; S225-F229 PolarHBondContact O-N 3.42Å
226	V	85.4	Confident	82.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.1	-44.7	175.4	178.4	0	0	0	0	110.8	Y137 P170 I172 L176 V211 D222 I223 F229 I230	Y137-V226 HydrophobicContact CE1-CB 4.38Å; Y137-V226 HydrophobicContact CE1-CG2 3.86Å; Y137-V226 HydrophobicContact CE2-CG2 4.48Å; P170-V226 HydrophobicContact CG-CG2 4.47Å; I172-V226 HydrophobicContact CD1-CG2 4.32Å; I172-V226 HydrophobicContact CG1-CG2 4.5Å; L176-V226 HydrophobicContact CD2-CG1 4.11Å; V211-V226 HydrophobicContact CG1-CB 4.4Å; V211-V226 HydrophobicContact CG1-CG2 4.22Å; D222-V226 WeakPolarHBondContact O-CG2 3.37Å; D222-V226 PolarHBondContact O-N 3.25Å; I223-V226 PolarHBondContact O-N 3.15Å; V226-F229 WeakPolarHBondContact O-CB 3.22Å; V226-F229 PolarHBondContact O-N 2.9Å; V226-I230 HydrophobicContact CG1-CD1 4.1Å; V226-I230 WeakPolarHBondContact O-CG1 3.15Å; V226-I230 PolarHBondContact O-N 3.49Å
227	A	90.9	Very high	85.1	Confident	12 Å²	12	28.3 Å²	28.3	10%	0.099	17%	0.172	C	C	.	.	H	α-helix	trans	-61.8	-45	176.7	0	0	0	0	0	111.2	L203 I223 A224 F229 I230 E231 L257	L203-A227 HydrophobicContact CD1-CB 4.46Å; I223-A227 WeakPolarHBondContact O-CB 3.45Å; I223-A227 PolarHBondContact O-N 3.16Å; A224-A227 PolarHBondContact O-N 3.06Å; A227-F229 VanDerWaalsContact C-N 3.3Å; A227-F229 PolarHBondContact O-N 3.36Å; A227-I230 PolarHBondContact O-N 2.64Å; A227-I230 VanDerWaalsContact O-N 3.12Å; A227-E231 WeakPolarHBondContact O-CB 3.46Å; A227-E231 WeakPolarHBondContact O-CG 3.5Å; A227-E231 PolarHBondContact O-N 2.83Å; A227-L257 HydrophobicContact CB-CD1 3.74Å; A227-L257 HydrophobicContact CB-CD2 4.37Å
228	S	92.8	Very high	87.1	Confident	2 Å²	2	21.9 Å²	21.9	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-58.2	-42.9	175.7	-174.2	0	0	0	0	111.5	A224 S225 I230 E231 T232 S254 N258 N264	A224-S228 VanDerWaalsContact O-CB 3.27Å; A224-S228 WeakPolarHBondContact O-CB 3.47Å; A224-S228 PolarHBondContact O-N 2.81Å; S225-S228 PolarHBondContact O-N 3.23Å; S228-I230 VanDerWaalsContact C-N 3.35Å; S228-I230 PolarHBondContact O-N 2.92Å; S228-E231 PolarHBondContact O-N 3.48Å; S228-T232 WeakPolarHBondContact O-CB 3.48Å; S228-T232 WeakPolarHBondContact O-CG2 3.27Å; S228-T232 PolarHBondContact O-N 3.48Å; S228-S254 PolarHBondContact OG-O 3.47Å; S228-N258 VanDerWaalsContact OG-CB 3.29Å; S228-N258 WeakPolarHBondContact OG-CB 3.26Å; S228-N264 PolarHBondContact OG-ND2 3.41Å
229	F	90.4	Very high	88.9	Confident	19 Å²	19	20.9 Å²	20.9	8%	0.083	13%	0.128	C	C	.	.	H	α-helix	trans	-58.4	-44.3	174.9	176.4	-96.5	0	0	0	112	Y137 L180 S225 V226 A227 T232 K233	Y137-F229 HydrophobicContact CD1-CB 4.44Å; Y137-F229 HydrophobicContact CE1-CB 4.11Å; Y137-F229 HydrophobicContact CE1-CD1 4.43Å; Y137-F229 HydrophobicContact CE1-CG 4.19Å; L180-F229 HydrophobicContact CD2-CE1 4.42Å; S225-F229 WeakPolarHBondContact O-CB 3.35Å; S225-F229 PolarHBondContact O-N 3.42Å; V226-F229 WeakPolarHBondContact O-CB 3.22Å; V226-F229 PolarHBondContact O-N 2.9Å; A227-F229 VanDerWaalsContact C-N 3.3Å; A227-F229 PolarHBondContact O-N 3.36Å; F229-T232 WeakPolarHBondContact O-CG2 3.21Å; F229-K233 HydrophobicContact CD1-CG 4.47Å; F229-K233 HydrophobicContact CE1-CG 4.12Å; F229-K233 HydrophobicContact CE2-CD 4.46Å; F229-K233 HydrophobicContact CE2-CG 4.37Å; F229-K233 HydrophobicContact CZ-CD 4.31Å; F229-K233 HydrophobicContact CZ-CG 4.08Å; F229-K233 VanDerWaalsContact O-CG 3.26Å; F229-K233 WeakPolarHBondContact O-CG 3.4Å; F229-K233 PolarHBondContact O-N 2.74Å; F229-K233 VanDerWaalsContact O-N 3.1Å
230	I	92.6	Very high	90.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-68.4	-46.4	179.6	-64.3	166.5	0	0	0	111.1	L176 L180 F199 A202 L203 C206 V226 A227 S228 T232 K233 L234	L176-I230 HydrophobicContact CD1-CD1 4.22Å; L180-I230 HydrophobicContact CD2-CD1 4.04Å; L180-I230 HydrophobicContact CD2-CG1 3.68Å; F199-I230 HydrophobicContact CB-CG2 4.21Å; F199-I230 HydrophobicContact CD1-CG2 4.45Å; F199-I230 WeakPolarHBondContact O-CG2 3.3Å; A202-I230 HydrophobicContact CB-CD1 4.02Å; L203-I230 HydrophobicContact CB-CG2 3.77Å; L203-I230 HydrophobicContact CD1-CB 4.33Å; L203-I230 HydrophobicContact CD1-CG2 4.2Å; L203-I230 HydrophobicContact CG-CG2 4.49Å; C206-I230 WeakPolarHBondContact SG-CD1 3.39Å; V226-I230 HydrophobicContact CG1-CD1 4.1Å; V226-I230 WeakPolarHBondContact O-CG1 3.15Å; V226-I230 PolarHBondContact O-N 3.49Å; A227-I230 PolarHBondContact O-N 2.64Å; A227-I230 VanDerWaalsContact O-N 3.12Å; S228-I230 VanDerWaalsContact C-N 3.35Å; S228-I230 PolarHBondContact O-N 2.92Å; I230-T232 VanDerWaalsContact C-N 3.29Å; I230-T232 PolarHBondContact O-N 3.26Å; I230-K233 PolarHBondContact O-N 3.41Å; I230-K233 VanDerWaalsContact O-N 3.16Å; I230-L234 HydrophobicContact CG2-CD1 4.39Å; I230-L234 WeakPolarHBondContact O-CG 3.48Å; I230-L234 PolarHBondContact O-N 3.43Å
231	E	95.9	Very high	91.1	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-55.3	-45.7	176.5	-67.6	-75.8	-175.5	0	0	111.1	L203 A227 S228 K233 L234 V235 H250 R253 L257	L203-E231 HydrophobicContact CD1-CG 4.27Å; L203-E231 WeakPolarHBondContact CD2-OE1 3.41Å; A227-E231 WeakPolarHBondContact O-CB 3.46Å; A227-E231 WeakPolarHBondContact O-CG 3.5Å; A227-E231 PolarHBondContact O-N 2.83Å; S228-E231 PolarHBondContact O-N 3.48Å; E231-K233 VanDerWaalsContact C-N 3.35Å; E231-K233 PolarHBondContact O-N 3.29Å; E231-L234 WeakPolarHBondContact O-CB 3.39Å; E231-L234 PolarHBondContact O-N 3.09Å; E231-V235 WeakPolarHBondContact O-CG2 3.11Å; E231-V235 PolarHBondContact O-N 2.98Å; E231-H250 IonicContact OE2-CE1 2.6Å; E231-H250 IonicContact OE2-CG 2.65Å; E231-H250 IonicContact OE2-ND1 3.75Å; E231-H250 PolarHBondContact OE2-ND1 3.32Å; E231-R253 HydrophobicContact CG-CB 4.29Å; E231-R253 IonicContact OE1-CZ 2.65Å; E231-R253 IonicContact OE1-NE 2.81Å; E231-R253 PolarHBondContact OE1-NE 2.97Å; E231-R253 IonicContact OE1-NH2 2.88Å; E231-R253 PolarHBondContact OE1-NH2 2.9Å; E231-R253 IonicContact OE2-NE 2.61Å; E231-L257 HydrophobicContact CG-CD1 3.92Å
232	T	94.2	Very high	92	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-70.2	-29.7	-179	-155.9	0	0	0	0	112.6	S228 F229 I230 V235 T236 N264 R267	S228-T232 WeakPolarHBondContact O-CB 3.48Å; S228-T232 WeakPolarHBondContact O-CG2 3.27Å; S228-T232 PolarHBondContact O-N 3.48Å; F229-T232 WeakPolarHBondContact O-CG2 3.21Å; I230-T232 VanDerWaalsContact C-N 3.29Å; I230-T232 PolarHBondContact O-N 3.26Å; T232-V235 WeakPolarHBondContact O-CB 3.46Å; T232-V235 PolarHBondContact O-N 3.48Å; T232-T236 PolarHBondContact O-N 2.88Å; T232-N264 VanDerWaalsContact CB-OD1 3.28Å; T232-N264 WeakPolarHBondContact CB-OD1 3.5Å; T232-N264 PolarHBondContact OG1-OD1 3.43Å; T232-R267 WeakPolarHBondContact OG1-CD 3.49Å; T232-R267 PolarHBondContact OG1-NH1 3.1Å
233	K	94.5	Very high	93	Very high	5 Å²	5	29.2 Å²	29.2	2%	0.022	13%	0.132	C	C	.	.	H	α-helix	trans	-73.2	-31.9	170.6	-64.7	-66.5	175.2	-173.8	0	112.6	E132 F199 F229 I230 E231 V235 T236 C237	E132-K233 WeakPolarHBondContact OE2-CE 3.32Å; E132-K233 IonicContact OE2-NZ 3.2Å; E132-K233 PolarHBondContact OE2-NZ 3.09Å; F199-K233 HydrophobicContact CD1-CB 4.05Å; F199-K233 HydrophobicContact CD2-CB 3.99Å; F199-K233 HydrophobicContact CE1-CB 3.79Å; F199-K233 HydrophobicContact CE1-CG 4.02Å; F199-K233 HydrophobicContact CE2-CB 3.73Å; F199-K233 HydrophobicContact CE2-CG 4.48Å; F199-K233 HydrophobicContact CG-CB 4.17Å; F199-K233 HydrophobicContact CZ-CB 3.63Å; F199-K233 HydrophobicContact CZ-CD 4.42Å; F199-K233 HydrophobicContact CZ-CG 3.93Å; F229-K233 HydrophobicContact CD1-CG 4.47Å; F229-K233 HydrophobicContact CE1-CG 4.12Å; F229-K233 HydrophobicContact CE2-CD 4.46Å; F229-K233 HydrophobicContact CE2-CG 4.37Å; F229-K233 HydrophobicContact CZ-CD 4.31Å; F229-K233 HydrophobicContact CZ-CG 4.08Å; F229-K233 VanDerWaalsContact O-CG 3.26Å; F229-K233 WeakPolarHBondContact O-CG 3.4Å; F229-K233 PolarHBondContact O-N 2.74Å; F229-K233 VanDerWaalsContact O-N 3.1Å; I230-K233 PolarHBondContact O-N 3.41Å; I230-K233 VanDerWaalsContact O-N 3.16Å; E231-K233 VanDerWaalsContact C-N 3.35Å; E231-K233 PolarHBondContact O-N 3.29Å; K233-V235 VanDerWaalsContact C-N 3.32Å; K233-T236 PolarHBondContact O-N 3.44Å; K233-T236 PolarHBondContact O-OG1 3.21Å; K233-C237 PolarHBondContact O-N 3.35Å; K233-C237 PolarHBondContact O-SG 2.85Å
234	L	96.5	Very high	93.9	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.6	-41.5	170.3	-73	169.4	0	0	0	111	A196 F199 R200 L203 I230 E231 T236 C237 Y238 H250	A196-L234 HydrophobicContact CB-CD2 4.26Å; A196-L234 WeakPolarHBondContact O-CD2 3.14Å; F199-L234 HydrophobicContact CB-CD2 3.54Å; F199-L234 HydrophobicContact CB-CG 3.84Å; R200-L234 HydrophobicContact CG-CD1 4.28Å; R200-L234 HydrophobicContact CG-CD2 3.91Å; L203-L234 HydrophobicContact CD2-CD1 4.16Å; I230-L234 HydrophobicContact CG2-CD1 4.39Å; I230-L234 WeakPolarHBondContact O-CG 3.48Å; I230-L234 PolarHBondContact O-N 3.43Å; E231-L234 WeakPolarHBondContact O-CB 3.39Å; E231-L234 PolarHBondContact O-N 3.09Å; L234-T236 PolarHBondContact O-N 3.45Å; L234-C237 PolarHBondContact O-N 2.98Å; L234-Y238 HydrophobicContact CB-CE2 4.06Å; L234-Y238 HydrophobicContact CD2-CE2 4.3Å; L234-Y238 WeakPolarHBondContact O-CD2 3.45Å; L234-Y238 PolarHBondContact O-N 3.26Å; L234-H250 HydrophobicContact CB-CB 4.39Å
235	V	97.4	Very high	94.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-55.8	-50.7	174.2	175.1	0	0	0	0	111.1	E231 T232 K233 C237 Y238 L239 A247 H250 A251 R267 V271	E231-V235 WeakPolarHBondContact O-CG2 3.11Å; E231-V235 PolarHBondContact O-N 2.98Å; T232-V235 WeakPolarHBondContact O-CB 3.46Å; T232-V235 PolarHBondContact O-N 3.48Å; K233-V235 VanDerWaalsContact C-N 3.32Å; V235-C237 VanDerWaalsContact C-N 3.34Å; V235-C237 PolarHBondContact O-N 3.22Å; V235-Y238 PolarHBondContact O-N 3.02Å; V235-L239 HydrophobicContact CG1-CD1 3.79Å; V235-L239 HydrophobicContact CG1-CG 4.28Å; V235-L239 WeakPolarHBondContact O-CB 3.3Å; V235-L239 WeakPolarHBondContact O-CG 3.31Å; V235-L239 PolarHBondContact O-N 3.28Å; V235-A247 HydrophobicContact CG1-CB 4.3Å; V235-H250 HydrophobicContact CG2-CB 3.7Å; V235-A251 HydrophobicContact CG2-CB 3.86Å; V235-A251 VanDerWaalsContact CG2-N 3.31Å; V235-R267 HydrophobicContact CG1-CB 3.97Å; V235-V271 HydrophobicContact CG1-CG2 3.77Å
236	T	95.9	Very high	94.9	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.012	16%	0.156	C	C	.	.	H	α-helix	trans	-64.7	-37.7	-179.1	60.3	0	0	0	0	112.4	V128 T232 K233 L234 R240 R267	V128-T236 WeakPolarHBondContact O-CG2 3.31Å; T232-T236 PolarHBondContact O-N 2.88Å; K233-T236 PolarHBondContact O-N 3.44Å; K233-T236 PolarHBondContact O-OG1 3.21Å; L234-T236 PolarHBondContact O-N 3.45Å; T236-R240 WeakPolarHBondContact O-CB 3.25Å; T236-R240 VanDerWaalsContact O-CG 3.25Å; T236-R240 WeakPolarHBondContact O-CG 3.44Å; T236-R240 PolarHBondContact O-N 3.01Å; T236-R267 HydrophobicContact CG2-CG 4.42Å
237	C	96.7	Very high	95.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.1	-49.8	173.8	-66.8	0	0	0	0	111.7	A196 K233 L234 V235 R240 M241	A196-C237 HydrophobicContact CB-CB 3.92Å; K233-C237 PolarHBondContact O-N 3.35Å; K233-C237 PolarHBondContact O-SG 2.85Å; L234-C237 PolarHBondContact O-N 2.98Å; V235-C237 VanDerWaalsContact C-N 3.34Å; V235-C237 PolarHBondContact O-N 3.22Å; C237-R240 WeakPolarHBondContact O-CB 3.43Å; C237-R240 PolarHBondContact O-N 3.42Å; C237-M241 VanDerWaalsContact O-CG 3.24Å; C237-M241 WeakPolarHBondContact O-CG 3.41Å; C237-M241 PolarHBondContact O-N 2.99Å
238	Y	98.1	Very high	95.8	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-67.8	-37.5	-178.9	-69.2	-48.9	0	0	0	113.3	A196 R200 L234 V235 M241 R242 K243 L246 A247 H250	A196-Y238 HydrophobicContact CB-CE1 4.09Å; R200-Y238 PolarHBondContact NE-OH 3.35Å; R200-Y238 PolarHBondContact NH2-OH 2.89Å; L234-Y238 HydrophobicContact CB-CE2 4.06Å; L234-Y238 HydrophobicContact CD2-CE2 4.3Å; L234-Y238 WeakPolarHBondContact O-CD2 3.45Å; L234-Y238 PolarHBondContact O-N 3.26Å; V235-Y238 PolarHBondContact O-N 3.02Å; Y238-M241 HydrophobicContact CD1-SD 4.24Å; Y238-M241 CarbonylContact O-C 3.58Å; Y238-M241 WeakPolarHBondContact O-CA 3.28Å; Y238-M241 PolarHBondContact O-N 2.87Å; Y238-M241 VanDerWaalsContact O-N 3.14Å; Y238-R242 PolarHBondContact O-N 3.05Å; Y238-R242 VanDerWaalsContact O-N 3.12Å; Y238-K243 PolarHBondContact O-N 3.02Å; Y238-L246 HydrophobicContact CD1-CB 3.85Å; Y238-L246 HydrophobicContact CD1-CD1 3.96Å; Y238-L246 HydrophobicContact CD2-CB 4.04Å; Y238-L246 HydrophobicContact CE1-CB 4.21Å; Y238-L246 HydrophobicContact CE1-CD1 3.96Å; Y238-L246 HydrophobicContact CE2-CB 4.38Å; Y238-L246 HydrophobicContact CG-CB 3.82Å; Y238-A247 HydrophobicContact CD2-CB 4.48Å; Y238-H250 AromaticContact CD2-CD2 3.86Å; Y238-H250 AromaticContact CE2-CD2 3.41Å; Y238-H250 VanDerWaalsContact CE2-CD2 3.41Å; Y238-H250 WeakPolarHBondContact CE2-CD2 3.49Å; Y238-H250 AromaticContact CE2-NE2 3.58Å
239	L	96.9	Very high	95.9	Very high	9 Å²	9	36.3 Å²	36.3	5%	0.047	17%	0.165	C	C	.	.	H	α-helix	trans	-61.2	-44.2	172.7	-74.8	175.8	0	0	0	111.3	V128 Y129 V235 M241 R242 P244 A247 T270 V271	V128-L239 HydrophobicContact CG1-CD1 4.3Å; Y129-L239 HydrophobicContact CE1-CB 3.72Å; Y129-L239 HydrophobicContact CE1-CD1 4.39Å; V235-L239 HydrophobicContact CG1-CD1 3.79Å; V235-L239 HydrophobicContact CG1-CG 4.28Å; V235-L239 WeakPolarHBondContact O-CB 3.3Å; V235-L239 WeakPolarHBondContact O-CG 3.31Å; V235-L239 PolarHBondContact O-N 3.28Å; L239-M241 PolarHBondContact O-N 3.15Å; L239-R242 PolarHBondContact O-N 3.3Å; L239-P244 HydrophobicContact CD2-CB 4.45Å; L239-A247 HydrophobicContact CG-CB 4.41Å; L239-T270 HydrophobicContact CD1-CG2 3.83Å; L239-T270 HydrophobicContact CD2-CG2 4.29Å; L239-V271 HydrophobicContact CD1-CG2 4.12Å; L239-V271 HydrophobicContact CD2-CG2 3.92Å; L239-V271 HydrophobicContact CG-CG2 4.17Å
240	R	96	Very high	96.3	Very high	77 Å²	77	36.8 Å²	36.8	29%	0.291	17%	0.167	S	C	.	.	H	α-helix	trans	-61.9	-29.3	173.6	-74.1	-69.1	-168.4	-171	-0.7	113.2	M125 Y129 Y187 Y192 T236 C237 R242	M125-R240 PolarHBondContact SD-NH1 3Å; M125-R240 PolarHBondContact SD-NH2 3.31Å; Y129-R240 HydrophobicContact CD1-CG 3.94Å; Y129-R240 HydrophobicContact CE1-CG 3.99Å; Y187-R240 HydrophobicContact CE2-CG 4.34Å; Y192-R240 HydrophobicContact CD1-CB 3.86Å; Y192-R240 HydrophobicContact CD1-CG 4.13Å; Y192-R240 HydrophobicContact CD2-CB 3.67Å; Y192-R240 HydrophobicContact CE1-CB 3.97Å; Y192-R240 HydrophobicContact CE1-CG 3.83Å; Y192-R240 HydrophobicContact CE2-CB 3.77Å; Y192-R240 HydrophobicContact CE2-CG 4.22Å; Y192-R240 HydrophobicContact CG-CB 3.71Å; Y192-R240 HydrophobicContact CG-CG 4.47Å; T236-R240 WeakPolarHBondContact O-CB 3.25Å; T236-R240 VanDerWaalsContact O-CG 3.25Å; T236-R240 WeakPolarHBondContact O-CG 3.44Å; T236-R240 PolarHBondContact O-N 3.01Å; C237-R240 WeakPolarHBondContact O-CB 3.43Å; C237-R240 PolarHBondContact O-N 3.42Å; R240-R242 VanDerWaalsContact C-N 3.29Å
241	M	96.9	Very high	96.5	Very high	54 Å²	54	36.8 Å²	36.8	27%	0.266	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	0.9	173.8	-65.4	169.2	65.9	0	0	113.8	A193 C237 Y238 L239 K243	A193-M241 HydrophobicContact CB-CE 3.87Å; A193-M241 HydrophobicContact CB-SD 4.26Å; C237-M241 VanDerWaalsContact O-CG 3.24Å; C237-M241 WeakPolarHBondContact O-CG 3.41Å; C237-M241 PolarHBondContact O-N 2.99Å; Y238-M241 HydrophobicContact CD1-SD 4.24Å; Y238-M241 CarbonylContact O-C 3.58Å; Y238-M241 WeakPolarHBondContact O-CA 3.28Å; Y238-M241 PolarHBondContact O-N 2.87Å; Y238-M241 VanDerWaalsContact O-N 3.14Å; L239-M241 PolarHBondContact O-N 3.15Å; M241-K243 VanDerWaalsContact C-N 3.29Å; M241-K243 HydrophobicContact CB-CG 4.31Å; M241-K243 HydrophobicContact CE-CD 4.31Å; M241-K243 PolarHBondContact O-N 3.24Å
242	R	96.6	Very high	96.6	Very high	225 Å²	225	36.7 Å²	36.7	85%	0.849	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	38.7	-173.2	-54.5	-177.3	178.6	-177.5	-1.1	113.3	Y238 L239 R240 P244	Y238-R242 PolarHBondContact O-N 3.05Å; Y238-R242 VanDerWaalsContact O-N 3.12Å; L239-R242 PolarHBondContact O-N 3.3Å; R240-R242 VanDerWaalsContact C-N 3.29Å; R242-P244 WeakPolarHBondContact O-CD 3.46Å
243	K	97.6	Very high	96.7	Very high	100 Å²	100	41.8 Å²	41.8	44%	0.435	19%	0.186	S	C	.	.			trans	-118.3	64.6	177.4	-63.7	-170	179.6	-174.5	0	111.3	Y238 M241 D245 L246 A247	Y238-K243 PolarHBondContact O-N 3.02Å; M241-K243 VanDerWaalsContact C-N 3.29Å; M241-K243 HydrophobicContact CB-CG 4.31Å; M241-K243 HydrophobicContact CE-CD 4.31Å; M241-K243 PolarHBondContact O-N 3.24Å; K243-D245 PolarHBondContact O-N 3.5Å; K243-L246 HydrophobicContact CB-CB 4.35Å; K243-L246 HydrophobicContact CB-CD1 4.08Å; K243-L246 HydrophobicContact CB-CG 4.24Å; K243-L246 HydrophobicContact CD-CD1 3.66Å; K243-L246 HydrophobicContact CG-CD1 4.5Å; K243-L246 PolarHBondContact O-N 3.2Å; K243-L246 VanDerWaalsContact O-N 3.15Å; K243-A247 PolarHBondContact O-N 2.75Å
244	P	97.1	Very high	96.8	Very high	18 Å²	18	41.6 Å²	41.6	12%	0.117	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-28.8	-176.2	28.8	-37	0	0	0	113.3	L239 R242 L246 A247 L248 V271 C274 L275	L239-P244 HydrophobicContact CD2-CB 4.45Å; R242-P244 WeakPolarHBondContact O-CD 3.46Å; P244-L246 VanDerWaalsContact C-N 3.3Å; P244-L246 PolarHBondContact O-N 3.46Å; P244-A247 WeakPolarHBondContact O-CB 3.38Å; P244-A247 PolarHBondContact O-N 2.66Å; P244-A247 VanDerWaalsContact O-N 3.07Å; P244-L248 PolarHBondContact O-N 3.29Å; P244-V271 HydrophobicContact CB-CG1 4.29Å; P244-V271 WeakPolarHBondContact O-CG1 3.46Å; P244-C274 HydrophobicContact CB-CB 3.61Å; P244-C274 HydrophobicContact CG-CB 3.91Å; P244-L275 HydrophobicContact CB-CD2 3.87Å; P244-L275 HydrophobicContact CB-CG 3.98Å; P244-L275 HydrophobicContact CG-CD2 3.72Å; P244-L275 HydrophobicContact CG-CG 4.3Å
245	D	95.8	Very high	96.8	Very high	114 Å²	114	41.6 Å²	41.6	61%	0.61	19%	0.185	S	C	*	.	H	α-helix	trans	-60.8	-37.9	175.4	-56.3	-68.8	0	0	0	112.9	K243 A247 L275	K243-D245 PolarHBondContact O-N 3.5Å; D245-A247 VanDerWaalsContact C-N 3.35Å; D245-L275 WeakPolarHBondContact OD1-CD2 3.39Å
246	L	95.5	Very high	96.7	Very high	78 Å²	78	43.8 Å²	43.8	41%	0.408	20%	0.199	S	C	.	.	H	α-helix	trans	-73.4	-31.8	175.7	-63.1	-176.5	0	0	0	111.3	Y238 K243 P244 H250	Y238-L246 HydrophobicContact CD1-CB 3.85Å; Y238-L246 HydrophobicContact CD1-CD1 3.96Å; Y238-L246 HydrophobicContact CD2-CB 4.04Å; Y238-L246 HydrophobicContact CE1-CB 4.21Å; Y238-L246 HydrophobicContact CE1-CD1 3.96Å; Y238-L246 HydrophobicContact CE2-CB 4.38Å; Y238-L246 HydrophobicContact CG-CB 3.82Å; K243-L246 HydrophobicContact CB-CB 4.35Å; K243-L246 HydrophobicContact CB-CD1 4.08Å; K243-L246 HydrophobicContact CB-CG 4.24Å; K243-L246 HydrophobicContact CD-CD1 3.66Å; K243-L246 HydrophobicContact CG-CD1 4.5Å; K243-L246 PolarHBondContact O-N 3.2Å; K243-L246 VanDerWaalsContact O-N 3.15Å; P244-L246 VanDerWaalsContact C-N 3.3Å; P244-L246 PolarHBondContact O-N 3.46Å; L246-H250 PolarHBondContact O-CD2 3.49Å
247	A	97.6	Very high	96.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-71.7	-28.6	-179.9	0	0	0	0	0	113.1	V235 Y238 L239 K243 P244 D245 N249 H250 A251 V271	V235-A247 HydrophobicContact CG1-CB 4.3Å; Y238-A247 HydrophobicContact CD2-CB 4.48Å; L239-A247 HydrophobicContact CG-CB 4.41Å; K243-A247 PolarHBondContact O-N 2.75Å; P244-A247 WeakPolarHBondContact O-CB 3.38Å; P244-A247 PolarHBondContact O-N 2.66Å; P244-A247 VanDerWaalsContact O-N 3.07Å; D245-A247 VanDerWaalsContact C-N 3.35Å; A247-N249 PolarHBondContact O-N 3.45Å; A247-H250 PolarHBondContact O-N 3.49Å; A247-A251 PolarHBondContact O-N 2.84Å; A247-V271 HydrophobicContact CB-CG1 4.3Å; A247-V271 HydrophobicContact CB-CG2 3.67Å
248	L	97.2	Very high	96.3	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-51.3	-167.9	-176.9	63.5	0	0	0	114.1	P244 H250 A251 H252 V271 F272 L275 Q476	P244-L248 PolarHBondContact O-N 3.29Å; L248-H250 VanDerWaalsContact C-N 3.31Å; L248-H250 PolarHBondContact O-N 2.79Å; L248-A251 WeakPolarHBondContact O-CB 3.48Å; L248-A251 PolarHBondContact O-N 2.98Å; L248-A251 VanDerWaalsContact O-N 3.17Å; L248-H252 VanDerWaalsContact CD1-NE2 3.33Å; L248-H252 WeakPolarHBondContact CD1-NE2 3.49Å; L248-H252 PolarHBondContact O-CD2 3.39Å; L248-H252 PolarHBondContact O-N 3.49Å; L248-H252 VanDerWaalsContact O-N 3.07Å; L248-V271 HydrophobicContact CB-CG1 3.93Å; L248-V271 HydrophobicContact CD1-CG1 3.83Å; L248-V271 HydrophobicContact CG-CG1 4.49Å; L248-F272 HydrophobicContact CD1-CD1 4.1Å; L248-F272 HydrophobicContact CD1-CE1 3.74Å; L248-L275 HydrophobicContact CB-CD1 4.42Å; L248-L275 HydrophobicContact CD1-CD1 4.14Å; L248-L275 HydrophobicContact CD2-CD1 3.89Å; L248-L275 HydrophobicContact CG-CD1 4.39Å; L248-Q476 HydrophobicContact CD2-CG 3.6Å; L248-Q476 HydrophobicContact CG-CG 4.46Å
249	N	95.6	Very high	96.1	Very high	55 Å²	55	48.5 Å²	48.5	29%	0.294	22%	0.224	S	C	.	.	H	α-helix	trans	-65.9	-35.7	179.2	-74.6	-25.2	0	0	0	112.1	A247 A251 H252 R253 N479	A247-N249 PolarHBondContact O-N 3.45Å; N249-A251 VanDerWaalsContact C-N 3.32Å; N249-H252 PolarHBondContact O-N 3.2Å; N249-R253 WeakPolarHBondContact O-CB 3.43Å; N249-R253 VanDerWaalsContact O-CG 3.29Å; N249-R253 WeakPolarHBondContact O-CG 3.28Å; N249-R253 PolarHBondContact O-N 2.88Å; N249-N479 PolarHBondContact OD1-ND2 3.43Å; N249-N479 VanDerWaalsContact OD1-ND2 3.09Å
250	H	97.3	Very high	95.8	Very high	28 Å²	28	49.2 Å²	49.2	13%	0.13	23%	0.231	C	C	.	.	H	α-helix	trans	-64.7	-37.6	174.3	-67	-62.4	0	0	0	111.4	E231 L234 V235 Y238 L246 A247 L248 R253 S254	E231-H250 IonicContact OE2-CE1 2.6Å; E231-H250 IonicContact OE2-CG 2.65Å; E231-H250 IonicContact OE2-ND1 3.75Å; E231-H250 PolarHBondContact OE2-ND1 3.32Å; L234-H250 HydrophobicContact CB-CB 4.39Å; V235-H250 HydrophobicContact CG2-CB 3.7Å; Y238-H250 AromaticContact CD2-CD2 3.86Å; Y238-H250 AromaticContact CE2-CD2 3.41Å; Y238-H250 VanDerWaalsContact CE2-CD2 3.41Å; Y238-H250 WeakPolarHBondContact CE2-CD2 3.49Å; Y238-H250 AromaticContact CE2-NE2 3.58Å; L246-H250 PolarHBondContact O-CD2 3.49Å; A247-H250 PolarHBondContact O-N 3.49Å; L248-H250 VanDerWaalsContact C-N 3.31Å; L248-H250 PolarHBondContact O-N 2.79Å; H250-R253 PolarHBondContact O-N 3.24Å; H250-S254 WeakPolarHBondContact O-CB 3.4Å; H250-S254 PolarHBondContact O-N 3.06Å
251	A	98.1	Very high	95.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-45.4	175.4	0	0	0	0	0	111.5	V235 A247 L248 N249 S254 I255 Q268 V271	V235-A251 HydrophobicContact CG2-CB 3.86Å; V235-A251 VanDerWaalsContact CG2-N 3.31Å; A247-A251 PolarHBondContact O-N 2.84Å; L248-A251 WeakPolarHBondContact O-CB 3.48Å; L248-A251 PolarHBondContact O-N 2.98Å; L248-A251 VanDerWaalsContact O-N 3.17Å; N249-A251 VanDerWaalsContact C-N 3.32Å; A251-S254 PolarHBondContact O-N 3.37Å; A251-S254 PolarHBondContact O-OG 3.05Å; A251-I255 PolarHBondContact O-N 3.27Å; A251-Q268 HydrophobicContact CB-CB 4.06Å; A251-Q268 HydrophobicContact CB-CG 4.26Å; A251-V271 HydrophobicContact CB-CG2 4.25Å
252	H	97.7	Very high	95.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-49.4	174.1	-64.8	-49.3	0	0	0	112.3	L248 N249 S254 I255 V256 Q268 F272 N479 Q480 A483	L248-H252 VanDerWaalsContact CD1-NE2 3.33Å; L248-H252 WeakPolarHBondContact CD1-NE2 3.49Å; L248-H252 PolarHBondContact O-CD2 3.39Å; L248-H252 PolarHBondContact O-N 3.49Å; L248-H252 VanDerWaalsContact O-N 3.07Å; N249-H252 PolarHBondContact O-N 3.2Å; H252-S254 VanDerWaalsContact C-N 3.32Å; H252-S254 PolarHBondContact O-N 3.06Å; H252-I255 PolarHBondContact O-N 2.98Å; H252-I255 VanDerWaalsContact O-N 3.15Å; H252-V256 WeakPolarHBondContact O-CG2 3.46Å; H252-V256 PolarHBondContact O-N 3.16Å; H252-Q268 PolarHBondContact CE1-NE2 3.06Å; H252-Q268 PolarHBondContact ND1-NE2 3.16Å; H252-F272 AromaticContact CE1-CZ 3.77Å; H252-N479 HydrophobicContact CB-CB 3.94Å; H252-Q480 VanDerWaalsContact CE1-CB 3.46Å; H252-Q480 WeakPolarHBondContact CE1-CB 3.45Å; H252-A483 HydrophobicContact CB-CB 4.19Å
253	R	96.1	Very high	95.4	Very high	108 Å²	108	35.2 Å²	35.2	41%	0.408	18%	0.176	S	C	.	.	H	α-helix	trans	-60.5	-40.3	179.5	-72.9	165.5	59.5	133.3	0.7	112.1	E231 N249 H250 I255 V256 L257	E231-R253 HydrophobicContact CG-CB 4.29Å; E231-R253 IonicContact OE1-CZ 2.65Å; E231-R253 IonicContact OE1-NE 2.81Å; E231-R253 PolarHBondContact OE1-NE 2.97Å; E231-R253 IonicContact OE1-NH2 2.88Å; E231-R253 PolarHBondContact OE1-NH2 2.9Å; E231-R253 IonicContact OE2-NE 2.61Å; N249-R253 WeakPolarHBondContact O-CB 3.43Å; N249-R253 VanDerWaalsContact O-CG 3.29Å; N249-R253 WeakPolarHBondContact O-CG 3.28Å; N249-R253 PolarHBondContact O-N 2.88Å; H250-R253 PolarHBondContact O-N 3.24Å; R253-I255 VanDerWaalsContact C-N 3.27Å; R253-I255 PolarHBondContact O-N 3.4Å; R253-V256 PolarHBondContact O-N 3.24Å; R253-L257 WeakPolarHBondContact O-CB 3.35Å; R253-L257 WeakPolarHBondContact O-CD1 3.38Å; R253-L257 VanDerWaalsContact O-CG 3.26Å; R253-L257 WeakPolarHBondContact O-CG 3.28Å; R253-L257 PolarHBondContact O-N 3.07Å
254	S	96.3	Very high	95.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.3	-37.9	177	73.4	0	0	0	0	112.8	S228 H250 A251 H252 N258 N264	S228-S254 PolarHBondContact OG-O 3.47Å; H250-S254 WeakPolarHBondContact O-CB 3.4Å; H250-S254 PolarHBondContact O-N 3.06Å; A251-S254 PolarHBondContact O-N 3.37Å; A251-S254 PolarHBondContact O-OG 3.05Å; H252-S254 VanDerWaalsContact C-N 3.32Å; H252-S254 PolarHBondContact O-N 3.06Å; S254-N258 PolarHBondContact O-N 2.61Å; S254-N264 PolarHBondContact O-ND2 3.01Å; S254-N264 VanDerWaalsContact O-ND2 3.11Å
255	I	96.8	Very high	95.3	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-74.6	-41	177	-68.2	166.5	0	0	0	111.1	A251 H252 R253 L257 N258 P259 N264 Q268 A483 T487	A251-I255 PolarHBondContact O-N 3.27Å; H252-I255 PolarHBondContact O-N 2.98Å; H252-I255 VanDerWaalsContact O-N 3.15Å; R253-I255 VanDerWaalsContact C-N 3.27Å; R253-I255 PolarHBondContact O-N 3.4Å; I255-L257 PolarHBondContact O-N 2.96Å; I255-N258 CarbonylContact O-C 3.59Å; I255-N258 VanDerWaalsContact O-C 3.25Å; I255-N258 PolarHBondContact O-N 3.29Å; I255-P259 HydrophobicContact CG2-CB 4.36Å; I255-P259 WeakPolarHBondContact O-CA 3.24Å; I255-P259 WeakPolarHBondContact O-CB 3.43Å; I255-P259 WeakPolarHBondContact O-CD 3.34Å; I255-N264 HydrophobicContact CG1-CB 3.78Å; I255-Q268 HydrophobicContact CD1-CB 3.87Å; I255-Q268 HydrophobicContact CD1-CG 4.17Å; I255-Q268 VanDerWaalsContact CD1-NE2 3.34Å; I255-A483 HydrophobicContact CB-CB 4.1Å; I255-A483 HydrophobicContact CG2-CB 3.96Å; I255-T487 WeakPolarHBondContact CG2-OG1 3.45Å
256	V	95	Very high	95.4	Very high	46 Å²	46	24.2 Å²	24.2	28%	0.279	12%	0.121	S	C	.	.	H	α-helix	trans	-57.6	-39.7	174.8	173.9	0	0	0	0	110.9	H252 R253 M482 A483	H252-V256 WeakPolarHBondContact O-CG2 3.46Å; H252-V256 PolarHBondContact O-N 3.16Å; R253-V256 PolarHBondContact O-N 3.24Å; V256-M482 HydrophobicContact CG1-CE 4.2Å; V256-M482 HydrophobicContact CG2-CB 3.82Å; V256-A483 HydrophobicContact CG2-CB 4.22Å
257	L	93	Very high	95.5	Very high	57 Å²	57	20.5 Å²	20.5	30%	0.298	10%	0.102	S	C	.	.	H	α-helix	trans	-79.6	-32.6	-179	-67.5	165.3	0	0	0	113.7	A224 A227 E231 R253 I255	A224-L257 HydrophobicContact CB-CD2 4.24Å; A227-L257 HydrophobicContact CB-CD1 3.74Å; A227-L257 HydrophobicContact CB-CD2 4.37Å; E231-L257 HydrophobicContact CG-CD1 3.92Å; R253-L257 WeakPolarHBondContact O-CB 3.35Å; R253-L257 WeakPolarHBondContact O-CD1 3.38Å; R253-L257 VanDerWaalsContact O-CG 3.26Å; R253-L257 WeakPolarHBondContact O-CG 3.28Å; R253-L257 PolarHBondContact O-N 3.07Å; I255-L257 PolarHBondContact O-N 2.96Å
258	N	92.4	Very high	95.5	Very high	35 Å²	35	21 Å²	21	19%	0.187	10%	0.104	C	C	.	.			trans	-146.9	84.8	176.1	-171.9	-16.7	0	0	0	110.3	S228 S254 I255 A260 Y261 N264	S228-N258 VanDerWaalsContact OG-CB 3.29Å; S228-N258 WeakPolarHBondContact OG-CB 3.26Å; S254-N258 PolarHBondContact O-N 2.61Å; I255-N258 CarbonylContact O-C 3.59Å; I255-N258 VanDerWaalsContact O-C 3.25Å; I255-N258 PolarHBondContact O-N 3.29Å; N258-A260 VanDerWaalsContact C-N 3.34Å; N258-A260 PolarHBondContact OD1-N 2.91Å; N258-Y261 PolarHBondContact OD1-N 2.77Å; N258-N264 PolarHBondContact O-ND2 3.03Å; N258-N264 VanDerWaalsContact O-ND2 3.14Å
259	P	92.7	Very high	95.6	Very high	13 Å²	13	21 Å²	21	8%	0.084	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-19.6	-176.5	27.1	-34.5	0	0	0	113.5	I255 Y261 H265 A486 Y490	I255-P259 HydrophobicContact CG2-CB 4.36Å; I255-P259 WeakPolarHBondContact O-CA 3.24Å; I255-P259 WeakPolarHBondContact O-CB 3.43Å; I255-P259 WeakPolarHBondContact O-CD 3.34Å; P259-Y261 VanDerWaalsContact C-N 3.33Å; P259-H265 PolarHBondContact O-NE2 2.87Å; P259-A486 HydrophobicContact CB-CB 4.37Å; P259-A486 WeakPolarHBondContact CB-O 3.18Å; P259-Y490 HydrophobicContact CB-CD2 4.12Å; P259-Y490 HydrophobicContact CB-CE2 3.86Å; P259-Y490 HydrophobicContact CG-CD2 4.06Å; P259-Y490 HydrophobicContact CG-CE2 3.29Å
260	A	91.6	Very high	95.7	Very high	23 Å²	23	18.4 Å²	18.4	19%	0.19	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-17.7	178.2	0	0	0	0	0	112.8	N258 F262 Y490	N258-A260 VanDerWaalsContact C-N 3.34Å; N258-A260 PolarHBondContact OD1-N 2.91Å; A260-F262 PolarHBondContact O-N 3.24Å; A260-Y490 HydrophobicContact CB-CD1 4.24Å; A260-Y490 HydrophobicContact CB-CE1 3.86Å
261	Y	91.7	Very high	95.8	Very high	21 Å²	21	17 Å²	17	8%	0.082	8%	0.084	C	C	.	.			trans	-80.2	106	-175.5	-167.1	-128.6	0	0	0	112.7	E132 E138 N258 P259 R263 N264	E132-Y261 PolarHBondContact OE1-OH 3.43Å; E132-Y261 VanDerWaalsContact OE1-OH 3.09Å; E138-Y261 HydrophobicContact CB-CE2 4.44Å; E138-Y261 PolarHBondContact OE2-OH 2.86Å; N258-Y261 PolarHBondContact OD1-N 2.77Å; P259-Y261 VanDerWaalsContact C-N 3.33Å; Y261-R263 HydrophobicContact CD1-CB 4.07Å; Y261-R263 HydrophobicContact CE1-CB 3.63Å; Y261-R263 HydrophobicContact CE1-CG 4.24Å; Y261-R263 PolarHBondContact O-N 3.21Å; Y261-R263 VanDerWaalsContact O-N 3.1Å; Y261-R263 PolarHBondContact OH-NH1 3.39Å; Y261-N264 WeakPolarHBondContact O-CB 3.4Å; Y261-N264 PolarHBondContact O-N 3.15Å
262	F	94	Very high	95.7	Very high	20 Å²	20	17.2 Å²	17.2	9%	0.088	9%	0.085	C	C	.	.	H	α-helix	trans	-56.4	-32.5	-174	82.9	-85.5	0	0	0	114.7	A260 N264 H265 L266 A288 M291 F292 I302 I306	A260-F262 PolarHBondContact O-N 3.24Å; F262-N264 VanDerWaalsContact C-N 3.27Å; F262-N264 PolarHBondContact O-N 2.68Å; F262-H265 WeakPolarHBondContact O-CB 3.38Å; F262-H265 PolarHBondContact O-N 3.12Å; F262-L266 PolarHBondContact O-N 3.43Å; F262-A288 VanDerWaalsContact CB-O 3.3Å; F262-A288 WeakPolarHBondContact CB-O 3.49Å; F262-A288 WeakPolarHBondContact O-CB 3.37Å; F262-M291 HydrophobicContact CB-CB 3.89Å; F262-F292 HydrophobicContact CB-CB 4.01Å; F262-F292 HydrophobicContact CD1-CB 4.31Å; F262-F292 HydrophobicContact CD1-CD2 4.01Å; F262-F292 HydrophobicContact CD2-CB 4.13Å; F262-F292 HydrophobicContact CD2-CD2 4.37Å; F262-F292 AromaticContact CE1-CD2 3.84Å; F262-F292 HydrophobicContact CE1-CD2 3.84Å; F262-F292 HydrophobicContact CE2-CD2 4.22Å; F262-F292 HydrophobicContact CG-CB 3.89Å; F262-F292 HydrophobicContact CG-CD2 4.27Å; F262-F292 AromaticContact CZ-CD2 3.94Å; F262-F292 HydrophobicContact CZ-CD2 3.94Å; F262-F292 HydrophobicContact CZ-CE2 4.48Å; F262-I302 HydrophobicContact CE2-CG2 4.21Å; F262-I302 HydrophobicContact CZ-CG2 4.41Å; F262-I306 HydrophobicContact CD2-CD1 3.81Å; F262-I306 HydrophobicContact CE2-CD1 3.97Å
263	R	94	Very high	95.7	Very high	21 Å²	21	19.2 Å²	19.2	8%	0.079	9%	0.092	C	C	.	.	H	α-helix	trans	-67.8	-27.7	179.1	-67.8	-167.3	-179.5	122.4	9	112.4	E132 E138 Y261 H265 L266 R267	E132-R263 VanDerWaalsContact CG-NH1 3.35Å; E132-R263 VanDerWaalsContact OE1-CD 3.25Å; E132-R263 WeakPolarHBondContact OE1-CD 3.49Å; E132-R263 IonicContact OE1-CZ 3.64Å; E132-R263 IonicContact OE1-NE 3.75Å; E132-R263 IonicContact OE1-NH1 2.86Å; E132-R263 PolarHBondContact OE1-NH1 3.07Å; E138-R263 IonicContact OE1-NH1 3.4Å; E138-R263 IonicContact OE2-CZ 3.62Å; E138-R263 IonicContact OE2-NH1 3.51Å; E138-R263 PolarHBondContact OE2-NH1 2.96Å; E138-R263 IonicContact OE2-NH2 3.29Å; Y261-R263 HydrophobicContact CD1-CB 4.07Å; Y261-R263 HydrophobicContact CE1-CB 3.63Å; Y261-R263 HydrophobicContact CE1-CG 4.24Å; Y261-R263 PolarHBondContact O-N 3.21Å; Y261-R263 VanDerWaalsContact O-N 3.1Å; Y261-R263 PolarHBondContact OH-NH1 3.39Å; R263-H265 VanDerWaalsContact C-N 3.33Å; R263-L266 PolarHBondContact O-N 3.41Å; R263-R267 VanDerWaalsContact O-CB 3.28Å; R263-R267 WeakPolarHBondContact O-CB 3.36Å; R263-R267 VanDerWaalsContact O-CG 3.29Å; R263-R267 WeakPolarHBondContact O-CG 3.47Å; R263-R267 PolarHBondContact O-N 3.39Å
264	N	95.9	Very high	95.8	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63.1	-44.6	173.9	-71.7	-15.1	0	0	0	110.3	S228 T232 S254 I255 N258 Y261 F262 R267 Q268	S228-N264 PolarHBondContact OG-ND2 3.41Å; T232-N264 VanDerWaalsContact CB-OD1 3.28Å; T232-N264 WeakPolarHBondContact CB-OD1 3.5Å; T232-N264 PolarHBondContact OG1-OD1 3.43Å; S254-N264 PolarHBondContact O-ND2 3.01Å; S254-N264 VanDerWaalsContact O-ND2 3.11Å; I255-N264 HydrophobicContact CG1-CB 3.78Å; N258-N264 PolarHBondContact O-ND2 3.03Å; N258-N264 VanDerWaalsContact O-ND2 3.14Å; Y261-N264 WeakPolarHBondContact O-CB 3.4Å; Y261-N264 PolarHBondContact O-N 3.15Å; F262-N264 VanDerWaalsContact C-N 3.27Å; F262-N264 PolarHBondContact O-N 2.68Å; N264-R267 PolarHBondContact O-N 2.84Å; N264-Q268 WeakPolarHBondContact O-CB 3.32Å; N264-Q268 PolarHBondContact O-N 3.05Å
265	H	97.7	Very high	95.8	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-63.6	-42.8	174.2	-65.2	-70.9	0	0	0	112.6	P259 F262 R263 Q268 A269 I287 A288 T487	P259-H265 PolarHBondContact O-NE2 2.87Å; F262-H265 WeakPolarHBondContact O-CB 3.38Å; F262-H265 PolarHBondContact O-N 3.12Å; R263-H265 VanDerWaalsContact C-N 3.33Å; H265-Q268 WeakPolarHBondContact O-CB 3.5Å; H265-Q268 PolarHBondContact O-N 3.39Å; H265-A269 PolarHBondContact O-N 2.82Å; H265-I287 HydrophobicContact CB-CG2 4.37Å; H265-I287 WeakPolarHBondContact ND1-CG2 3.33Å; H265-A288 HydrophobicContact CB-CB 3.77Å; H265-T487 PolarHBondContact CE1-OG1 3.24Å
266	L	97.3	Very high	95.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.6	-38.3	178.6	-170.3	64.6	0	0	0	112.8	L127 V128 F262 R263 A269 T270 A288 I306 Y309	L127-L266 HydrophobicContact CB-CD2 3.47Å; L127-L266 VanDerWaalsContact CB-CD2 3.47Å; L127-L266 HydrophobicContact CD1-CD2 3.91Å; L127-L266 HydrophobicContact CG-CD2 4.36Å; V128-L266 HydrophobicContact CG2-CD2 3.98Å; V128-L266 HydrophobicContact CG2-CG 3.84Å; F262-L266 PolarHBondContact O-N 3.43Å; R263-L266 PolarHBondContact O-N 3.41Å; L266-A269 WeakPolarHBondContact O-CB 3.32Å; L266-A269 PolarHBondContact O-N 2.99Å; L266-T270 PolarHBondContact O-N 3.05Å; L266-T270 PolarHBondContact O-OG1 3.18Å; L266-A288 HydrophobicContact CB-CB 4.1Å; L266-I306 HydrophobicContact CD1-CG2 4.43Å; L266-I306 HydrophobicContact CD2-CG1 4.48Å; L266-Y309 HydrophobicContact CD1-CD1 4.28Å; L266-Y309 HydrophobicContact CD1-CG 4.43Å
267	R	97.6	Very high	95.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.2	-41	173.2	-76.9	167.7	-178.7	154.8	10.2	110.7	V128 E132 T232 V235 T236 R263 N264 T270 V271	V128-R267 HydrophobicContact CG1-CG 3.84Å; V128-R267 PolarHBondContact O-NE 3.29Å; V128-R267 VanDerWaalsContact O-NE 3.15Å; E132-R267 IonicContact OE1-CZ 2.8Å; E132-R267 IonicContact OE1-NH1 3.04Å; E132-R267 IonicContact OE1-NH2 2.96Å; E132-R267 PolarHBondContact OE1-NH2 3.06Å; E132-R267 IonicContact OE2-NH2 2.73Å; T232-R267 WeakPolarHBondContact OG1-CD 3.49Å; T232-R267 PolarHBondContact OG1-NH1 3.1Å; V235-R267 HydrophobicContact CG1-CB 3.97Å; T236-R267 HydrophobicContact CG2-CG 4.42Å; R263-R267 VanDerWaalsContact O-CB 3.28Å; R263-R267 WeakPolarHBondContact O-CB 3.36Å; R263-R267 VanDerWaalsContact O-CG 3.29Å; R263-R267 WeakPolarHBondContact O-CG 3.47Å; R263-R267 PolarHBondContact O-N 3.39Å; N264-R267 PolarHBondContact O-N 2.84Å; R267-T270 WeakPolarHBondContact O-CB 3.3Å; R267-T270 PolarHBondContact O-N 3.22Å; R267-V271 WeakPolarHBondContact O-CG2 3.41Å; R267-V271 PolarHBondContact O-N 2.88Å
268	Q	98.1	Very high	95.9	Very high	12 Å²	12	23.2 Å²	23.2	6%	0.056	11%	0.113	C	C	.	.	H	α-helix	trans	-60.2	-44.5	171.2	-175.6	-173.2	64.5	0	0	111.9	A251 H252 I255 N264 H265 T270 V271 F272 S284	A251-Q268 HydrophobicContact CB-CB 4.06Å; A251-Q268 HydrophobicContact CB-CG 4.26Å; H252-Q268 PolarHBondContact CE1-NE2 3.06Å; H252-Q268 PolarHBondContact ND1-NE2 3.16Å; I255-Q268 HydrophobicContact CD1-CB 3.87Å; I255-Q268 HydrophobicContact CD1-CG 4.17Å; I255-Q268 VanDerWaalsContact CD1-NE2 3.34Å; N264-Q268 WeakPolarHBondContact O-CB 3.32Å; N264-Q268 PolarHBondContact O-N 3.05Å; H265-Q268 WeakPolarHBondContact O-CB 3.5Å; H265-Q268 PolarHBondContact O-N 3.39Å; Q268-T270 PolarHBondContact O-N 3.18Å; Q268-V271 WeakPolarHBondContact O-CB 3.15Å; Q268-V271 PolarHBondContact O-N 3.28Å; Q268-V271 VanDerWaalsContact O-N 3.08Å; Q268-F272 HydrophobicContact CG-CD2 3.85Å; Q268-F272 HydrophobicContact CG-CE2 3.48Å; Q268-F272 VanDerWaalsContact CG-CE2 3.48Å; Q268-F272 HydrophobicContact CG-CZ 4.06Å; Q268-F272 PolarHBondContact O-N 3.02Å; Q268-S284 PolarHBondContact OE1-OG 2.99Å
269	A	98.3	Very high	96	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-58	-37.3	175.9	0	0	0	0	0	111.9	H265 L266 F272 R273 A281 A285 Y309	H265-A269 PolarHBondContact O-N 2.82Å; L266-A269 WeakPolarHBondContact O-CB 3.32Å; L266-A269 PolarHBondContact O-N 2.99Å; A269-F272 PolarHBondContact O-N 3.23Å; A269-R273 WeakPolarHBondContact O-CB 2.97Å; A269-R273 PolarHBondContact O-N 3.02Å; A269-A281 WeakPolarHBondContact CB-O 3.49Å; A269-A281 WeakPolarHBondContact O-CB 3.31Å; A269-A285 HydrophobicContact CB-CB 4.24Å; A269-Y309 HydrophobicContact CB-CE1 3.94Å
270	T	98.4	Very high	96.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.5	-41.7	175.3	-52.3	0	0	0	0	112.1	E124 V128 L239 L266 R267 Q268 R273 C274 Y309	E124-T270 HydrophobicContact CG-CG2 4.22Å; V128-T270 HydrophobicContact CG1-CG2 4.2Å; V128-T270 VanDerWaalsContact CG2-OG1 3.22Å; V128-T270 WeakPolarHBondContact CG2-OG1 3.29Å; L239-T270 HydrophobicContact CD1-CG2 3.83Å; L239-T270 HydrophobicContact CD2-CG2 4.29Å; L266-T270 PolarHBondContact O-N 3.05Å; L266-T270 PolarHBondContact O-OG1 3.18Å; R267-T270 WeakPolarHBondContact O-CB 3.3Å; R267-T270 PolarHBondContact O-N 3.22Å; Q268-T270 PolarHBondContact O-N 3.18Å; T270-R273 PolarHBondContact O-N 2.65Å; T270-C274 PolarHBondContact O-N 3.14Å; T270-C274 PolarHBondContact O-SG 3.44Å; T270-Y309 WeakPolarHBondContact CA-OH 3.32Å
271	V	98.5	Very high	96.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61	-48.6	174.4	178.9	0	0	0	0	110.6	V235 L239 P244 A247 L248 A251 R267 Q268 R273 C274 L275	V235-V271 HydrophobicContact CG1-CG2 3.77Å; L239-V271 HydrophobicContact CD1-CG2 4.12Å; L239-V271 HydrophobicContact CD2-CG2 3.92Å; L239-V271 HydrophobicContact CG-CG2 4.17Å; P244-V271 HydrophobicContact CB-CG1 4.29Å; P244-V271 WeakPolarHBondContact O-CG1 3.46Å; A247-V271 HydrophobicContact CB-CG1 4.3Å; A247-V271 HydrophobicContact CB-CG2 3.67Å; L248-V271 HydrophobicContact CB-CG1 3.93Å; L248-V271 HydrophobicContact CD1-CG1 3.83Å; L248-V271 HydrophobicContact CG-CG1 4.49Å; A251-V271 HydrophobicContact CB-CG2 4.25Å; R267-V271 WeakPolarHBondContact O-CG2 3.41Å; R267-V271 PolarHBondContact O-N 2.88Å; Q268-V271 WeakPolarHBondContact O-CB 3.15Å; Q268-V271 PolarHBondContact O-N 3.28Å; Q268-V271 VanDerWaalsContact O-N 3.08Å; V271-R273 VanDerWaalsContact C-N 3.35Å; V271-R273 PolarHBondContact O-N 3.32Å; V271-C274 PolarHBondContact O-N 3.26Å; V271-C274 VanDerWaalsContact O-N 3.17Å; V271-L275 HydrophobicContact CG1-CD1 3.94Å; V271-L275 HydrophobicContact CG1-CG 4.49Å; V271-L275 WeakPolarHBondContact O-CG 3.4Å; V271-L275 PolarHBondContact O-N 2.81Å; V271-L275 VanDerWaalsContact O-N 3.08Å
272	F	97.9	Very high	96.6	Very high	3 Å²	3	20.7 Å²	20.7	1%	0.013	10%	0.098	C	C	.	.	H	α-helix	trans	-59.6	-43.2	177.3	-73.1	-42.8	0	0	0	112.4	L248 H252 Q268 A269 C274 L275 E276 R277 E280 A281 S284	L248-F272 HydrophobicContact CD1-CD1 4.1Å; L248-F272 HydrophobicContact CD1-CE1 3.74Å; H252-F272 AromaticContact CE1-CZ 3.77Å; Q268-F272 HydrophobicContact CG-CD2 3.85Å; Q268-F272 HydrophobicContact CG-CE2 3.48Å; Q268-F272 VanDerWaalsContact CG-CE2 3.48Å; Q268-F272 HydrophobicContact CG-CZ 4.06Å; Q268-F272 PolarHBondContact O-N 3.02Å; A269-F272 PolarHBondContact O-N 3.23Å; F272-C274 VanDerWaalsContact C-N 3.33Å; F272-C274 PolarHBondContact O-N 2.85Å; F272-L275 CarbonylContact O-C 3.56Å; F272-L275 WeakPolarHBondContact O-CA 3.49Å; F272-L275 PolarHBondContact O-N 2.81Å; F272-E276 PolarHBondContact O-N 2.97Å; F272-E276 VanDerWaalsContact O-N 3.15Å; F272-R277 HydrophobicContact CB-CB 4.04Å; F272-R277 HydrophobicContact CD1-CB 4.11Å; F272-R277 VanDerWaalsContact CE1-CZ 3.42Å; F272-R277 HydrophobicContact CG-CB 4.42Å; F272-R277 WeakPolarHBondContact O-CB 3.39Å; F272-R277 PolarHBondContact O-N 2.95Å; F272-E280 HydrophobicContact CB-CB 4.41Å; F272-E280 HydrophobicContact CD1-CB 4.09Å; F272-E280 HydrophobicContact CD2-CB 3.71Å; F272-E280 HydrophobicContact CE1-CB 4.22Å; F272-E280 HydrophobicContact CE2-CB 3.81Å; F272-E280 HydrophobicContact CG-CB 3.85Å; F272-E280 HydrophobicContact CZ-CB 4.06Å; F272-A281 HydrophobicContact CB-CB 3.73Å; F272-S284 WeakPolarHBondContact CE2-OG 3.47Å
273	R	97.3	Very high	96.7	Very high	42 Å²	42	20.7 Å²	20.7	16%	0.158	10%	0.097	C	C	.	.	H	α-helix	trans	-58.5	-44.6	174.6	-172.4	-164.3	63.2	71	-4.7	112	E124 A269 T270 V271 L275 E276 Y278 A281 Y309 M313	E124-R273 IonicContact OE1-CZ 3.77Å; E124-R273 IonicContact OE1-NE 3.51Å; E124-R273 PolarHBondContact OE1-NE 3.09Å; E124-R273 IonicContact OE1-NH2 2.84Å; E124-R273 PolarHBondContact OE1-NH2 2.87Å; E124-R273 IonicContact OE2-NH2 3.09Å; E124-R273 PolarHBondContact OE2-NH2 3.26Å; A269-R273 WeakPolarHBondContact O-CB 2.97Å; A269-R273 PolarHBondContact O-N 3.02Å; T270-R273 PolarHBondContact O-N 2.65Å; V271-R273 VanDerWaalsContact C-N 3.35Å; V271-R273 PolarHBondContact O-N 3.32Å; R273-L275 PolarHBondContact O-N 2.8Å; R273-E276 PolarHBondContact O-N 2.73Å; R273-Y278 HydrophobicContact CG-CD1 4.37Å; R273-Y278 HydrophobicContact CG-CE1 4Å; R273-A281 HydrophobicContact CB-CB 4.38Å; R273-Y309 WeakPolarHBondContact CB-OH 3.38Å; R273-Y309 WeakPolarHBondContact CD-OH 3.49Å; R273-Y309 PolarHBondContact NE-OH 3.29Å; R273-M313 HydrophobicContact CB-SD 3.76Å; R273-M313 HydrophobicContact CG-CE 3.9Å; R273-M313 HydrophobicContact CG-SD 3.59Å; R273-M313 VanDerWaalsContact CG-SD 3.59Å
274	C	97	Very high	96.8	Very high	47 Å²	47	19.9 Å²	19.9	32%	0.318	10%	0.095	S	C	.	.	H	α-helix	trans	-66.1	-19.7	178.2	-66.2	0	0	0	0	113.2	P244 T270 V271 F272	P244-C274 HydrophobicContact CB-CB 3.61Å; P244-C274 HydrophobicContact CG-CB 3.91Å; T270-C274 PolarHBondContact O-N 3.14Å; T270-C274 PolarHBondContact O-SG 3.44Å; V271-C274 PolarHBondContact O-N 3.26Å; V271-C274 VanDerWaalsContact O-N 3.17Å; F272-C274 VanDerWaalsContact C-N 3.33Å; F272-C274 PolarHBondContact O-N 2.85Å
275	L	96.9	Very high	96.8	Very high	40 Å²	40	19.9 Å²	19.9	21%	0.209	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	8.7	173.5	-63.2	173.2	0	0	0	112.9	P244 D245 L248 V271 F272 R273 R277	P244-L275 HydrophobicContact CB-CD2 3.87Å; P244-L275 HydrophobicContact CB-CG 3.98Å; P244-L275 HydrophobicContact CG-CD2 3.72Å; P244-L275 HydrophobicContact CG-CG 4.3Å; D245-L275 WeakPolarHBondContact OD1-CD2 3.39Å; L248-L275 HydrophobicContact CB-CD1 4.42Å; L248-L275 HydrophobicContact CD1-CD1 4.14Å; L248-L275 HydrophobicContact CD2-CD1 3.89Å; L248-L275 HydrophobicContact CG-CD1 4.39Å; V271-L275 HydrophobicContact CG1-CD1 3.94Å; V271-L275 HydrophobicContact CG1-CG 4.49Å; V271-L275 WeakPolarHBondContact O-CG 3.4Å; V271-L275 PolarHBondContact O-N 2.81Å; V271-L275 VanDerWaalsContact O-N 3.08Å; F272-L275 CarbonylContact O-C 3.56Å; F272-L275 WeakPolarHBondContact O-CA 3.49Å; F272-L275 PolarHBondContact O-N 2.81Å; R273-L275 PolarHBondContact O-N 2.8Å; L275-R277 HydrophobicContact CB-CG 4.2Å; L275-R277 PolarHBondContact O-N 3.25Å
276	E	95.4	Very high	96.7	Very high	131 Å²	131	19.9 Å²	19.9	61%	0.612	10%	0.095	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	24.9	-177.1	-53.5	-173.7	172.7	0	0	114.1	F272 R273 Y278	F272-E276 PolarHBondContact O-N 2.97Å; F272-E276 VanDerWaalsContact O-N 3.15Å; R273-E276 PolarHBondContact O-N 2.73Å; E276-Y278 HydrophobicContact CB-CE2 3.9Å; E276-Y278 HydrophobicContact CG-CE2 4.47Å; E276-Y278 WeakPolarHBondContact O-CD2 3.36Å; E276-Y278 PolarHBondContact O-N 3.12Å
277	R	95.2	Very high	96.6	Very high	51 Å²	51	20.3 Å²	20.3	19%	0.192	10%	0.097	C	C	.	.			trans	-94.3	61.9	178.8	-72.4	170.3	72.2	-178.2	8	110.8	F272 L275 S279 E280 A281	F272-R277 HydrophobicContact CB-CB 4.04Å; F272-R277 HydrophobicContact CD1-CB 4.11Å; F272-R277 VanDerWaalsContact CE1-CZ 3.42Å; F272-R277 HydrophobicContact CG-CB 4.42Å; F272-R277 WeakPolarHBondContact O-CB 3.39Å; F272-R277 PolarHBondContact O-N 2.95Å; L275-R277 HydrophobicContact CB-CG 4.2Å; L275-R277 PolarHBondContact O-N 3.25Å; R277-S279 PolarHBondContact O-N 3.42Å; R277-E280 HydrophobicContact CB-CB 4.45Å; R277-E280 VanDerWaalsContact CB-OE2 3.28Å; R277-E280 WeakPolarHBondContact CB-OE2 3.39Å; R277-E280 WeakPolarHBondContact CG-OE2 3.34Å; R277-E280 IonicContact CZ-OE1 2.75Å; R277-E280 IonicContact CZ-OE2 3.2Å; R277-E280 IonicContact NE-OE1 2.66Å; R277-E280 PolarHBondContact NE-OE1 3.41Å; R277-E280 IonicContact NE-OE2 3.89Å; R277-E280 PolarHBondContact NE-OE2 3.26Å; R277-E280 IonicContact NH2-OE1 2.66Å; R277-E280 PolarHBondContact NH2-OE1 2.6Å; R277-E280 IonicContact NH2-OE2 3.09Å; R277-E280 PolarHBondContact NH2-OE2 2.89Å; R277-E280 PolarHBondContact O-N 2.87Å; R277-A281 PolarHBondContact O-N 3.45Å
278	Y	95.8	Very high	96.5	Very high	27 Å²	27	20.3 Å²	20.3	11%	0.106	10%	0.097	C	C	.	.	H	α-helix	trans	-64.8	-37.1	-166.2	-60.2	-72.9	0	0	0	114.7	R273 E276 E280 A281 A282 M313 E316 R320	R273-Y278 HydrophobicContact CG-CD1 4.37Å; R273-Y278 HydrophobicContact CG-CE1 4Å; E276-Y278 HydrophobicContact CB-CE2 3.9Å; E276-Y278 HydrophobicContact CG-CE2 4.47Å; E276-Y278 WeakPolarHBondContact O-CD2 3.36Å; E276-Y278 PolarHBondContact O-N 3.12Å; Y278-E280 VanDerWaalsContact C-N 3.29Å; Y278-E280 PolarHBondContact O-N 2.68Å; Y278-A281 WeakPolarHBondContact O-CB 3.49Å; Y278-A281 PolarHBondContact O-N 3.32Å; Y278-A282 WeakPolarHBondContact O-CB 3.5Å; Y278-A282 PolarHBondContact O-N 2.83Å; Y278-M313 HydrophobicContact CD1-SD 4.12Å; Y278-E316 HydrophobicContact CD1-CB 3.52Å; Y278-E316 HydrophobicContact CD1-CG 4.23Å; Y278-E316 HydrophobicContact CD2-CB 4.23Å; Y278-E316 HydrophobicContact CE1-CB 3.83Å; Y278-E316 HydrophobicContact CE1-CG 4.12Å; Y278-E316 HydrophobicContact CG-CB 3.72Å; Y278-R320 HydrophobicContact CD2-CG 4.13Å; Y278-R320 HydrophobicContact CE2-CG 3.91Å
279	S	94.6	Very high	96.4	Very high	16 Å²	16	19.8 Å²	19.8	11%	0.112	10%	0.095	C	C	.	.	H	α-helix	trans	-59.8	-41.8	175.7	-58.7	0	0	0	0	112.1	R277 A282 R283 P435	R277-S279 PolarHBondContact O-N 3.42Å; S279-A282 PolarHBondContact O-N 3.08Å; S279-R283 PolarHBondContact O-N 2.61Å; S279-P435 PolarHBondContact OG-O 2.94Å
280	E	95.3	Very high	96.1	Very high	23 Å²	23	21.2 Å²	21.2	11%	0.107	10%	0.1	C	C	.	.	H	α-helix	trans	-73.9	-38.6	179.9	-63.9	165.1	100.3	0	0	110.5	F272 R277 Y278 A282 R283 S284 D438 Q480	F272-E280 HydrophobicContact CB-CB 4.41Å; F272-E280 HydrophobicContact CD1-CB 4.09Å; F272-E280 HydrophobicContact CD2-CB 3.71Å; F272-E280 HydrophobicContact CE1-CB 4.22Å; F272-E280 HydrophobicContact CE2-CB 3.81Å; F272-E280 HydrophobicContact CG-CB 3.85Å; F272-E280 HydrophobicContact CZ-CB 4.06Å; R277-E280 HydrophobicContact CB-CB 4.45Å; R277-E280 VanDerWaalsContact CB-OE2 3.28Å; R277-E280 WeakPolarHBondContact CB-OE2 3.39Å; R277-E280 WeakPolarHBondContact CG-OE2 3.34Å; R277-E280 IonicContact CZ-OE1 2.75Å; R277-E280 IonicContact CZ-OE2 3.2Å; R277-E280 IonicContact NE-OE1 2.66Å; R277-E280 PolarHBondContact NE-OE1 3.41Å; R277-E280 IonicContact NE-OE2 3.89Å; R277-E280 PolarHBondContact NE-OE2 3.26Å; R277-E280 IonicContact NH2-OE1 2.66Å; R277-E280 PolarHBondContact NH2-OE1 2.6Å; R277-E280 IonicContact NH2-OE2 3.09Å; R277-E280 PolarHBondContact NH2-OE2 2.89Å; R277-E280 PolarHBondContact O-N 2.87Å; Y278-E280 VanDerWaalsContact C-N 3.29Å; Y278-E280 PolarHBondContact O-N 2.68Å; E280-A282 VanDerWaalsContact C-N 3.33Å; E280-A282 PolarHBondContact O-N 3.05Å; E280-R283 PolarHBondContact O-N 3.03Å; E280-S284 PolarHBondContact O-N 3.4Å; E280-S284 PolarHBondContact O-OG 3.42Å; E280-D438 HydrophobicContact CG-CB 3.8Å; E280-D438 WeakPolarHBondContact CG-OD2 3.18Å; E280-Q480 PolarHBondContact OE1-NE2 2.97Å; E280-Q480 PolarHBondContact OE1-OE1 2.91Å
281	A	97.4	Very high	95.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.2	-43.7	171.5	0	0	0	0	0	112.1	A269 F272 R273 R277 Y278 S284 A285 M313	A269-A281 WeakPolarHBondContact CB-O 3.49Å; A269-A281 WeakPolarHBondContact O-CB 3.31Å; F272-A281 HydrophobicContact CB-CB 3.73Å; R273-A281 HydrophobicContact CB-CB 4.38Å; R277-A281 PolarHBondContact O-N 3.45Å; Y278-A281 WeakPolarHBondContact O-CB 3.49Å; Y278-A281 PolarHBondContact O-N 3.32Å; A281-S284 PolarHBondContact O-N 3.28Å; A281-A285 WeakPolarHBondContact O-CB 3.49Å; A281-A285 PolarHBondContact O-N 3.41Å; A281-M313 HydrophobicContact CB-CB 4.26Å; A281-M313 HydrophobicContact CB-CG 3.8Å; A281-M313 HydrophobicContact CB-SD 3.68Å
282	A	96.5	Very high	95.5	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.2	-44.5	177.3	0	0	0	0	0	111.2	Y278 S279 E280 A285 M286 M313 I314	Y278-A282 WeakPolarHBondContact O-CB 3.5Å; Y278-A282 PolarHBondContact O-N 2.83Å; S279-A282 PolarHBondContact O-N 3.08Å; E280-A282 VanDerWaalsContact C-N 3.33Å; E280-A282 PolarHBondContact O-N 3.05Å; A282-A285 PolarHBondContact O-N 3.42Å; A282-M286 PolarHBondContact O-N 3.08Å; A282-M313 HydrophobicContact CB-CB 3.62Å; A282-I314 HydrophobicContact CB-CG1 3.92Å
283	R	94.8	Very high	95.2	Very high	20 Å²	20	26.1 Å²	26.1	8%	0.075	12%	0.12	C	C	.	.	H	α-helix	trans	-62.1	-47	176	-178.9	165.4	178.5	67.3	3.8	112.4	S279 E280 A285 M286 I287 R441 Q444	S279-R283 PolarHBondContact O-N 2.61Å; E280-R283 PolarHBondContact O-N 3.03Å; R283-A285 VanDerWaalsContact C-N 3.3Å; R283-A285 PolarHBondContact O-N 3.01Å; R283-M286 WeakPolarHBondContact O-CB 3.34Å; R283-M286 PolarHBondContact O-N 2.94Å; R283-I287 HydrophobicContact CG-CD1 4.01Å; R283-I287 WeakPolarHBondContact O-CG1 3.44Å; R283-I287 PolarHBondContact O-N 3.39Å; R283-R441 VanDerWaalsContact CZ-CZ 3.44Å; R283-R441 PolarHBondContact NH1-O 3.43Å; R283-Q444 PolarHBondContact NH1-O 3.42Å
284	S	96.6	Very high	94.7	Very high	5 Å²	5	27 Å²	27	4%	0.035	13%	0.127	C	C	.	.	H	α-helix	trans	-63.7	-35.6	177.6	-61.5	0	0	0	0	112.1	Q268 F272 E280 A281 I287 A288	Q268-S284 PolarHBondContact OE1-OG 2.99Å; F272-S284 WeakPolarHBondContact CE2-OG 3.47Å; E280-S284 PolarHBondContact O-N 3.4Å; E280-S284 PolarHBondContact O-OG 3.42Å; A281-S284 PolarHBondContact O-N 3.28Å; S284-I287 PolarHBondContact O-N 3.19Å; S284-A288 WeakPolarHBondContact O-CB 3.47Å; S284-A288 PolarHBondContact O-N 3.17Å
285	A	97	Very high	94	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-68.8	-40.6	176	0	0	0	0	0	112.8	A269 A281 A282 R283 A288 D289 I306 Y309 W310	A269-A285 HydrophobicContact CB-CB 4.24Å; A281-A285 WeakPolarHBondContact O-CB 3.49Å; A281-A285 PolarHBondContact O-N 3.41Å; A282-A285 PolarHBondContact O-N 3.42Å; R283-A285 VanDerWaalsContact C-N 3.3Å; R283-A285 PolarHBondContact O-N 3.01Å; A285-A288 WeakPolarHBondContact O-CB 3.36Å; A285-A288 PolarHBondContact O-N 2.91Å; A285-D289 PolarHBondContact O-N 2.78Å; A285-I306 WeakPolarHBondContact O-CG2 3.36Å; A285-Y309 HydrophobicContact CB-CD1 3.94Å; A285-W310 HydrophobicContact CB-CB 3.79Å; A285-W310 HydrophobicContact CB-CG 4.38Å
286	M	95.4	Very high	93.3	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-58.3	-47.8	172.1	-179.8	-168.1	70.8	0	0	111.2	A282 R283 A288 D289 Y290 W310 R441 S442 Q444 L445	A282-M286 PolarHBondContact O-N 3.08Å; R283-M286 WeakPolarHBondContact O-CB 3.34Å; R283-M286 PolarHBondContact O-N 2.94Å; M286-A288 VanDerWaalsContact C-N 3.31Å; M286-A288 PolarHBondContact O-N 3.5Å; M286-D289 PolarHBondContact O-N 2.95Å; M286-Y290 PolarHBondContact O-N 3.2Å; M286-Y290 VanDerWaalsContact O-N 3.08Å; M286-W310 HydrophobicContact CB-CD2 3.85Å; M286-W310 HydrophobicContact CB-CE3 4.28Å; M286-W310 HydrophobicContact CB-CG 4.31Å; M286-W310 HydrophobicContact CB-CH2 4.29Å; M286-W310 HydrophobicContact CB-CZ2 3.83Å; M286-W310 HydrophobicContact CB-CZ3 4.48Å; M286-W310 HydrophobicContact CG-CD2 4.3Å; M286-W310 HydrophobicContact CG-CE3 4.37Å; M286-W310 HydrophobicContact CG-CH2 3.67Å; M286-W310 HydrophobicContact CG-CZ2 3.52Å; M286-W310 HydrophobicContact CG-CZ3 4.08Å; M286-W310 HydrophobicContact SD-CH2 4.29Å; M286-W310 HydrophobicContact SD-CZ2 3.88Å; M286-R441 WeakPolarHBondContact CE-O 3.28Å; M286-S442 VanDerWaalsContact SD-O 3.36Å; M286-Q444 VanDerWaalsContact CE-O 3.24Å; M286-Q444 WeakPolarHBondContact CE-O 3.25Å; M286-L445 HydrophobicContact CE-CD2 4.24Å
287	I	94.9	Very high	92.6	Very high	9 Å²	9	21.3 Å²	21.3	5%	0.046	12%	0.121	C	C	.	.	H	α-helix	trans	-61.8	-41.4	177.6	-67.7	169.1	0	0	0	110.2	H265 R283 S284 D289 Y290 M291 T487 L491	H265-I287 HydrophobicContact CB-CG2 4.37Å; H265-I287 WeakPolarHBondContact ND1-CG2 3.33Å; R283-I287 HydrophobicContact CG-CD1 4.01Å; R283-I287 WeakPolarHBondContact O-CG1 3.44Å; R283-I287 PolarHBondContact O-N 3.39Å; S284-I287 PolarHBondContact O-N 3.19Å; I287-D289 PolarHBondContact O-N 3.23Å; I287-Y290 PolarHBondContact O-N 2.86Å; I287-M291 HydrophobicContact CG2-CE 4.03Å; I287-M291 HydrophobicContact CG2-CG 4Å; I287-M291 WeakPolarHBondContact O-CB 3.43Å; I287-M291 VanDerWaalsContact O-CG 3.27Å; I287-M291 WeakPolarHBondContact O-CG 3.33Å; I287-M291 PolarHBondContact O-N 3.19Å; I287-T487 HydrophobicContact CD1-CG2 4.4Å; I287-T487 HydrophobicContact CG2-CG2 3.8Å; I287-L491 HydrophobicContact CD1-CD1 4.18Å; I287-L491 HydrophobicContact CG1-CD1 4.24Å; I287-L491 HydrophobicContact CG1-CD2 4.27Å; I287-L491 HydrophobicContact CG2-CD2 4.28Å
288	A	95.8	Very high	91.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.8	-46	176.2	0	0	0	0	0	112.3	F262 H265 L266 S284 A285 M286 Y290 M291 F292 I306	F262-A288 VanDerWaalsContact CB-O 3.3Å; F262-A288 WeakPolarHBondContact CB-O 3.49Å; F262-A288 WeakPolarHBondContact O-CB 3.37Å; H265-A288 HydrophobicContact CB-CB 3.77Å; L266-A288 HydrophobicContact CB-CB 4.1Å; S284-A288 WeakPolarHBondContact O-CB 3.47Å; S284-A288 PolarHBondContact O-N 3.17Å; A285-A288 WeakPolarHBondContact O-CB 3.36Å; A285-A288 PolarHBondContact O-N 2.91Å; M286-A288 VanDerWaalsContact C-N 3.31Å; M286-A288 PolarHBondContact O-N 3.5Å; A288-Y290 VanDerWaalsContact C-N 3.31Å; A288-Y290 PolarHBondContact O-N 2.75Å; A288-M291 PolarHBondContact O-N 3.48Å; A288-F292 WeakPolarHBondContact O-CB 3.28Å; A288-F292 PolarHBondContact O-N 3.48Å; A288-I306 HydrophobicContact CB-CG2 4.16Å
289	D	94.8	Very high	91.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.8	-39.5	178.8	-171.1	58.6	0	0	0	111.6	A285 M286 I287 F292 W293 S303 I306 K307 W374	A285-D289 PolarHBondContact O-N 2.78Å; M286-D289 PolarHBondContact O-N 2.95Å; I287-D289 PolarHBondContact O-N 3.23Å; D289-F292 PolarHBondContact O-N 3.31Å; D289-W293 PolarHBondContact O-N 3.4Å; D289-W293 VanDerWaalsContact O-N 3.16Å; D289-S303 WeakPolarHBondContact OD1-CA 3.41Å; D289-S303 WeakPolarHBondContact OD1-CB 3.48Å; D289-S303 PolarHBondContact OD1-OG 3.49Å; D289-I306 HydrophobicContact CB-CB 4.23Å; D289-I306 HydrophobicContact CB-CG2 3.66Å; D289-K307 WeakPolarHBondContact OD2-CE 3.25Å; D289-K307 IonicContact OD2-NZ 3.39Å; D289-W374 PolarHBondContact OD2-NE1 3.41Å
290	Y	92.4	Very high	90.9	Very high	30 Å²	30	39.8 Å²	39.8	12%	0.118	20%	0.199	C	C	.	.	H	α-helix	trans	-67.5	-45	176.8	-175.7	-111.2	0	0	0	112.6	M286 I287 A288 F292 W293 L294 W374 L445 Y490 L491	M286-Y290 PolarHBondContact O-N 3.2Å; M286-Y290 VanDerWaalsContact O-N 3.08Å; I287-Y290 PolarHBondContact O-N 2.86Å; A288-Y290 VanDerWaalsContact C-N 3.31Å; A288-Y290 PolarHBondContact O-N 2.75Å; Y290-F292 VanDerWaalsContact C-N 3.32Å; Y290-F292 PolarHBondContact O-N 2.76Å; Y290-W293 AromaticContact CD2-CE3 3.94Å; Y290-W293 HydrophobicContact CD2-CE3 3.94Å; Y290-W293 HydrophobicContact CD2-CZ3 4.25Å; Y290-W293 AromaticContact CE2-CE3 3.7Å; Y290-W293 HydrophobicContact CE2-CE3 3.7Å; Y290-W293 AromaticContact CE2-CZ3 3.52Å; Y290-W293 HydrophobicContact CE2-CZ3 3.52Å; Y290-W293 PolarHBondContact O-N 3.32Å; Y290-L294 HydrophobicContact CD1-CD1 3.71Å; Y290-L294 HydrophobicContact CD1-CG 4.26Å; Y290-L294 HydrophobicContact CE1-CD1 3.2Å; Y290-L294 HydrophobicContact CE1-CG 3.85Å; Y290-L294 HydrophobicContact CE2-CG 4.34Å; Y290-L294 PolarHBondContact O-N 3.2Å; Y290-W374 AromaticContact CD2-CD2 3.92Å; Y290-W374 HydrophobicContact CD2-CD2 3.92Å; Y290-W374 AromaticContact CD2-CE3 4Å; Y290-W374 HydrophobicContact CD2-CE3 4Å; Y290-W374 HydrophobicContact CD2-CG 4.47Å; Y290-W374 HydrophobicContact CD2-CH2 4.41Å; Y290-W374 HydrophobicContact CD2-CZ2 4.28Å; Y290-W374 HydrophobicContact CD2-CZ3 4.29Å; Y290-W374 HydrophobicContact CE2-CE3 4.45Å; Y290-L445 HydrophobicContact CD1-CD2 3.8Å; Y290-L445 HydrophobicContact CD2-CD1 3.59Å; Y290-L445 HydrophobicContact CD2-CD2 4.05Å; Y290-L445 HydrophobicContact CE1-CD2 4.3Å; Y290-L445 HydrophobicContact CE2-CD1 3.74Å; Y290-L445 HydrophobicContact CG-CD1 4.09Å; Y290-L445 HydrophobicContact CG-CD2 3.65Å; Y290-Y490 WeakPolarHBondContact CE1-O 3.45Å; Y290-L491 HydrophobicContact CD1-CD2 3.67Å; Y290-L491 HydrophobicContact CE1-CD2 4.01Å
291	M	93.2	Very high	90.6	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.015	21%	0.212	C	C	.	.	H	α-helix	trans	-64.4	-36.5	175.8	-68.8	-51.7	175.3	0	0	112.3	F262 I287 A288 W293 L294 G295 T487 Y490 L491	F262-M291 HydrophobicContact CB-CB 3.89Å; I287-M291 HydrophobicContact CG2-CE 4.03Å; I287-M291 HydrophobicContact CG2-CG 4Å; I287-M291 WeakPolarHBondContact O-CB 3.43Å; I287-M291 VanDerWaalsContact O-CG 3.27Å; I287-M291 WeakPolarHBondContact O-CG 3.33Å; I287-M291 PolarHBondContact O-N 3.19Å; A288-M291 PolarHBondContact O-N 3.48Å; M291-W293 VanDerWaalsContact C-N 3.32Å; M291-W293 PolarHBondContact O-N 3.07Å; M291-L294 PolarHBondContact O-N 3.09Å; M291-L294 HydrophobicContact SD-CD1 4.04Å; M291-G295 PolarHBondContact O-N 3.42Å; M291-T487 HydrophobicContact CE-CG2 3.57Å; M291-Y490 HydrophobicContact CE-CG 4.1Å; M291-L491 HydrophobicContact CE-CD2 3.73Å; M291-L491 HydrophobicContact CE-CG 4.36Å
292	F	91.9	Very high	90.3	Very high	19 Å²	19	42.2 Å²	42.2	8%	0.083	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-45	174.3	173.4	-102.8	0	0	0	110.9	F262 A288 D289 Y290 G297 E299 I302 I306	F262-F292 HydrophobicContact CB-CB 4.01Å; F262-F292 HydrophobicContact CD1-CB 4.31Å; F262-F292 HydrophobicContact CD1-CD2 4.01Å; F262-F292 HydrophobicContact CD2-CB 4.13Å; F262-F292 HydrophobicContact CD2-CD2 4.37Å; F262-F292 AromaticContact CE1-CD2 3.84Å; F262-F292 HydrophobicContact CE1-CD2 3.84Å; F262-F292 HydrophobicContact CE2-CD2 4.22Å; F262-F292 HydrophobicContact CG-CB 3.89Å; F262-F292 HydrophobicContact CG-CD2 4.27Å; F262-F292 AromaticContact CZ-CD2 3.94Å; F262-F292 HydrophobicContact CZ-CD2 3.94Å; F262-F292 HydrophobicContact CZ-CE2 4.48Å; A288-F292 WeakPolarHBondContact O-CB 3.28Å; A288-F292 PolarHBondContact O-N 3.48Å; D289-F292 PolarHBondContact O-N 3.31Å; Y290-F292 VanDerWaalsContact C-N 3.32Å; Y290-F292 PolarHBondContact O-N 2.76Å; F292-G297 WeakPolarHBondContact O-CA 3.48Å; F292-G297 PolarHBondContact O-N 3.28Å; F292-E299 HydrophobicContact CZ-CB 4.09Å; F292-I302 HydrophobicContact CD1-CG2 4.44Å; F292-I302 HydrophobicContact CD2-CG2 3.92Å; F292-I302 HydrophobicContact CE1-CB 4.18Å; F292-I302 HydrophobicContact CE1-CG2 4.2Å; F292-I302 HydrophobicContact CE2-CB 3.98Å; F292-I302 HydrophobicContact CE2-CD1 3.93Å; F292-I302 HydrophobicContact CE2-CG2 3.65Å; F292-I302 HydrophobicContact CG-CG2 4.3Å; F292-I302 HydrophobicContact CZ-CB 3.69Å; F292-I302 HydrophobicContact CZ-CD1 4.18Å; F292-I302 HydrophobicContact CZ-CG1 4.45Å; F292-I302 HydrophobicContact CZ-CG2 3.8Å; F292-I306 HydrophobicContact CB-CD1 4.22Å; F292-I306 HydrophobicContact CG-CD1 4.42Å
293	W	90.2	Very high	90	Very high	84 Å²	84	43.1 Å²	43.1	32%	0.318	22%	0.223	S	C	.	.	H	α-helix	trans	-66	-48.2	175.4	168.5	79.9	0	0	0	112.6	D289 Y290 M291 G295 G296 W374 F377	D289-W293 PolarHBondContact O-N 3.4Å; D289-W293 VanDerWaalsContact O-N 3.16Å; Y290-W293 AromaticContact CD2-CE3 3.94Å; Y290-W293 HydrophobicContact CD2-CE3 3.94Å; Y290-W293 HydrophobicContact CD2-CZ3 4.25Å; Y290-W293 AromaticContact CE2-CE3 3.7Å; Y290-W293 HydrophobicContact CE2-CE3 3.7Å; Y290-W293 AromaticContact CE2-CZ3 3.52Å; Y290-W293 HydrophobicContact CE2-CZ3 3.52Å; Y290-W293 PolarHBondContact O-N 3.32Å; M291-W293 VanDerWaalsContact C-N 3.32Å; M291-W293 PolarHBondContact O-N 3.07Å; W293-G295 VanDerWaalsContact C-N 3.27Å; W293-G295 PolarHBondContact O-N 3.4Å; W293-G296 PolarHBondContact O-N 2.96Å; W293-W374 HydrophobicContact CB-CB 4.09Å; W293-W374 HydrophobicContact CB-CG 4.09Å; W293-W374 HydrophobicContact CD2-CB 3.39Å; W293-W374 HydrophobicContact CD2-CG 4.11Å; W293-W374 HydrophobicContact CE3-CB 3.95Å; W293-W374 HydrophobicContact CE3-CG 4.41Å; W293-W374 HydrophobicContact CG-CB 3.4Å; W293-W374 VanDerWaalsContact CG-CB 3.4Å; W293-W374 AromaticContact CG-CD1 3.94Å; W293-W374 AromaticContact CG-CG 3.94Å; W293-W374 HydrophobicContact CG-CG 3.94Å; W293-W374 HydrophobicContact CZ2-CB 4.32Å; W293-W374 VanDerWaalsContact CZ2-O 3.3Å; W293-W374 WeakPolarHBondContact CZ2-O 3.5Å; W293-F377 HydrophobicContact CH2-CE2 4.4Å; W293-F377 HydrophobicContact CZ2-CE2 4.5Å
294	L	87	Confident	89.9	Confident	61 Å²	61	48.8 Å²	48.8	32%	0.319	25%	0.248	S	C	.	.	H	α-helix	trans	-58	-39.3	178.4	-83.9	-179.7	0	0	0	112.3	Y290 M291 G296 Y490	Y290-L294 HydrophobicContact CD1-CD1 3.71Å; Y290-L294 HydrophobicContact CD1-CG 4.26Å; Y290-L294 HydrophobicContact CE1-CD1 3.2Å; Y290-L294 HydrophobicContact CE1-CG 3.85Å; Y290-L294 HydrophobicContact CE2-CG 4.34Å; Y290-L294 PolarHBondContact O-N 3.2Å; M291-L294 PolarHBondContact O-N 3.09Å; M291-L294 HydrophobicContact SD-CD1 4.04Å; L294-G296 PolarHBondContact O-N 3Å; L294-Y490 WeakPolarHBondContact CD1-O 3.28Å
295	G	83.5	Confident	89.8	Confident	30 Å²	30	50.4 Å²	50.4	31%	0.309	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	13.1	175.9	0	0	0	0	0	114.6	M291 W293 G297	M291-G295 PolarHBondContact O-N 3.42Å; W293-G295 VanDerWaalsContact C-N 3.27Å; W293-G295 PolarHBondContact O-N 3.4Å; G295-G297 VanDerWaalsContact C-N 3.34Å
296	G	82	Confident	89.8	Confident	44 Å²	44	50.4 Å²	50.4	45%	0.454	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	15.4	179	0	0	0	0	0	114.3	W293 L294 R298	W293-G296 PolarHBondContact O-N 2.96Å; L294-G296 PolarHBondContact O-N 3Å; G296-R298 PolarHBondContact O-N 3.46Å
297	G	81.4	Confident	89.7	Confident	24 Å²	24	52 Å²	52	25%	0.247	26%	0.263	C	S	.	.			trans	-62.2	106.6	177.5	0	0	0	0	0	111.8	F292 G295	F292-G297 WeakPolarHBondContact O-CA 3.48Å; F292-G297 PolarHBondContact O-N 3.28Å; G295-G297 VanDerWaalsContact C-N 3.34Å
298	R	77.1	Confident	89.7	Confident	227 Å²	227	54.2 Å²	54.2	86%	0.857	28%	0.275	S	S	*	.			trans	-97.3	-7.1	178.4	-68.4	-169.2	-80.3	-101.3	4.9	113.8	G296 Q300	G296-R298 PolarHBondContact O-N 3.46Å; R298-Q300 PolarHBondContact O-N 3.44Å
299	E	85.3	Confident	89.7	Confident	112 Å²	112	54.2 Å²	54.2	52%	0.523	28%	0.275	S	S	.	.			trans	-74.8	100.2	-177.1	-147.5	-166.1	149.4	0	0	111	F292 S301 I302 S303	F292-E299 HydrophobicContact CZ-CB 4.09Å; E299-S301 WeakPolarHBondContact CG-OG 3.46Å; E299-S301 PolarHBondContact O-N 3.22Å; E299-S301 PolarHBondContact OE1-OG 2.93Å; E299-I302 HydrophobicContact CB-CB 4.47Å; E299-I302 HydrophobicContact CB-CD1 4.15Å; E299-I302 HydrophobicContact CB-CG1 4.21Å; E299-I302 HydrophobicContact CG-CG1 4.47Å; E299-I302 PolarHBondContact O-N 3.3Å; E299-I302 VanDerWaalsContact O-N 3.16Å; E299-I302 WeakPolarHBondContact OE2-CD1 3.28Å; E299-S303 PolarHBondContact O-N 3.07Å
300	Q	85.5	Confident	89.8	Confident	144 Å²	144	54.2 Å²	54.2	67%	0.673	28%	0.275	S	S	*	.	H	α-helix	trans	-61.2	-27.9	-178.2	-65.9	-177.4	-1.6	0	0	113.2	R298 K304	R298-Q300 PolarHBondContact O-N 3.44Å; Q300-K304 VanDerWaalsContact O-CB 3.31Å; Q300-K304 WeakPolarHBondContact O-CB 3.48Å; Q300-K304 WeakPolarHBondContact O-CD 3.45Å; Q300-K304 WeakPolarHBondContact O-CG 3.29Å; Q300-K304 PolarHBondContact O-N 2.98Å
301	S	89.3	Confident	89.9	Confident	52 Å²	52	53.8 Å²	53.8	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-61.1	-45	175.2	52.1	0	0	0	0	111.5	E299 K304 L305	E299-S301 WeakPolarHBondContact CG-OG 3.46Å; E299-S301 PolarHBondContact O-N 3.22Å; E299-S301 PolarHBondContact OE1-OG 2.93Å; S301-K304 PolarHBondContact O-N 2.97Å; S301-L305 WeakPolarHBondContact O-CG 3.22Å; S301-L305 PolarHBondContact O-N 3.01Å; S301-L305 VanDerWaalsContact O-N 3.08Å
302	I	90.9	Very high	90	Very high	22 Å²	22	53.7 Å²	53.7	11%	0.113	27%	0.273	C	S	.	.	H	α-helix	trans	-65.5	-51.7	179.5	-65.5	179.9	0	0	0	109.8	L127 F262 F292 E299 K304 L305 I306	L127-I302 HydrophobicContact CD1-CG2 4.39Å; L127-I302 HydrophobicContact CD2-CG1 4.25Å; L127-I302 HydrophobicContact CD2-CG2 4.2Å; F262-I302 HydrophobicContact CE2-CG2 4.21Å; F262-I302 HydrophobicContact CZ-CG2 4.41Å; F292-I302 HydrophobicContact CD1-CG2 4.44Å; F292-I302 HydrophobicContact CD2-CG2 3.92Å; F292-I302 HydrophobicContact CE1-CB 4.18Å; F292-I302 HydrophobicContact CE1-CG2 4.2Å; F292-I302 HydrophobicContact CE2-CB 3.98Å; F292-I302 HydrophobicContact CE2-CD1 3.93Å; F292-I302 HydrophobicContact CE2-CG2 3.65Å; F292-I302 HydrophobicContact CG-CG2 4.3Å; F292-I302 HydrophobicContact CZ-CB 3.69Å; F292-I302 HydrophobicContact CZ-CD1 4.18Å; F292-I302 HydrophobicContact CZ-CG1 4.45Å; F292-I302 HydrophobicContact CZ-CG2 3.8Å; E299-I302 HydrophobicContact CB-CB 4.47Å; E299-I302 HydrophobicContact CB-CD1 4.15Å; E299-I302 HydrophobicContact CB-CG1 4.21Å; E299-I302 HydrophobicContact CG-CG1 4.47Å; E299-I302 PolarHBondContact O-N 3.3Å; E299-I302 VanDerWaalsContact O-N 3.16Å; E299-I302 WeakPolarHBondContact OE2-CD1 3.28Å; I302-K304 VanDerWaalsContact C-N 3.29Å; I302-K304 PolarHBondContact O-N 3.28Å; I302-L305 WeakPolarHBondContact O-CB 3.37Å; I302-L305 PolarHBondContact O-N 2.84Å; I302-I306 HydrophobicContact CG2-CD1 3.8Å; I302-I306 HydrophobicContact CG2-CG1 4.3Å; I302-I306 WeakPolarHBondContact O-CG1 3.41Å; I302-I306 PolarHBondContact O-N 3.45Å
303	S	91.4	Very high	90.2	Very high	18 Å²	18	52.8 Å²	52.8	13%	0.126	27%	0.27	C	S	.	.	H	α-helix	trans	-59.2	-39.8	178.5	177.8	0	0	0	0	111.9	D289 E299 L305 I306 K307	D289-S303 WeakPolarHBondContact OD1-CA 3.41Å; D289-S303 WeakPolarHBondContact OD1-CB 3.48Å; D289-S303 PolarHBondContact OD1-OG 3.49Å; E299-S303 PolarHBondContact O-N 3.07Å; S303-L305 VanDerWaalsContact C-N 3.34Å; S303-L305 PolarHBondContact O-N 3.29Å; S303-I306 PolarHBondContact O-N 2.97Å; S303-K307 WeakPolarHBondContact O-CB 3.41Å; S303-K307 WeakPolarHBondContact O-CG 3.19Å; S303-K307 PolarHBondContact O-N 3.32Å; S303-K307 VanDerWaalsContact OG-CE 3.26Å; S303-K307 WeakPolarHBondContact OG-CE 3.28Å; S303-K307 PolarHBondContact OG-NZ 3.46Å
304	K	92.8	Very high	90.5	Very high	139 Å²	139	48.8 Å²	48.8	60%	0.604	25%	0.254	S	S	*	.	H	α-helix	trans	-59.2	-42.6	174	-77.9	170.5	-175.6	175.5	0	112.5	Q300 S301 I302 L308	Q300-K304 VanDerWaalsContact O-CB 3.31Å; Q300-K304 WeakPolarHBondContact O-CB 3.48Å; Q300-K304 WeakPolarHBondContact O-CD 3.45Å; Q300-K304 WeakPolarHBondContact O-CG 3.29Å; Q300-K304 PolarHBondContact O-N 2.98Å; S301-K304 PolarHBondContact O-N 2.97Å; I302-K304 VanDerWaalsContact C-N 3.29Å; I302-K304 PolarHBondContact O-N 3.28Å; K304-L308 WeakPolarHBondContact O-CB 3.49Å; K304-L308 PolarHBondContact O-N 3.2Å
305	L	94.9	Very high	90.7	Very high	39 Å²	39	46.4 Å²	46.4	20%	0.204	24%	0.241	C	C	.	.	H	α-helix	trans	-67.5	-41.2	177.6	-70.4	171.6	0	0	0	111.8	V123 K126 L127 S301 I302 S303 L308 Y309	V123-L305 HydrophobicContact CG1-CB 4.2Å; V123-L305 HydrophobicContact CG2-CB 4.27Å; V123-L305 HydrophobicContact CG2-CD2 3.86Å; K126-L305 HydrophobicContact CB-CD1 4.36Å; K126-L305 HydrophobicContact CD-CD1 4.12Å; L127-L305 HydrophobicContact CD1-CB 3.7Å; L127-L305 HydrophobicContact CD1-CD1 4.33Å; L127-L305 HydrophobicContact CD2-CD1 4.34Å; L127-L305 HydrophobicContact CG-CB 4.47Å; L127-L305 HydrophobicContact CG-CD1 4.26Å; S301-L305 WeakPolarHBondContact O-CG 3.22Å; S301-L305 PolarHBondContact O-N 3.01Å; S301-L305 VanDerWaalsContact O-N 3.08Å; I302-L305 WeakPolarHBondContact O-CB 3.37Å; I302-L305 PolarHBondContact O-N 2.84Å; S303-L305 VanDerWaalsContact C-N 3.34Å; S303-L305 PolarHBondContact O-N 3.29Å; L305-L308 WeakPolarHBondContact O-CB 3.39Å; L305-L308 PolarHBondContact O-N 2.93Å; L305-Y309 PolarHBondContact O-N 3.33Å
306	I	95.2	Very high	91.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-44.4	177	-58	170	0	0	0	110.5	L127 F262 L266 A285 A288 D289 F292 I302 S303 L308 Y309 W310	L127-I306 HydrophobicContact CD1-CG1 3.75Å; F262-I306 HydrophobicContact CD2-CD1 3.81Å; F262-I306 HydrophobicContact CE2-CD1 3.97Å; L266-I306 HydrophobicContact CD1-CG2 4.43Å; L266-I306 HydrophobicContact CD2-CG1 4.48Å; A285-I306 WeakPolarHBondContact O-CG2 3.36Å; A288-I306 HydrophobicContact CB-CG2 4.16Å; D289-I306 HydrophobicContact CB-CB 4.23Å; D289-I306 HydrophobicContact CB-CG2 3.66Å; F292-I306 HydrophobicContact CB-CD1 4.22Å; F292-I306 HydrophobicContact CG-CD1 4.42Å; I302-I306 HydrophobicContact CG2-CD1 3.8Å; I302-I306 HydrophobicContact CG2-CG1 4.3Å; I302-I306 WeakPolarHBondContact O-CG1 3.41Å; I302-I306 PolarHBondContact O-N 3.45Å; S303-I306 PolarHBondContact O-N 2.97Å; I306-L308 VanDerWaalsContact C-N 3.33Å; I306-L308 PolarHBondContact O-N 3.42Å; I306-Y309 WeakPolarHBondContact O-CB 3.36Å; I306-Y309 PolarHBondContact O-N 3.42Å; I306-Y309 VanDerWaalsContact O-N 3.12Å; I306-W310 WeakPolarHBondContact O-CB 3.38Å; I306-W310 PolarHBondContact O-N 3.18Å
307	K	94.3	Very high	91.8	Very high	36 Å²	36	45 Å²	45	16%	0.157	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-38.9	176.1	-73.4	171.9	-176.8	174.3	0	112.7	D289 S303 Y309 W310 Q311 P369 V372	D289-K307 WeakPolarHBondContact OD2-CE 3.25Å; D289-K307 IonicContact OD2-NZ 3.39Å; S303-K307 WeakPolarHBondContact O-CB 3.41Å; S303-K307 WeakPolarHBondContact O-CG 3.19Å; S303-K307 PolarHBondContact O-N 3.32Å; S303-K307 VanDerWaalsContact OG-CE 3.26Å; S303-K307 WeakPolarHBondContact OG-CE 3.28Å; S303-K307 PolarHBondContact OG-NZ 3.46Å; K307-Y309 VanDerWaalsContact C-N 3.33Å; K307-W310 PolarHBondContact O-N 3.4Å; K307-Q311 WeakPolarHBondContact O-CB 3.45Å; K307-Q311 PolarHBondContact O-N 2.87Å; K307-P369 HydrophobicContact CB-CB 4.11Å; K307-P369 HydrophobicContact CG-CB 4.45Å; K307-P369 WeakPolarHBondContact O-CB 3.42Å; K307-V372 WeakPolarHBondContact CE-O 3.26Å; K307-V372 PolarHBondContact NZ-O 2.86Å
308	L	94.7	Very high	92.3	Very high	54 Å²	54	46 Å²	46	28%	0.283	22%	0.216	S	C	.	.	H	α-helix	trans	-60.3	-45.1	172.6	-173.9	74.6	0	0	0	110.9	I115 N119 V123 K304 L305 I306 A312	I115-L308 HydrophobicContact CD1-CD1 3.5Å; I115-L308 HydrophobicContact CD1-CG 4.06Å; I115-L308 VanDerWaalsContact CD1-O 3.22Å; I115-L308 WeakPolarHBondContact CD1-O 3.48Å; I115-L308 HydrophobicContact CG1-CD1 4.03Å; I115-L308 HydrophobicContact CG2-CD1 4.18Å; I115-L308 HydrophobicContact CG2-CG 4.28Å; N119-L308 HydrophobicContact CB-CD2 4.32Å; V123-L308 HydrophobicContact CG2-CD2 3.99Å; K304-L308 WeakPolarHBondContact O-CB 3.49Å; K304-L308 PolarHBondContact O-N 3.2Å; L305-L308 WeakPolarHBondContact O-CB 3.39Å; L305-L308 PolarHBondContact O-N 2.93Å; I306-L308 VanDerWaalsContact C-N 3.33Å; I306-L308 PolarHBondContact O-N 3.42Å; L308-A312 PolarHBondContact O-N 2.71Å
309	Y	96.4	Very high	92.9	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-63.1	-47	176.5	-165.3	-83.2	0	0	0	111.7	I120 V123 E124 L266 A269 T270 R273 A285 L305 I306 K307 Q311 A312 M313	I120-Y309 HydrophobicContact CG2-CD2 3.82Å; I120-Y309 HydrophobicContact CG2-CE2 3.47Å; I120-Y309 VanDerWaalsContact CG2-CE2 3.47Å; V123-Y309 HydrophobicContact CB-CD2 4.21Å; V123-Y309 HydrophobicContact CG1-CD2 3.97Å; V123-Y309 HydrophobicContact CG1-CG 4.4Å; E124-Y309 HydrophobicContact CG-CD2 4.49Å; E124-Y309 HydrophobicContact CG-CE2 3.71Å; E124-Y309 PolarHBondContact OE1-OH 3.34Å; L266-Y309 HydrophobicContact CD1-CD1 4.28Å; L266-Y309 HydrophobicContact CD1-CG 4.43Å; A269-Y309 HydrophobicContact CB-CE1 3.94Å; T270-Y309 WeakPolarHBondContact CA-OH 3.32Å; R273-Y309 WeakPolarHBondContact CB-OH 3.38Å; R273-Y309 WeakPolarHBondContact CD-OH 3.49Å; R273-Y309 PolarHBondContact NE-OH 3.29Å; A285-Y309 HydrophobicContact CB-CD1 3.94Å; L305-Y309 PolarHBondContact O-N 3.33Å; I306-Y309 WeakPolarHBondContact O-CB 3.36Å; I306-Y309 PolarHBondContact O-N 3.42Å; I306-Y309 VanDerWaalsContact O-N 3.12Å; K307-Y309 VanDerWaalsContact C-N 3.33Å; Y309-Q311 PolarHBondContact O-N 2.95Å; Y309-A312 PolarHBondContact O-N 3.15Å; Y309-M313 HydrophobicContact CD1-CG 3.91Å; Y309-M313 HydrophobicContact CE1-CE 4.49Å; Y309-M313 HydrophobicContact CE1-CG 3.67Å; Y309-M313 HydrophobicContact CE1-SD 3.95Å; Y309-M313 WeakPolarHBondContact O-CG 3.32Å; Y309-M313 PolarHBondContact O-N 3.29Å
310	W	96.4	Very high	93.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-57.1	-48.6	176.9	175.6	21.6	0	0	0	111.8	A285 M286 I306 K307 A312 M313 I314 M367 P369 V372 W374 S442 T443	A285-W310 HydrophobicContact CB-CB 3.79Å; A285-W310 HydrophobicContact CB-CG 4.38Å; M286-W310 HydrophobicContact CB-CD2 3.85Å; M286-W310 HydrophobicContact CB-CE3 4.28Å; M286-W310 HydrophobicContact CB-CG 4.31Å; M286-W310 HydrophobicContact CB-CH2 4.29Å; M286-W310 HydrophobicContact CB-CZ2 3.83Å; M286-W310 HydrophobicContact CB-CZ3 4.48Å; M286-W310 HydrophobicContact CG-CD2 4.3Å; M286-W310 HydrophobicContact CG-CE3 4.37Å; M286-W310 HydrophobicContact CG-CH2 3.67Å; M286-W310 HydrophobicContact CG-CZ2 3.52Å; M286-W310 HydrophobicContact CG-CZ3 4.08Å; M286-W310 HydrophobicContact SD-CH2 4.29Å; M286-W310 HydrophobicContact SD-CZ2 3.88Å; I306-W310 WeakPolarHBondContact O-CB 3.38Å; I306-W310 PolarHBondContact O-N 3.18Å; K307-W310 PolarHBondContact O-N 3.4Å; W310-A312 VanDerWaalsContact C-N 3.33Å; W310-A312 PolarHBondContact O-N 2.94Å; W310-M313 PolarHBondContact O-N 2.82Å; W310-M313 VanDerWaalsContact O-N 3.16Å; W310-I314 HydrophobicContact CZ2-CD1 4.44Å; W310-I314 VanDerWaalsContact NE1-CD1 3.33Å; W310-I314 PolarHBondContact O-N 3.32Å; W310-M367 WeakPolarHBondContact CZ2-O 3.26Å; W310-P369 HydrophobicContact CB-CB 4.47Å; W310-P369 HydrophobicContact CD2-CB 3.79Å; W310-P369 HydrophobicContact CD2-CG 3.92Å; W310-P369 HydrophobicContact CE3-CB 3.51Å; W310-P369 HydrophobicContact CE3-CG 4.12Å; W310-P369 HydrophobicContact CG-CB 4.26Å; W310-P369 HydrophobicContact CG-CG 4.2Å; W310-P369 HydrophobicContact CZ3-CB 3.95Å; W310-V372 HydrophobicContact CH2-CG2 4.04Å; W310-V372 HydrophobicContact CZ3-CB 4.39Å; W310-V372 HydrophobicContact CZ3-CG2 4.1Å; W310-W374 HydrophobicContact CZ3-CZ2 4.41Å; W310-S442 VanDerWaalsContact CZ2-O 3.32Å; W310-S442 WeakPolarHBondContact CZ2-O 3.48Å; W310-S442 PolarHBondContact NE1-O 3.07Å; W310-T443 HydrophobicContact CZ2-CG2 4.38Å
311	Q	94.8	Very high	93.4	Very high	20 Å²	20	35.6 Å²	35.6	9%	0.093	18%	0.181	C	C	.	.	H	α-helix	trans	-56.7	-47.1	176.3	177.2	175.2	-23.7	0	0	111.8	L112 P113 I115 K307 Y309 M313 I314 E315 P369 Q370	L112-Q311 HydrophobicContact CD2-CG 4.37Å; P113-Q311 VanDerWaalsContact CD-NE2 3.26Å; P113-Q311 PolarHBondContact O-NE2 3.1Å; I115-Q311 HydrophobicContact CD1-CB 3.71Å; I115-Q311 HydrophobicContact CD1-CG 3.58Å; K307-Q311 WeakPolarHBondContact O-CB 3.45Å; K307-Q311 PolarHBondContact O-N 2.87Å; Y309-Q311 PolarHBondContact O-N 2.95Å; Q311-M313 PolarHBondContact O-N 3.26Å; Q311-I314 PolarHBondContact O-N 2.74Å; Q311-I314 VanDerWaalsContact O-N 3.17Å; Q311-E315 VanDerWaalsContact CG-OE1 3.26Å; Q311-E315 WeakPolarHBondContact CG-OE1 3.49Å; Q311-E315 PolarHBondContact NE2-OE1 2.87Å; Q311-E315 WeakPolarHBondContact O-CG 3.47Å; Q311-E315 PolarHBondContact O-N 3.33Å; Q311-P369 HydrophobicContact CB-CB 4.18Å; Q311-P369 HydrophobicContact CB-CG 3.63Å; Q311-P369 HydrophobicContact CG-CG 4.37Å; Q311-Q370 VanDerWaalsContact CG-NE2 3.31Å
312	A	95	Very high	93.4	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-61.1	-36.6	-179.6	0	0	0	0	0	111.6	I115 I120 L308 Y309 W310 E315 E316	I115-A312 HydrophobicContact CB-CB 3.92Å; I115-A312 HydrophobicContact CD1-CB 3.91Å; I115-A312 HydrophobicContact CG1-CB 4.48Å; I115-A312 HydrophobicContact CG2-CB 4.12Å; I120-A312 HydrophobicContact CD1-CB 3.6Å; I120-A312 HydrophobicContact CG1-CB 3.81Å; L308-A312 PolarHBondContact O-N 2.71Å; Y309-A312 PolarHBondContact O-N 3.15Å; W310-A312 VanDerWaalsContact C-N 3.33Å; W310-A312 PolarHBondContact O-N 2.94Å; A312-E315 PolarHBondContact O-N 2.94Å; A312-E316 WeakPolarHBondContact O-CG 3.31Å; A312-E316 PolarHBondContact O-N 2.85Å
313	M	96.7	Very high	93.2	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-70.8	-36.1	177.3	-62.6	-56.3	91.2	0	0	112.6	I120 R273 Y278 A281 A282 Y309 W310 Q311 A317	I120-M313 HydrophobicContact CD1-CE 4.03Å; I120-M313 HydrophobicContact CG2-CE 4.39Å; R273-M313 HydrophobicContact CB-SD 3.76Å; R273-M313 HydrophobicContact CG-CE 3.9Å; R273-M313 HydrophobicContact CG-SD 3.59Å; R273-M313 VanDerWaalsContact CG-SD 3.59Å; Y278-M313 HydrophobicContact CD1-SD 4.12Å; A281-M313 HydrophobicContact CB-CB 4.26Å; A281-M313 HydrophobicContact CB-CG 3.8Å; A281-M313 HydrophobicContact CB-SD 3.68Å; A282-M313 HydrophobicContact CB-CB 3.62Å; Y309-M313 HydrophobicContact CD1-CG 3.91Å; Y309-M313 HydrophobicContact CE1-CE 4.49Å; Y309-M313 HydrophobicContact CE1-CG 3.67Å; Y309-M313 HydrophobicContact CE1-SD 3.95Å; Y309-M313 WeakPolarHBondContact O-CG 3.32Å; Y309-M313 PolarHBondContact O-N 3.29Å; W310-M313 PolarHBondContact O-N 2.82Å; W310-M313 VanDerWaalsContact O-N 3.16Å; Q311-M313 PolarHBondContact O-N 3.26Å; M313-A317 VanDerWaalsContact O-CB 3.26Å; M313-A317 WeakPolarHBondContact O-CB 3.26Å; M313-A317 PolarHBondContact O-N 3.18Å
314	I	94.8	Very high	93.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.6	-47.1	172.1	-67.9	176	0	0	0	110	L112 A282 W310 Q311 A317 I318 P369 F439 T443	L112-I314 HydrophobicContact CD1-CG2 3.65Å; A282-I314 HydrophobicContact CB-CG1 3.92Å; W310-I314 HydrophobicContact CZ2-CD1 4.44Å; W310-I314 VanDerWaalsContact NE1-CD1 3.33Å; W310-I314 PolarHBondContact O-N 3.32Å; Q311-I314 PolarHBondContact O-N 2.74Å; Q311-I314 VanDerWaalsContact O-N 3.17Å; I314-A317 PolarHBondContact O-N 3.08Å; I314-I318 HydrophobicContact CG2-CD1 3.77Å; I314-I318 HydrophobicContact CG2-CG1 4.42Å; I314-I318 WeakPolarHBondContact O-CG1 3.36Å; I314-I318 PolarHBondContact O-N 3.06Å; I314-P369 HydrophobicContact CD1-CG 4.27Å; I314-F439 HydrophobicContact CG2-CE2 4.23Å; I314-F439 HydrophobicContact CG2-CZ 4.42Å; I314-T443 HydrophobicContact CD1-CG2 3.61Å
315	E	92.6	Very high	93.3	Very high	10 Å²	10	35 Å²	35	5%	0.047	18%	0.178	C	C	.	.	H	α-helix	trans	-60.7	-46.6	-179.5	-74.7	170.1	-167.9	0	0	112.3	L112 P113 H114 I115 Q311 A312 I318 T319	L112-E315 VanDerWaalsContact C-OE1 3.28Å; L112-E315 HydrophobicContact CB-CG 3.51Å; L112-E315 WeakPolarHBondContact CB-OE1 3.33Å; L112-E315 HydrophobicContact CD1-CG 4.28Å; L112-E315 HydrophobicContact CG-CG 4.47Å; P113-E315 VanDerWaalsContact C-OE1 3.29Å; H114-E315 WeakPolarHBondContact CA-OE2 3.43Å; I115-E315 PolarHBondContact N-OE2 2.99Å; Q311-E315 VanDerWaalsContact CG-OE1 3.26Å; Q311-E315 WeakPolarHBondContact CG-OE1 3.49Å; Q311-E315 PolarHBondContact NE2-OE1 2.87Å; Q311-E315 WeakPolarHBondContact O-CG 3.47Å; Q311-E315 PolarHBondContact O-N 3.33Å; A312-E315 PolarHBondContact O-N 2.94Å; E315-I318 PolarHBondContact O-N 3.4Å; E315-T319 WeakPolarHBondContact O-CB 3.48Å; E315-T319 PolarHBondContact O-N 3.32Å; E315-T319 PolarHBondContact O-OG1 3.42Å
316	E	93.8	Very high	93.2	Very high	40 Å²	40	33.7 Å²	33.7	19%	0.187	17%	0.172	C	C	.	.	H	α-helix	trans	-64	-40.7	175.4	-74.6	-66.8	160.4	0	0	111.5	Y278 A312 I318 T319 R320	Y278-E316 HydrophobicContact CD1-CB 3.52Å; Y278-E316 HydrophobicContact CD1-CG 4.23Å; Y278-E316 HydrophobicContact CD2-CB 4.23Å; Y278-E316 HydrophobicContact CE1-CB 3.83Å; Y278-E316 HydrophobicContact CE1-CG 4.12Å; Y278-E316 HydrophobicContact CG-CB 3.72Å; A312-E316 WeakPolarHBondContact O-CG 3.31Å; A312-E316 PolarHBondContact O-N 2.85Å; E316-I318 VanDerWaalsContact C-N 3.35Å; E316-I318 PolarHBondContact O-N 3.46Å; E316-T319 PolarHBondContact O-N 2.97Å; E316-R320 WeakPolarHBondContact O-CB 3.33Å; E316-R320 WeakPolarHBondContact O-CG 3.41Å; E316-R320 PolarHBondContact O-N 2.7Å; E316-R320 IonicContact OE2-NE 3.44Å
317	A	93.8	Very high	93.1	Very high	6 Å²	6	34 Å²	34	5%	0.05	17%	0.173	C	C	.	.	H	α-helix	trans	-60.2	-43.5	176.6	0	0	0	0	0	112.1	M313 I314 A321 F439	M313-A317 VanDerWaalsContact O-CB 3.26Å; M313-A317 WeakPolarHBondContact O-CB 3.26Å; M313-A317 PolarHBondContact O-N 3.18Å; I314-A317 PolarHBondContact O-N 3.08Å; A317-A321 VanDerWaalsContact O-CB 3.3Å; A317-A321 WeakPolarHBondContact O-CB 2.88Å; A317-A321 PolarHBondContact O-N 3.08Å; A317-A321 VanDerWaalsContact O-N 3.1Å; A317-F439 HydrophobicContact CB-CD2 3.89Å; A317-F439 HydrophobicContact CB-CE2 4.11Å
318	I	91.9	Very high	92.9	Very high	45 Å²	45	33.4 Å²	33.4	23%	0.231	17%	0.17	C	C	.	.	H	α-helix	trans	-67.5	-44.5	176.6	-65.2	168.8	0	0	0	110.8	L112 I314 E315 E316 R320 A321 V326 F439	L112-I318 HydrophobicContact CD1-CD1 4.08Å; I314-I318 HydrophobicContact CG2-CD1 3.77Å; I314-I318 HydrophobicContact CG2-CG1 4.42Å; I314-I318 WeakPolarHBondContact O-CG1 3.36Å; I314-I318 PolarHBondContact O-N 3.06Å; E315-I318 PolarHBondContact O-N 3.4Å; E316-I318 VanDerWaalsContact C-N 3.35Å; E316-I318 PolarHBondContact O-N 3.46Å; I318-R320 VanDerWaalsContact C-N 3.3Å; I318-R320 PolarHBondContact O-N 3.33Å; I318-A321 PolarHBondContact O-N 3.11Å; I318-V326 HydrophobicContact CD1-CB 4.23Å; I318-V326 HydrophobicContact CG1-CB 4.29Å; I318-V326 HydrophobicContact CG1-CG2 4.05Å; I318-F439 HydrophobicContact CD1-CE2 4.29Å; I318-F439 HydrophobicContact CD1-CZ 4Å; I318-F439 HydrophobicContact CG1-CE2 3.66Å; I318-F439 HydrophobicContact CG1-CZ 3.69Å
319	T	90.6	Very high	92.6	Very high	106 Å²	106	31.5 Å²	31.5	65%	0.65	16%	0.161	S	C	*	.	H	α-helix	trans	-65.5	-34.8	-176.3	-57.7	0	0	0	0	112.1	E315 E316	E315-T319 WeakPolarHBondContact O-CB 3.48Å; E315-T319 PolarHBondContact O-N 3.32Å; E315-T319 PolarHBondContact O-OG1 3.42Å; E316-T319 PolarHBondContact O-N 2.97Å
320	R	90.8	Very high	92.1	Very high	139 Å²	139	34.6 Å²	34.6	53%	0.525	18%	0.18	S	C	.	.	H	α-helix	trans	-88.4	-12.5	179.2	-61.3	-68.1	-173.1	132.6	4.2	113.4	Y278 E316 I318 E322	Y278-R320 HydrophobicContact CD2-CG 4.13Å; Y278-R320 HydrophobicContact CE2-CG 3.91Å; E316-R320 WeakPolarHBondContact O-CB 3.33Å; E316-R320 WeakPolarHBondContact O-CG 3.41Å; E316-R320 PolarHBondContact O-N 2.7Å; E316-R320 IonicContact OE2-NE 3.44Å; I318-R320 VanDerWaalsContact C-N 3.3Å; I318-R320 PolarHBondContact O-N 3.33Å; R320-E322 PolarHBondContact O-N 3.15Å
321	A	90.2	Very high	91	Very high	18 Å²	18	36.1 Å²	36.1	15%	0.149	19%	0.187	C	C	.	.			trans	-68.9	117.5	-179.6	0	0	0	0	0	111	A317 I318 F324	A317-A321 VanDerWaalsContact O-CB 3.3Å; A317-A321 WeakPolarHBondContact O-CB 2.88Å; A317-A321 PolarHBondContact O-N 3.08Å; A317-A321 VanDerWaalsContact O-N 3.1Å; I318-A321 PolarHBondContact O-N 3.11Å; A321-F324 HydrophobicContact CB-CD1 4.16Å; A321-F324 HydrophobicContact CB-CD2 4.48Å; A321-F324 HydrophobicContact CB-CE1 3.85Å; A321-F324 HydrophobicContact CB-CE2 4.19Å; A321-F324 HydrophobicContact CB-CG 4.47Å; A321-F324 HydrophobicContact CB-CZ 3.86Å
322	E	89.1	Confident	89.7	Confident	158 Å²	158	39.8 Å²	39.8	74%	0.738	22%	0.221	S	C	*	.	S	Bend	trans	-90.8	-29.3	176	-65.4	-175	175.8	0	0	112.9	R320 Y354 K389	R320-E322 PolarHBondContact O-N 3.15Å; E322-Y354 WeakPolarHBondContact O-CE1 3.46Å; E322-K389 WeakPolarHBondContact O-CD 3.46Å; E322-K389 WeakPolarHBondContact O-CE 3.45Å; E322-K389 PolarHBondContact O-NZ 3.25Å
323	S	87.9	Confident	88.3	Confident	37 Å²	37	44.4 Å²	44.4	26%	0.259	25%	0.249	S	C	.	.	S	Bend	trans	-91.2	-24.1	-169.3	54.5	0	0	0	0	114.1	K389	S323-K389 PolarHBondContact O-N 3.32Å
324	F	92.5	Very high	86.9	Confident	9 Å²	9	54 Å²	54	4%	0.039	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	158.7	-177.7	69.8	-88.8	0	0	0	112.9	A321 V326 L386 G387 F388 I436 F439	A321-F324 HydrophobicContact CB-CD1 4.16Å; A321-F324 HydrophobicContact CB-CD2 4.48Å; A321-F324 HydrophobicContact CB-CE1 3.85Å; A321-F324 HydrophobicContact CB-CE2 4.19Å; A321-F324 HydrophobicContact CB-CG 4.47Å; A321-F324 HydrophobicContact CB-CZ 3.86Å; F324-V326 HydrophobicContact CD2-CG2 3.63Å; F324-V326 HydrophobicContact CE2-CG2 3.53Å; F324-L386 HydrophobicContact CD2-CD2 4Å; F324-L386 HydrophobicContact CE2-CD2 4.38Å; F324-G387 CarbonylContact C-O 3.46Å; F324-G387 WeakPolarHBondContact CA-O 3.25Å; F324-G387 WeakPolarHBondContact CB-O 3.4Å; F324-F388 HydrophobicContact CB-CD1 3.7Å; F324-F388 HydrophobicContact CB-CE1 3.58Å; F324-F388 HydrophobicContact CB-CZ 4.42Å; F324-F388 HydrophobicContact CG-CE1 4.38Å; F324-I436 HydrophobicContact CD1-CG1 3.73Å; F324-I436 HydrophobicContact CE1-CG1 3.9Å; F324-F439 HydrophobicContact CE2-CB 4.46Å; F324-F439 AromaticContact CE2-CD1 3.77Å; F324-F439 HydrophobicContact CE2-CD1 3.77Å; F324-F439 HydrophobicContact CE2-CD2 4.36Å; F324-F439 HydrophobicContact CE2-CE1 4.17Å; F324-F439 AromaticContact CE2-CG 3.9Å; F324-F439 HydrophobicContact CE2-CG 3.9Å; F324-F439 HydrophobicContact CZ-CB 4Å; F324-F439 HydrophobicContact CZ-CD1 4.16Å; F324-F439 HydrophobicContact CZ-CD2 4.27Å; F324-F439 AromaticContact CZ-CG 3.84Å; F324-F439 HydrophobicContact CZ-CG 3.84Å
325	S	93.3	Very high	85.8	Confident	15 Å²	15	56.6 Å²	56.6	11%	0.105	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	161.2	167.5	-168	0	0	0	0	110.6	H351 L386 G387	S325-H351 PolarHBondContact OG-CD2 3.14Å; S325-H351 PolarHBondContact OG-NE2 3.03Å; S325-L386 WeakPolarHBondContact O-CA 3.15Å; S325-G387 PolarHBondContact N-O 2.69Å; S325-G387 PolarHBondContact O-N 2.93Å
326	V	93.5	Very high	85.1	Confident	12 Å²	12	63.7 Å²	63.7	7%	0.073	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	140	-163.7	-173.8	0	0	0	0	111.2	I318 F324 Y328 H351 L384 T385 L386 F439	I318-V326 HydrophobicContact CD1-CB 4.23Å; I318-V326 HydrophobicContact CG1-CB 4.29Å; I318-V326 HydrophobicContact CG1-CG2 4.05Å; F324-V326 HydrophobicContact CD2-CG2 3.63Å; F324-V326 HydrophobicContact CE2-CG2 3.53Å; V326-Y328 HydrophobicContact CG1-CD2 4.05Å; V326-Y328 HydrophobicContact CG1-CE2 3.57Å; V326-H351 PolarHBondContact O-NE2 3.07Å; V326-L384 HydrophobicContact CG1-CD1 3.43Å; V326-L384 VanDerWaalsContact CG1-CD1 3.43Å; V326-T385 WeakPolarHBondContact CA-O 3.44Å; V326-L386 HydrophobicContact CB-CD2 4.32Å; V326-L386 HydrophobicContact CG1-CD2 4.22Å; V326-L386 HydrophobicContact CG2-CD2 3.69Å; V326-F439 HydrophobicContact CB-CE1 4.2Å; V326-F439 HydrophobicContact CB-CZ 4.23Å; V326-F439 HydrophobicContact CG1-CE1 3.73Å; V326-F439 HydrophobicContact CG1-CZ 3.91Å; V326-F439 HydrophobicContact CG2-CD1 4.25Å; V326-F439 HydrophobicContact CG2-CE1 3.43Å; V326-F439 VanDerWaalsContact CG2-CE1 3.43Å; V326-F439 HydrophobicContact CG2-CZ 3.61Å
327	M	91.7	Very high	84.5	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.025	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	128.7	168.2	-170.3	174.3	71	0	0	110.4	T109 V343 V346 F347 T385	T109-M327 HydrophobicContact CG2-CG 4.18Å; M327-V343 HydrophobicContact CE-CG1 3.63Å; M327-V343 WeakPolarHBondContact CE-O 3.45Å; M327-V346 HydrophobicContact CE-CG1 4.39Å; M327-V346 HydrophobicContact SD-CG1 4.13Å; M327-F347 HydrophobicContact CB-CD2 3.61Å; M327-F347 HydrophobicContact CB-CE2 3.93Å; M327-F347 HydrophobicContact CE-CB 3.83Å; M327-F347 HydrophobicContact CE-CD2 4.14Å; M327-F347 HydrophobicContact SD-CB 4.48Å; M327-F347 HydrophobicContact SD-CD2 4.35Å; M327-T385 PolarHBondContact N-O 2.95Å; M327-T385 PolarHBondContact O-N 3.3Å
328	Y	90.1	Very high	83.9	Confident	25 Å²	25	68.3 Å²	68.3	10%	0.098	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122.7	172.4	-67	-82.3	0	0	0	109.6	V326 H366 L368 L384 F439 T443	V326-Y328 HydrophobicContact CG1-CD2 4.05Å; V326-Y328 HydrophobicContact CG1-CE2 3.57Å; Y328-H366 HydrophobicContact CE1-CB 4.37Å; Y328-L368 HydrophobicContact CD1-CD1 4.4Å; Y328-L368 HydrophobicContact CD1-CD2 3.9Å; Y328-L368 HydrophobicContact CD1-CG 4.34Å; Y328-L368 HydrophobicContact CD2-CD1 4.31Å; Y328-L368 HydrophobicContact CD2-CD2 4.04Å; Y328-L368 HydrophobicContact CE1-CD2 3.81Å; Y328-L368 HydrophobicContact CE2-CD2 3.97Å; Y328-L368 HydrophobicContact CG-CD1 3.99Å; Y328-L368 HydrophobicContact CG-CD2 4Å; Y328-L368 HydrophobicContact CG-CG 4.38Å; Y328-L384 HydrophobicContact CD1-CD1 4.11Å; Y328-L384 HydrophobicContact CE1-CB 4.46Å; Y328-L384 HydrophobicContact CE1-CD1 3.61Å; Y328-L384 HydrophobicContact CE2-CD1 4.47Å; Y328-F439 HydrophobicContact CE2-CZ 4.49Å; Y328-F439 WeakPolarHBondContact OH-CZ 3.48Å; Y328-T443 HydrophobicContact CE1-CG2 4.07Å; Y328-T443 WeakPolarHBondContact OH-CG2 3.21Å
329	T	88.1	Confident	83.4	Confident	14 Å²	14	70.2 Å²	70.2	9%	0.086	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	120.4	178	-58.5	0	0	0	0	110.1	L107 F331 V343 Y382 L383	L107-T329 HydrophobicContact CD2-CG2 3.54Å; T329-F331 PolarHBondContact O-N 3.28Å; T329-V343 HydrophobicContact CG2-CG2 4.06Å; T329-Y382 CarbonylContact O-C 3.58Å; T329-Y382 WeakPolarHBondContact O-CA 3.33Å; T329-L383 PolarHBondContact N-O 2.86Å; T329-L383 PolarHBondContact O-N 3.3Å
330	P	86.2	Confident	83.2	Confident	65 Å²	65	66.3 Å²	66.3	42%	0.422	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	138.8	177.7	-11.8	22.2	0	0	0	110.9	Y382	P330-Y382 HydrophobicContact CB-CD1 4.36Å; P330-Y382 HydrophobicContact CB-CE1 4.11Å; P330-Y382 HydrophobicContact CG-CD1 4.27Å; P330-Y382 HydrophobicContact CG-CE1 3.84Å
331	F	74.5	Confident	83.1	Confident	33 Å²	33	64.7 Å²	64.7	15%	0.145	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	149.2	171.9	76	-86.3	0	0	0	111.6	T329 I335 L365 Q380 Q381 Y382 L383	T329-F331 PolarHBondContact O-N 3.28Å; F331-I335 HydrophobicContact CB-CD1 4.41Å; F331-I335 HydrophobicContact CB-CG1 4.31Å; F331-I335 HydrophobicContact CD1-CD1 4.49Å; F331-I335 HydrophobicContact CG-CD1 4.23Å; F331-I335 HydrophobicContact CG-CG1 4.45Å; F331-L365 HydrophobicContact CE1-CD2 4.46Å; F331-L365 HydrophobicContact CE2-CD2 3.98Å; F331-L365 HydrophobicContact CZ-CB 4.33Å; F331-L365 HydrophobicContact CZ-CD2 3.43Å; F331-L365 VanDerWaalsContact CZ-CD2 3.43Å; F331-L365 HydrophobicContact CZ-CG 4.39Å; F331-Q380 PolarHBondContact O-NE2 2.9Å; F331-Q381 HydrophobicContact CD1-CB 4.06Å; F331-Q381 WeakPolarHBondContact CD1-O 3.49Å; F331-Q381 VanDerWaalsContact CE1-C 3.47Å; F331-Q381 HydrophobicContact CE1-CB 3.32Å; F331-Q381 HydrophobicContact CE2-CB 3.86Å; F331-Q381 HydrophobicContact CZ-CB 3.18Å; F331-Q381 HydrophobicContact CZ-CG 4.11Å; F331-Q381 PolarHBondContact N-O 3.08Å; F331-Y382 VanDerWaalsContact CD1-C 3.43Å; F331-Y382 VanDerWaalsContact CE1-N 3.34Å; F331-Y382 WeakPolarHBondContact CE1-O 3.46Å; F331-L383 HydrophobicContact CD1-CB 4.23Å
332	A	65.8	Low	83	Confident	96 Å²	96	69.2 Å²	69.2	79%	0.793	36%	0.362	S	S	*	.	S	Bend	trans	-117.8	-17.7	-178.8	0	0	0	0	0	113.4
333	T	65.6	Low	83	Confident	98 Å²	98	62.1 Å²	62.1	60%	0.601	33%	0.329	S	S	*	.	S	Bend	trans	-147.7	169.2	-176.9	51.5	0	0	0	0	111	I335	T333-I335 PolarHBondContact O-N 3.27Å
334	K	69.1	Low	83.2	Confident	203 Å²	203	63 Å²	63	88%	0.883	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-48.5	124.7	177.6	-78.4	-174.6	177.9	-179.9	0	111.2
335	I	70.8	Confident	83.1	Confident	54 Å²	54	66.8 Å²	66.8	28%	0.277	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-74.5	129.2	-175.3	-61.9	157.3	0	0	0	109.2	F331 T333 K339 I340 L383	F331-I335 HydrophobicContact CB-CD1 4.41Å; F331-I335 HydrophobicContact CB-CG1 4.31Å; F331-I335 HydrophobicContact CD1-CD1 4.49Å; F331-I335 HydrophobicContact CG-CD1 4.23Å; F331-I335 HydrophobicContact CG-CG1 4.45Å; T333-I335 PolarHBondContact O-N 3.27Å; I335-K339 HydrophobicContact CG2-CB 4.19Å; I335-I340 HydrophobicContact CG2-CD1 4.11Å; I335-I340 HydrophobicContact CG2-CG1 3.47Å; I335-I340 VanDerWaalsContact CG2-CG1 3.47Å; I335-L383 HydrophobicContact CD1-CB 4.11Å; I335-L383 HydrophobicContact CD1-CD1 3.59Å; I335-L383 HydrophobicContact CD1-CD2 3.82Å; I335-L383 HydrophobicContact CD1-CG 4.05Å
336	R	78.6	Confident	83.1	Confident	160 Å²	160	68 Å²	68	60%	0.604	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-86.8	151.3	173.2	-65.4	171.9	42.2	162.1	-1.9	110.5	D338 K339 I340	R336-D338 VanDerWaalsContact C-N 3.25Å; R336-D338 WeakPolarHBondContact CB-OD1 3.43Å; R336-D338 IonicContact CZ-OD1 3.55Å; R336-D338 IonicContact CZ-OD2 3.93Å; R336-D338 IonicContact NE-OD1 2.68Å; R336-D338 PolarHBondContact NE-OD1 3.26Å; R336-D338 IonicContact NE-OD2 3.96Å; R336-D338 IonicContact NH2-OD1 2.69Å; R336-D338 PolarHBondContact NH2-OD1 3.14Å; R336-D338 VanDerWaalsContact NH2-OD1 3.09Å; R336-D338 IonicContact NH2-OD2 2.72Å; R336-D338 PolarHBondContact O-N 3.1Å; R336-K339 WeakPolarHBondContact O-CB 3.3Å; R336-K339 PolarHBondContact O-N 2.94Å; R336-I340 PolarHBondContact O-N 2.89Å
337	A	80.8	Confident	83.1	Confident	75 Å²	75	67.4 Å²	67.4	62%	0.62	35%	0.352	S	S	*	.	H	α-helix	trans	-55.6	-37.6	-179.4	0	0	0	0	0	113.4	K339 I340 E341	A337-K339 PolarHBondContact O-N 3.21Å; A337-I340 PolarHBondContact O-N 3.3Å; A337-I340 VanDerWaalsContact O-N 3.14Å; A337-E341 PolarHBondContact O-N 3.43Å
338	D	80.8	Confident	83.2	Confident	68 Å²	68	69.9 Å²	69.9	36%	0.364	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-29.7	176.5	57.9	-71.3	0	0	0	113.2	R336 K342	R336-D338 VanDerWaalsContact C-N 3.25Å; R336-D338 WeakPolarHBondContact CB-OD1 3.43Å; R336-D338 IonicContact CZ-OD1 3.55Å; R336-D338 IonicContact CZ-OD2 3.93Å; R336-D338 IonicContact NE-OD1 2.68Å; R336-D338 PolarHBondContact NE-OD1 3.26Å; R336-D338 IonicContact NE-OD2 3.96Å; R336-D338 IonicContact NH2-OD1 2.69Å; R336-D338 PolarHBondContact NH2-OD1 3.14Å; R336-D338 VanDerWaalsContact NH2-OD1 3.09Å; R336-D338 IonicContact NH2-OD2 2.72Å; R336-D338 PolarHBondContact O-N 3.1Å; D338-K342 WeakPolarHBondContact O-CG 3.48Å; D338-K342 PolarHBondContact O-N 3.3Å
339	K	82.6	Confident	83.3	Confident	85 Å²	85	76.8 Å²	76.8	37%	0.37	40%	0.398	S	S	.	.	H	α-helix	trans	-76.3	-33.8	174.9	-64.8	-173.3	175.9	-174.7	0	112	I335 R336 A337 K342 V343	I335-K339 HydrophobicContact CG2-CB 4.19Å; R336-K339 WeakPolarHBondContact O-CB 3.3Å; R336-K339 PolarHBondContact O-N 2.94Å; A337-K339 PolarHBondContact O-N 3.21Å; K339-K342 PolarHBondContact O-N 2.96Å; K339-V343 WeakPolarHBondContact O-CG2 3.46Å; K339-V343 PolarHBondContact O-N 3.46Å
340	I	84.5	Confident	83.5	Confident	23 Å²	23	79.5 Å²	79.5	12%	0.118	42%	0.415	C	S	.	.	H	α-helix	trans	-63.4	-46.3	177.6	-59.8	172.2	0	0	0	109.9	I335 R336 A337 K342 V343 K344 L362	I335-I340 HydrophobicContact CG2-CD1 4.11Å; I335-I340 HydrophobicContact CG2-CG1 3.47Å; I335-I340 VanDerWaalsContact CG2-CG1 3.47Å; R336-I340 PolarHBondContact O-N 2.89Å; A337-I340 PolarHBondContact O-N 3.3Å; A337-I340 VanDerWaalsContact O-N 3.14Å; I340-K342 PolarHBondContact O-N 3.13Å; I340-V343 WeakPolarHBondContact O-CB 3.47Å; I340-V343 PolarHBondContact O-N 2.93Å; I340-V343 VanDerWaalsContact O-N 3.16Å; I340-K344 HydrophobicContact CG2-CD 4.43Å; I340-K344 WeakPolarHBondContact O-CG 3.5Å; I340-K344 PolarHBondContact O-N 3.14Å; I340-L362 HydrophobicContact CD1-CD1 3.8Å; I340-L362 HydrophobicContact CD1-CD2 3.55Å; I340-L362 HydrophobicContact CD1-CG 4.34Å; I340-L362 HydrophobicContact CG1-CD2 4.13Å
341	E	88.7	Confident	83.7	Confident	106 Å²	106	78.5 Å²	78.5	50%	0.495	40%	0.404	S	S	.	.	H	α-helix	trans	-62.5	-42.2	177.6	-67.9	-57.7	155.8	0	0	111.7	A337 V343 K344 D345	A337-E341 PolarHBondContact O-N 3.43Å; E341-V343 VanDerWaalsContact C-N 3.3Å; E341-V343 PolarHBondContact O-N 3.34Å; E341-K344 PolarHBondContact O-N 2.91Å; E341-K344 VanDerWaalsContact O-N 3.14Å; E341-D345 PolarHBondContact O-N 3.17Å
342	K	89.1	Confident	84.6	Confident	113 Å²	113	81.4 Å²	81.4	49%	0.491	43%	0.427	S	S	.	.	H	α-helix	trans	-57.5	-41.5	173	-73	179.9	178.9	-170.3	0	112.6	D338 K339 I340 D345 V346	D338-K342 WeakPolarHBondContact O-CG 3.48Å; D338-K342 PolarHBondContact O-N 3.3Å; K339-K342 PolarHBondContact O-N 2.96Å; I340-K342 PolarHBondContact O-N 3.13Å; K342-D345 PolarHBondContact O-N 3.25Å; K342-V346 WeakPolarHBondContact O-CG2 3.42Å; K342-V346 PolarHBondContact O-N 3.03Å
343	V	89.3	Confident	85.9	Confident	8 Å²	8	80.1 Å²	80.1	5%	0.048	42%	0.416	C	S	.	.	H	α-helix	trans	-64.8	-41.9	177.2	169.7	0	0	0	0	111	M327 T329 K339 I340 E341 V346 F347 L383 T385	M327-V343 HydrophobicContact CE-CG1 3.63Å; M327-V343 WeakPolarHBondContact CE-O 3.45Å; T329-V343 HydrophobicContact CG2-CG2 4.06Å; K339-V343 WeakPolarHBondContact O-CG2 3.46Å; K339-V343 PolarHBondContact O-N 3.46Å; I340-V343 WeakPolarHBondContact O-CB 3.47Å; I340-V343 PolarHBondContact O-N 2.93Å; I340-V343 VanDerWaalsContact O-N 3.16Å; E341-V343 VanDerWaalsContact C-N 3.3Å; E341-V343 PolarHBondContact O-N 3.34Å; V343-V346 PolarHBondContact O-N 3.42Å; V343-F347 WeakPolarHBondContact O-CB 3.48Å; V343-F347 PolarHBondContact O-N 3.1Å; V343-L383 HydrophobicContact CG1-CD2 4.39Å; V343-L383 HydrophobicContact CG2-CD2 4.44Å; V343-T385 WeakPolarHBondContact CG1-OG1 3.28Å
344	K	91.3	Very high	87.3	Confident	57 Å²	57	77.5 Å²	77.5	25%	0.248	40%	0.395	C	S	.	.	H	α-helix	trans	-64.8	-39.2	175.5	-68.4	-178.5	176.7	179.4	0	112.4	I340 E341 F347 T348 I358	I340-K344 HydrophobicContact CG2-CD 4.43Å; I340-K344 WeakPolarHBondContact O-CG 3.5Å; I340-K344 PolarHBondContact O-N 3.14Å; E341-K344 PolarHBondContact O-N 2.91Å; E341-K344 VanDerWaalsContact O-N 3.14Å; K344-F347 PolarHBondContact O-N 3.48Å; K344-T348 WeakPolarHBondContact O-CB 3.24Å; K344-T348 PolarHBondContact O-N 2.95Å; K344-T348 PolarHBondContact O-OG1 2.83Å; K344-I358 HydrophobicContact CB-CD1 4.42Å; K344-I358 HydrophobicContact CD-CG2 4.46Å; K344-I358 HydrophobicContact CG-CG2 3.9Å
345	D	92.1	Very high	88.4	Confident	88 Å²	88	69.4 Å²	69.4	47%	0.471	37%	0.367	S	S	.	.	H	α-helix	trans	-63.2	-44.5	175.6	-74	-21.2	0	0	0	111.5	E341 K342 T348 K349	E341-D345 PolarHBondContact O-N 3.17Å; K342-D345 PolarHBondContact O-N 3.25Å; D345-T348 PolarHBondContact O-N 3.44Å; D345-K349 WeakPolarHBondContact O-CG 3.49Å; D345-K349 PolarHBondContact O-N 3.15Å; D345-K349 VanDerWaalsContact O-N 3.17Å
346	V	91.9	Very high	89.5	Confident	40 Å²	40	72.5 Å²	72.5	24%	0.242	38%	0.38	C	S	.	.	H	α-helix	trans	-62.3	-47.4	174.8	171.5	0	0	0	0	110.2	L107 M327 K342 V343 T348 K349 T350	L107-V346 HydrophobicContact CD1-CG2 4.04Å; M327-V346 HydrophobicContact CE-CG1 4.39Å; M327-V346 HydrophobicContact SD-CG1 4.13Å; K342-V346 WeakPolarHBondContact O-CG2 3.42Å; K342-V346 PolarHBondContact O-N 3.03Å; V343-V346 PolarHBondContact O-N 3.42Å; V346-T348 VanDerWaalsContact C-N 3.32Å; V346-T348 PolarHBondContact O-N 3.41Å; V346-K349 PolarHBondContact O-N 3.16Å; V346-K349 VanDerWaalsContact O-N 3.16Å; V346-T350 PolarHBondContact O-N 3.03Å; V346-T350 PolarHBondContact O-OG1 3.15Å
347	F	92.9	Very high	90.2	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-56.2	-46.7	177.4	-172.6	-80.3	0	0	0	111.7	M327 V343 K344 K349 T350 H351 I358 T385 G387	M327-F347 HydrophobicContact CB-CD2 3.61Å; M327-F347 HydrophobicContact CB-CE2 3.93Å; M327-F347 HydrophobicContact CE-CB 3.83Å; M327-F347 HydrophobicContact CE-CD2 4.14Å; M327-F347 HydrophobicContact SD-CB 4.48Å; M327-F347 HydrophobicContact SD-CD2 4.35Å; V343-F347 WeakPolarHBondContact O-CB 3.48Å; V343-F347 PolarHBondContact O-N 3.1Å; K344-F347 PolarHBondContact O-N 3.48Å; F347-K349 VanDerWaalsContact C-N 3.26Å; F347-K349 PolarHBondContact O-N 3.48Å; F347-T350 PolarHBondContact O-N 3.32Å; F347-H351 HydrophobicContact CD1-CB 4.24Å; F347-H351 HydrophobicContact CE1-CB 3.75Å; F347-H351 AromaticContact CE2-CD2 3.58Å; F347-H351 HydrophobicContact CZ-CB 3.95Å; F347-H351 AromaticContact CZ-CD2 3.62Å; F347-H351 PolarHBondContact O-N 3.26Å; F347-I358 HydrophobicContact CD1-CD1 3.87Å; F347-I358 HydrophobicContact CD1-CG1 4.11Å; F347-I358 HydrophobicContact CE1-CG1 4.48Å; F347-T385 HydrophobicContact CB-CG2 4.21Å; F347-T385 HydrophobicContact CD2-CG2 3.63Å; F347-T385 HydrophobicContact CE2-CG2 4.2Å; F347-T385 HydrophobicContact CG-CG2 3.97Å; F347-G387 VanDerWaalsContact CE1-CA 3.47Å; F347-G387 VanDerWaalsContact CZ-CA 3.42Å
348	T	93.9	Very high	90.8	Very high	57 Å²	57	64.3 Å²	64.3	35%	0.35	34%	0.335	S	S	.	.	H	α-helix	trans	-59.4	-38.6	-179.8	-57.8	0	0	0	0	111.7	K344 D345 V346 P352 A355 I358	K344-T348 WeakPolarHBondContact O-CB 3.24Å; K344-T348 PolarHBondContact O-N 2.95Å; K344-T348 PolarHBondContact O-OG1 2.83Å; D345-T348 PolarHBondContact O-N 3.44Å; V346-T348 VanDerWaalsContact C-N 3.32Å; V346-T348 PolarHBondContact O-N 3.41Å; T348-P352 VanDerWaalsContact O-CA 3.3Å; T348-P352 WeakPolarHBondContact O-CA 3.42Å; T348-A355 HydrophobicContact CG2-CB 3.91Å; T348-I358 VanDerWaalsContact OG1-CD1 3.23Å; T348-I358 WeakPolarHBondContact OG1-CD1 3.32Å
349	K	93.4	Very high	91.3	Very high	170 Å²	170	61.8 Å²	61.8	74%	0.739	32%	0.32	S	S	*	.	H	α-helix	trans	-70.8	-41.1	177	-69.5	171.2	-175.4	175.6	0	112.1	D345 V346 F347	D345-K349 WeakPolarHBondContact O-CG 3.49Å; D345-K349 PolarHBondContact O-N 3.15Å; D345-K349 VanDerWaalsContact O-N 3.17Å; V346-K349 PolarHBondContact O-N 3.16Å; V346-K349 VanDerWaalsContact O-N 3.16Å; F347-K349 VanDerWaalsContact C-N 3.26Å; F347-K349 PolarHBondContact O-N 3.48Å
350	T	91.1	Very high	91.6	Very high	70 Å²	70	58.4 Å²	58.4	43%	0.429	31%	0.307	S	S	.	.	H	α-helix	trans	-76.4	-35.4	-177.7	-46.3	0	0	0	0	111.8	V346 F347 P352	V346-T350 PolarHBondContact O-N 3.03Å; V346-T350 PolarHBondContact O-OG1 3.15Å; F347-T350 PolarHBondContact O-N 3.32Å; T350-P352 VanDerWaalsContact C-CD 3.48Å
351	H	91.8	Very high	91.7	Very high	44 Å²	44	57.6 Å²	57.6	20%	0.204	30%	0.303	C	S	.	.			trans	-131.4	58.2	-171.4	-59	-9.3	0	0	0	112	S325 V326 F347 A353 Y354	S325-H351 PolarHBondContact OG-CD2 3.14Å; S325-H351 PolarHBondContact OG-NE2 3.03Å; V326-H351 PolarHBondContact O-NE2 3.07Å; F347-H351 HydrophobicContact CD1-CB 4.24Å; F347-H351 HydrophobicContact CE1-CB 3.75Å; F347-H351 AromaticContact CE2-CD2 3.58Å; F347-H351 HydrophobicContact CZ-CB 3.95Å; F347-H351 AromaticContact CZ-CD2 3.62Å; F347-H351 PolarHBondContact O-N 3.26Å; H351-A353 PolarHBondContact O-N 2.85Å; H351-A353 VanDerWaalsContact O-N 3.14Å; H351-Y354 HydrophobicContact CB-CD2 4.47Å; H351-Y354 PolarHBondContact O-N 3.49Å
352	P	93.1	Very high	91.1	Very high	95 Å²	95	57.4 Å²	57.4	62%	0.617	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-60.7	-30.8	-172.3	23.9	-34.7	0	0	0	113.4	T348 T350 Y354 A355	T348-P352 VanDerWaalsContact O-CA 3.3Å; T348-P352 WeakPolarHBondContact O-CA 3.42Å; T350-P352 VanDerWaalsContact C-CD 3.48Å; P352-Y354 PolarHBondContact O-N 3.36Å; P352-A355 WeakPolarHBondContact O-CB 3.4Å; P352-A355 PolarHBondContact O-N 3.3Å
353	A	93.4	Very high	90.2	Very high	68 Å²	68	57.4 Å²	57.4	56%	0.562	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-66	-16.9	177.8	0	0	0	0	0	113.9	H351 K389	H351-A353 PolarHBondContact O-N 2.85Å; H351-A353 VanDerWaalsContact O-N 3.14Å; A353-K389 WeakPolarHBondContact O-CG 3.44Å
354	Y	93.9	Very high	89.4	Confident	43 Å²	43	57.9 Å²	57.9	17%	0.169	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-115.7	19.3	-177.1	-62.2	-86.9	0	0	0	112	E322 H351 P352 G387 F388 K389	E322-Y354 WeakPolarHBondContact O-CE1 3.46Å; H351-Y354 HydrophobicContact CB-CD2 4.47Å; H351-Y354 PolarHBondContact O-N 3.49Å; P352-Y354 PolarHBondContact O-N 3.36Å; Y354-G387 CarbonylContact O-C 3.16Å; Y354-G387 WeakPolarHBondContact O-CA 3.29Å; Y354-F388 CarbonylContact C-O 3.37Å; Y354-F388 PolarHBondContact O-N 3.46Å; Y354-K389 HydrophobicContact CD1-CD 4.34Å; Y354-K389 HydrophobicContact CD1-CG 3.71Å; Y354-K389 HydrophobicContact CE1-CD 3.88Å; Y354-K389 HydrophobicContact CE1-CG 3.77Å; Y354-K389 HydrophobicContact CG-CG 4.46Å; Y354-K389 VanDerWaalsContact CZ-CE 3.46Å; Y354-K389 WeakPolarHBondContact OH-CE 3.31Å; Y354-K389 PolarHBondContact OH-NZ 2.89Å; Y354-K389 VanDerWaalsContact OH-NZ 3.07Å
355	A	93.4	Very high	88.7	Confident	34 Å²	34	59.7 Å²	59.7	28%	0.281	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-92.6	6.3	-175	0	0	0	0	0	113.9	T348 P352 Y357	T348-A355 HydrophobicContact CG2-CB 3.91Å; P352-A355 WeakPolarHBondContact O-CB 3.4Å; P352-A355 PolarHBondContact O-N 3.3Å; A355-Y357 PolarHBondContact O-N 2.89Å
356	E	92.8	Very high	88.5	Confident	119 Å²	119	55.5 Å²	55.5	56%	0.556	30%	0.299	S	S	*	.	S	Bend	trans	-62.9	-35	-179.9	-164.9	180	122.8	0	0	111.5	F388 K391	E356-F388 WeakPolarHBondContact CB-O 3.45Å; E356-F388 PolarHBondContact N-O 2.88Å; E356-K391 HydrophobicContact CG-CB 4.07Å; E356-K391 WeakPolarHBondContact OE1-CB 3.44Å; E356-K391 PolarHBondContact OE1-N 2.86Å
357	Y	93.7	Very high	88.3	Confident	35 Å²	35	54.2 Å²	54.2	14%	0.137	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	132	168.8	-173.2	-82	0	0	0	110	A355 G387 F388 K391 G394 K395 E398	A355-Y357 PolarHBondContact O-N 2.89Å; Y357-G387 WeakPolarHBondContact O-CA 3.38Å; Y357-F388 HydrophobicContact CD1-CD2 4.08Å; Y357-F388 PolarHBondContact O-N 2.68Å; Y357-K391 HydrophobicContact CD2-CG 3.98Å; Y357-K391 HydrophobicContact CG-CG 4.47Å; Y357-G394 VanDerWaalsContact CD1-CA 3.44Å; Y357-G394 WeakPolarHBondContact CE1-O 2.97Å; Y357-K395 HydrophobicContact CD2-CG 4.2Å; Y357-K395 HydrophobicContact CE2-CG 3.84Å; Y357-E398 WeakPolarHBondContact OH-CB 3.24Å; Y357-E398 PolarHBondContact OH-OE1 3.28Å; Y357-E398 PolarHBondContact OH-OE2 3.12Å
358	I	93.9	Very high	88.2	Confident	27 Å²	27	54.7 Å²	54.7	14%	0.138	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	116.8	179.2	-57.8	173.5	0	0	0	108.9	K344 F347 T348 T385 L386	K344-I358 HydrophobicContact CB-CD1 4.42Å; K344-I358 HydrophobicContact CD-CG2 4.46Å; K344-I358 HydrophobicContact CG-CG2 3.9Å; F347-I358 HydrophobicContact CD1-CD1 3.87Å; F347-I358 HydrophobicContact CD1-CG1 4.11Å; F347-I358 HydrophobicContact CE1-CG1 4.48Å; T348-I358 VanDerWaalsContact OG1-CD1 3.23Å; T348-I358 WeakPolarHBondContact OG1-CD1 3.32Å; I358-T385 HydrophobicContact CG2-CG2 3.5Å; I358-L386 CarbonylContact C-O 3.58Å; I358-L386 WeakPolarHBondContact CA-O 3.42Å
359	Y	90.9	Very high	88	Confident	15 Å²	15	52.1 Å²	52.1	6%	0.059	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	139.1	173.3	176.4	-97.7	0	0	0	109.7	D361 T385 L386 L397 E398 S401	Y359-D361 HydrophobicContact CE1-CB 3.85Å; Y359-T385 WeakPolarHBondContact O-CA 3.44Å; Y359-L386 HydrophobicContact CD1-CB 4.44Å; Y359-L386 HydrophobicContact CD1-CD1 4.12Å; Y359-L386 PolarHBondContact N-O 3.29Å; Y359-L386 PolarHBondContact O-N 2.85Å; Y359-L397 HydrophobicContact CD1-CD2 3.65Å; Y359-L397 HydrophobicContact CD1-CG 4.49Å; Y359-L397 HydrophobicContact CD2-CD2 4.38Å; Y359-L397 HydrophobicContact CE1-CD2 3.92Å; Y359-L397 HydrophobicContact CE1-CG 4.43Å; Y359-L397 HydrophobicContact CG-CD2 3.89Å; Y359-E398 HydrophobicContact CD2-CB 4.14Å; Y359-E398 HydrophobicContact CE2-CB 4.3Å; Y359-S401 VanDerWaalsContact OH-CB 3.28Å; Y359-S401 WeakPolarHBondContact OH-CB 3.43Å; Y359-S401 PolarHBondContact OH-OG 3.16Å
360	T	88.8	Confident	87.5	Confident	14 Å²	14	48 Å²	48	9%	0.086	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	122.1	173.9	-55.9	0	0	0	0	107.4	L362 L383 L384	T360-L362 HydrophobicContact CG2-CD2 3.88Å; T360-L362 HydrophobicContact CG2-CG 4.36Å; T360-L362 PolarHBondContact O-N 3.09Å; T360-L362 VanDerWaalsContact O-N 3.15Å; T360-L383 HydrophobicContact CG2-CD1 3.51Å; T360-L383 HydrophobicContact CG2-CD2 3.77Å; T360-L383 HydrophobicContact CG2-CG 3.69Å; T360-L384 WeakPolarHBondContact CA-O 3.32Å
361	D	85.4	Confident	86.9	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.037	25%	0.254	C	S	.	.			trans	-76.4	104.6	176.9	-167.9	-20	0	0	0	109.2	Y359 Q363 T364 H366 L383 L384 Q444	Y359-D361 HydrophobicContact CE1-CB 3.85Å; D361-Q363 PolarHBondContact OD1-N 3.46Å; D361-T364 PolarHBondContact OD1-N 2.91Å; D361-T364 PolarHBondContact OD1-OG1 3.44Å; D361-T364 PolarHBondContact OD2-OG1 3.41Å; D361-H366 IonicContact OD2-NE2 2.88Å; D361-H366 PolarHBondContact OD2-NE2 3.4Å; D361-L383 WeakPolarHBondContact O-CD1 3.3Å; D361-L384 HydrophobicContact CB-CB 4.36Å; D361-L384 PolarHBondContact N-O 3.46Å; D361-Q444 PolarHBondContact OD2-NE2 3.19Å
362	L	77.8	Confident	86.4	Confident	102 Å²	102	45.1 Å²	45.1	53%	0.534	25%	0.246	S	C	.	.			trans	-97.8	-8.7	178.9	-60.8	173.8	0	0	0	112.8	I340 T360 L383	I340-L362 HydrophobicContact CD1-CD1 3.8Å; I340-L362 HydrophobicContact CD1-CD2 3.55Å; I340-L362 HydrophobicContact CD1-CG 4.34Å; I340-L362 HydrophobicContact CG1-CD2 4.13Å; T360-L362 HydrophobicContact CG2-CD2 3.88Å; T360-L362 HydrophobicContact CG2-CG 4.36Å; T360-L362 PolarHBondContact O-N 3.09Å; T360-L362 VanDerWaalsContact O-N 3.15Å; L362-L383 HydrophobicContact CD2-CD1 4.05Å
363	Q	68.6	Low	85.8	Confident	113 Å²	113	44 Å²	44	53%	0.528	23%	0.234	S	C	.	.	S	Bend	trans	-90.5	-25.4	-171.7	-63.9	-174.2	2.1	0	0	111.9	D361 S401	D361-Q363 PolarHBondContact OD1-N 3.46Å; Q363-S401 PolarHBondContact NE2-O 3.16Å; Q363-S401 PolarHBondContact OE1-O 2.66Å
364	T	72.1	Confident	85.2	Confident	17 Å²	17	41.1 Å²	41.1	10%	0.104	21%	0.209	C	C	.	.	S	Bend	trans	-126.6	161.9	-172.4	69.5	0	0	0	0	111.9	D361 H366 Q444	D361-T364 PolarHBondContact OD1-N 2.91Å; D361-T364 PolarHBondContact OD1-OG1 3.44Å; D361-T364 PolarHBondContact OD2-OG1 3.41Å; T364-H366 PolarHBondContact OG1-NE2 3.21Å; T364-Q444 PolarHBondContact OG1-NE2 3.13Å
365	L	77.6	Confident	84.3	Confident	95 Å²	95	43.4 Å²	43.4	50%	0.497	23%	0.231	S	C	.	.			trans	-108.7	122.5	-179.6	-46	170.4	0	0	0	107.2	F331 Q381	F331-L365 HydrophobicContact CE1-CD2 4.46Å; F331-L365 HydrophobicContact CE2-CD2 3.98Å; F331-L365 HydrophobicContact CZ-CB 4.33Å; F331-L365 HydrophobicContact CZ-CD2 3.43Å; F331-L365 VanDerWaalsContact CZ-CD2 3.43Å; F331-L365 HydrophobicContact CZ-CG 4.39Å; L365-Q381 HydrophobicContact CB-CG 4.49Å
366	H	87.5	Confident	83.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-95.6	145.5	-178.9	-65.2	-101.6	0	0	0	112.1	Y328 D361 T364 Q381 Y382 L384 T443 Q444	Y328-H366 HydrophobicContact CE1-CB 4.37Å; D361-H366 IonicContact OD2-NE2 2.88Å; D361-H366 PolarHBondContact OD2-NE2 3.4Å; T364-H366 PolarHBondContact OG1-NE2 3.21Å; H366-Q381 CarbonylContact O-C 3.46Å; H366-Q381 WeakPolarHBondContact O-CA 3.44Å; H366-Y382 VanDerWaalsContact CB-O 3.3Å; H366-Y382 WeakPolarHBondContact CB-O 3.39Å; H366-Y382 PolarHBondContact N-O 2.98Å; H366-Y382 PolarHBondContact O-N 3.43Å; H366-L384 VanDerWaalsContact CD2-CB 3.49Å; H366-L384 WeakPolarHBondContact CD2-CB 3.28Å; H366-L384 WeakPolarHBondContact CE1-CD2 3.45Å; H366-L384 VanDerWaalsContact NE2-CB 3.32Å; H366-L384 WeakPolarHBondContact NE2-CB 3.4Å; H366-T443 CarbonylContact C-O 3.4Å; H366-T443 VanDerWaalsContact CA-O 3.29Å; H366-T443 WeakPolarHBondContact CA-O 3.36Å; H366-T443 PolarHBondContact ND1-OG1 2.89Å; H366-Q444 VanDerWaalsContact CE1-CG 3.43Å; H366-Q444 WeakPolarHBondContact CE1-CG 3.49Å; H366-Q444 PolarHBondContact CE1-NE2 3.4Å; H366-Q444 PolarHBondContact NE2-NE2 3.07Å; H366-Q444 VanDerWaalsContact NE2-NE2 3.1Å
367	M	87.9	Confident	81.9	Confident	14 Å²	14	45.7 Å²	45.7	7%	0.069	24%	0.24	C	C	.	.			trans	-125.6	135.1	-177.9	-64.5	-51.8	-48.5	0	0	110.2	W310 V372 P379 Q380 Q381 T443	W310-M367 WeakPolarHBondContact CZ2-O 3.26Å; M367-V372 HydrophobicContact CB-CG2 3.65Å; M367-V372 HydrophobicContact CE-CG2 3.68Å; M367-P379 HydrophobicContact CE-CB 3.3Å; M367-P379 HydrophobicContact CE-CG 3.34Å; M367-P379 HydrophobicContact SD-CB 4.35Å; M367-P379 HydrophobicContact SD-CG 3.8Å; M367-Q380 WeakPolarHBondContact CE-O 3.43Å; M367-Q380 VanDerWaalsContact SD-O 3.4Å; M367-Q381 HydrophobicContact SD-CB 4.49Å; M367-Q381 HydrophobicContact SD-CG 4.09Å; M367-T443 PolarHBondContact N-O 3.17Å; M367-T443 VanDerWaalsContact O-CB 3.32Å; M367-T443 WeakPolarHBondContact O-CB 3.47Å; M367-T443 WeakPolarHBondContact O-CG2 3.47Å
368	L	90.1	Very high	80.6	Confident	9 Å²	9	48.7 Å²	48.7	5%	0.047	26%	0.264	C	S	.	.			trans	-110.2	145.4	-179.9	-67.2	-177.6	0	0	0	112	Y328 Q370 T371 V372 Y382 T443	Y328-L368 HydrophobicContact CD1-CD1 4.4Å; Y328-L368 HydrophobicContact CD1-CD2 3.9Å; Y328-L368 HydrophobicContact CD1-CG 4.34Å; Y328-L368 HydrophobicContact CD2-CD1 4.31Å; Y328-L368 HydrophobicContact CD2-CD2 4.04Å; Y328-L368 HydrophobicContact CE1-CD2 3.81Å; Y328-L368 HydrophobicContact CE2-CD2 3.97Å; Y328-L368 HydrophobicContact CG-CD1 3.99Å; Y328-L368 HydrophobicContact CG-CD2 4Å; Y328-L368 HydrophobicContact CG-CG 4.38Å; L368-Q370 PolarHBondContact O-N 3Å; L368-T371 PolarHBondContact O-N 3.28Å; L368-T371 VanDerWaalsContact O-N 3.1Å; L368-T371 PolarHBondContact O-OG1 2.91Å; L368-V372 WeakPolarHBondContact O-CG2 3.42Å; L368-V372 PolarHBondContact O-N 3.09Å; L368-Y382 HydrophobicContact CB-CD2 4.33Å; L368-Y382 HydrophobicContact CB-CE2 4.08Å; L368-Y382 HydrophobicContact CD1-CD1 3.92Å; L368-Y382 HydrophobicContact CD1-CD2 4.04Å; L368-Y382 HydrophobicContact CD1-CE1 3.79Å; L368-Y382 HydrophobicContact CD1-CE2 3.94Å; L368-Y382 HydrophobicContact CD1-CG 4.03Å; L368-Y382 HydrophobicContact CG-CD2 3.87Å; L368-Y382 HydrophobicContact CG-CE2 4Å; L368-Y382 HydrophobicContact CG-CG 4.17Å; L368-T443 HydrophobicContact CD2-CG2 3.87Å
369	P	89.8	Confident	79.7	Confident	4 Å²	4	48 Å²	48	3%	0.026	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-28.9	-175.9	12.2	-23.3	0	0	0	114.3	K307 W310 Q311 I314 T371	K307-P369 HydrophobicContact CB-CB 4.11Å; K307-P369 HydrophobicContact CG-CB 4.45Å; K307-P369 WeakPolarHBondContact O-CB 3.42Å; W310-P369 HydrophobicContact CB-CB 4.47Å; W310-P369 HydrophobicContact CD2-CB 3.79Å; W310-P369 HydrophobicContact CD2-CG 3.92Å; W310-P369 HydrophobicContact CE3-CB 3.51Å; W310-P369 HydrophobicContact CE3-CG 4.12Å; W310-P369 HydrophobicContact CG-CB 4.26Å; W310-P369 HydrophobicContact CG-CG 4.2Å; W310-P369 HydrophobicContact CZ3-CB 3.95Å; Q311-P369 HydrophobicContact CB-CB 4.18Å; Q311-P369 HydrophobicContact CB-CG 3.63Å; Q311-P369 HydrophobicContact CG-CG 4.37Å; I314-P369 HydrophobicContact CD1-CG 4.27Å; P369-T371 VanDerWaalsContact C-N 3.35Å
370	Q	83.4	Confident	79.3	Confident	84 Å²	84	51.2 Å²	51.2	39%	0.393	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-28.2	-177.7	-54	81.3	27.2	0	0	113.2	Q311 L368	Q311-Q370 VanDerWaalsContact CG-NE2 3.31Å; L368-Q370 PolarHBondContact O-N 3Å
371	T	79.2	Confident	79.1	Confident	46 Å²	46	52.6 Å²	52.6	28%	0.282	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-4.9	-171.6	63.2	0	0	0	0	113.2	L368 P369 D373 Q380 Y382	L368-T371 PolarHBondContact O-N 3.28Å; L368-T371 VanDerWaalsContact O-N 3.1Å; L368-T371 PolarHBondContact O-OG1 2.91Å; P369-T371 VanDerWaalsContact C-N 3.35Å; T371-D373 PolarHBondContact O-N 2.99Å; T371-Q380 HydrophobicContact CG2-CB 4.47Å; T371-Y382 HydrophobicContact CG2-CE2 4.33Å; T371-Y382 WeakPolarHBondContact CG2-OH 3.09Å; T371-Y382 WeakPolarHBondContact OG1-CE2 3.31Å
372	V	80.9	Confident	79.2	Confident	7 Å²	7	53.6 Å²	53.6	4%	0.042	29%	0.285	C	S	.	.			trans	-70.5	120	174.8	161.8	0	0	0	0	109.3	K307 W310 M367 L368 W374	K307-V372 WeakPolarHBondContact CE-O 3.26Å; K307-V372 PolarHBondContact NZ-O 2.86Å; W310-V372 HydrophobicContact CH2-CG2 4.04Å; W310-V372 HydrophobicContact CZ3-CB 4.39Å; W310-V372 HydrophobicContact CZ3-CG2 4.1Å; M367-V372 HydrophobicContact CB-CG2 3.65Å; M367-V372 HydrophobicContact CE-CG2 3.68Å; L368-V372 WeakPolarHBondContact O-CG2 3.42Å; L368-V372 PolarHBondContact O-N 3.09Å; V372-W374 HydrophobicContact CG1-CD2 3.51Å; V372-W374 HydrophobicContact CG1-CE3 3.78Å; V372-W374 HydrophobicContact CG1-CG 4.17Å; V372-W374 HydrophobicContact CG1-CH2 3.57Å; V372-W374 HydrophobicContact CG1-CZ2 3.34Å; V372-W374 HydrophobicContact CG1-CZ3 3.76Å; V372-W374 HydrophobicContact CG2-CH2 4.09Å; V372-W374 HydrophobicContact CG2-CZ3 4.34Å
373	D	81.8	Confident	79.7	Confident	70 Å²	70	49 Å²	49	37%	0.374	26%	0.261	S	S	.	.			trans	-130.7	106	159.1	174.3	8	0	0	0	107.2	T371 S375 S376	T371-D373 PolarHBondContact O-N 2.99Å; D373-S375 VanDerWaalsContact CG-OG 3.22Å; D373-S375 PolarHBondContact O-N 2.72Å; D373-S375 VanDerWaalsContact O-N 3.17Å; D373-S375 WeakPolarHBondContact OD1-CB 3.25Å; D373-S375 PolarHBondContact OD1-N 2.69Å; D373-S375 PolarHBondContact OD1-OG 2.99Å; D373-S375 PolarHBondContact OD2-OG 3.42Å; D373-S376 WeakPolarHBondContact CB-OG 3.41Å; D373-S376 PolarHBondContact O-N 2.94Å; D373-S376 PolarHBondContact O-OG 3.3Å
374	W	80.2	Confident	80.8	Confident	9 Å²	9	43.7 Å²	43.7	3%	0.034	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-17	-178.8	-52.9	122.9	0	0	0	113.1	D289 Y290 W293 W310 V372 F377 L445	D289-W374 PolarHBondContact OD2-NE1 3.41Å; Y290-W374 AromaticContact CD2-CD2 3.92Å; Y290-W374 HydrophobicContact CD2-CD2 3.92Å; Y290-W374 AromaticContact CD2-CE3 4Å; Y290-W374 HydrophobicContact CD2-CE3 4Å; Y290-W374 HydrophobicContact CD2-CG 4.47Å; Y290-W374 HydrophobicContact CD2-CH2 4.41Å; Y290-W374 HydrophobicContact CD2-CZ2 4.28Å; Y290-W374 HydrophobicContact CD2-CZ3 4.29Å; Y290-W374 HydrophobicContact CE2-CE3 4.45Å; W293-W374 HydrophobicContact CB-CB 4.09Å; W293-W374 HydrophobicContact CB-CG 4.09Å; W293-W374 HydrophobicContact CD2-CB 3.39Å; W293-W374 HydrophobicContact CD2-CG 4.11Å; W293-W374 HydrophobicContact CE3-CB 3.95Å; W293-W374 HydrophobicContact CE3-CG 4.41Å; W293-W374 HydrophobicContact CG-CB 3.4Å; W293-W374 VanDerWaalsContact CG-CB 3.4Å; W293-W374 AromaticContact CG-CD1 3.94Å; W293-W374 AromaticContact CG-CG 3.94Å; W293-W374 HydrophobicContact CG-CG 3.94Å; W293-W374 HydrophobicContact CZ2-CB 4.32Å; W293-W374 VanDerWaalsContact CZ2-O 3.3Å; W293-W374 WeakPolarHBondContact CZ2-O 3.5Å; W310-W374 HydrophobicContact CZ3-CZ2 4.41Å; V372-W374 HydrophobicContact CG1-CD2 3.51Å; V372-W374 HydrophobicContact CG1-CE3 3.78Å; V372-W374 HydrophobicContact CG1-CG 4.17Å; V372-W374 HydrophobicContact CG1-CH2 3.57Å; V372-W374 HydrophobicContact CG1-CZ2 3.34Å; V372-W374 HydrophobicContact CG1-CZ3 3.76Å; V372-W374 HydrophobicContact CG2-CH2 4.09Å; V372-W374 HydrophobicContact CG2-CZ3 4.34Å; W374-F377 WeakPolarHBondContact O-CE2 3.41Å; W374-L445 HydrophobicContact CE3-CD1 3.96Å; W374-L445 HydrophobicContact CH2-CD1 3.33Å; W374-L445 HydrophobicContact CH2-CD2 4.48Å; W374-L445 HydrophobicContact CH2-CG 3.98Å; W374-L445 HydrophobicContact CZ2-CD1 4.29Å; W374-L445 HydrophobicContact CZ3-CD1 3.14Å; W374-L445 HydrophobicContact CZ3-CG 4.22Å
375	S	74	Confident	81.8	Confident	90 Å²	90	42.9 Å²	42.9	63%	0.629	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-18	173.9	73.5	0	0	0	0	113.3	D373	D373-S375 VanDerWaalsContact CG-OG 3.22Å; D373-S375 PolarHBondContact O-N 2.72Å; D373-S375 VanDerWaalsContact O-N 3.17Å; D373-S375 WeakPolarHBondContact OD1-CB 3.25Å; D373-S375 PolarHBondContact OD1-N 2.69Å; D373-S375 PolarHBondContact OD1-OG 2.99Å; D373-S375 PolarHBondContact OD2-OG 3.42Å
376	S	70	Confident	82.5	Confident	50 Å²	50	38.3 Å²	38.3	35%	0.35	21%	0.208	S	C	.	.	S	Bend	trans	-103.7	123.5	178.8	75.3	0	0	0	0	110.7	D373 P379	D373-S376 WeakPolarHBondContact CB-OG 3.41Å; D373-S376 PolarHBondContact O-N 2.94Å; D373-S376 PolarHBondContact O-OG 3.3Å; S376-P379 WeakPolarHBondContact O-CD 3.34Å
377	F	66.4	Low	82.9	Confident	151 Å²	151	38.3 Å²	38.3	66%	0.662	21%	0.208	S	C	*	.	S	Bend	trans	-122.1	133.5	-178.9	-91.5	-86	0	0	0	112.7	W293 W374	W293-F377 HydrophobicContact CH2-CE2 4.4Å; W293-F377 HydrophobicContact CZ2-CE2 4.5Å; W374-F377 WeakPolarHBondContact O-CE2 3.41Å
378	P	67.3	Low	83.1	Confident	99 Å²	99	37.7 Å²	37.7	64%	0.643	20%	0.204	S	C	*	.	S	Bend	cis	-77.6	141	-11.1	31.4	-31.9	0	0	0	111.2
379	P	74.4	Confident	83.2	Confident	13 Å²	13	41.7 Å²	41.7	8%	0.084	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-68.5	160.9	173.7	33	-37.6	0	0	0	110.4	M367 S376 Q381	M367-P379 HydrophobicContact CE-CB 3.3Å; M367-P379 HydrophobicContact CE-CG 3.34Å; M367-P379 HydrophobicContact SD-CB 4.35Å; M367-P379 HydrophobicContact SD-CG 3.8Å; S376-P379 WeakPolarHBondContact O-CD 3.34Å; P379-Q381 WeakPolarHBondContact O-CG 3.33Å; P379-Q381 PolarHBondContact O-N 3.49Å
380	Q	82.8	Confident	83.1	Confident	81 Å²	81	44.2 Å²	44.2	38%	0.379	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-59	120	-175.7	175.4	60.5	59.9	0	0	111.9	F331 M367 T371 Y382	F331-Q380 PolarHBondContact O-NE2 2.9Å; M367-Q380 WeakPolarHBondContact CE-O 3.43Å; M367-Q380 VanDerWaalsContact SD-O 3.4Å; T371-Q380 HydrophobicContact CG2-CB 4.47Å; Q380-Y382 HydrophobicContact CB-CE2 4.42Å; Q380-Y382 HydrophobicContact CG-CE2 3.76Å; Q380-Y382 WeakPolarHBondContact O-CD2 3.41Å; Q380-Y382 WeakPolarHBondContact O-CE2 3.35Å
381	Q	84.8	Confident	83.4	Confident	43 Å²	43	44.6 Å²	44.6	20%	0.201	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	150.2	-173.8	-51.2	-179.6	-16	0	0	111.9	F331 L365 H366 M367 P379	F331-Q381 HydrophobicContact CD1-CB 4.06Å; F331-Q381 WeakPolarHBondContact CD1-O 3.49Å; F331-Q381 VanDerWaalsContact CE1-C 3.47Å; F331-Q381 HydrophobicContact CE1-CB 3.32Å; F331-Q381 HydrophobicContact CE2-CB 3.86Å; F331-Q381 HydrophobicContact CZ-CB 3.18Å; F331-Q381 HydrophobicContact CZ-CG 4.11Å; F331-Q381 PolarHBondContact N-O 3.08Å; L365-Q381 HydrophobicContact CB-CG 4.49Å; H366-Q381 CarbonylContact O-C 3.46Å; H366-Q381 WeakPolarHBondContact O-CA 3.44Å; M367-Q381 HydrophobicContact SD-CB 4.49Å; M367-Q381 HydrophobicContact SD-CG 4.09Å; P379-Q381 WeakPolarHBondContact O-CG 3.33Å; P379-Q381 PolarHBondContact O-N 3.49Å
382	Y	87.5	Confident	83.8	Confident	29 Å²	29	47.1 Å²	47.1	11%	0.114	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.4	-179.2	-66.5	-96.1	0	0	0	112.1	T329 P330 F331 H366 L368 T371 Q380	T329-Y382 CarbonylContact O-C 3.58Å; T329-Y382 WeakPolarHBondContact O-CA 3.33Å; P330-Y382 HydrophobicContact CB-CD1 4.36Å; P330-Y382 HydrophobicContact CB-CE1 4.11Å; P330-Y382 HydrophobicContact CG-CD1 4.27Å; P330-Y382 HydrophobicContact CG-CE1 3.84Å; F331-Y382 VanDerWaalsContact CD1-C 3.43Å; F331-Y382 VanDerWaalsContact CE1-N 3.34Å; F331-Y382 WeakPolarHBondContact CE1-O 3.46Å; H366-Y382 VanDerWaalsContact CB-O 3.3Å; H366-Y382 WeakPolarHBondContact CB-O 3.39Å; H366-Y382 PolarHBondContact N-O 2.98Å; H366-Y382 PolarHBondContact O-N 3.43Å; L368-Y382 HydrophobicContact CB-CD2 4.33Å; L368-Y382 HydrophobicContact CB-CE2 4.08Å; L368-Y382 HydrophobicContact CD1-CD1 3.92Å; L368-Y382 HydrophobicContact CD1-CD2 4.04Å; L368-Y382 HydrophobicContact CD1-CE1 3.79Å; L368-Y382 HydrophobicContact CD1-CE2 3.94Å; L368-Y382 HydrophobicContact CD1-CG 4.03Å; L368-Y382 HydrophobicContact CG-CD2 3.87Å; L368-Y382 HydrophobicContact CG-CE2 4Å; L368-Y382 HydrophobicContact CG-CG 4.17Å; T371-Y382 HydrophobicContact CG2-CE2 4.33Å; T371-Y382 WeakPolarHBondContact CG2-OH 3.09Å; T371-Y382 WeakPolarHBondContact OG1-CE2 3.31Å; Q380-Y382 HydrophobicContact CB-CE2 4.42Å; Q380-Y382 HydrophobicContact CG-CE2 3.76Å; Q380-Y382 WeakPolarHBondContact O-CD2 3.41Å; Q380-Y382 WeakPolarHBondContact O-CE2 3.35Å
383	L	88.3	Confident	83.9	Confident	6 Å²	6	47.1 Å²	47.1	3%	0.031	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	119.2	168.6	-179.6	64.8	0	0	0	108	T329 F331 I335 V343 T360 D361 L362	T329-L383 PolarHBondContact N-O 2.86Å; T329-L383 PolarHBondContact O-N 3.3Å; F331-L383 HydrophobicContact CD1-CB 4.23Å; I335-L383 HydrophobicContact CD1-CB 4.11Å; I335-L383 HydrophobicContact CD1-CD1 3.59Å; I335-L383 HydrophobicContact CD1-CD2 3.82Å; I335-L383 HydrophobicContact CD1-CG 4.05Å; V343-L383 HydrophobicContact CG1-CD2 4.39Å; V343-L383 HydrophobicContact CG2-CD2 4.44Å; T360-L383 HydrophobicContact CG2-CD1 3.51Å; T360-L383 HydrophobicContact CG2-CD2 3.77Å; T360-L383 HydrophobicContact CG2-CG 3.69Å; D361-L383 WeakPolarHBondContact O-CD1 3.3Å; L362-L383 HydrophobicContact CD2-CD1 4.05Å
384	L	91	Very high	84.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	123.6	174.9	177.4	63.9	0	0	0	110.1	V326 Y328 T360 D361 H366 L386 F439 I440	V326-L384 HydrophobicContact CG1-CD1 3.43Å; V326-L384 VanDerWaalsContact CG1-CD1 3.43Å; Y328-L384 HydrophobicContact CD1-CD1 4.11Å; Y328-L384 HydrophobicContact CE1-CB 4.46Å; Y328-L384 HydrophobicContact CE1-CD1 3.61Å; Y328-L384 HydrophobicContact CE2-CD1 4.47Å; T360-L384 WeakPolarHBondContact CA-O 3.32Å; D361-L384 HydrophobicContact CB-CB 4.36Å; D361-L384 PolarHBondContact N-O 3.46Å; H366-L384 VanDerWaalsContact CD2-CB 3.49Å; H366-L384 WeakPolarHBondContact CD2-CB 3.28Å; H366-L384 WeakPolarHBondContact CE1-CD2 3.45Å; H366-L384 VanDerWaalsContact NE2-CB 3.32Å; H366-L384 WeakPolarHBondContact NE2-CB 3.4Å; L384-L386 HydrophobicContact CD1-CD2 4Å; L384-L386 HydrophobicContact CD1-CG 4.38Å; L384-L386 HydrophobicContact CD2-CD1 4.29Å; L384-L386 HydrophobicContact CD2-CD2 4.33Å; L384-L386 HydrophobicContact CD2-CG 4.23Å; L384-L386 HydrophobicContact CG-CD2 4.26Å; L384-L386 HydrophobicContact CG-CG 4.12Å; L384-F439 HydrophobicContact CD1-CE1 4.4Å; L384-I440 HydrophobicContact CD2-CB 4.26Å; L384-I440 HydrophobicContact CD2-CG1 3.78Å; L384-I440 HydrophobicContact CD2-CG2 4.31Å
385	T	92.4	Very high	84.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.3	169.1	-56.7	0	0	0	0	109.4	V326 M327 V343 F347 I358 Y359	V326-T385 WeakPolarHBondContact CA-O 3.44Å; M327-T385 PolarHBondContact N-O 2.95Å; M327-T385 PolarHBondContact O-N 3.3Å; V343-T385 WeakPolarHBondContact CG1-OG1 3.28Å; F347-T385 HydrophobicContact CB-CG2 4.21Å; F347-T385 HydrophobicContact CD2-CG2 3.63Å; F347-T385 HydrophobicContact CE2-CG2 4.2Å; F347-T385 HydrophobicContact CG-CG2 3.97Å; I358-T385 HydrophobicContact CG2-CG2 3.5Å; Y359-T385 WeakPolarHBondContact O-CA 3.44Å
386	L	93.4	Very high	84.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.6	177	-62.4	174.7	0	0	0	109.4	F324 S325 V326 I358 Y359 L384 F388 L397 I436 F439 I440	F324-L386 HydrophobicContact CD2-CD2 4Å; F324-L386 HydrophobicContact CE2-CD2 4.38Å; S325-L386 WeakPolarHBondContact O-CA 3.15Å; V326-L386 HydrophobicContact CB-CD2 4.32Å; V326-L386 HydrophobicContact CG1-CD2 4.22Å; V326-L386 HydrophobicContact CG2-CD2 3.69Å; I358-L386 CarbonylContact C-O 3.58Å; I358-L386 WeakPolarHBondContact CA-O 3.42Å; Y359-L386 HydrophobicContact CD1-CB 4.44Å; Y359-L386 HydrophobicContact CD1-CD1 4.12Å; Y359-L386 PolarHBondContact N-O 3.29Å; Y359-L386 PolarHBondContact O-N 2.85Å; L384-L386 HydrophobicContact CD1-CD2 4Å; L384-L386 HydrophobicContact CD1-CG 4.38Å; L384-L386 HydrophobicContact CD2-CD1 4.29Å; L384-L386 HydrophobicContact CD2-CD2 4.33Å; L384-L386 HydrophobicContact CD2-CG 4.23Å; L384-L386 HydrophobicContact CG-CD2 4.26Å; L384-L386 HydrophobicContact CG-CG 4.12Å; L386-F388 HydrophobicContact CB-CE2 3.77Å; L386-F388 HydrophobicContact CB-CZ 3.81Å; L386-F388 HydrophobicContact CD1-CZ 4.09Å; L386-L397 HydrophobicContact CD1-CD2 3.81Å; L386-I436 HydrophobicContact CD1-CG2 4.05Å; L386-F439 HydrophobicContact CD2-CD1 4.35Å; L386-F439 HydrophobicContact CD2-CE1 4.26Å; L386-I440 HydrophobicContact CD1-CD1 3.65Å; L386-I440 HydrophobicContact CD1-CG1 3.66Å
387	G	94.6	Very high	85.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	143	169.4	0	0	0	0	0	110.6	F324 S325 F347 Y354 Y357	F324-G387 CarbonylContact C-O 3.46Å; F324-G387 WeakPolarHBondContact CA-O 3.25Å; F324-G387 WeakPolarHBondContact CB-O 3.4Å; S325-G387 PolarHBondContact N-O 2.69Å; S325-G387 PolarHBondContact O-N 2.93Å; F347-G387 VanDerWaalsContact CE1-CA 3.47Å; F347-G387 VanDerWaalsContact CZ-CA 3.42Å; Y354-G387 CarbonylContact O-C 3.16Å; Y354-G387 WeakPolarHBondContact O-CA 3.29Å; Y357-G387 WeakPolarHBondContact O-CA 3.38Å
388	F	94.1	Very high	86.4	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	142.7	-179.4	-61.2	-83	0	0	0	111.4	F324 Y354 E356 Y357 L386 N390 D393 L397 I436	F324-F388 HydrophobicContact CB-CD1 3.7Å; F324-F388 HydrophobicContact CB-CE1 3.58Å; F324-F388 HydrophobicContact CB-CZ 4.42Å; F324-F388 HydrophobicContact CG-CE1 4.38Å; Y354-F388 CarbonylContact C-O 3.37Å; Y354-F388 PolarHBondContact O-N 3.46Å; E356-F388 WeakPolarHBondContact CB-O 3.45Å; E356-F388 PolarHBondContact N-O 2.88Å; Y357-F388 HydrophobicContact CD1-CD2 4.08Å; Y357-F388 PolarHBondContact O-N 2.68Å; L386-F388 HydrophobicContact CB-CE2 3.77Å; L386-F388 HydrophobicContact CB-CZ 3.81Å; L386-F388 HydrophobicContact CD1-CZ 4.09Å; F388-N390 VanDerWaalsContact C-N 3.33Å; F388-N390 WeakPolarHBondContact CB-O 3.34Å; F388-D393 HydrophobicContact CD1-CB 4.26Å; F388-L397 HydrophobicContact CE2-CD2 4.15Å; F388-L397 HydrophobicContact CZ-CD2 3.69Å; F388-I436 HydrophobicContact CD1-CD1 4.35Å; F388-I436 HydrophobicContact CE1-CD1 3.56Å; F388-I436 HydrophobicContact CE1-CG1 4.23Å; F388-I436 HydrophobicContact CE1-CG2 4.33Å; F388-I436 HydrophobicContact CZ-CD1 4.37Å; F388-I436 HydrophobicContact CZ-CG2 4.27Å
389	K	91.4	Very high	87.1	Confident	93 Å²	93	37.2 Å²	37.2	40%	0.404	17%	0.171	S	C	.	.	S	Bend	trans	-69.8	-33	165.8	-80.2	176.3	-173.9	154	0	112	E322 S323 A353 Y354	E322-K389 WeakPolarHBondContact O-CD 3.46Å; E322-K389 WeakPolarHBondContact O-CE 3.45Å; E322-K389 PolarHBondContact O-NZ 3.25Å; S323-K389 PolarHBondContact O-N 3.32Å; A353-K389 WeakPolarHBondContact O-CG 3.44Å; Y354-K389 HydrophobicContact CD1-CD 4.34Å; Y354-K389 HydrophobicContact CD1-CG 3.71Å; Y354-K389 HydrophobicContact CE1-CD 3.88Å; Y354-K389 HydrophobicContact CE1-CG 3.77Å; Y354-K389 HydrophobicContact CG-CG 4.46Å; Y354-K389 VanDerWaalsContact CZ-CE 3.46Å; Y354-K389 WeakPolarHBondContact OH-CE 3.31Å; Y354-K389 PolarHBondContact OH-NZ 2.89Å; Y354-K389 VanDerWaalsContact OH-NZ 3.07Å
390	N	88.3	Confident	87.3	Confident	57 Å²	57	36.7 Å²	36.7	31%	0.305	17%	0.168	S	C	.	.	S	Bend	trans	-111.1	119.4	-178.7	-179.6	-7.1	0	0	0	109.9	F388 E392 D393	F388-N390 VanDerWaalsContact C-N 3.33Å; F388-N390 WeakPolarHBondContact CB-O 3.34Å; N390-E392 PolarHBondContact O-N 3.36Å; N390-E392 PolarHBondContact OD1-N 3.05Å; N390-D393 PolarHBondContact O-N 3.03Å
391	K	89.6	Confident	87	Confident	92 Å²	92	33.3 Å²	33.3	40%	0.4	15%	0.153	S	C	.	.	H	α-helix	trans	-58.3	-31.7	179	-172.6	175.1	-169.1	167	0	114.3	E356 Y357 K395	E356-K391 HydrophobicContact CG-CB 4.07Å; E356-K391 WeakPolarHBondContact OE1-CB 3.44Å; E356-K391 PolarHBondContact OE1-N 2.86Å; Y357-K391 HydrophobicContact CD2-CG 3.98Å; Y357-K391 HydrophobicContact CG-CG 4.47Å; K391-K395 HydrophobicContact CG-CD 4.24Å; K391-K395 HydrophobicContact CG-CG 4.44Å; K391-K395 WeakPolarHBondContact O-CG 3.5Å; K391-K395 PolarHBondContact O-N 3.23Å; K391-K395 VanDerWaalsContact O-N 3.08Å
392	E	85.9	Confident	86.5	Confident	100 Å²	100	35 Å²	35	47%	0.467	17%	0.169	S	C	.	.	H	α-helix	trans	-71.3	-32.8	-177	-60.6	-51.1	138.9	0	0	112.3	N390 K395 F396	N390-E392 PolarHBondContact O-N 3.36Å; N390-E392 PolarHBondContact OD1-N 3.05Å; E392-K395 IonicContact OE1-NZ 3.49Å; E392-K395 PolarHBondContact OE1-NZ 3.22Å; E392-K395 WeakPolarHBondContact OE2-CD 3Å; E392-K395 IonicContact OE2-NZ 2.69Å; E392-K395 PolarHBondContact OE2-NZ 2.99Å; E392-F396 VanDerWaalsContact O-CB 3.29Å; E392-F396 WeakPolarHBondContact O-CB 3.24Å; E392-F396 PolarHBondContact O-N 3.27Å
393	D	84.3	Confident	85.9	Confident	7 Å²	7	35.2 Å²	35.2	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-66.2	-45.2	177.1	-62.5	-17.7	0	0	0	110.4	F388 N390 F396 L397 R432	F388-D393 HydrophobicContact CD1-CB 4.26Å; N390-D393 PolarHBondContact O-N 3.03Å; D393-F396 PolarHBondContact O-N 2.86Å; D393-L397 PolarHBondContact O-N 3.4Å; D393-R432 IonicContact OD1-CZ 3.94Å; D393-R432 IonicContact OD1-NE 3.73Å; D393-R432 IonicContact OD1-NH1 3.62Å; D393-R432 PolarHBondContact OD1-NH1 3.41Å
394	G	86.4	Confident	85.2	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.5	-41.6	177.3	0	0	0	0	0	113.6	Y357 F396 L397 E398	Y357-G394 VanDerWaalsContact CD1-CA 3.44Å; Y357-G394 WeakPolarHBondContact CE1-O 2.97Å; G394-F396 VanDerWaalsContact C-N 3.31Å; G394-F396 PolarHBondContact O-N 3.38Å; G394-L397 PolarHBondContact O-N 2.91Å; G394-E398 PolarHBondContact O-N 3.46Å
395	K	86	Confident	84.3	Confident	62 Å²	62	44.5 Å²	44.5	27%	0.27	21%	0.212	S	C	.	.	H	α-helix	trans	-62.8	-38	172.5	-75.2	170.6	179.1	165	0	112.3	Y357 K391 E392 K399	Y357-K395 HydrophobicContact CD2-CG 4.2Å; Y357-K395 HydrophobicContact CE2-CG 3.84Å; K391-K395 HydrophobicContact CG-CD 4.24Å; K391-K395 HydrophobicContact CG-CG 4.44Å; K391-K395 WeakPolarHBondContact O-CG 3.5Å; K391-K395 PolarHBondContact O-N 3.23Å; K391-K395 VanDerWaalsContact O-N 3.08Å; E392-K395 IonicContact OE1-NZ 3.49Å; E392-K395 PolarHBondContact OE1-NZ 3.22Å; E392-K395 WeakPolarHBondContact OE2-CD 3Å; E392-K395 IonicContact OE2-NZ 2.69Å; E392-K395 PolarHBondContact OE2-NZ 2.99Å; K395-K399 VanDerWaalsContact O-CG 3.28Å; K395-K399 WeakPolarHBondContact O-CG 3.41Å; K395-K399 PolarHBondContact O-N 3.04Å
396	F	82.2	Confident	83.2	Confident	15 Å²	15	44.6 Å²	44.6	7%	0.066	21%	0.213	C	C	.	.	H	α-helix	trans	-66.6	-44.2	178.8	-176	-88.5	0	0	0	110.5	E392 D393 G394 E398 K399 I400 I407 T409 M429 I433	E392-F396 VanDerWaalsContact O-CB 3.29Å; E392-F396 WeakPolarHBondContact O-CB 3.24Å; E392-F396 PolarHBondContact O-N 3.27Å; D393-F396 PolarHBondContact O-N 2.86Å; G394-F396 VanDerWaalsContact C-N 3.31Å; G394-F396 PolarHBondContact O-N 3.38Å; F396-E398 PolarHBondContact O-N 3.45Å; F396-K399 WeakPolarHBondContact O-CB 3.3Å; F396-K399 PolarHBondContact O-N 3.46Å; F396-I400 HydrophobicContact CD1-CD1 3.71Å; F396-I400 HydrophobicContact CD1-CG1 4.22Å; F396-I400 HydrophobicContact CE1-CD1 3.11Å; F396-I400 HydrophobicContact CE1-CG1 3.86Å; F396-I400 HydrophobicContact CZ-CD1 3.8Å; F396-I400 HydrophobicContact CZ-CG1 4.29Å; F396-I400 PolarHBondContact O-N 3.26Å; F396-I407 HydrophobicContact CE2-CG2 4.29Å; F396-T409 HydrophobicContact CD2-CG2 3.5Å; F396-T409 HydrophobicContact CE2-CG2 3.44Å; F396-T409 VanDerWaalsContact CE2-CG2 3.44Å; F396-T409 WeakPolarHBondContact CE2-OG1 3.27Å; F396-M429 HydrophobicContact CE1-CE 4.42Å; F396-M429 HydrophobicContact CZ-CE 3.96Å; F396-I433 HydrophobicContact CB-CD1 4.23Å; F396-I433 HydrophobicContact CD1-CB 4.29Å; F396-I433 HydrophobicContact CD1-CD1 3.27Å; F396-I433 HydrophobicContact CD1-CG1 3.43Å; F396-I433 VanDerWaalsContact CD1-CG1 3.43Å; F396-I433 HydrophobicContact CD1-CG2 3.92Å; F396-I433 HydrophobicContact CE1-CB 4.01Å; F396-I433 HydrophobicContact CE1-CD1 3.86Å; F396-I433 HydrophobicContact CE1-CG1 3.42Å; F396-I433 VanDerWaalsContact CE1-CG1 3.42Å; F396-I433 HydrophobicContact CE1-CG2 3.54Å; F396-I433 HydrophobicContact CG-CD1 4.02Å; F396-I433 HydrophobicContact CG-CG1 4.36Å; F396-I433 HydrophobicContact CZ-CG1 4.42Å
397	L	84.1	Confident	82.1	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-58.4	-47.8	173.3	-179.5	68.2	0	0	0	111.9	Y359 L386 F388 D393 G394 K399 I400 S401 I436 L437 I440	Y359-L397 HydrophobicContact CD1-CD2 3.65Å; Y359-L397 HydrophobicContact CD1-CG 4.49Å; Y359-L397 HydrophobicContact CD2-CD2 4.38Å; Y359-L397 HydrophobicContact CE1-CD2 3.92Å; Y359-L397 HydrophobicContact CE1-CG 4.43Å; Y359-L397 HydrophobicContact CG-CD2 3.89Å; L386-L397 HydrophobicContact CD1-CD2 3.81Å; F388-L397 HydrophobicContact CE2-CD2 4.15Å; F388-L397 HydrophobicContact CZ-CD2 3.69Å; D393-L397 PolarHBondContact O-N 3.4Å; G394-L397 PolarHBondContact O-N 2.91Å; L397-K399 VanDerWaalsContact C-N 3.26Å; L397-K399 PolarHBondContact O-N 3.29Å; L397-I400 PolarHBondContact O-N 3.28Å; L397-I400 VanDerWaalsContact O-N 3.07Å; L397-S401 PolarHBondContact O-N 3.02Å; L397-S401 PolarHBondContact O-OG 2.69Å; L397-I436 HydrophobicContact CD1-CG2 4.24Å; L397-I436 HydrophobicContact CD2-CG2 3.94Å; L397-L437 HydrophobicContact CD1-CD2 3.63Å; L397-I440 HydrophobicContact CD1-CD1 3.69Å; L397-I440 HydrophobicContact CD2-CD1 3.8Å; L397-I440 HydrophobicContact CG-CD1 4.32Å
398	E	84.9	Confident	80.9	Confident	101 Å²	101	45.3 Å²	45.3	47%	0.472	22%	0.216	S	C	.	.	H	α-helix	trans	-57	-41.3	177.7	-176.8	-179.5	-141.7	0	0	111.7	Y357 Y359 G394 F396 S401 S402	Y357-E398 WeakPolarHBondContact OH-CB 3.24Å; Y357-E398 PolarHBondContact OH-OE1 3.28Å; Y357-E398 PolarHBondContact OH-OE2 3.12Å; Y359-E398 HydrophobicContact CD2-CB 4.14Å; Y359-E398 HydrophobicContact CE2-CB 4.3Å; G394-E398 PolarHBondContact O-N 3.46Å; F396-E398 PolarHBondContact O-N 3.45Å; E398-S401 PolarHBondContact O-N 3.21Å; E398-S402 WeakPolarHBondContact O-CB 3.38Å; E398-S402 PolarHBondContact O-N 3.17Å; E398-S402 PolarHBondContact O-OG 2.65Å
399	K	82.2	Confident	79.1	Confident	81 Å²	81	46.7 Å²	46.7	35%	0.352	22%	0.224	S	C	.	.	H	α-helix	trans	-60.8	-49	174.4	-71.7	170.5	-176.5	174.9	0	111.1	K395 F396 L397 S401 S402 R403 I407	K395-K399 VanDerWaalsContact O-CG 3.28Å; K395-K399 WeakPolarHBondContact O-CG 3.41Å; K395-K399 PolarHBondContact O-N 3.04Å; F396-K399 WeakPolarHBondContact O-CB 3.3Å; F396-K399 PolarHBondContact O-N 3.46Å; L397-K399 VanDerWaalsContact C-N 3.26Å; L397-K399 PolarHBondContact O-N 3.29Å; K399-S401 VanDerWaalsContact C-N 3.34Å; K399-S401 PolarHBondContact O-N 2.9Å; K399-S402 PolarHBondContact O-N 3.42Å; K399-S402 VanDerWaalsContact O-N 3.09Å; K399-S402 PolarHBondContact O-OG 3.43Å; K399-R403 WeakPolarHBondContact O-CG 3.34Å; K399-R403 PolarHBondContact O-N 3.08Å; K399-I407 HydrophobicContact CB-CD1 3.58Å; K399-I407 VanDerWaalsContact O-CD1 3.29Å; K399-I407 WeakPolarHBondContact O-CD1 3.3Å
400	I	79.8	Confident	77.3	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-56.1	-49.5	179.8	-74	-177	0	0	0	110.6	F396 L397 S402 R403 I407 I433 L437 E457	F396-I400 HydrophobicContact CD1-CD1 3.71Å; F396-I400 HydrophobicContact CD1-CG1 4.22Å; F396-I400 HydrophobicContact CE1-CD1 3.11Å; F396-I400 HydrophobicContact CE1-CG1 3.86Å; F396-I400 HydrophobicContact CZ-CD1 3.8Å; F396-I400 HydrophobicContact CZ-CG1 4.29Å; F396-I400 PolarHBondContact O-N 3.26Å; L397-I400 PolarHBondContact O-N 3.28Å; L397-I400 VanDerWaalsContact O-N 3.07Å; I400-S402 PolarHBondContact O-N 2.59Å; I400-R403 PolarHBondContact O-N 3.37Å; I400-I407 VanDerWaalsContact CA-CD1 3.42Å; I400-I407 HydrophobicContact CB-CD1 4.3Å; I400-I407 HydrophobicContact CG1-CB 4.45Å; I400-I407 HydrophobicContact CG1-CD1 3.81Å; I400-I407 HydrophobicContact CG1-CG1 4.19Å; I400-I407 VanDerWaalsContact N-CD1 3.26Å; I400-I433 HydrophobicContact CD1-CG2 3.73Å; I400-L437 HydrophobicContact CD1-CD1 4.31Å; I400-L437 HydrophobicContact CG2-CD2 4.24Å; I400-E457 HydrophobicContact CD1-CG 4.08Å; I400-E457 WeakPolarHBondContact CG2-OE1 3.4Å
401	S	76.1	Confident	75.7	Confident	10 Å²	10	46.2 Å²	46.2	7%	0.07	22%	0.222	C	C	.	.	H	α-helix	trans	-64.6	-29	-179.8	-53.4	0	0	0	0	112.7	Y359 Q363 L397 E398 K399	Y359-S401 VanDerWaalsContact OH-CB 3.28Å; Y359-S401 WeakPolarHBondContact OH-CB 3.43Å; Y359-S401 PolarHBondContact OH-OG 3.16Å; Q363-S401 PolarHBondContact NE2-O 3.16Å; Q363-S401 PolarHBondContact OE1-O 2.66Å; L397-S401 PolarHBondContact O-N 3.02Å; L397-S401 PolarHBondContact O-OG 2.69Å; E398-S401 PolarHBondContact O-N 3.21Å; K399-S401 VanDerWaalsContact C-N 3.34Å; K399-S401 PolarHBondContact O-N 2.9Å
402	S	74.7	Confident	73.8	Confident	77 Å²	77	51.7 Å²	51.7	54%	0.538	25%	0.245	S	C	.	.	H	α-helix	trans	-80.6	-12.3	-178.7	70.8	0	0	0	0	114.8	E398 K399 I400	E398-S402 WeakPolarHBondContact O-CB 3.38Å; E398-S402 PolarHBondContact O-N 3.17Å; E398-S402 PolarHBondContact O-OG 2.65Å; K399-S402 PolarHBondContact O-N 3.42Å; K399-S402 VanDerWaalsContact O-N 3.09Å; K399-S402 PolarHBondContact O-OG 3.43Å; I400-S402 PolarHBondContact O-N 2.59Å
403	R	75.3	Confident	72.2	Confident	34 Å²	34	50.9 Å²	50.9	13%	0.128	25%	0.247	C	C	.	.			trans	-116.7	152.5	-170.4	-65.1	-172.3	-169.2	175.3	-4.9	112.6	K399 I400 I407 A451 D535 Y538	K399-R403 WeakPolarHBondContact O-CG 3.34Å; K399-R403 PolarHBondContact O-N 3.08Å; I400-R403 PolarHBondContact O-N 3.37Å; R403-I407 HydrophobicContact CB-CD1 4.23Å; R403-I407 HydrophobicContact CB-CG1 4.47Å; R403-I407 HydrophobicContact CG-CD1 4.16Å; R403-A451 WeakPolarHBondContact O-CB 3.47Å; R403-D535 IonicContact CZ-OD1 2.72Å; R403-D535 IonicContact NH1-OD1 3.69Å; R403-D535 PolarHBondContact NH1-OD1 2.78Å; R403-D535 IonicContact NH1-OD2 3.55Å; R403-Y538 HydrophobicContact CG-CE2 4.3Å
404	K	71.7	Confident	70.6	Confident	157 Å²	157	53.1 Å²	53.1	68%	0.683	26%	0.262	S	S	*	.	S	Bend	trans	-89.3	-29.6	177.4	-67.6	-173.3	177.2	-175	0	113.4	A451	K404-A451 HydrophobicContact CG-CB 4.33Å
405	L	73.1	Confident	69	Low	44 Å²	44	62.1 Å²	62.1	23%	0.23	30%	0.301	C	S	.	.	S	Bend	trans	-103.1	160.8	-179.9	-62.9	-178.3	0	0	0	112	I527 V530 E534	L405-I527 HydrophobicContact CD2-CG2 4.42Å; L405-V530 HydrophobicContact CD1-CB 4.1Å; L405-V530 HydrophobicContact CD1-CG1 3.46Å; L405-V530 VanDerWaalsContact CD1-CG1 3.46Å; L405-E534 VanDerWaalsContact CB-OE2 3.3Å; L405-E534 WeakPolarHBondContact CB-OE2 3.16Å; L405-E534 VanDerWaalsContact CD1-OE2 3.28Å; L405-E534 WeakPolarHBondContact CD1-OE2 3.41Å; L405-E534 WeakPolarHBondContact CG-OE2 3.45Å
406	P	69.1	Low	67.5	Low	3 Å²	3	61.9 Å²	61.9	2%	0.019	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-61.4	146.4	179.7	-16	28	0	0	0	111.6	F408 M456 W524 I527	P406-F408 HydrophobicContact CB-CE2 3.87Å; P406-F408 HydrophobicContact CB-CZ 4.05Å; P406-F408 WeakPolarHBondContact O-CD2 3.37Å; P406-F408 VanDerWaalsContact O-CE2 3.32Å; P406-F408 WeakPolarHBondContact O-CE2 3.47Å; P406-M456 HydrophobicContact CG-CB 4.3Å; P406-W524 HydrophobicContact CB-CH2 4.37Å; P406-W524 HydrophobicContact CG-CH2 3.79Å; P406-W524 HydrophobicContact CG-CZ3 3.95Å; P406-I527 HydrophobicContact CG-CG2 3.8Å
407	I	71.5	Confident	66.6	Low	3 Å²	3	63.8 Å²	63.8	2%	0.015	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-102.2	129	-177.2	-53	-168	0	0	0	110.2	F396 K399 I400 R403 T409 Q460 D535	F396-I407 HydrophobicContact CE2-CG2 4.29Å; K399-I407 HydrophobicContact CB-CD1 3.58Å; K399-I407 VanDerWaalsContact O-CD1 3.29Å; K399-I407 WeakPolarHBondContact O-CD1 3.3Å; I400-I407 VanDerWaalsContact CA-CD1 3.42Å; I400-I407 HydrophobicContact CB-CD1 4.3Å; I400-I407 HydrophobicContact CG1-CB 4.45Å; I400-I407 HydrophobicContact CG1-CD1 3.81Å; I400-I407 HydrophobicContact CG1-CG1 4.19Å; I400-I407 VanDerWaalsContact N-CD1 3.26Å; R403-I407 HydrophobicContact CB-CD1 4.23Å; R403-I407 HydrophobicContact CB-CG1 4.47Å; R403-I407 HydrophobicContact CG-CD1 4.16Å; I407-T409 HydrophobicContact CG2-CG2 3.72Å; I407-Q460 PolarHBondContact O-NE2 3.2Å; I407-Q460 PolarHBondContact O-OE1 3.06Å; I407-D535 WeakPolarHBondContact CA-OD2 3.39Å; I407-D535 VanDerWaalsContact CG2-OD2 3.28Å; I407-D535 WeakPolarHBondContact CG2-OD2 3.2Å
408	F	67.8	Low	66.2	Low	11 Å²	11	66.9 Å²	66.9	5%	0.048	35%	0.347	C	S	.	.			trans	-113.8	72.8	178.1	-57.1	-91.7	0	0	0	108	P406 H411 Q460 Q528 Q532 D535	P406-F408 HydrophobicContact CB-CE2 3.87Å; P406-F408 HydrophobicContact CB-CZ 4.05Å; P406-F408 WeakPolarHBondContact O-CD2 3.37Å; P406-F408 VanDerWaalsContact O-CE2 3.32Å; P406-F408 WeakPolarHBondContact O-CE2 3.47Å; F408-H411 PolarHBondContact O-CE1 3Å; F408-H411 PolarHBondContact O-ND1 2.64Å; F408-Q460 HydrophobicContact CD1-CG 4.44Å; F408-Q460 VanDerWaalsContact CD1-NE2 3.27Å; F408-Q460 HydrophobicContact CE1-CG 3.88Å; F408-Q460 HydrophobicContact CZ-CG 4.47Å; F408-Q528 HydrophobicContact CZ-CB 4.02Å; F408-Q528 HydrophobicContact CZ-CG 4.03Å; F408-Q532 HydrophobicContact CB-CG 4.41Å; F408-Q532 HydrophobicContact CD1-CG 4.17Å; F408-Q532 HydrophobicContact CD2-CG 3.76Å; F408-Q532 HydrophobicContact CE1-CG 4.42Å; F408-Q532 HydrophobicContact CE2-CG 4.03Å; F408-Q532 HydrophobicContact CG-CG 3.85Å; F408-Q532 HydrophobicContact CZ-CG 4.36Å; F408-D535 WeakPolarHBondContact CA-OD2 3.46Å; F408-D535 PolarHBondContact N-OD2 2.93Å
409	T	56.2	Low	66	Low	29 Å²	29	70.8 Å²	70.8	18%	0.178	36%	0.357	C	S	.	.			trans	-67.7	146.7	177.8	52.6	0	0	0	0	112.2	F396 I407 Q425	F396-T409 HydrophobicContact CD2-CG2 3.5Å; F396-T409 HydrophobicContact CE2-CG2 3.44Å; F396-T409 VanDerWaalsContact CE2-CG2 3.44Å; F396-T409 WeakPolarHBondContact CE2-OG1 3.27Å; I407-T409 HydrophobicContact CG2-CG2 3.72Å; T409-Q425 PolarHBondContact O-NE2 3.07Å; T409-Q425 VanDerWaalsContact O-NE2 3.14Å
410	E	54.3	Low	66.1	Low	111 Å²	111	72.8 Å²	72.8	52%	0.519	37%	0.367	S	S	.	.			trans	91.7	36.5	173.7	-52.2	-173.3	167.4	0	0	117	R424	E410-R424 VanDerWaalsContact OE2-CD 3.3Å; E410-R424 WeakPolarHBondContact OE2-CD 3.29Å
411	H	54.8	Low	66.2	Low	30 Å²	30	75.3 Å²	75.3	14%	0.139	38%	0.381	C	S	.	.			trans	-107.8	114.2	175.5	-62	86.5	0	0	0	112	F408 T413 L417 Q425 Q539	F408-H411 PolarHBondContact O-CE1 3Å; F408-H411 PolarHBondContact O-ND1 2.64Å; H411-T413 VanDerWaalsContact C-N 3.31Å; H411-L417 WeakPolarHBondContact NE2-CD1 3.42Å; H411-Q425 PolarHBondContact CE1-NE2 3.48Å; H411-Q425 VanDerWaalsContact CE1-NE2 3.26Å; H411-Q539 PolarHBondContact O-OE1 3.17Å
412	K	50.3	Low	66.5	Low	207 Å²	207	75.1 Å²	75.1	90%	0.9	38%	0.38	S	S	*	.	S	Bend	trans	-80	-17.8	163.1	-72.3	-178	-178.4	173.2	0	112.1
413	T	50.8	Low	67	Low	83 Å²	83	74.1 Å²	74.1	51%	0.509	37%	0.37	S	S	.	.	S	Bend	trans	-142.7	138.8	-178.3	45.5	0	0	0	0	110.7	H411 F415	H411-T413 VanDerWaalsContact C-N 3.31Å; T413-F415 VanDerWaalsContact C-N 3.25Å; T413-F415 PolarHBondContact O-N 2.99Å
414	P	51.3	Low	67.5	Low	53 Å²	53	79.1 Å²	79.1	34%	0.344	39%	0.389	S	S	.	.	S	Bend	trans	-71.9	-9.3	-175.9	21.6	-27.9	0	0	0	115.2
415	F	53.2	Low	68	Low	189 Å²	189	72.2 Å²	72.2	83%	0.829	36%	0.359	S	S	*	.	S	Bend	trans	-135.8	86.1	-171.1	-51.7	-67.3	0	0	0	111.6	T413	T413-F415 VanDerWaalsContact C-N 3.25Å; T413-F415 PolarHBondContact O-N 2.99Å
416	G	54.4	Low	68.7	Low	57 Å²	57	70.5 Å²	70.5	59%	0.588	35%	0.35	S	S	*	.			trans	136.2	103.6	168.9	0	0	0	0	0	112.9
417	L	62.9	Low	69.6	Low	55 Å²	55	74.2 Å²	74.2	29%	0.288	37%	0.367	S	S	.	.			trans	-84.3	132.3	159.4	-87.4	113.3	0	0	0	108.8	H411 D421	H411-L417 WeakPolarHBondContact NE2-CD1 3.42Å; L417-D421 HydrophobicContact CD2-CB 3.95Å
418	T	76.5	Confident	70.2	Confident	67 Å²	67	74.7 Å²	74.7	41%	0.411	37%	0.37	S	S	.	.			trans	-69.7	157.2	160.8	69.3	0	0	0	0	109	E420 D421 T422	T418-E420 PolarHBondContact O-N 3.35Å; T418-D421 PolarHBondContact O-N 3.37Å; T418-D421 VanDerWaalsContact O-N 3.15Å; T418-D421 WeakPolarHBondContact OG1-CB 3.31Å; T418-D421 PolarHBondContact OG1-N 2.89Å; T418-D421 VanDerWaalsContact OG1-N 3.16Å; T418-D421 PolarHBondContact OG1-OD2 2.96Å; T418-T422 PolarHBondContact O-N 2.93Å; T418-T422 PolarHBondContact O-OG1 3.44Å
419	R	80.8	Confident	71	Confident	182 Å²	182	74.5 Å²	74.5	69%	0.687	37%	0.37	S	S	*	.	H	α-helix	trans	-59.4	-37	177.8	-174.9	-178.1	179.8	-150.2	1.2	110.9	T422 V423 L468	R419-T422 WeakPolarHBondContact O-CB 3.38Å; R419-T422 PolarHBondContact O-N 3.38Å; R419-V423 WeakPolarHBondContact O-CG2 3.06Å; R419-V423 PolarHBondContact O-N 2.8Å; R419-L468 HydrophobicContact CG-CD2 4.18Å
420	E	83.1	Confident	72.4	Confident	123 Å²	123	73.9 Å²	73.9	58%	0.575	37%	0.369	S	S	*	.	H	α-helix	trans	-63.8	-41.5	177.8	-65.2	67.7	-147.7	0	0	111.5	T418 V423 R424	T418-E420 PolarHBondContact O-N 3.35Å; E420-V423 PolarHBondContact O-N 3.15Å; E420-R424 PolarHBondContact O-N 2.89Å
421	D	81.7	Confident	73.9	Confident	57 Å²	57	75.4 Å²	75.4	31%	0.305	37%	0.373	S	S	.	.	H	α-helix	trans	-65.8	-41.4	175	-62.3	-36.6	0	0	0	111.1	L417 T418 V423 R424 Q425	L417-D421 HydrophobicContact CD2-CB 3.95Å; T418-D421 PolarHBondContact O-N 3.37Å; T418-D421 VanDerWaalsContact O-N 3.15Å; T418-D421 WeakPolarHBondContact OG1-CB 3.31Å; T418-D421 PolarHBondContact OG1-N 2.89Å; T418-D421 VanDerWaalsContact OG1-N 3.16Å; T418-D421 PolarHBondContact OG1-OD2 2.96Å; D421-V423 VanDerWaalsContact C-N 3.32Å; D421-V423 PolarHBondContact O-N 3.21Å; D421-R424 PolarHBondContact O-N 3.13Å; D421-Q425 WeakPolarHBondContact O-CB 3.45Å; D421-Q425 WeakPolarHBondContact O-CG 3.37Å; D421-Q425 PolarHBondContact O-N 3.26Å
422	T	82.6	Confident	75.2	Confident	6 Å²	6	77.7 Å²	77.7	4%	0.037	38%	0.381	C	S	.	.	H	α-helix	trans	-59.6	-42	175	-56	0	0	0	0	111.5	T418 R419 Q425 M426 L464 Q467 L468	T418-T422 PolarHBondContact O-N 2.93Å; T418-T422 PolarHBondContact O-OG1 3.44Å; R419-T422 WeakPolarHBondContact O-CB 3.38Å; R419-T422 PolarHBondContact O-N 3.38Å; T422-Q425 PolarHBondContact O-N 2.93Å; T422-M426 WeakPolarHBondContact O-CB 3.4Å; T422-M426 PolarHBondContact O-N 3.23Å; T422-L464 HydrophobicContact CG2-CB 4.37Å; T422-L464 HydrophobicContact CG2-CD2 3.87Å; T422-Q467 HydrophobicContact CG2-CB 4.09Å; T422-L468 HydrophobicContact CG2-CD1 4.11Å; T422-L468 HydrophobicContact CG2-CD2 3.85Å; T422-L468 HydrophobicContact CG2-CG 3.74Å
423	V	86.8	Confident	77	Confident	56 Å²	56	67.9 Å²	67.9	34%	0.339	34%	0.338	S	S	.	.	H	α-helix	trans	-62.5	-48.4	176.3	172.5	0	0	0	0	110.7	R419 E420 D421 Q425 M426 E427 L468	R419-V423 WeakPolarHBondContact O-CG2 3.06Å; R419-V423 PolarHBondContact O-N 2.8Å; E420-V423 PolarHBondContact O-N 3.15Å; D421-V423 VanDerWaalsContact C-N 3.32Å; D421-V423 PolarHBondContact O-N 3.21Å; V423-Q425 VanDerWaalsContact C-N 3.34Å; V423-Q425 PolarHBondContact O-N 3.38Å; V423-M426 WeakPolarHBondContact O-CB 3.41Å; V423-M426 PolarHBondContact O-N 2.92Å; V423-E427 WeakPolarHBondContact O-CG 3.46Å; V423-E427 PolarHBondContact O-N 3.39Å; V423-L468 HydrophobicContact CG2-CD1 4.04Å; V423-L468 HydrophobicContact CG2-CD2 3.66Å
424	R	84.4	Confident	78.8	Confident	138 Å²	138	64.5 Å²	64.5	52%	0.521	32%	0.317	S	S	.	.	H	α-helix	trans	-60.6	-43.4	179.2	-173.7	-169.9	-57.4	-86.2	-4.4	112.1	E410 E420 D421 E427 T428	E410-R424 VanDerWaalsContact OE2-CD 3.3Å; E410-R424 WeakPolarHBondContact OE2-CD 3.29Å; E420-R424 PolarHBondContact O-N 2.89Å; D421-R424 PolarHBondContact O-N 3.13Å; R424-E427 PolarHBondContact O-N 3.47Å; R424-T428 WeakPolarHBondContact O-CB 3.5Å; R424-T428 PolarHBondContact O-N 3.09Å; R424-T428 PolarHBondContact O-OG1 3.46Å
425	Q	81.8	Confident	80.6	Confident	13 Å²	13	64.2 Å²	64.2	6%	0.061	32%	0.315	C	S	.	.	H	α-helix	trans	-66.1	-41.6	177	-74.2	-175.1	15.7	0	0	111.6	T409 H411 D421 T422 V423 E427 T428 M429 L464	T409-Q425 PolarHBondContact O-NE2 3.07Å; T409-Q425 VanDerWaalsContact O-NE2 3.14Å; H411-Q425 PolarHBondContact CE1-NE2 3.48Å; H411-Q425 VanDerWaalsContact CE1-NE2 3.26Å; D421-Q425 WeakPolarHBondContact O-CB 3.45Å; D421-Q425 WeakPolarHBondContact O-CG 3.37Å; D421-Q425 PolarHBondContact O-N 3.26Å; T422-Q425 PolarHBondContact O-N 2.93Å; V423-Q425 VanDerWaalsContact C-N 3.34Å; V423-Q425 PolarHBondContact O-N 3.38Å; Q425-E427 PolarHBondContact O-N 3.18Å; Q425-T428 PolarHBondContact O-N 2.95Å; Q425-M429 WeakPolarHBondContact O-CB 3.45Å; Q425-M429 PolarHBondContact O-N 3.08Å; Q425-L464 HydrophobicContact CB-CD1 4.1Å; Q425-L464 HydrophobicContact CB-CD2 4.43Å
426	M	88.8	Confident	82.3	Confident	8 Å²	8	55.2 Å²	55.2	4%	0.039	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-45.9	175.7	176.8	-128.1	56.2	0	0	110.6	T422 V423 T428 G430 Y461 L464 L465 L468 R470	T422-M426 WeakPolarHBondContact O-CB 3.4Å; T422-M426 PolarHBondContact O-N 3.23Å; V423-M426 WeakPolarHBondContact O-CB 3.41Å; V423-M426 PolarHBondContact O-N 2.92Å; M426-T428 PolarHBondContact O-N 3.38Å; M426-G430 PolarHBondContact O-N 2.9Å; M426-Y461 HydrophobicContact CG-CD2 4.26Å; M426-Y461 HydrophobicContact CG-CE2 3.64Å; M426-Y461 VanDerWaalsContact O-CE2 3.31Å; M426-Y461 WeakPolarHBondContact O-CE2 3.48Å; M426-L464 HydrophobicContact CB-CB 4.08Å; M426-L464 HydrophobicContact CB-CD1 4.32Å; M426-L464 HydrophobicContact CG-CB 4.48Å; M426-L465 HydrophobicContact CG-CD2 4.07Å; M426-L465 HydrophobicContact SD-CD2 3.99Å; M426-L468 HydrophobicContact CB-CD1 3.96Å; M426-L468 HydrophobicContact CG-CD1 4.01Å; M426-L468 HydrophobicContact SD-CD1 3.64Å; M426-R470 PolarHBondContact SD-NH1 2.79Å
427	E	87.4	Confident	84	Confident	80 Å²	80	52.8 Å²	52.8	37%	0.374	25%	0.249	S	C	.	.	H	α-helix	trans	-65.1	-40.4	177.6	-69.1	-161.6	124.4	0	0	112.3	V423 R424 Q425 K431	V423-E427 WeakPolarHBondContact O-CG 3.46Å; V423-E427 PolarHBondContact O-N 3.39Å; R424-E427 PolarHBondContact O-N 3.47Å; Q425-E427 PolarHBondContact O-N 3.18Å; E427-K431 VanDerWaalsContact O-CB 3.27Å; E427-K431 WeakPolarHBondContact O-CB 3.31Å; E427-K431 PolarHBondContact O-N 3.22Å; E427-K431 IonicContact OE1-NZ 3.26Å; E427-K431 PolarHBondContact OE1-NZ 3.42Å
428	T	84.1	Confident	85.3	Confident	14 Å²	14	50.3 Å²	50.3	9%	0.086	24%	0.236	C	C	.	.	I	π-helix	trans	-62.9	-54.3	177.9	-56.8	0	0	0	0	110.8	R424 Q425 M426 R432 I433	R424-T428 WeakPolarHBondContact O-CB 3.5Å; R424-T428 PolarHBondContact O-N 3.09Å; R424-T428 PolarHBondContact O-OG1 3.46Å; Q425-T428 PolarHBondContact O-N 2.95Å; M426-T428 PolarHBondContact O-N 3.38Å; T428-R432 VanDerWaalsContact CG2-NH2 3.33Å; T428-R432 WeakPolarHBondContact O-CA 3.5Å; T428-R432 VanDerWaalsContact O-CB 3.32Å; T428-R432 WeakPolarHBondContact O-CB 3.43Å; T428-R432 PolarHBondContact O-N 3.27Å; T428-R432 VanDerWaalsContact O-N 3.09Å; T428-R432 PolarHBondContact OG1-NH2 2.86Å; T428-I433 HydrophobicContact CG2-CG1 4.31Å; T428-I433 WeakPolarHBondContact O-CG1 3.5Å; T428-I433 PolarHBondContact O-N 3.22Å; T428-I433 VanDerWaalsContact O-N 3.09Å
429	M	84.6	Confident	86	Confident	7 Å²	7	47.1 Å²	47.1	3%	0.034	22%	0.217	C	C	.	.	I	π-helix	trans	-62	-50.3	-179.8	-171.7	62.1	77.3	0	0	111	F396 Q425 I433 L434 E457 Y461	F396-M429 HydrophobicContact CE1-CE 4.42Å; F396-M429 HydrophobicContact CZ-CE 3.96Å; Q425-M429 WeakPolarHBondContact O-CB 3.45Å; Q425-M429 PolarHBondContact O-N 3.08Å; M429-I433 PolarHBondContact O-N 2.87Å; M429-I433 HydrophobicContact SD-CB 4.21Å; M429-I433 HydrophobicContact SD-CG2 4.08Å; M429-L434 HydrophobicContact CG-CG 4.36Å; M429-L434 WeakPolarHBondContact O-CB 3.43Å; M429-L434 WeakPolarHBondContact O-CG 3.41Å; M429-L434 PolarHBondContact O-N 3.36Å; M429-E457 HydrophobicContact SD-CB 3.94Å; M429-E457 HydrophobicContact SD-CG 4.29Å; M429-Y461 HydrophobicContact CB-CD2 4.2Å; M429-Y461 HydrophobicContact CG-CD2 4.27Å; M429-Y461 HydrophobicContact CG-CG 4.49Å
430	G	86.3	Confident	86.5	Confident	15 Å²	15	38.9 Å²	38.9	16%	0.155	19%	0.186	C	C	.	.	I	π-helix	trans	-71.8	-47.4	-173.7	0	0	0	0	0	114.9	M426 P435 Y461	M426-G430 PolarHBondContact O-N 2.9Å; G430-P435 WeakPolarHBondContact O-CD 3.42Å; G430-Y461 VanDerWaalsContact CA-CE2 3.4Å
431	K	84.7	Confident	86.8	Confident	143 Å²	143	33.7 Å²	33.7	62%	0.622	16%	0.161	S	C	*	.	I	π-helix	trans	-93.1	-30.6	-172.6	-61.3	176.7	177.8	168.6	0	113.2	E427	E427-K431 VanDerWaalsContact O-CB 3.27Å; E427-K431 WeakPolarHBondContact O-CB 3.31Å; E427-K431 PolarHBondContact O-N 3.22Å; E427-K431 IonicContact OE1-NZ 3.26Å; E427-K431 PolarHBondContact OE1-NZ 3.42Å
432	R	83.8	Confident	87.3	Confident	78 Å²	78	31 Å²	31	29%	0.294	15%	0.147	S	C	.	.	I	π-helix	trans	-100.5	-47.2	-174.3	-59.8	-170.1	-77.9	160.7	-9.5	111.9	D393 T428 I436	D393-R432 IonicContact OD1-CZ 3.94Å; D393-R432 IonicContact OD1-NE 3.73Å; D393-R432 IonicContact OD1-NH1 3.62Å; D393-R432 PolarHBondContact OD1-NH1 3.41Å; T428-R432 VanDerWaalsContact CG2-NH2 3.33Å; T428-R432 WeakPolarHBondContact O-CA 3.5Å; T428-R432 VanDerWaalsContact O-CB 3.32Å; T428-R432 WeakPolarHBondContact O-CB 3.43Å; T428-R432 PolarHBondContact O-N 3.27Å; T428-R432 VanDerWaalsContact O-N 3.09Å; T428-R432 PolarHBondContact OG1-NH2 2.86Å; R432-I436 WeakPolarHBondContact O-CD1 3.42Å; R432-I436 VanDerWaalsContact O-CG1 3.25Å; R432-I436 WeakPolarHBondContact O-CG1 3.5Å
433	I	86.4	Confident	87.7	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.005	15%	0.145	C	C	.	.	I	π-helix	trans	-91.4	-53.4	-167.5	-56.4	-53.2	0	0	0	113.1	F396 I400 T428 M429 P435 I436 L437	F396-I433 HydrophobicContact CB-CD1 4.23Å; F396-I433 HydrophobicContact CD1-CB 4.29Å; F396-I433 HydrophobicContact CD1-CD1 3.27Å; F396-I433 HydrophobicContact CD1-CG1 3.43Å; F396-I433 VanDerWaalsContact CD1-CG1 3.43Å; F396-I433 HydrophobicContact CD1-CG2 3.92Å; F396-I433 HydrophobicContact CE1-CB 4.01Å; F396-I433 HydrophobicContact CE1-CD1 3.86Å; F396-I433 HydrophobicContact CE1-CG1 3.42Å; F396-I433 VanDerWaalsContact CE1-CG1 3.42Å; F396-I433 HydrophobicContact CE1-CG2 3.54Å; F396-I433 HydrophobicContact CG-CD1 4.02Å; F396-I433 HydrophobicContact CG-CG1 4.36Å; F396-I433 HydrophobicContact CZ-CG1 4.42Å; I400-I433 HydrophobicContact CD1-CG2 3.73Å; T428-I433 HydrophobicContact CG2-CG1 4.31Å; T428-I433 WeakPolarHBondContact O-CG1 3.5Å; T428-I433 PolarHBondContact O-N 3.22Å; T428-I433 VanDerWaalsContact O-N 3.09Å; M429-I433 PolarHBondContact O-N 2.87Å; M429-I433 HydrophobicContact SD-CB 4.21Å; M429-I433 HydrophobicContact SD-CG2 4.08Å; I433-P435 VanDerWaalsContact C-CD 3.48Å; I433-P435 VanDerWaalsContact C-N 3.32Å; I433-I436 WeakPolarHBondContact O-CB 3.29Å; I433-I436 PolarHBondContact O-N 2.93Å; I433-L437 HydrophobicContact CG2-CD1 3.81Å; I433-L437 HydrophobicContact CG2-CG 4.1Å; I433-L437 PolarHBondContact O-N 3.38Å
434	L	88.8	Confident	87.7	Confident	12 Å²	12	28.5 Å²	28.5	6%	0.063	13%	0.131	C	C	.	.	H	α-helix	trans	-53.5	-43.4	-177.2	-76	179.6	0	0	0	112.8	M429 I436 L437 D438 E457 K458 Y461	M429-L434 HydrophobicContact CG-CG 4.36Å; M429-L434 WeakPolarHBondContact O-CB 3.43Å; M429-L434 WeakPolarHBondContact O-CG 3.41Å; M429-L434 PolarHBondContact O-N 3.36Å; L434-I436 VanDerWaalsContact C-N 3.29Å; L434-I436 PolarHBondContact O-N 3.36Å; L434-L437 PolarHBondContact O-N 2.87Å; L434-D438 WeakPolarHBondContact O-CB 3.44Å; L434-D438 PolarHBondContact O-N 2.87Å; L434-E457 HydrophobicContact CD2-CB 3.72Å; L434-K458 HydrophobicContact CD1-CG 4.1Å; L434-K458 HydrophobicContact CD2-CG 3.72Å; L434-Y461 HydrophobicContact CD1-CD1 3.78Å; L434-Y461 HydrophobicContact CD1-CE1 4.48Å; L434-Y461 HydrophobicContact CD1-CG 3.83Å
435	P	89.1	Confident	87.3	Confident	47 Å²	47	23.1 Å²	23.1	31%	0.305	11%	0.113	S	C	.	.	H	α-helix	trans	-61.8	-34	177	-25.6	36.9	0	0	0	113.9	S279 G430 I433 F439	S279-P435 PolarHBondContact OG-O 2.94Å; G430-P435 WeakPolarHBondContact O-CD 3.42Å; I433-P435 VanDerWaalsContact C-CD 3.48Å; I433-P435 VanDerWaalsContact C-N 3.32Å; P435-F439 VanDerWaalsContact O-CB 3.31Å; P435-F439 WeakPolarHBondContact O-CB 3.45Å; P435-F439 PolarHBondContact O-N 3.17Å
436	I	90.3	Very high	86.5	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-70.1	-45.3	175.8	-61	162.5	0	0	0	109.9	F324 L386 F388 L397 R432 I433 L434 D438 F439 I440	F324-I436 HydrophobicContact CD1-CG1 3.73Å; F324-I436 HydrophobicContact CE1-CG1 3.9Å; L386-I436 HydrophobicContact CD1-CG2 4.05Å; F388-I436 HydrophobicContact CD1-CD1 4.35Å; F388-I436 HydrophobicContact CE1-CD1 3.56Å; F388-I436 HydrophobicContact CE1-CG1 4.23Å; F388-I436 HydrophobicContact CE1-CG2 4.33Å; F388-I436 HydrophobicContact CZ-CD1 4.37Å; F388-I436 HydrophobicContact CZ-CG2 4.27Å; L397-I436 HydrophobicContact CD1-CG2 4.24Å; L397-I436 HydrophobicContact CD2-CG2 3.94Å; R432-I436 WeakPolarHBondContact O-CD1 3.42Å; R432-I436 VanDerWaalsContact O-CG1 3.25Å; R432-I436 WeakPolarHBondContact O-CG1 3.5Å; I433-I436 WeakPolarHBondContact O-CB 3.29Å; I433-I436 PolarHBondContact O-N 2.93Å; L434-I436 VanDerWaalsContact C-N 3.29Å; L434-I436 PolarHBondContact O-N 3.36Å; I436-D438 VanDerWaalsContact C-N 3.35Å; I436-D438 PolarHBondContact O-N 3.17Å; I436-F439 WeakPolarHBondContact O-CB 3.44Å; I436-F439 PolarHBondContact O-N 3.3Å; I436-I440 HydrophobicContact CG2-CD1 3.83Å; I436-I440 HydrophobicContact CG2-CG1 4.36Å; I436-I440 VanDerWaalsContact O-CG1 3.28Å; I436-I440 WeakPolarHBondContact O-CG1 3.08Å; I436-I440 PolarHBondContact O-N 3.46Å
437	L	89.3	Confident	85	Confident	5 Å²	5	28.2 Å²	28.2	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-62.5	-43.3	178	-67.9	177	0	0	0	111.4	L397 I400 I433 L434 F439 I440 R441 E457	L397-L437 HydrophobicContact CD1-CD2 3.63Å; I400-L437 HydrophobicContact CD1-CD1 4.31Å; I400-L437 HydrophobicContact CG2-CD2 4.24Å; I433-L437 HydrophobicContact CG2-CD1 3.81Å; I433-L437 HydrophobicContact CG2-CG 4.1Å; I433-L437 PolarHBondContact O-N 3.38Å; L434-L437 PolarHBondContact O-N 2.87Å; L437-F439 VanDerWaalsContact C-N 3.29Å; L437-F439 PolarHBondContact O-N 3.19Å; L437-I440 PolarHBondContact O-N 3.39Å; L437-R441 VanDerWaalsContact O-CB 3.25Å; L437-R441 WeakPolarHBondContact O-CB 3.29Å; L437-R441 WeakPolarHBondContact O-CG 3.37Å; L437-R441 PolarHBondContact O-N 2.91Å; L437-E457 HydrophobicContact CD1-CB 3.98Å; L437-E457 HydrophobicContact CD1-CG 3.66Å
438	D	89.7	Confident	83.5	Confident	3 Å²	3	27.2 Å²	27.2	2%	0.016	15%	0.147	C	C	.	.	H	α-helix	trans	-65.4	-34.9	176.2	-72.4	-33	0	0	0	111.6	E280 L434 I436 R441 S442 K458	E280-D438 HydrophobicContact CG-CB 3.8Å; E280-D438 WeakPolarHBondContact CG-OD2 3.18Å; L434-D438 WeakPolarHBondContact O-CB 3.44Å; L434-D438 PolarHBondContact O-N 2.87Å; I436-D438 VanDerWaalsContact C-N 3.35Å; I436-D438 PolarHBondContact O-N 3.17Å; D438-R441 IonicContact OD1-NH1 2.64Å; D438-R441 PolarHBondContact OD1-NH1 3.25Å; D438-S442 PolarHBondContact O-N 2.89Å; D438-K458 VanDerWaalsContact CG-NZ 3.35Å; D438-K458 IonicContact OD1-NZ 3.41Å; D438-K458 PolarHBondContact OD1-NZ 3.47Å; D438-K458 IonicContact OD2-NZ 3.71Å; D438-K458 PolarHBondContact OD2-NZ 3.39Å
439	F	92.5	Very high	82.2	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.7	-51.1	174.1	-179.7	-92.9	0	0	0	112.1	I314 A317 I318 F324 V326 Y328 L384 L386 P435 I436 L437 R441 S442	I314-F439 HydrophobicContact CG2-CE2 4.23Å; I314-F439 HydrophobicContact CG2-CZ 4.42Å; A317-F439 HydrophobicContact CB-CD2 3.89Å; A317-F439 HydrophobicContact CB-CE2 4.11Å; I318-F439 HydrophobicContact CD1-CE2 4.29Å; I318-F439 HydrophobicContact CD1-CZ 4Å; I318-F439 HydrophobicContact CG1-CE2 3.66Å; I318-F439 HydrophobicContact CG1-CZ 3.69Å; F324-F439 HydrophobicContact CE2-CB 4.46Å; F324-F439 AromaticContact CE2-CD1 3.77Å; F324-F439 HydrophobicContact CE2-CD1 3.77Å; F324-F439 HydrophobicContact CE2-CD2 4.36Å; F324-F439 HydrophobicContact CE2-CE1 4.17Å; F324-F439 AromaticContact CE2-CG 3.9Å; F324-F439 HydrophobicContact CE2-CG 3.9Å; F324-F439 HydrophobicContact CZ-CB 4Å; F324-F439 HydrophobicContact CZ-CD1 4.16Å; F324-F439 HydrophobicContact CZ-CD2 4.27Å; F324-F439 AromaticContact CZ-CG 3.84Å; F324-F439 HydrophobicContact CZ-CG 3.84Å; V326-F439 HydrophobicContact CB-CE1 4.2Å; V326-F439 HydrophobicContact CB-CZ 4.23Å; V326-F439 HydrophobicContact CG1-CE1 3.73Å; V326-F439 HydrophobicContact CG1-CZ 3.91Å; V326-F439 HydrophobicContact CG2-CD1 4.25Å; V326-F439 HydrophobicContact CG2-CE1 3.43Å; V326-F439 VanDerWaalsContact CG2-CE1 3.43Å; V326-F439 HydrophobicContact CG2-CZ 3.61Å; Y328-F439 HydrophobicContact CE2-CZ 4.49Å; Y328-F439 WeakPolarHBondContact OH-CZ 3.48Å; L384-F439 HydrophobicContact CD1-CE1 4.4Å; L386-F439 HydrophobicContact CD2-CD1 4.35Å; L386-F439 HydrophobicContact CD2-CE1 4.26Å; P435-F439 VanDerWaalsContact O-CB 3.31Å; P435-F439 WeakPolarHBondContact O-CB 3.45Å; P435-F439 PolarHBondContact O-N 3.17Å; I436-F439 WeakPolarHBondContact O-CB 3.44Å; I436-F439 PolarHBondContact O-N 3.3Å; L437-F439 VanDerWaalsContact C-N 3.29Å; L437-F439 PolarHBondContact O-N 3.19Å; F439-R441 PolarHBondContact O-N 3.3Å; F439-S442 VanDerWaalsContact O-CB 3.28Å; F439-S442 WeakPolarHBondContact O-CB 3.49Å; F439-S442 PolarHBondContact O-N 3.06Å; F439-S442 PolarHBondContact O-OG 3.43Å
440	I	91.1	Very high	80.7	Confident	9 Å²	9	28.8 Å²	28.8	5%	0.046	16%	0.157	C	C	.	.	H	α-helix	trans	-51.9	-48.8	175.8	-72.7	168.1	0	0	0	109.6	L384 L386 L397 I436 L437 S442 T443 Q444	L384-I440 HydrophobicContact CD2-CB 4.26Å; L384-I440 HydrophobicContact CD2-CG1 3.78Å; L384-I440 HydrophobicContact CD2-CG2 4.31Å; L386-I440 HydrophobicContact CD1-CD1 3.65Å; L386-I440 HydrophobicContact CD1-CG1 3.66Å; L397-I440 HydrophobicContact CD1-CD1 3.69Å; L397-I440 HydrophobicContact CD2-CD1 3.8Å; L397-I440 HydrophobicContact CG-CD1 4.32Å; I436-I440 HydrophobicContact CG2-CD1 3.83Å; I436-I440 HydrophobicContact CG2-CG1 4.36Å; I436-I440 VanDerWaalsContact O-CG1 3.28Å; I436-I440 WeakPolarHBondContact O-CG1 3.08Å; I436-I440 PolarHBondContact O-N 3.46Å; L437-I440 PolarHBondContact O-N 3.39Å; I440-S442 PolarHBondContact O-N 2.89Å; I440-T443 PolarHBondContact O-N 3.34Å; I440-T443 PolarHBondContact O-OG1 3.25Å; I440-Q444 WeakPolarHBondContact O-CG 3.48Å
441	R	89.3	Confident	78.9	Confident	15 Å²	15	28.6 Å²	28.6	6%	0.057	15%	0.154	C	C	.	.	H	α-helix	trans	-69.6	-15	180	-72.3	177	71.2	-145.4	14.4	114	R283 M286 L437 D438 F439 T443 Q444 S453 E484	R283-R441 VanDerWaalsContact CZ-CZ 3.44Å; R283-R441 PolarHBondContact NH1-O 3.43Å; M286-R441 WeakPolarHBondContact CE-O 3.28Å; L437-R441 VanDerWaalsContact O-CB 3.25Å; L437-R441 WeakPolarHBondContact O-CB 3.29Å; L437-R441 WeakPolarHBondContact O-CG 3.37Å; L437-R441 PolarHBondContact O-N 2.91Å; D438-R441 IonicContact OD1-NH1 2.64Å; D438-R441 PolarHBondContact OD1-NH1 3.25Å; F439-R441 PolarHBondContact O-N 3.3Å; R441-T443 PolarHBondContact O-N 2.73Å; R441-Q444 PolarHBondContact O-N 3.05Å; R441-S453 PolarHBondContact NE-O 3.3Å; R441-S453 PolarHBondContact NH1-O 2.92Å; R441-S453 PolarHBondContact NH2-O 2.99Å; R441-E484 IonicContact CZ-OE2 3.7Å; R441-E484 VanDerWaalsContact CZ-OE2 3.26Å; R441-E484 IonicContact NH1-OE1 3.1Å; R441-E484 IonicContact NH1-OE2 2.72Å; R441-E484 PolarHBondContact NH1-OE2 2.91Å; R441-E484 IonicContact NH2-OE2 3.18Å; R441-E484 PolarHBondContact NH2-OE2 3.4Å
442	S	91.9	Very high	77.4	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-6.8	175.5	77.4	0	0	0	0	113.8	M286 W310 D438 F439 I440	M286-S442 VanDerWaalsContact SD-O 3.36Å; W310-S442 VanDerWaalsContact CZ2-O 3.32Å; W310-S442 WeakPolarHBondContact CZ2-O 3.48Å; W310-S442 PolarHBondContact NE1-O 3.07Å; D438-S442 PolarHBondContact O-N 2.89Å; F439-S442 VanDerWaalsContact O-CB 3.28Å; F439-S442 WeakPolarHBondContact O-CB 3.49Å; F439-S442 PolarHBondContact O-N 3.06Å; F439-S442 PolarHBondContact O-OG 3.43Å; I440-S442 PolarHBondContact O-N 2.89Å
443	T	90.6	Very high	76.4	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.6	14.4	177.3	51.4	0	0	0	0	112.4	W310 I314 Y328 H366 M367 L368 I440 R441	W310-T443 HydrophobicContact CZ2-CG2 4.38Å; I314-T443 HydrophobicContact CD1-CG2 3.61Å; Y328-T443 HydrophobicContact CE1-CG2 4.07Å; Y328-T443 WeakPolarHBondContact OH-CG2 3.21Å; H366-T443 CarbonylContact C-O 3.4Å; H366-T443 VanDerWaalsContact CA-O 3.29Å; H366-T443 WeakPolarHBondContact CA-O 3.36Å; H366-T443 PolarHBondContact ND1-OG1 2.89Å; M367-T443 PolarHBondContact N-O 3.17Å; M367-T443 VanDerWaalsContact O-CB 3.32Å; M367-T443 WeakPolarHBondContact O-CB 3.47Å; M367-T443 WeakPolarHBondContact O-CG2 3.47Å; L368-T443 HydrophobicContact CD2-CG2 3.87Å; I440-T443 PolarHBondContact O-N 3.34Å; I440-T443 PolarHBondContact O-OG1 3.25Å; R441-T443 PolarHBondContact O-N 2.73Å
444	Q	87	Confident	75.9	Confident	10 Å²	10	19.3 Å²	19.3	5%	0.047	12%	0.119	C	C	.	.			trans	-127.2	120.6	-178.6	-64.8	171.9	-13.1	0	0	111.6	R283 M286 D361 T364 H366 I440 R441	R283-Q444 PolarHBondContact NH1-O 3.42Å; M286-Q444 VanDerWaalsContact CE-O 3.24Å; M286-Q444 WeakPolarHBondContact CE-O 3.25Å; D361-Q444 PolarHBondContact OD2-NE2 3.19Å; T364-Q444 PolarHBondContact OG1-NE2 3.13Å; H366-Q444 VanDerWaalsContact CE1-CG 3.43Å; H366-Q444 WeakPolarHBondContact CE1-CG 3.49Å; H366-Q444 PolarHBondContact CE1-NE2 3.4Å; H366-Q444 PolarHBondContact NE2-NE2 3.07Å; H366-Q444 VanDerWaalsContact NE2-NE2 3.1Å; I440-Q444 WeakPolarHBondContact O-CG 3.48Å; R441-Q444 PolarHBondContact O-N 3.05Å
445	L	75.9	Confident	75.8	Confident	25 Å²	25	18.8 Å²	18.8	13%	0.131	12%	0.116	C	C	.	.	S	Bend	trans	-82.6	-50.8	168.6	-78.1	175.9	0	0	0	112	M286 Y290 W374 L491	M286-L445 HydrophobicContact CE-CD2 4.24Å; Y290-L445 HydrophobicContact CD1-CD2 3.8Å; Y290-L445 HydrophobicContact CD2-CD1 3.59Å; Y290-L445 HydrophobicContact CD2-CD2 4.05Å; Y290-L445 HydrophobicContact CE1-CD2 4.3Å; Y290-L445 HydrophobicContact CE2-CD1 3.74Å; Y290-L445 HydrophobicContact CG-CD1 4.09Å; Y290-L445 HydrophobicContact CG-CD2 3.65Å; W374-L445 HydrophobicContact CE3-CD1 3.96Å; W374-L445 HydrophobicContact CH2-CD1 3.33Å; W374-L445 HydrophobicContact CH2-CD2 4.48Å; W374-L445 HydrophobicContact CH2-CG 3.98Å; W374-L445 HydrophobicContact CZ2-CD1 4.29Å; W374-L445 HydrophobicContact CZ3-CD1 3.14Å; W374-L445 HydrophobicContact CZ3-CG 4.22Å; L445-L491 HydrophobicContact CD2-CD2 4.15Å
446	N	64.8	Low	75.5	Confident	107 Å²	107	16.8 Å²	16.8	57%	0.572	10%	0.102	S	C	*	.			trans	-104.1	85.3	-173.4	-67.3	-0.6	0	0	0	110.8	L491	N446-L491 PolarHBondContact OD1-O 3.31Å
447	G	58.6	Low	75.4	Confident	21 Å²	21	17 Å²	17	22%	0.216	10%	0.104	C	C	.	.			trans	-76.9	163.8	159.3	0	0	0	0	0	110.4	R492	G447-R492 VanDerWaalsContact C-NH1 3.33Å; G447-R492 PolarHBondContact O-NH1 3.21Å
448	S	55.9	Low	75.5	Confident	58 Å²	58	17 Å²	17	41%	0.406	10%	0.103	S	C	.	.			trans	-76.2	149.5	164.2	57.6	0	0	0	0	109.9	A451 R492	S448-A451 PolarHBondContact OG-O 2.98Å; S448-R492 PolarHBondContact O-NH1 3.48Å; S448-R492 VanDerWaalsContact O-NH1 3.17Å
449	F	56.6	Low	75.5	Confident	16 Å²	16	17.2 Å²	17.2	7%	0.07	10%	0.104	C	C	.	.	S	Bend	trans	-106.2	144	164.7	-160.2	-124.5	0	0	0	106.6	M456 I488 R492 E498 L501 L505	F449-M456 HydrophobicContact CE2-CE 3.86Å; F449-M456 HydrophobicContact CZ-CE 3.82Å; F449-I488 HydrophobicContact CD2-CD1 4.25Å; F449-I488 HydrophobicContact CE2-CD1 4.04Å; F449-R492 VanDerWaalsContact CD2-NH2 3.3Å; F449-R492 VanDerWaalsContact N-NH1 3.12Å; F449-E498 HydrophobicContact CD1-CB 4.02Å; F449-E498 HydrophobicContact CD1-CG 4Å; F449-L501 HydrophobicContact CD1-CD2 4.48Å; F449-L501 HydrophobicContact CE1-CB 4.46Å; F449-L501 HydrophobicContact CE1-CD2 3.75Å; F449-L501 HydrophobicContact CE1-CG 4.03Å; F449-L501 HydrophobicContact CZ-CD2 4.38Å; F449-L501 HydrophobicContact CZ-CG 4.49Å; F449-L505 HydrophobicContact CZ-CD1 4.07Å
450	P	52.9	Low	75.2	Confident	39 Å²	39	17.6 Å²	17.6	25%	0.253	11%	0.106	S	C	.	.	S	Bend	cis	-81	-10.5	-11.1	31.5	-33	0	0	0	114	S452 M456	P450-S452 PolarHBondContact O-N 3.4Å; P450-M456 HydrophobicContact CB-CE 3.88Å
451	A	48.8	Very low	75.2	Confident	11 Å²	11	18.7 Å²	18.7	9%	0.091	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	124.9	-173.7	0	0	0	0	0	111.4	R403 K404 S448 S453	R403-A451 WeakPolarHBondContact O-CB 3.47Å; K404-A451 HydrophobicContact CG-CB 4.33Å; S448-A451 PolarHBondContact OG-O 2.98Å; A451-S453 VanDerWaalsContact C-N 3.28Å; A451-S453 PolarHBondContact O-N 2.85Å
452	S	51.8	Low	75.3	Confident	20 Å²	20	18 Å²	18	14%	0.14	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	28	174.6	64.5	0	0	0	0	116	P450 G454	P450-S452 PolarHBondContact O-N 3.4Å; S452-G454 PolarHBondContact O-N 3.01Å
453	S	62.3	Low	75.2	Confident	7 Å²	7	18.9 Å²	18.9	5%	0.049	12%	0.116	C	C	.	.			trans	-70.4	-11.5	178.6	66.5	0	0	0	0	114	R441 A451 V455	R441-S453 PolarHBondContact NE-O 3.3Å; R441-S453 PolarHBondContact NH1-O 2.92Å; R441-S453 PolarHBondContact NH2-O 2.99Å; A451-S453 VanDerWaalsContact C-N 3.28Å; A451-S453 PolarHBondContact O-N 2.85Å; S453-V455 PolarHBondContact O-N 3.39Å; S453-V455 PolarHBondContact OG-N 2.97Å
454	G	77.5	Confident	75.1	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	70.8	-25.6	-171.8	0	0	0	0	0	113.5	S452 E457 K458	S452-G454 PolarHBondContact O-N 3.01Å; G454-E457 WeakPolarHBondContact CA-OE2 3.33Å; G454-E457 PolarHBondContact N-OE2 2.8Å; G454-E457 VanDerWaalsContact N-OE2 3.08Å; G454-K458 WeakPolarHBondContact O-CG 3.42Å; G454-K458 PolarHBondContact O-N 3.15Å; G454-K458 VanDerWaalsContact O-N 3.09Å
455	V	85.2	Confident	75.3	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-71.2	-42.7	178.8	177.9	0	0	0	0	110.8	S453 E457 K458 L459 A481 E484 L485	S453-V455 PolarHBondContact O-N 3.39Å; S453-V455 PolarHBondContact OG-N 2.97Å; V455-E457 VanDerWaalsContact C-N 3.3Å; V455-E457 PolarHBondContact O-N 3.3Å; V455-K458 WeakPolarHBondContact O-CB 3.44Å; V455-K458 PolarHBondContact O-N 2.83Å; V455-K458 VanDerWaalsContact O-N 3.12Å; V455-L459 HydrophobicContact CG1-CD1 4.42Å; V455-L459 HydrophobicContact CG1-CG 4.48Å; V455-L459 WeakPolarHBondContact O-CG 3.09Å; V455-L459 PolarHBondContact O-N 3.24Å; V455-A481 HydrophobicContact CG1-CB 4.31Å; V455-E484 HydrophobicContact CG2-CB 3.7Å; V455-E484 WeakPolarHBondContact CG2-OE2 3.49Å; V455-L485 HydrophobicContact CG1-CD1 4.23Å; V455-L485 HydrophobicContact CG1-CD2 3.74Å; V455-L485 HydrophobicContact CG1-CG 3.73Å
456	M	84.5	Confident	76	Confident	5 Å²	5	20.3 Å²	20.3	3%	0.025	13%	0.129	C	C	.	.	H	α-helix	trans	-61.4	-42.6	177.9	-64.8	-61.6	170.9	0	0	111	P406 F449 P450 K458 L459 Q460 L505 W524	P406-M456 HydrophobicContact CG-CB 4.3Å; F449-M456 HydrophobicContact CE2-CE 3.86Å; F449-M456 HydrophobicContact CZ-CE 3.82Å; P450-M456 HydrophobicContact CB-CE 3.88Å; M456-K458 VanDerWaalsContact C-N 3.32Å; M456-K458 PolarHBondContact O-N 2.72Å; M456-L459 PolarHBondContact O-N 3.21Å; M456-Q460 WeakPolarHBondContact O-CB 3.2Å; M456-Q460 PolarHBondContact O-N 3.26Å; M456-L505 HydrophobicContact CE-CD1 3.44Å; M456-L505 VanDerWaalsContact CE-CD1 3.44Å; M456-L505 HydrophobicContact SD-CD1 4.39Å; M456-W524 HydrophobicContact CB-CZ3 4.36Å; M456-W524 VanDerWaalsContact O-CH2 3.24Å; M456-W524 WeakPolarHBondContact O-CH2 3.27Å; M456-W524 HydrophobicContact SD-CE3 4.17Å; M456-W524 HydrophobicContact SD-CZ3 3.57Å; M456-W524 VanDerWaalsContact SD-CZ3 3.57Å
457	E	87.5	Confident	77.1	Confident	7 Å²	7	20.8 Å²	20.8	3%	0.033	13%	0.128	C	C	.	.	H	α-helix	trans	-65.1	-35.2	175.6	-65.7	77.6	-166.9	0	0	111.7	I400 M429 L434 L437 G454 V455 Q460 Y461	I400-E457 HydrophobicContact CD1-CG 4.08Å; I400-E457 WeakPolarHBondContact CG2-OE1 3.4Å; M429-E457 HydrophobicContact SD-CB 3.94Å; M429-E457 HydrophobicContact SD-CG 4.29Å; L434-E457 HydrophobicContact CD2-CB 3.72Å; L437-E457 HydrophobicContact CD1-CB 3.98Å; L437-E457 HydrophobicContact CD1-CG 3.66Å; G454-E457 WeakPolarHBondContact CA-OE2 3.33Å; G454-E457 PolarHBondContact N-OE2 2.8Å; G454-E457 VanDerWaalsContact N-OE2 3.08Å; V455-E457 VanDerWaalsContact C-N 3.3Å; V455-E457 PolarHBondContact O-N 3.3Å; E457-Q460 PolarHBondContact O-N 2.95Å; E457-Y461 VanDerWaalsContact O-CB 3.31Å; E457-Y461 WeakPolarHBondContact O-CB 3.36Å; E457-Y461 PolarHBondContact O-N 3.04Å
458	K	90.8	Very high	78.6	Confident	4 Å²	4	21 Å²	21	2%	0.017	12%	0.124	C	C	.	.	H	α-helix	trans	-67.5	-42	172.4	-76.2	-175.3	-179.2	100.4	0	112.5	L434 D438 G454 V455 M456 Q460 Y461 A462 V477 Q480 A481 E484	L434-K458 HydrophobicContact CD1-CG 4.1Å; L434-K458 HydrophobicContact CD2-CG 3.72Å; D438-K458 VanDerWaalsContact CG-NZ 3.35Å; D438-K458 IonicContact OD1-NZ 3.41Å; D438-K458 PolarHBondContact OD1-NZ 3.47Å; D438-K458 IonicContact OD2-NZ 3.71Å; D438-K458 PolarHBondContact OD2-NZ 3.39Å; G454-K458 WeakPolarHBondContact O-CG 3.42Å; G454-K458 PolarHBondContact O-N 3.15Å; G454-K458 VanDerWaalsContact O-N 3.09Å; V455-K458 WeakPolarHBondContact O-CB 3.44Å; V455-K458 PolarHBondContact O-N 2.83Å; V455-K458 VanDerWaalsContact O-N 3.12Å; M456-K458 VanDerWaalsContact C-N 3.32Å; M456-K458 PolarHBondContact O-N 2.72Å; K458-Q460 VanDerWaalsContact C-N 3.3Å; K458-Q460 PolarHBondContact O-N 3.21Å; K458-Y461 PolarHBondContact O-N 3.39Å; K458-A462 WeakPolarHBondContact O-CB 3.34Å; K458-A462 PolarHBondContact O-N 2.98Å; K458-V477 HydrophobicContact CB-CG1 4.05Å; K458-V477 VanDerWaalsContact O-CG1 3.29Å; K458-V477 WeakPolarHBondContact O-CG1 3.47Å; K458-Q480 HydrophobicContact CD-CG 4.28Å; K458-A481 HydrophobicContact CB-CB 4.46Å; K458-E484 VanDerWaalsContact CE-OE1 3.31Å; K458-E484 WeakPolarHBondContact CE-OE1 3.18Å; K458-E484 IonicContact NZ-OE1 2.73Å; K458-E484 PolarHBondContact NZ-OE1 3.43Å; K458-E484 IonicContact NZ-OE2 2.68Å
459	L	89.6	Confident	80.2	Confident	8 Å²	8	26.3 Å²	26.3	4%	0.042	14%	0.142	C	C	.	.	H	α-helix	trans	-64.1	-38.1	174.8	-67.5	177.5	0	0	0	111.2	V455 M456 A462 G463 I478 A481 L505 W524	V455-L459 HydrophobicContact CG1-CD1 4.42Å; V455-L459 HydrophobicContact CG1-CG 4.48Å; V455-L459 WeakPolarHBondContact O-CG 3.09Å; V455-L459 PolarHBondContact O-N 3.24Å; M456-L459 PolarHBondContact O-N 3.21Å; L459-A462 PolarHBondContact O-N 3.1Å; L459-G463 PolarHBondContact O-N 2.75Å; L459-I478 HydrophobicContact CD2-CD1 3.81Å; L459-A481 HydrophobicContact CD2-CB 3.86Å; L459-A481 HydrophobicContact CG-CB 4.38Å; L459-L505 HydrophobicContact CD1-CD2 4.09Å; L459-W524 VanDerWaalsContact C-CZ2 3.5Å; L459-W524 HydrophobicContact CB-CD2 3.94Å; L459-W524 HydrophobicContact CB-CE3 4.14Å; L459-W524 HydrophobicContact CB-CH2 3.86Å; L459-W524 HydrophobicContact CB-CZ2 3.62Å; L459-W524 HydrophobicContact CB-CZ3 4.11Å; L459-W524 HydrophobicContact CD1-CD2 4.15Å; L459-W524 HydrophobicContact CD1-CE3 3.91Å; L459-W524 HydrophobicContact CD1-CZ3 4.27Å
460	Q	87.3	Confident	82	Confident	7 Å²	7	29.9 Å²	29.9	3%	0.033	16%	0.155	C	C	.	.	H	α-helix	trans	-64.3	-46.5	172.9	-175.5	-179.6	-6.2	0	0	111.6	I407 F408 M456 E457 K458 A462 G463 L464 W524	I407-Q460 PolarHBondContact O-NE2 3.2Å; I407-Q460 PolarHBondContact O-OE1 3.06Å; F408-Q460 HydrophobicContact CD1-CG 4.44Å; F408-Q460 VanDerWaalsContact CD1-NE2 3.27Å; F408-Q460 HydrophobicContact CE1-CG 3.88Å; F408-Q460 HydrophobicContact CZ-CG 4.47Å; M456-Q460 WeakPolarHBondContact O-CB 3.2Å; M456-Q460 PolarHBondContact O-N 3.26Å; E457-Q460 PolarHBondContact O-N 2.95Å; K458-Q460 VanDerWaalsContact C-N 3.3Å; K458-Q460 PolarHBondContact O-N 3.21Å; Q460-A462 VanDerWaalsContact C-N 3.32Å; Q460-A462 PolarHBondContact O-N 3.23Å; Q460-G463 WeakPolarHBondContact O-CA 3.49Å; Q460-G463 PolarHBondContact O-N 2.72Å; Q460-G463 VanDerWaalsContact O-N 3.1Å; Q460-L464 PolarHBondContact O-N 3.45Å; Q460-W524 HydrophobicContact CB-CH2 4.19Å; Q460-W524 HydrophobicContact CB-CZ2 3.92Å; Q460-W524 VanDerWaalsContact N-CZ2 3.26Å
461	Y	91.1	Very high	83.8	Confident	32 Å²	32	32.7 Å²	32.7	13%	0.125	17%	0.171	C	C	.	.	H	α-helix	trans	-58.7	-43.4	175.1	-179.7	-117.7	0	0	0	111.9	M426 M429 G430 L434 E457 K458 G463 L464 L465 V477	M426-Y461 HydrophobicContact CG-CD2 4.26Å; M426-Y461 HydrophobicContact CG-CE2 3.64Å; M426-Y461 VanDerWaalsContact O-CE2 3.31Å; M426-Y461 WeakPolarHBondContact O-CE2 3.48Å; M429-Y461 HydrophobicContact CB-CD2 4.2Å; M429-Y461 HydrophobicContact CG-CD2 4.27Å; M429-Y461 HydrophobicContact CG-CG 4.49Å; G430-Y461 VanDerWaalsContact CA-CE2 3.4Å; L434-Y461 HydrophobicContact CD1-CD1 3.78Å; L434-Y461 HydrophobicContact CD1-CE1 4.48Å; L434-Y461 HydrophobicContact CD1-CG 3.83Å; E457-Y461 VanDerWaalsContact O-CB 3.31Å; E457-Y461 WeakPolarHBondContact O-CB 3.36Å; E457-Y461 PolarHBondContact O-N 3.04Å; K458-Y461 PolarHBondContact O-N 3.39Å; Y461-G463 VanDerWaalsContact C-N 3.31Å; Y461-G463 PolarHBondContact O-N 3.5Å; Y461-L464 WeakPolarHBondContact O-CB 3.46Å; Y461-L464 PolarHBondContact O-N 2.88Å; Y461-L464 VanDerWaalsContact O-N 3.17Å; Y461-L465 HydrophobicContact CD1-CD1 3.91Å; Y461-L465 HydrophobicContact CE1-CD1 3.53Å; Y461-L465 HydrophobicContact CE1-CG 4.21Å; Y461-L465 HydrophobicContact CE2-CG 4.43Å; Y461-L465 WeakPolarHBondContact O-CG 3.33Å; Y461-L465 PolarHBondContact O-N 3.48Å; Y461-V477 HydrophobicContact CD1-CB 4.48Å; Y461-V477 HydrophobicContact CD1-CG1 4.01Å; Y461-V477 HydrophobicContact CD1-CG2 3.72Å; Y461-V477 HydrophobicContact CE1-CG2 3.69Å
462	A	91.6	Very high	85.8	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-38	174	0	0	0	0	0	112.5	K458 L459 Q460 L465 S466 Q474 V477 I478	K458-A462 WeakPolarHBondContact O-CB 3.34Å; K458-A462 PolarHBondContact O-N 2.98Å; L459-A462 PolarHBondContact O-N 3.1Å; Q460-A462 VanDerWaalsContact C-N 3.32Å; Q460-A462 PolarHBondContact O-N 3.23Å; A462-L465 PolarHBondContact O-N 3.42Å; A462-S466 PolarHBondContact O-N 3.2Å; A462-Q474 HydrophobicContact CB-CG 4.25Å; A462-V477 HydrophobicContact CB-CB 4.31Å; A462-V477 HydrophobicContact CB-CG1 3.94Å; A462-I478 HydrophobicContact CB-CD1 3.44Å; A462-I478 VanDerWaalsContact CB-CD1 3.44Å; A462-I478 HydrophobicContact CB-CG1 3.83Å
463	G	88.3	Confident	87.8	Confident	18 Å²	18	42.7 Å²	42.7	19%	0.186	21%	0.211	C	C	.	.	H	α-helix	trans	-59.4	-43.3	172.2	0	0	0	0	0	112.8	L459 Q460 Y461 S466 Q467	L459-G463 PolarHBondContact O-N 2.75Å; Q460-G463 WeakPolarHBondContact O-CA 3.49Å; Q460-G463 PolarHBondContact O-N 2.72Å; Q460-G463 VanDerWaalsContact O-N 3.1Å; Y461-G463 VanDerWaalsContact C-N 3.31Å; Y461-G463 PolarHBondContact O-N 3.5Å; G463-S466 WeakPolarHBondContact O-CB 3.38Å; G463-S466 PolarHBondContact O-N 2.82Å; G463-Q467 WeakPolarHBondContact O-CG 3.43Å; G463-Q467 PolarHBondContact O-N 2.88Å; G463-Q467 VanDerWaalsContact O-N 3.13Å
464	L	88.9	Confident	89.3	Confident	10 Å²	10	43.5 Å²	43.5	5%	0.052	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-42	175.2	-62.6	169.9	0	0	0	111.6	T422 Q425 M426 Q460 Y461 S466 Q467 L468	T422-L464 HydrophobicContact CG2-CB 4.37Å; T422-L464 HydrophobicContact CG2-CD2 3.87Å; Q425-L464 HydrophobicContact CB-CD1 4.1Å; Q425-L464 HydrophobicContact CB-CD2 4.43Å; M426-L464 HydrophobicContact CB-CB 4.08Å; M426-L464 HydrophobicContact CB-CD1 4.32Å; M426-L464 HydrophobicContact CG-CB 4.48Å; Q460-L464 PolarHBondContact O-N 3.45Å; Y461-L464 WeakPolarHBondContact O-CB 3.46Å; Y461-L464 PolarHBondContact O-N 2.88Å; Y461-L464 VanDerWaalsContact O-N 3.17Å; L464-S466 VanDerWaalsContact C-N 3.31Å; L464-S466 PolarHBondContact O-N 2.98Å; L464-Q467 PolarHBondContact O-N 3.23Å; L464-L468 WeakPolarHBondContact O-CG 3.38Å; L464-L468 PolarHBondContact O-N 2.87Å; L464-L468 VanDerWaalsContact O-N 3.1Å
465	L	92	Very high	90.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-39.2	175.4	-69.6	172.1	0	0	0	112.2	M426 Y461 A462 L468 Q469 R470 E473 Q474 V477	M426-L465 HydrophobicContact CG-CD2 4.07Å; M426-L465 HydrophobicContact SD-CD2 3.99Å; Y461-L465 HydrophobicContact CD1-CD1 3.91Å; Y461-L465 HydrophobicContact CE1-CD1 3.53Å; Y461-L465 HydrophobicContact CE1-CG 4.21Å; Y461-L465 HydrophobicContact CE2-CG 4.43Å; Y461-L465 WeakPolarHBondContact O-CG 3.33Å; Y461-L465 PolarHBondContact O-N 3.48Å; A462-L465 PolarHBondContact O-N 3.42Å; L465-L468 CarbonylContact O-C 3.25Å; L465-L468 PolarHBondContact O-N 3Å; L465-Q469 PolarHBondContact O-N 2.66Å; L465-Q469 VanDerWaalsContact O-N 3.11Å; L465-R470 HydrophobicContact CB-CB 4.29Å; L465-R470 HydrophobicContact CD2-CB 3.92Å; L465-R470 HydrophobicContact CD2-CG 4.43Å; L465-R470 PolarHBondContact O-N 3.03Å; L465-E473 HydrophobicContact CD1-CB 3.91Å; L465-E473 HydrophobicContact CD2-CB 4.27Å; L465-Q474 HydrophobicContact CB-CB 4Å; L465-V477 HydrophobicContact CD1-CG2 3.91Å
466	S	89.6	Confident	90.5	Very high	56 Å²	56	48 Å²	48	39%	0.392	24%	0.24	S	C	.	.	H	α-helix	trans	-59.4	-49	174.6	-169.7	0	0	0	0	111.7	A462 G463 L464 L468 Q469 Q474	A462-S466 PolarHBondContact O-N 3.2Å; G463-S466 WeakPolarHBondContact O-CB 3.38Å; G463-S466 PolarHBondContact O-N 2.82Å; L464-S466 VanDerWaalsContact C-N 3.31Å; L464-S466 PolarHBondContact O-N 2.98Å; S466-L468 PolarHBondContact O-N 3.33Å; S466-Q469 PolarHBondContact O-N 2.93Å; S466-Q474 VanDerWaalsContact CB-NE2 3.34Å; S466-Q474 PolarHBondContact OG-NE2 3.22Å
467	Q	87.6	Confident	91	Very high	116 Å²	116	48.6 Å²	48.6	54%	0.542	24%	0.244	S	C	.	.	H	α-helix	trans	-60.4	-33.1	177.7	-69.5	174.6	5.4	0	0	112.2	T422 G463 L464 Q469	T422-Q467 HydrophobicContact CG2-CB 4.09Å; G463-Q467 WeakPolarHBondContact O-CG 3.43Å; G463-Q467 PolarHBondContact O-N 2.88Å; G463-Q467 VanDerWaalsContact O-N 3.13Å; L464-Q467 PolarHBondContact O-N 3.23Å; Q467-Q469 VanDerWaalsContact C-N 3.3Å
468	L	90.4	Very high	91.4	Very high	27 Å²	27	48.6 Å²	48.6	14%	0.141	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	5.2	176.4	-62.4	175	0	0	0	113.8	R419 T422 V423 M426 L464 L465 S466 R470	R419-L468 HydrophobicContact CG-CD2 4.18Å; T422-L468 HydrophobicContact CG2-CD1 4.11Å; T422-L468 HydrophobicContact CG2-CD2 3.85Å; T422-L468 HydrophobicContact CG2-CG 3.74Å; V423-L468 HydrophobicContact CG2-CD1 4.04Å; V423-L468 HydrophobicContact CG2-CD2 3.66Å; M426-L468 HydrophobicContact CB-CD1 3.96Å; M426-L468 HydrophobicContact CG-CD1 4.01Å; M426-L468 HydrophobicContact SD-CD1 3.64Å; L464-L468 WeakPolarHBondContact O-CG 3.38Å; L464-L468 PolarHBondContact O-N 2.87Å; L464-L468 VanDerWaalsContact O-N 3.1Å; L465-L468 CarbonylContact O-C 3.25Å; L465-L468 PolarHBondContact O-N 3Å; S466-L468 PolarHBondContact O-N 3.33Å; L468-R470 HydrophobicContact CB-CG 4.28Å; L468-R470 PolarHBondContact O-N 3.06Å
469	Q	90.6	Very high	91.6	Very high	168 Å²	168	49.4 Å²	49.4	79%	0.785	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	26.4	-178.8	-55.2	179.1	-1.5	0	0	114.4	L465 S466 Q467 V471	L465-Q469 PolarHBondContact O-N 2.66Å; L465-Q469 VanDerWaalsContact O-N 3.11Å; S466-Q469 PolarHBondContact O-N 2.93Å; Q467-Q469 VanDerWaalsContact C-N 3.3Å; Q469-V471 PolarHBondContact O-N 3.04Å; Q469-V471 VanDerWaalsContact O-N 3.08Å
470	R	92.9	Very high	91.9	Very high	91 Å²	91	49.3 Å²	49.3	34%	0.343	25%	0.248	S	C	.	.			trans	-86.9	58.8	176.5	-64.2	-179	74.1	178.3	10.2	111.2	M426 L465 L468 K472 E473 Q474	M426-R470 PolarHBondContact SD-NH1 2.79Å; L465-R470 HydrophobicContact CB-CB 4.29Å; L465-R470 HydrophobicContact CD2-CB 3.92Å; L465-R470 HydrophobicContact CD2-CG 4.43Å; L465-R470 PolarHBondContact O-N 3.03Å; L468-R470 HydrophobicContact CB-CG 4.28Å; L468-R470 PolarHBondContact O-N 3.06Å; R470-K472 VanDerWaalsContact C-N 3.31Å; R470-K472 PolarHBondContact O-N 3.21Å; R470-E473 HydrophobicContact CB-CB 4.48Å; R470-E473 IonicContact CZ-OE1 3.93Å; R470-E473 IonicContact CZ-OE2 2.64Å; R470-E473 VanDerWaalsContact NE-CD 3.31Å; R470-E473 IonicContact NE-OE1 3.04Å; R470-E473 PolarHBondContact NE-OE1 3.44Å; R470-E473 IonicContact NE-OE2 2.81Å; R470-E473 PolarHBondContact NE-OE2 3.06Å; R470-E473 IonicContact NH1-OE2 3.78Å; R470-E473 IonicContact NH2-OE1 3.92Å; R470-E473 PolarHBondContact NH2-OE1 2.85Å; R470-E473 IonicContact NH2-OE2 2.72Å; R470-E473 PolarHBondContact NH2-OE2 2.73Å; R470-E473 PolarHBondContact O-N 3.41Å; R470-E473 VanDerWaalsContact O-N 3.14Å; R470-Q474 PolarHBondContact O-N 3.25Å
471	V	90.8	Very high	92.2	Very high	98 Å²	98	49 Å²	49	59%	0.594	25%	0.246	S	C	*	.	H	α-helix	trans	-56.6	-39.3	-168.6	-177.4	0	0	0	0	113.3	Q469 Q474 S475	Q469-V471 PolarHBondContact O-N 3.04Å; Q469-V471 VanDerWaalsContact O-N 3.08Å; V471-Q474 PolarHBondContact O-N 3Å; V471-S475 WeakPolarHBondContact O-CB 3.13Å; V471-S475 PolarHBondContact O-N 3.41Å
472	K	91.9	Very high	92.3	Very high	177 Å²	177	47.7 Å²	47.7	77%	0.77	24%	0.241	S	C	*	.	H	α-helix	trans	-62.7	-46	179.4	-174.5	-177.3	176.8	-172.1	0	112	R470 S475 Q476	R470-K472 VanDerWaalsContact C-N 3.31Å; R470-K472 PolarHBondContact O-N 3.21Å; K472-S475 PolarHBondContact O-N 3.16Å; K472-Q476 PolarHBondContact O-N 3.22Å; K472-Q476 VanDerWaalsContact O-N 3.14Å
473	E	93.3	Very high	92.5	Very high	64 Å²	64	47.8 Å²	47.8	30%	0.299	24%	0.242	S	C	.	.	H	α-helix	trans	-72	-38.5	179.6	-69.8	171.5	-119.7	0	0	111.3	L465 R470 S475 Q476 V477	L465-E473 HydrophobicContact CD1-CB 3.91Å; L465-E473 HydrophobicContact CD2-CB 4.27Å; R470-E473 HydrophobicContact CB-CB 4.48Å; R470-E473 IonicContact CZ-OE1 3.93Å; R470-E473 IonicContact CZ-OE2 2.64Å; R470-E473 VanDerWaalsContact NE-CD 3.31Å; R470-E473 IonicContact NE-OE1 3.04Å; R470-E473 PolarHBondContact NE-OE1 3.44Å; R470-E473 IonicContact NE-OE2 2.81Å; R470-E473 PolarHBondContact NE-OE2 3.06Å; R470-E473 IonicContact NH1-OE2 3.78Å; R470-E473 IonicContact NH2-OE1 3.92Å; R470-E473 PolarHBondContact NH2-OE1 2.85Å; R470-E473 IonicContact NH2-OE2 2.72Å; R470-E473 PolarHBondContact NH2-OE2 2.73Å; R470-E473 PolarHBondContact O-N 3.41Å; R470-E473 VanDerWaalsContact O-N 3.14Å; E473-S475 VanDerWaalsContact C-N 3.34Å; E473-S475 PolarHBondContact O-N 3.36Å; E473-Q476 PolarHBondContact O-N 2.97Å; E473-V477 VanDerWaalsContact O-CG2 3.3Å; E473-V477 WeakPolarHBondContact O-CG2 3.33Å; E473-V477 PolarHBondContact O-N 3.17Å
474	Q	94.2	Very high	92.7	Very high	24 Å²	24	48.1 Å²	48.1	11%	0.112	24%	0.239	C	C	.	.	H	α-helix	trans	-55.4	-51.6	172.5	-179.8	-169.6	6.3	0	0	110.4	A462 L465 S466 R470 V471 Q476 V477 I478	A462-Q474 HydrophobicContact CB-CG 4.25Å; L465-Q474 HydrophobicContact CB-CB 4Å; S466-Q474 VanDerWaalsContact CB-NE2 3.34Å; S466-Q474 PolarHBondContact OG-NE2 3.22Å; R470-Q474 PolarHBondContact O-N 3.25Å; V471-Q474 PolarHBondContact O-N 3Å; Q474-Q476 VanDerWaalsContact C-N 3.3Å; Q474-Q476 PolarHBondContact O-N 2.64Å; Q474-V477 PolarHBondContact O-N 3.24Å; Q474-I478 HydrophobicContact CG-CG1 4.32Å; Q474-I478 VanDerWaalsContact O-CG1 3.27Å; Q474-I478 WeakPolarHBondContact O-CG1 3.37Å; Q474-I478 PolarHBondContact O-N 3.07Å
475	S	93.4	Very high	92.9	Very high	41 Å²	41	47.6 Å²	47.6	29%	0.287	24%	0.236	S	C	.	.	H	α-helix	trans	-58.4	-42.3	179	177	0	0	0	0	112	V471 K472 E473 I478 N479 L513	V471-S475 WeakPolarHBondContact O-CB 3.13Å; V471-S475 PolarHBondContact O-N 3.41Å; K472-S475 PolarHBondContact O-N 3.16Å; E473-S475 VanDerWaalsContact C-N 3.34Å; E473-S475 PolarHBondContact O-N 3.36Å; S475-I478 PolarHBondContact O-N 3.41Å; S475-N479 WeakPolarHBondContact O-CB 3.25Å; S475-N479 PolarHBondContact O-N 3.01Å; S475-N479 PolarHBondContact O-ND2 3.47Å; S475-N479 VanDerWaalsContact O-ND2 3.15Å; S475-L513 WeakPolarHBondContact OG-CD2 3.43Å
476	Q	94.2	Very high	92.9	Very high	55 Å²	55	48 Å²	48	26%	0.257	24%	0.239	S	C	.	.	H	α-helix	trans	-61.6	-45.7	176.7	-176.4	-179.9	-45.5	0	0	112.3	L248 K472 E473 Q474 N479 Q480	L248-Q476 HydrophobicContact CD2-CG 3.6Å; L248-Q476 HydrophobicContact CG-CG 4.46Å; K472-Q476 PolarHBondContact O-N 3.22Å; K472-Q476 VanDerWaalsContact O-N 3.14Å; E473-Q476 PolarHBondContact O-N 2.97Å; Q474-Q476 VanDerWaalsContact C-N 3.3Å; Q474-Q476 PolarHBondContact O-N 2.64Å; Q476-N479 PolarHBondContact O-N 3.35Å; Q476-Q480 PolarHBondContact O-N 3.46Å; Q476-Q480 VanDerWaalsContact O-N 3.08Å
477	V	95	Very high	93	Very high	16 Å²	16	45.5 Å²	45.5	10%	0.097	22%	0.222	C	C	.	.	H	α-helix	trans	-65.7	-40.2	178	174.8	0	0	0	0	111.2	K458 Y461 A462 L465 E473 Q474 Q480 A481	K458-V477 HydrophobicContact CB-CG1 4.05Å; K458-V477 VanDerWaalsContact O-CG1 3.29Å; K458-V477 WeakPolarHBondContact O-CG1 3.47Å; Y461-V477 HydrophobicContact CD1-CB 4.48Å; Y461-V477 HydrophobicContact CD1-CG1 4.01Å; Y461-V477 HydrophobicContact CD1-CG2 3.72Å; Y461-V477 HydrophobicContact CE1-CG2 3.69Å; A462-V477 HydrophobicContact CB-CB 4.31Å; A462-V477 HydrophobicContact CB-CG1 3.94Å; L465-V477 HydrophobicContact CD1-CG2 3.91Å; E473-V477 VanDerWaalsContact O-CG2 3.3Å; E473-V477 WeakPolarHBondContact O-CG2 3.33Å; E473-V477 PolarHBondContact O-N 3.17Å; Q474-V477 PolarHBondContact O-N 3.24Å; V477-Q480 WeakPolarHBondContact O-CB 3.42Å; V477-Q480 PolarHBondContact O-N 3.23Å; V477-A481 WeakPolarHBondContact O-CB 3.33Å; V477-A481 PolarHBondContact O-N 2.73Å
478	I	95.2	Very high	93.1	Very high	8 Å²	8	40.3 Å²	40.3	4%	0.041	20%	0.198	C	C	.	.	H	α-helix	trans	-66.2	-41.8	177.1	-64.9	-66	0	0	0	111.1	L459 A462 Q474 S475 Q480 A481 M482 A509 T512 L513	L459-I478 HydrophobicContact CD2-CD1 3.81Å; A462-I478 HydrophobicContact CB-CD1 3.44Å; A462-I478 VanDerWaalsContact CB-CD1 3.44Å; A462-I478 HydrophobicContact CB-CG1 3.83Å; Q474-I478 HydrophobicContact CG-CG1 4.32Å; Q474-I478 VanDerWaalsContact O-CG1 3.27Å; Q474-I478 WeakPolarHBondContact O-CG1 3.37Å; Q474-I478 PolarHBondContact O-N 3.07Å; S475-I478 PolarHBondContact O-N 3.41Å; I478-Q480 VanDerWaalsContact C-N 3.27Å; I478-Q480 PolarHBondContact O-N 2.8Å; I478-A481 PolarHBondContact O-N 2.72Å; I478-M482 HydrophobicContact CG2-CG 4.48Å; I478-M482 WeakPolarHBondContact O-CB 3.34Å; I478-M482 WeakPolarHBondContact O-CG 3.45Å; I478-M482 PolarHBondContact O-N 3Å; I478-A509 HydrophobicContact CG2-CB 3.8Å; I478-A509 WeakPolarHBondContact CG2-O 3.33Å; I478-T512 HydrophobicContact CG1-CG2 4.29Å; I478-L513 HydrophobicContact CB-CD2 4.01Å; I478-L513 HydrophobicContact CB-CG 4.28Å; I478-L513 HydrophobicContact CG2-CD1 3.91Å; I478-L513 HydrophobicContact CG2-CD2 3.89Å; I478-L513 HydrophobicContact CG2-CG 3.59Å
479	N	95.5	Very high	93.1	Very high	21 Å²	21	41.6 Å²	41.6	11%	0.112	21%	0.208	C	C	.	.	H	α-helix	trans	-58.2	-41	173.4	-77.5	-39.7	0	0	0	111.6	N249 H252 S475 Q476 M482 A483 L513	N249-N479 PolarHBondContact OD1-ND2 3.43Å; N249-N479 VanDerWaalsContact OD1-ND2 3.09Å; H252-N479 HydrophobicContact CB-CB 3.94Å; S475-N479 WeakPolarHBondContact O-CB 3.25Å; S475-N479 PolarHBondContact O-N 3.01Å; S475-N479 PolarHBondContact O-ND2 3.47Å; S475-N479 VanDerWaalsContact O-ND2 3.15Å; Q476-N479 PolarHBondContact O-N 3.35Å; N479-M482 PolarHBondContact O-N 3.36Å; N479-A483 PolarHBondContact O-N 3.49Å; N479-L513 VanDerWaalsContact OD1-CD1 3.25Å; N479-L513 WeakPolarHBondContact OD1-CD1 3.27Å
480	Q	95.3	Very high	92.9	Very high	5 Å²	5	37.9 Å²	37.9	2%	0.023	19%	0.187	C	C	.	.	H	α-helix	trans	-65.8	-45.8	175.3	-176.6	169.8	-6.2	0	0	112.5	H252 E280 K458 Q476 V477 I478 M482 A483 E484	H252-Q480 VanDerWaalsContact CE1-CB 3.46Å; H252-Q480 WeakPolarHBondContact CE1-CB 3.45Å; E280-Q480 PolarHBondContact OE1-NE2 2.97Å; E280-Q480 PolarHBondContact OE1-OE1 2.91Å; K458-Q480 HydrophobicContact CD-CG 4.28Å; Q476-Q480 PolarHBondContact O-N 3.46Å; Q476-Q480 VanDerWaalsContact O-N 3.08Å; V477-Q480 WeakPolarHBondContact O-CB 3.42Å; V477-Q480 PolarHBondContact O-N 3.23Å; I478-Q480 VanDerWaalsContact C-N 3.27Å; I478-Q480 PolarHBondContact O-N 2.8Å; Q480-M482 VanDerWaalsContact C-N 3.29Å; Q480-M482 PolarHBondContact O-N 3.22Å; Q480-A483 PolarHBondContact O-N 2.94Å; Q480-E484 WeakPolarHBondContact O-CG 3.48Å; Q480-E484 PolarHBondContact O-N 2.9Å
481	A	94.1	Very high	92.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.9	-41.9	176.2	0	0	0	0	0	111.4	V455 K458 L459 V477 I478 E484 L485	V455-A481 HydrophobicContact CG1-CB 4.31Å; K458-A481 HydrophobicContact CB-CB 4.46Å; L459-A481 HydrophobicContact CD2-CB 3.86Å; L459-A481 HydrophobicContact CG-CB 4.38Å; V477-A481 WeakPolarHBondContact O-CB 3.33Å; V477-A481 PolarHBondContact O-N 2.73Å; I478-A481 PolarHBondContact O-N 2.72Å; A481-E484 PolarHBondContact O-N 2.97Å; A481-L485 WeakPolarHBondContact O-CB 3.5Å; A481-L485 VanDerWaalsContact O-CG 3.29Å; A481-L485 WeakPolarHBondContact O-CG 3.27Å; A481-L485 PolarHBondContact O-N 3.25Å
482	M	94.1	Very high	92.3	Very high	6 Å²	6	31 Å²	31	3%	0.03	15%	0.151	C	C	.	.	H	α-helix	trans	-58.9	-47	174.1	-80.4	-64.6	-62.7	0	0	112.7	V256 I478 N479 Q480 E484 L485 A486 M506 A509 M510	V256-M482 HydrophobicContact CG1-CE 4.2Å; V256-M482 HydrophobicContact CG2-CB 3.82Å; I478-M482 HydrophobicContact CG2-CG 4.48Å; I478-M482 WeakPolarHBondContact O-CB 3.34Å; I478-M482 WeakPolarHBondContact O-CG 3.45Å; I478-M482 PolarHBondContact O-N 3Å; N479-M482 PolarHBondContact O-N 3.36Å; Q480-M482 VanDerWaalsContact C-N 3.29Å; Q480-M482 PolarHBondContact O-N 3.22Å; M482-E484 VanDerWaalsContact C-N 3.32Å; M482-E484 PolarHBondContact O-N 3.3Å; M482-L485 PolarHBondContact O-N 2.91Å; M482-A486 WeakPolarHBondContact O-CB 3.5Å; M482-A486 PolarHBondContact O-N 3.34Å; M482-M506 HydrophobicContact CE-CB 4Å; M482-M506 HydrophobicContact CE-CE 3.72Å; M482-M506 HydrophobicContact CE-CG 4.23Å; M482-M506 HydrophobicContact SD-CB 3.91Å; M482-M506 HydrophobicContact SD-CG 4.06Å; M482-M506 VanDerWaalsContact SD-O 3.37Å; M482-A509 HydrophobicContact CG-CB 3.75Å; M482-A509 HydrophobicContact SD-CB 3.42Å; M482-A509 WeakPolarHBondContact SD-CB 3.29Å; M482-M510 HydrophobicContact CE-CG 3.57Å; M482-M510 HydrophobicContact CE-SD 3.6Å; M482-M510 VanDerWaalsContact CE-SD 3.6Å; M482-M510 HydrophobicContact SD-CG 4.14Å; M482-M510 HydrophobicContact SD-SD 4.35Å
483	A	95.3	Very high	91.8	Very high	3 Å²	3	30.4 Å²	30.4	3%	0.025	16%	0.156	C	C	.	.	H	α-helix	trans	-62.5	-40.9	177.9	0	0	0	0	0	111.7	H252 I255 V256 N479 Q480 T487	H252-A483 HydrophobicContact CB-CB 4.19Å; I255-A483 HydrophobicContact CB-CB 4.1Å; I255-A483 HydrophobicContact CG2-CB 3.96Å; V256-A483 HydrophobicContact CG2-CB 4.22Å; N479-A483 PolarHBondContact O-N 3.49Å; Q480-A483 PolarHBondContact O-N 2.94Å; A483-T487 PolarHBondContact O-N 3.18Å; A483-T487 PolarHBondContact O-OG1 3.15Å
484	E	92.8	Very high	91.4	Very high	24 Å²	24	29.8 Å²	29.8	11%	0.112	15%	0.154	C	C	.	.	H	α-helix	trans	-67.2	-42.1	176.3	-70.8	-174.3	-146.2	0	0	112.3	R441 V455 K458 Q480 A481 M482 T487 I488	R441-E484 IonicContact CZ-OE2 3.7Å; R441-E484 VanDerWaalsContact CZ-OE2 3.26Å; R441-E484 IonicContact NH1-OE1 3.1Å; R441-E484 IonicContact NH1-OE2 2.72Å; R441-E484 PolarHBondContact NH1-OE2 2.91Å; R441-E484 IonicContact NH2-OE2 3.18Å; R441-E484 PolarHBondContact NH2-OE2 3.4Å; V455-E484 HydrophobicContact CG2-CB 3.7Å; V455-E484 WeakPolarHBondContact CG2-OE2 3.49Å; K458-E484 VanDerWaalsContact CE-OE1 3.31Å; K458-E484 WeakPolarHBondContact CE-OE1 3.18Å; K458-E484 IonicContact NZ-OE1 2.73Å; K458-E484 PolarHBondContact NZ-OE1 3.43Å; K458-E484 IonicContact NZ-OE2 2.68Å; Q480-E484 WeakPolarHBondContact O-CG 3.48Å; Q480-E484 PolarHBondContact O-N 2.9Å; A481-E484 PolarHBondContact O-N 2.97Å; M482-E484 VanDerWaalsContact C-N 3.32Å; M482-E484 PolarHBondContact O-N 3.3Å; E484-T487 PolarHBondContact O-N 3.16Å; E484-I488 WeakPolarHBondContact O-CG1 3.37Å; E484-I488 PolarHBondContact O-N 3.36Å
485	L	92.3	Very high	91	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.4	-47.9	174.2	-74.1	169	0	0	0	111.2	V455 A481 M482 T487 I488 P489 L502 L505 M506	V455-L485 HydrophobicContact CG1-CD1 4.23Å; V455-L485 HydrophobicContact CG1-CD2 3.74Å; V455-L485 HydrophobicContact CG1-CG 3.73Å; A481-L485 WeakPolarHBondContact O-CB 3.5Å; A481-L485 VanDerWaalsContact O-CG 3.29Å; A481-L485 WeakPolarHBondContact O-CG 3.27Å; A481-L485 PolarHBondContact O-N 3.25Å; M482-L485 PolarHBondContact O-N 2.91Å; L485-T487 PolarHBondContact O-N 2.99Å; L485-T487 VanDerWaalsContact O-N 3.12Å; L485-I488 HydrophobicContact CD2-CD1 4.15Å; L485-I488 PolarHBondContact O-N 3.38Å; L485-I488 VanDerWaalsContact O-N 3.16Å; L485-P489 WeakPolarHBondContact O-CD 3.45Å; L485-L502 HydrophobicContact CB-CD1 4.37Å; L485-L502 HydrophobicContact CD2-CD1 3.81Å; L485-L502 HydrophobicContact CD2-CG 4.31Å; L485-L502 WeakPolarHBondContact O-CD1 3.26Å; L485-L505 HydrophobicContact CD1-CB 4.11Å; L485-M506 HydrophobicContact CB-CG 3.65Å; L485-M506 HydrophobicContact CB-SD 4.03Å; L485-M506 HydrophobicContact CD1-CG 3.8Å; L485-M506 HydrophobicContact CG-CG 4.3Å
486	A	92.5	Very high	90.7	Very high	8 Å²	8	35.8 Å²	35.8	7%	0.066	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-25.4	178.4	0	0	0	0	0	113.2	P259 M482 M506	P259-A486 HydrophobicContact CB-CB 4.37Å; P259-A486 WeakPolarHBondContact CB-O 3.18Å; M482-A486 WeakPolarHBondContact O-CB 3.5Å; M482-A486 PolarHBondContact O-N 3.34Å; A486-M506 HydrophobicContact CB-CE 3.93Å
487	T	92.2	Very high	90.4	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.025	21%	0.206	C	C	.	.	H	α-helix	trans	-86.4	-25.2	-178.4	-51.4	0	0	0	0	112.7	I255 H265 I287 M291 A483 E484 L485 P489 Y490 L491	I255-T487 WeakPolarHBondContact CG2-OG1 3.45Å; H265-T487 PolarHBondContact CE1-OG1 3.24Å; I287-T487 HydrophobicContact CD1-CG2 4.4Å; I287-T487 HydrophobicContact CG2-CG2 3.8Å; M291-T487 HydrophobicContact CE-CG2 3.57Å; A483-T487 PolarHBondContact O-N 3.18Å; A483-T487 PolarHBondContact O-OG1 3.15Å; E484-T487 PolarHBondContact O-N 3.16Å; L485-T487 PolarHBondContact O-N 2.99Å; L485-T487 VanDerWaalsContact O-N 3.12Å; T487-P489 VanDerWaalsContact C-CD 3.47Å; T487-Y490 PolarHBondContact O-N 3.35Å; T487-Y490 VanDerWaalsContact O-N 3.07Å; T487-L491 HydrophobicContact CG2-CD1 3.96Å; T487-L491 HydrophobicContact CG2-CD2 4.28Å; T487-L491 HydrophobicContact CG2-CG 3.99Å; T487-L491 PolarHBondContact O-N 3.32Å
488	I	90.1	Very high	89.9	Confident	7 Å²	7	42 Å²	42	4%	0.036	21%	0.212	C	C	.	.	H	α-helix	trans	-51.7	-46.4	-175	-77.5	169.1	0	0	0	113.9	F449 E484 L485 Y490 L491 R492 I494 L502	F449-I488 HydrophobicContact CD2-CD1 4.25Å; F449-I488 HydrophobicContact CE2-CD1 4.04Å; E484-I488 WeakPolarHBondContact O-CG1 3.37Å; E484-I488 PolarHBondContact O-N 3.36Å; L485-I488 HydrophobicContact CD2-CD1 4.15Å; L485-I488 PolarHBondContact O-N 3.38Å; L485-I488 VanDerWaalsContact O-N 3.16Å; I488-Y490 PolarHBondContact O-N 3.46Å; I488-Y490 VanDerWaalsContact O-N 3.1Å; I488-L491 PolarHBondContact O-N 2.99Å; I488-R492 VanDerWaalsContact CG2-NH2 3.3Å; I488-R492 PolarHBondContact O-N 2.91Å; I488-I494 HydrophobicContact CG2-CG2 4.01Å; I488-L502 HydrophobicContact CB-CD1 3.8Å; I488-L502 HydrophobicContact CD1-CD1 3.78Å; I488-L502 HydrophobicContact CG1-CD1 4.37Å; I488-L502 HydrophobicContact CG2-CD1 3.86Å
489	P	88.9	Confident	89.6	Confident	54 Å²	54	42.5 Å²	42.5	35%	0.351	22%	0.218	S	C	.	.	H	α-helix	trans	-60.3	-21.8	-178	-24.9	34.9	0	0	0	114.3	L485 T487 I494 L502	L485-P489 WeakPolarHBondContact O-CD 3.45Å; T487-P489 VanDerWaalsContact C-CD 3.47Å; P489-I494 HydrophobicContact CB-CD1 4.02Å; P489-I494 HydrophobicContact CG-CD1 4.01Å; P489-L502 HydrophobicContact CG-CD2 3.89Å
490	Y	87.9	Confident	89.3	Confident	90 Å²	90	46.2 Å²	46.2	35%	0.353	23%	0.234	S	C	.	.	H	α-helix	trans	-91.4	-20.4	-179.9	-61.1	-89.1	0	0	0	112.5	P259 A260 Y290 M291 L294 T487 I488	P259-Y490 HydrophobicContact CB-CD2 4.12Å; P259-Y490 HydrophobicContact CB-CE2 3.86Å; P259-Y490 HydrophobicContact CG-CD2 4.06Å; P259-Y490 HydrophobicContact CG-CE2 3.29Å; A260-Y490 HydrophobicContact CB-CD1 4.24Å; A260-Y490 HydrophobicContact CB-CE1 3.86Å; Y290-Y490 WeakPolarHBondContact CE1-O 3.45Å; M291-Y490 HydrophobicContact CE-CG 4.1Å; L294-Y490 WeakPolarHBondContact CD1-O 3.28Å; T487-Y490 PolarHBondContact O-N 3.35Å; T487-Y490 VanDerWaalsContact O-N 3.07Å; I488-Y490 PolarHBondContact O-N 3.46Å; I488-Y490 VanDerWaalsContact O-N 3.1Å
491	L	86.3	Confident	89	Confident	7 Å²	7	48 Å²	48	4%	0.037	24%	0.244	C	C	.	.	H	α-helix	trans	-86.7	-23.4	-177.3	-61.9	-178.5	0	0	0	112.9	I287 Y290 M291 L445 N446 T487 I488	I287-L491 HydrophobicContact CD1-CD1 4.18Å; I287-L491 HydrophobicContact CG1-CD1 4.24Å; I287-L491 HydrophobicContact CG1-CD2 4.27Å; I287-L491 HydrophobicContact CG2-CD2 4.28Å; Y290-L491 HydrophobicContact CD1-CD2 3.67Å; Y290-L491 HydrophobicContact CE1-CD2 4.01Å; M291-L491 HydrophobicContact CE-CD2 3.73Å; M291-L491 HydrophobicContact CE-CG 4.36Å; L445-L491 HydrophobicContact CD2-CD2 4.15Å; N446-L491 PolarHBondContact OD1-O 3.31Å; T487-L491 HydrophobicContact CG2-CD1 3.96Å; T487-L491 HydrophobicContact CG2-CD2 4.28Å; T487-L491 HydrophobicContact CG2-CG 3.99Å; T487-L491 PolarHBondContact O-N 3.32Å; I488-L491 PolarHBondContact O-N 2.99Å
492	R	83.3	Confident	88.8	Confident	38 Å²	38	48.5 Å²	48.5	14%	0.143	25%	0.246	C	C	.	.	S	Bend	trans	-158.8	162	-176.9	63.3	-179.8	169.5	-155.7	-11.2	111.3	G447 S448 F449 I488 I494	G447-R492 VanDerWaalsContact C-NH1 3.33Å; G447-R492 PolarHBondContact O-NH1 3.21Å; S448-R492 PolarHBondContact O-NH1 3.48Å; S448-R492 VanDerWaalsContact O-NH1 3.17Å; F449-R492 VanDerWaalsContact CD2-NH2 3.3Å; F449-R492 VanDerWaalsContact N-NH1 3.12Å; I488-R492 VanDerWaalsContact CG2-NH2 3.3Å; I488-R492 PolarHBondContact O-N 2.91Å; R492-I494 HydrophobicContact CG-CG2 4.12Å
493	D	82.2	Confident	88.6	Confident	164 Å²	164	54.5 Å²	54.5	88%	0.877	27%	0.274	S	S	*	.			trans	-67.7	131.6	166.7	-57.9	-36.6	0	0	0	109.9
494	I	84.2	Confident	88.4	Confident	50 Å²	50	56.6 Å²	56.6	26%	0.256	29%	0.289	S	S	.	.			trans	-117.7	139.6	176.7	58.8	176.1	0	0	0	109.7	I488 P489 R492 E498 A499	I488-I494 HydrophobicContact CG2-CG2 4.01Å; P489-I494 HydrophobicContact CB-CD1 4.02Å; P489-I494 HydrophobicContact CG-CD1 4.01Å; R492-I494 HydrophobicContact CG-CG2 4.12Å; I494-E498 HydrophobicContact CB-CB 4.24Å; I494-A499 HydrophobicContact CD1-CB 3.83Å; I494-A499 HydrophobicContact CG1-CB 4.41Å
495	S	86.6	Confident	88.3	Confident	56 Å²	56	55.5 Å²	55.5	39%	0.392	28%	0.284	S	S	.	.			trans	-71	161.4	170.9	64.2	0	0	0	0	111.2	Q497 E498 A499	S495-Q497 VanDerWaalsContact C-N 3.26Å; S495-Q497 PolarHBondContact O-N 2.94Å; S495-E498 WeakPolarHBondContact CB-OE2 3.4Å; S495-E498 PolarHBondContact N-OE2 2.9Å; S495-E498 PolarHBondContact O-N 3.32Å; S495-E498 VanDerWaalsContact OG-CD 3.3Å; S495-E498 VanDerWaalsContact OG-CG 3.22Å; S495-E498 WeakPolarHBondContact OG-CG 3.35Å; S495-E498 PolarHBondContact OG-N 2.87Å; S495-E498 PolarHBondContact OG-OE2 3.44Å; S495-A499 PolarHBondContact O-N 3.11Å
496	Q	87.6	Confident	88.3	Confident	136 Å²	136	57.4 Å²	57.4	64%	0.636	29%	0.293	S	S	*	.	H	α-helix	trans	-54.8	-42.7	176.6	-178.2	59.4	29.4	0	0	112.3	E498 A499 E500	Q496-E498 VanDerWaalsContact C-N 3.34Å; Q496-E498 PolarHBondContact O-N 3Å; Q496-A499 PolarHBondContact O-N 2.96Å; Q496-E500 PolarHBondContact NE2-OE1 2.79Å; Q496-E500 WeakPolarHBondContact O-CG 3.31Å; Q496-E500 PolarHBondContact O-N 3.14Å
497	Q	86.6	Confident	88.2	Confident	152 Å²	152	59.5 Å²	59.5	71%	0.71	31%	0.31	S	S	*	.	H	α-helix	trans	-63.7	-38.7	177.9	-173.8	-179.9	6.7	0	0	112.2	S495 L501	S495-Q497 VanDerWaalsContact C-N 3.26Å; S495-Q497 PolarHBondContact O-N 2.94Å; Q497-L501 WeakPolarHBondContact O-CB 3.42Å; Q497-L501 PolarHBondContact O-N 2.93Å; Q497-L501 VanDerWaalsContact O-N 3.07Å
498	E	85.8	Confident	88.1	Confident	49 Å²	49	60.2 Å²	60.2	23%	0.229	31%	0.314	C	S	.	.	H	α-helix	trans	-70.5	-35.4	176.9	-69.6	168.3	130.2	0	0	111.8	F449 I494 S495 Q496 L501 L502	F449-E498 HydrophobicContact CD1-CB 4.02Å; F449-E498 HydrophobicContact CD1-CG 4Å; I494-E498 HydrophobicContact CB-CB 4.24Å; S495-E498 WeakPolarHBondContact CB-OE2 3.4Å; S495-E498 PolarHBondContact N-OE2 2.9Å; S495-E498 PolarHBondContact O-N 3.32Å; S495-E498 VanDerWaalsContact OG-CD 3.3Å; S495-E498 VanDerWaalsContact OG-CG 3.22Å; S495-E498 WeakPolarHBondContact OG-CG 3.35Å; S495-E498 PolarHBondContact OG-N 2.87Å; S495-E498 PolarHBondContact OG-OE2 3.44Å; Q496-E498 VanDerWaalsContact C-N 3.34Å; Q496-E498 PolarHBondContact O-N 3Å; E498-L501 PolarHBondContact O-N 2.75Å; E498-L502 VanDerWaalsContact O-CB 3.27Å; E498-L502 WeakPolarHBondContact O-CB 3.36Å; E498-L502 PolarHBondContact O-N 3.1Å
499	A	87.5	Confident	88.1	Confident	19 Å²	19	60 Å²	60	16%	0.157	31%	0.313	C	S	.	.	H	α-helix	trans	-64.3	-45.2	174.7	0	0	0	0	0	111.8	I494 S495 Q496 L501 L502 Q503	I494-A499 HydrophobicContact CD1-CB 3.83Å; I494-A499 HydrophobicContact CG1-CB 4.41Å; S495-A499 PolarHBondContact O-N 3.11Å; Q496-A499 PolarHBondContact O-N 2.96Å; A499-L501 PolarHBondContact O-N 3.35Å; A499-L502 WeakPolarHBondContact O-CB 3.45Å; A499-L502 PolarHBondContact O-N 3.31Å; A499-Q503 WeakPolarHBondContact O-CG 3.26Å; A499-Q503 PolarHBondContact O-N 3.12Å
500	E	89.7	Confident	88.2	Confident	98 Å²	98	60.8 Å²	60.8	46%	0.458	31%	0.313	S	S	.	.	H	α-helix	trans	-62.2	-42.8	175.8	-73.2	168.2	-165.4	0	0	112	Q496 Q503 S504	Q496-E500 PolarHBondContact NE2-OE1 2.79Å; Q496-E500 WeakPolarHBondContact O-CG 3.31Å; Q496-E500 PolarHBondContact O-N 3.14Å; E500-Q503 PolarHBondContact O-N 3.16Å; E500-S504 WeakPolarHBondContact O-CB 3.14Å; E500-S504 PolarHBondContact O-N 2.88Å; E500-S504 PolarHBondContact O-OG 2.81Å
501	L	88.8	Confident	88.2	Confident	44 Å²	44	58 Å²	58	23%	0.23	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-45	174.9	175.8	58.5	0	0	0	111.5	F449 Q497 E498 A499 S504 L505 V523 I527	F449-L501 HydrophobicContact CD1-CD2 4.48Å; F449-L501 HydrophobicContact CE1-CB 4.46Å; F449-L501 HydrophobicContact CE1-CD2 3.75Å; F449-L501 HydrophobicContact CE1-CG 4.03Å; F449-L501 HydrophobicContact CZ-CD2 4.38Å; F449-L501 HydrophobicContact CZ-CG 4.49Å; Q497-L501 WeakPolarHBondContact O-CB 3.42Å; Q497-L501 PolarHBondContact O-N 2.93Å; Q497-L501 VanDerWaalsContact O-N 3.07Å; E498-L501 PolarHBondContact O-N 2.75Å; A499-L501 PolarHBondContact O-N 3.35Å; L501-S504 PolarHBondContact O-N 3.48Å; L501-L505 HydrophobicContact CD1-CD1 4.01Å; L501-L505 HydrophobicContact CD1-CG 4.16Å; L501-L505 HydrophobicContact CG-CD1 4Å; L501-L505 VanDerWaalsContact O-CG 3.31Å; L501-L505 WeakPolarHBondContact O-CG 3.28Å; L501-L505 PolarHBondContact O-N 3.07Å; L501-V523 HydrophobicContact CD1-CG1 3.66Å; L501-I527 HydrophobicContact CD1-CD1 3.94Å
502	L	89.8	Confident	88.3	Confident	10 Å²	10	59.6 Å²	59.6	5%	0.052	31%	0.314	C	S	.	.	H	α-helix	trans	-59.7	-48.6	178	-174	110.7	0	0	0	111.4	L485 I488 P489 E498 A499 S504 L505 M506	L485-L502 HydrophobicContact CB-CD1 4.37Å; L485-L502 HydrophobicContact CD2-CD1 3.81Å; L485-L502 HydrophobicContact CD2-CG 4.31Å; L485-L502 WeakPolarHBondContact O-CD1 3.26Å; I488-L502 HydrophobicContact CB-CD1 3.8Å; I488-L502 HydrophobicContact CD1-CD1 3.78Å; I488-L502 HydrophobicContact CG1-CD1 4.37Å; I488-L502 HydrophobicContact CG2-CD1 3.86Å; P489-L502 HydrophobicContact CG-CD2 3.89Å; E498-L502 VanDerWaalsContact O-CB 3.27Å; E498-L502 WeakPolarHBondContact O-CB 3.36Å; E498-L502 PolarHBondContact O-N 3.1Å; A499-L502 WeakPolarHBondContact O-CB 3.45Å; A499-L502 PolarHBondContact O-N 3.31Å; L502-S504 VanDerWaalsContact C-N 3.31Å; L502-S504 PolarHBondContact O-N 2.88Å; L502-L505 PolarHBondContact O-N 2.86Å; L502-M506 HydrophobicContact CD2-SD 3.96Å; L502-M506 HydrophobicContact CG-SD 4.32Å; L502-M506 WeakPolarHBondContact O-CG 3.34Å; L502-M506 PolarHBondContact O-N 3.27Å
503	Q	90.4	Very high	88.5	Confident	132 Å²	132	60.2 Å²	60.2	62%	0.617	32%	0.32	S	S	*	.	H	α-helix	trans	-59.1	-43.4	177.4	-73.4	174.7	-4.1	0	0	111.6	A499 E500 M506 A507	A499-Q503 WeakPolarHBondContact O-CG 3.26Å; A499-Q503 PolarHBondContact O-N 3.12Å; E500-Q503 PolarHBondContact O-N 3.16Å; Q503-M506 PolarHBondContact O-N 2.88Å; Q503-A507 PolarHBondContact O-N 3.25Å
504	S	90.7	Very high	88.7	Confident	47 Å²	47	57.2 Å²	57.2	33%	0.329	30%	0.301	S	S	.	.	H	α-helix	trans	-64.1	-41.8	178.1	-56.7	0	0	0	0	112.4	E500 L501 L502 A507 D508	E500-S504 WeakPolarHBondContact O-CB 3.14Å; E500-S504 PolarHBondContact O-N 2.88Å; E500-S504 PolarHBondContact O-OG 2.81Å; L501-S504 PolarHBondContact O-N 3.48Å; L502-S504 VanDerWaalsContact C-N 3.31Å; L502-S504 PolarHBondContact O-N 2.88Å; S504-A507 PolarHBondContact O-N 2.65Å; S504-D508 PolarHBondContact O-N 3.47Å
505	L	91.3	Very high	88.6	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-66.1	-37.4	176.1	-72.3	167.4	0	0	0	112.4	F449 M456 L459 L485 L501 L502 D508 A509 W524 I527	F449-L505 HydrophobicContact CZ-CD1 4.07Å; M456-L505 HydrophobicContact CE-CD1 3.44Å; M456-L505 VanDerWaalsContact CE-CD1 3.44Å; M456-L505 HydrophobicContact SD-CD1 4.39Å; L459-L505 HydrophobicContact CD1-CD2 4.09Å; L485-L505 HydrophobicContact CD1-CB 4.11Å; L501-L505 HydrophobicContact CD1-CD1 4.01Å; L501-L505 HydrophobicContact CD1-CG 4.16Å; L501-L505 HydrophobicContact CG-CD1 4Å; L501-L505 VanDerWaalsContact O-CG 3.31Å; L501-L505 WeakPolarHBondContact O-CG 3.28Å; L501-L505 PolarHBondContact O-N 3.07Å; L502-L505 PolarHBondContact O-N 2.86Å; L505-D508 PolarHBondContact O-N 3.09Å; L505-A509 WeakPolarHBondContact O-CB 3.19Å; L505-A509 PolarHBondContact O-N 3.1Å; L505-W524 HydrophobicContact CD2-CB 4.15Å; L505-W524 HydrophobicContact CD2-CE3 4.19Å; L505-I527 HydrophobicContact CD2-CD1 4Å
506	M	91.8	Very high	88.2	Confident	39 Å²	39	61 Å²	61	19%	0.192	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-40.9	174	-71.2	179.4	72.9	0	0	111.2	M482 L485 A486 L502 Q503 A509 M510	M482-M506 HydrophobicContact CE-CB 4Å; M482-M506 HydrophobicContact CE-CE 3.72Å; M482-M506 HydrophobicContact CE-CG 4.23Å; M482-M506 HydrophobicContact SD-CB 3.91Å; M482-M506 HydrophobicContact SD-CG 4.06Å; M482-M506 VanDerWaalsContact SD-O 3.37Å; L485-M506 HydrophobicContact CB-CG 3.65Å; L485-M506 HydrophobicContact CB-SD 4.03Å; L485-M506 HydrophobicContact CD1-CG 3.8Å; L485-M506 HydrophobicContact CG-CG 4.3Å; A486-M506 HydrophobicContact CB-CE 3.93Å; L502-M506 HydrophobicContact CD2-SD 3.96Å; L502-M506 HydrophobicContact CG-SD 4.32Å; L502-M506 WeakPolarHBondContact O-CG 3.34Å; L502-M506 PolarHBondContact O-N 3.27Å; Q503-M506 PolarHBondContact O-N 2.88Å; M506-A509 PolarHBondContact O-N 3.44Å; M506-M510 WeakPolarHBondContact O-CG 3.18Å; M506-M510 PolarHBondContact O-N 3.06Å
507	A	90.6	Very high	87.1	Confident	52 Å²	52	65.9 Å²	65.9	43%	0.43	33%	0.333	S	S	.	.	H	α-helix	trans	-61.7	-46.7	174.3	0	0	0	0	0	111.8	Q503 S504 A509 M510 D511	Q503-A507 PolarHBondContact O-N 3.25Å; S504-A507 PolarHBondContact O-N 2.65Å; A507-A509 VanDerWaalsContact C-N 3.3Å; A507-A509 PolarHBondContact O-N 3.46Å; A507-M510 PolarHBondContact O-N 2.81Å; A507-D511 PolarHBondContact O-N 2.76Å
508	D	89.6	Confident	85.9	Confident	19 Å²	19	62.7 Å²	62.7	10%	0.102	32%	0.321	C	S	.	.	H	α-helix	trans	-58.8	-40.8	176.5	-76.1	-16.1	0	0	0	112.5	S504 L505 T512 R522 V523 W524	S504-D508 PolarHBondContact O-N 3.47Å; L505-D508 PolarHBondContact O-N 3.09Å; D508-T512 WeakPolarHBondContact O-CB 3.48Å; D508-T512 PolarHBondContact O-N 3.04Å; D508-T512 PolarHBondContact O-OG1 2.94Å; D508-R522 VanDerWaalsContact OD1-CB 3.3Å; D508-R522 WeakPolarHBondContact OD1-CB 3.45Å; D508-R522 WeakPolarHBondContact OD1-CG 3.41Å; D508-V523 WeakPolarHBondContact OD2-CA 3.33Å; D508-V523 PolarHBondContact OD2-N 3.07Å; D508-W524 PolarHBondContact OD2-N 2.94Å
509	A	90.8	Very high	84.5	Confident	2 Å²	2	68.6 Å²	68.6	2%	0.017	35%	0.354	C	S	.	.	H	α-helix	trans	-68.4	-41.5	177.6	0	0	0	0	0	111.8	I478 M482 L505 M506 A507 T512 L513	I478-A509 HydrophobicContact CG2-CB 3.8Å; I478-A509 WeakPolarHBondContact CG2-O 3.33Å; M482-A509 HydrophobicContact CG-CB 3.75Å; M482-A509 HydrophobicContact SD-CB 3.42Å; M482-A509 WeakPolarHBondContact SD-CB 3.29Å; L505-A509 WeakPolarHBondContact O-CB 3.19Å; L505-A509 PolarHBondContact O-N 3.1Å; M506-A509 PolarHBondContact O-N 3.44Å; A507-A509 VanDerWaalsContact C-N 3.3Å; A507-A509 PolarHBondContact O-N 3.46Å; A509-T512 WeakPolarHBondContact O-CB 3.49Å; A509-T512 PolarHBondContact O-N 3.18Å; A509-L513 WeakPolarHBondContact O-CG 3.47Å; A509-L513 PolarHBondContact O-N 3.15Å
510	M	90.6	Very high	83.4	Confident	72 Å²	72	74 Å²	74	36%	0.355	38%	0.381	S	S	.	.	H	α-helix	trans	-63.8	-46.4	174	-72.2	-57	-65.5	0	0	112.1	M482 M506 A507 T512 L513 E514	M482-M510 HydrophobicContact CE-CG 3.57Å; M482-M510 HydrophobicContact CE-SD 3.6Å; M482-M510 VanDerWaalsContact CE-SD 3.6Å; M482-M510 HydrophobicContact SD-CG 4.14Å; M482-M510 HydrophobicContact SD-SD 4.35Å; M506-M510 WeakPolarHBondContact O-CG 3.18Å; M506-M510 PolarHBondContact O-N 3.06Å; A507-M510 PolarHBondContact O-N 2.81Å; M510-T512 PolarHBondContact O-N 3.31Å; M510-L513 PolarHBondContact O-N 3.12Å; M510-L513 HydrophobicContact SD-CD1 4.11Å; M510-E514 WeakPolarHBondContact O-CG 3.39Å; M510-E514 PolarHBondContact O-N 3.28Å
511	D	89	Confident	82.5	Confident	32 Å²	32	75 Å²	75	17%	0.171	39%	0.385	C	S	.	.	H	α-helix	trans	-57.8	-34.8	174.6	-83.9	-4.1	0	0	0	111.8	A507 G515 R516 N518	A507-D511 PolarHBondContact O-N 2.76Å; D511-G515 PolarHBondContact O-N 3.26Å; D511-G515 VanDerWaalsContact O-N 3.12Å; D511-R516 HydrophobicContact CB-CB 4.28Å; D511-R516 PolarHBondContact O-N 3.46Å; D511-N518 PolarHBondContact OD2-ND2 3.38Å
512	T	87.5	Confident	82.3	Confident	39 Å²	39	75.1 Å²	75.1	24%	0.239	38%	0.383	C	S	.	.	H	α-helix	trans	-67.1	-43.6	174.7	-56.9	0	0	0	0	112.1	I478 D508 A509 M510 E514 G515 R522	I478-T512 HydrophobicContact CG1-CG2 4.29Å; D508-T512 WeakPolarHBondContact O-CB 3.48Å; D508-T512 PolarHBondContact O-N 3.04Å; D508-T512 PolarHBondContact O-OG1 2.94Å; A509-T512 WeakPolarHBondContact O-CB 3.49Å; A509-T512 PolarHBondContact O-N 3.18Å; M510-T512 PolarHBondContact O-N 3.31Å; T512-E514 VanDerWaalsContact C-N 3.32Å; T512-G515 PolarHBondContact O-N 2.94Å; T512-R522 PolarHBondContact OG1-NH1 3.26Å
513	L	87.4	Confident	82.1	Confident	51 Å²	51	77 Å²	77	27%	0.267	39%	0.394	S	S	.	.	H	α-helix	trans	-65.9	-35.7	177.6	-71.9	170.8	0	0	0	112.3	S475 I478 N479 A509 M510 G515	S475-L513 WeakPolarHBondContact OG-CD2 3.43Å; I478-L513 HydrophobicContact CB-CD2 4.01Å; I478-L513 HydrophobicContact CB-CG 4.28Å; I478-L513 HydrophobicContact CG2-CD1 3.91Å; I478-L513 HydrophobicContact CG2-CD2 3.89Å; I478-L513 HydrophobicContact CG2-CG 3.59Å; N479-L513 VanDerWaalsContact OD1-CD1 3.25Å; N479-L513 WeakPolarHBondContact OD1-CD1 3.27Å; A509-L513 WeakPolarHBondContact O-CG 3.47Å; A509-L513 PolarHBondContact O-N 3.15Å; M510-L513 PolarHBondContact O-N 3.12Å; M510-L513 HydrophobicContact SD-CD1 4.11Å; L513-G515 VanDerWaalsContact C-N 3.27Å
514	E	86.4	Confident	81.9	Confident	102 Å²	102	71.8 Å²	71.8	48%	0.477	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-5.5	178.8	-66.2	-174.9	-171.5	0	0	113.2	M510 T512 R516	M510-E514 WeakPolarHBondContact O-CG 3.39Å; M510-E514 PolarHBondContact O-N 3.28Å; T512-E514 VanDerWaalsContact C-N 3.32Å; E514-R516 HydrophobicContact CB-CG 4.01Å; E514-R516 PolarHBondContact O-N 3.37Å; E514-R516 IonicContact OE2-CZ 3.01Å; E514-R516 IonicContact OE2-NE 2.65Å; E514-R516 PolarHBondContact OE2-NE 2.67Å; E514-R516 IonicContact OE2-NH2 2.66Å; E514-R516 PolarHBondContact OE2-NH2 3.21Å
515	G	81.7	Confident	81.5	Confident	56 Å²	56	72.5 Å²	72.5	58%	0.577	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	16.2	-178.5	0	0	0	0	0	113.9	D511 T512 L513 R517	D511-G515 PolarHBondContact O-N 3.26Å; D511-G515 VanDerWaalsContact O-N 3.12Å; T512-G515 PolarHBondContact O-N 2.94Å; L513-G515 VanDerWaalsContact C-N 3.27Å; G515-R517 PolarHBondContact O-N 2.87Å; G515-R517 VanDerWaalsContact O-N 3.15Å
516	R	78.8	Confident	81.3	Confident	130 Å²	130	75.2 Å²	75.2	49%	0.491	39%	0.386	S	S	.	.			trans	-68.5	109.2	178.1	-64.8	-170.9	-167.9	-164.3	8.7	109.7	D511 E514 N518 R522	D511-R516 HydrophobicContact CB-CB 4.28Å; D511-R516 PolarHBondContact O-N 3.46Å; E514-R516 HydrophobicContact CB-CG 4.01Å; E514-R516 PolarHBondContact O-N 3.37Å; E514-R516 IonicContact OE2-CZ 3.01Å; E514-R516 IonicContact OE2-NE 2.65Å; E514-R516 PolarHBondContact OE2-NE 2.67Å; E514-R516 IonicContact OE2-NH2 2.66Å; E514-R516 PolarHBondContact OE2-NH2 3.21Å; R516-N518 PolarHBondContact O-N 3.43Å; R516-R522 PolarHBondContact O-NH2 3.15Å
517	R	64.4	Low	81	Confident	237 Å²	237	74.5 Å²	74.5	89%	0.894	38%	0.382	S	S	*	.			trans	-92.3	84.9	171.1	-65.3	-174.7	-176.2	-175.1	1.4	108.4	G515	G515-R517 PolarHBondContact O-N 2.87Å; G515-R517 VanDerWaalsContact O-N 3.15Å
518	N	60.3	Low	80.5	Confident	86 Å²	86	73.8 Å²	73.8	46%	0.46	37%	0.37	S	S	.	.			trans	-80.3	136.2	170.3	-64.2	-12.9	0	0	0	108.3	D511 R516 N520	D511-N518 PolarHBondContact OD2-ND2 3.38Å; R516-N518 PolarHBondContact O-N 3.43Å; N518-N520 PolarHBondContact O-N 3.32Å
519	D	56.5	Low	80.2	Confident	173 Å²	173	78.1 Å²	78.1	93%	0.925	39%	0.388	S	S	*	.	S	Bend	trans	-68.8	-9.6	176.7	-69.6	-30.9	0	0	0	112.8
520	N	64.4	Low	79.9	Confident	132 Å²	132	81.4 Å²	81.4	71%	0.706	41%	0.408	S	S	*	.	S	Bend	trans	-71.8	141.9	177.6	-67.3	-10.6	0	0	0	111.6	N518 R522	N518-N520 PolarHBondContact O-N 3.32Å; N520-R522 PolarHBondContact O-N 2.89Å; N520-R522 VanDerWaalsContact O-N 3.15Å
521	E	71.9	Confident	79.5	Confident	118 Å²	118	78 Å²	78	55%	0.551	39%	0.391	S	S	*	.			trans	-68.6	112.9	178.6	-170.5	163.6	-146.5	0	0	111	K529	E521-K529 IonicContact OE1-NZ 3.45Å; E521-K529 PolarHBondContact OE1-NZ 3.27Å
522	R	84.5	Confident	79.1	Confident	48 Å²	48	80 Å²	80	18%	0.181	40%	0.399	C	S	.	.			trans	-68	144.8	175	-68.3	-174.4	-175.9	-178.3	-5.1	111.5	D508 T512 R516 N520 W524 N525 T526	D508-R522 VanDerWaalsContact OD1-CB 3.3Å; D508-R522 WeakPolarHBondContact OD1-CB 3.45Å; D508-R522 WeakPolarHBondContact OD1-CG 3.41Å; T512-R522 PolarHBondContact OG1-NH1 3.26Å; R516-R522 PolarHBondContact O-NH2 3.15Å; N520-R522 PolarHBondContact O-N 2.89Å; N520-R522 VanDerWaalsContact O-N 3.15Å; R522-W524 VanDerWaalsContact C-N 3.27Å; R522-W524 PolarHBondContact O-N 3.46Å; R522-N525 HydrophobicContact CB-CB 4.35Å; R522-N525 WeakPolarHBondContact O-CB 3.5Å; R522-N525 PolarHBondContact O-N 3.15Å; R522-T526 PolarHBondContact O-N 2.92Å; R522-T526 VanDerWaalsContact O-N 3.16Å; R522-T526 PolarHBondContact O-OG1 3.38Å
523	V	86.6	Confident	78.8	Confident	48 Å²	48	83.1 Å²	83.1	29%	0.291	41%	0.413	S	S	.	.	H	α-helix	trans	-60.4	-40	-179.9	172.8	0	0	0	0	111.1	L501 D508 N525 T526 I527	L501-V523 HydrophobicContact CD1-CG1 3.66Å; D508-V523 WeakPolarHBondContact OD2-CA 3.33Å; D508-V523 PolarHBondContact OD2-N 3.07Å; V523-N525 VanDerWaalsContact C-N 3.32Å; V523-N525 PolarHBondContact O-N 2.91Å; V523-T526 WeakPolarHBondContact O-CB 3.4Å; V523-T526 PolarHBondContact O-N 3.21Å; V523-I527 HydrophobicContact CG1-CD1 3.92Å; V523-I527 HydrophobicContact CG1-CG1 4.49Å; V523-I527 WeakPolarHBondContact O-CG1 3.22Å; V523-I527 PolarHBondContact O-N 3.29Å
524	W	86.1	Confident	78.7	Confident	23 Å²	23	83 Å²	83	9%	0.087	41%	0.412	C	S	.	.	H	α-helix	trans	-59.3	-41.3	174.1	178.3	-116.8	0	0	0	112.5	P406 M456 L459 Q460 L505 D508 R522 T526 I527 Q528	P406-W524 HydrophobicContact CB-CH2 4.37Å; P406-W524 HydrophobicContact CG-CH2 3.79Å; P406-W524 HydrophobicContact CG-CZ3 3.95Å; M456-W524 HydrophobicContact CB-CZ3 4.36Å; M456-W524 VanDerWaalsContact O-CH2 3.24Å; M456-W524 WeakPolarHBondContact O-CH2 3.27Å; M456-W524 HydrophobicContact SD-CE3 4.17Å; M456-W524 HydrophobicContact SD-CZ3 3.57Å; M456-W524 VanDerWaalsContact SD-CZ3 3.57Å; L459-W524 VanDerWaalsContact C-CZ2 3.5Å; L459-W524 HydrophobicContact CB-CD2 3.94Å; L459-W524 HydrophobicContact CB-CE3 4.14Å; L459-W524 HydrophobicContact CB-CH2 3.86Å; L459-W524 HydrophobicContact CB-CZ2 3.62Å; L459-W524 HydrophobicContact CB-CZ3 4.11Å; L459-W524 HydrophobicContact CD1-CD2 4.15Å; L459-W524 HydrophobicContact CD1-CE3 3.91Å; L459-W524 HydrophobicContact CD1-CZ3 4.27Å; Q460-W524 HydrophobicContact CB-CH2 4.19Å; Q460-W524 HydrophobicContact CB-CZ2 3.92Å; Q460-W524 VanDerWaalsContact N-CZ2 3.26Å; L505-W524 HydrophobicContact CD2-CB 4.15Å; L505-W524 HydrophobicContact CD2-CE3 4.19Å; D508-W524 PolarHBondContact OD2-N 2.94Å; R522-W524 VanDerWaalsContact C-N 3.27Å; R522-W524 PolarHBondContact O-N 3.46Å; W524-T526 VanDerWaalsContact C-N 3.31Å; W524-T526 PolarHBondContact O-N 2.95Å; W524-I527 HydrophobicContact CE3-CB 4.24Å; W524-I527 HydrophobicContact CE3-CD1 4.46Å; W524-I527 HydrophobicContact CE3-CG2 4.12Å; W524-I527 HydrophobicContact CZ3-CB 4.47Å; W524-I527 HydrophobicContact CZ3-CG2 3.86Å; W524-I527 PolarHBondContact O-N 3.3Å; W524-Q528 HydrophobicContact CD2-CG 4Å; W524-Q528 VanDerWaalsContact CE2-CD 3.47Å; W524-Q528 VanDerWaalsContact CE2-CG 3.45Å; W524-Q528 HydrophobicContact CG-CG 4.46Å; W524-Q528 HydrophobicContact CH2-CG 4.13Å; W524-Q528 HydrophobicContact CZ2-CG 3.51Å; W524-Q528 VanDerWaalsContact O-CG 3.31Å; W524-Q528 WeakPolarHBondContact O-CG 3.41Å; W524-Q528 PolarHBondContact O-N 2.92Å
525	N	82.3	Confident	78.3	Confident	62 Å²	62	78.3 Å²	78.3	33%	0.332	39%	0.39	S	S	.	.	H	α-helix	trans	-63.5	-40	178.3	-67.2	-11.2	0	0	0	111.2	R522 V523 Q528 K529	R522-N525 HydrophobicContact CB-CB 4.35Å; R522-N525 WeakPolarHBondContact O-CB 3.5Å; R522-N525 PolarHBondContact O-N 3.15Å; V523-N525 VanDerWaalsContact C-N 3.32Å; V523-N525 PolarHBondContact O-N 2.91Å; N525-Q528 PolarHBondContact O-N 3.45Å; N525-K529 WeakPolarHBondContact O-CG 3.47Å; N525-K529 PolarHBondContact O-N 3.37Å
526	T	85.5	Confident	78.3	Confident	58 Å²	58	79.1 Å²	79.1	36%	0.356	38%	0.377	S	S	.	.	H	α-helix	trans	-61.8	-47.5	174.6	-55.5	0	0	0	0	111	R522 V523 W524 Q528 K529 V530	R522-T526 PolarHBondContact O-N 2.92Å; R522-T526 VanDerWaalsContact O-N 3.16Å; R522-T526 PolarHBondContact O-OG1 3.38Å; V523-T526 WeakPolarHBondContact O-CB 3.4Å; V523-T526 PolarHBondContact O-N 3.21Å; W524-T526 VanDerWaalsContact C-N 3.31Å; W524-T526 PolarHBondContact O-N 2.95Å; T526-Q528 VanDerWaalsContact C-N 3.3Å; T526-Q528 PolarHBondContact O-N 3.47Å; T526-K529 PolarHBondContact O-N 3.12Å; T526-V530 HydrophobicContact CG2-CG2 4.43Å; T526-V530 WeakPolarHBondContact O-CG2 3.3Å; T526-V530 PolarHBondContact O-N 2.95Å
527	I	85.9	Confident	78.6	Confident	24 Å²	24	77.8 Å²	77.8	12%	0.123	38%	0.38	C	S	.	.	H	α-helix	trans	-58.6	-43.4	176.8	-68.8	165.4	0	0	0	111	L405 P406 L501 L505 V523 W524 G531	L405-I527 HydrophobicContact CD2-CG2 4.42Å; P406-I527 HydrophobicContact CG-CG2 3.8Å; L501-I527 HydrophobicContact CD1-CD1 3.94Å; L505-I527 HydrophobicContact CD2-CD1 4Å; V523-I527 HydrophobicContact CG1-CD1 3.92Å; V523-I527 HydrophobicContact CG1-CG1 4.49Å; V523-I527 WeakPolarHBondContact O-CG1 3.22Å; V523-I527 PolarHBondContact O-N 3.29Å; W524-I527 HydrophobicContact CE3-CB 4.24Å; W524-I527 HydrophobicContact CE3-CD1 4.46Å; W524-I527 HydrophobicContact CE3-CG2 4.12Å; W524-I527 HydrophobicContact CZ3-CB 4.47Å; W524-I527 HydrophobicContact CZ3-CG2 3.86Å; W524-I527 PolarHBondContact O-N 3.3Å; I527-G531 PolarHBondContact O-N 2.91Å
528	Q	80.9	Confident	79.5	Confident	37 Å²	37	70.6 Å²	70.6	17%	0.173	35%	0.353	C	S	.	.	H	α-helix	trans	-61.7	-47.4	176.9	-70.6	-172.7	-54.4	0	0	111.8	F408 W524 N525 T526 G531 Q532	F408-Q528 HydrophobicContact CZ-CB 4.02Å; F408-Q528 HydrophobicContact CZ-CG 4.03Å; W524-Q528 HydrophobicContact CD2-CG 4Å; W524-Q528 VanDerWaalsContact CE2-CD 3.47Å; W524-Q528 VanDerWaalsContact CE2-CG 3.45Å; W524-Q528 HydrophobicContact CG-CG 4.46Å; W524-Q528 HydrophobicContact CH2-CG 4.13Å; W524-Q528 HydrophobicContact CZ2-CG 3.51Å; W524-Q528 VanDerWaalsContact O-CG 3.31Å; W524-Q528 WeakPolarHBondContact O-CG 3.41Å; W524-Q528 PolarHBondContact O-N 2.92Å; N525-Q528 PolarHBondContact O-N 3.45Å; T526-Q528 VanDerWaalsContact C-N 3.3Å; T526-Q528 PolarHBondContact O-N 3.47Å; Q528-G531 PolarHBondContact O-N 2.98Å; Q528-Q532 WeakPolarHBondContact O-CB 3.32Å; Q528-Q532 VanDerWaalsContact O-CG 3.28Å; Q528-Q532 WeakPolarHBondContact O-CG 3.38Å; Q528-Q532 PolarHBondContact O-N 3.31Å
529	K	82.3	Confident	80.5	Confident	111 Å²	111	69.9 Å²	69.9	48%	0.483	35%	0.347	S	S	.	.	H	α-helix	trans	-60.8	-46.6	178.7	-73.3	174	-178.2	177.5	0	111.9	E521 N525 T526 Q532 I533	E521-K529 IonicContact OE1-NZ 3.45Å; E521-K529 PolarHBondContact OE1-NZ 3.27Å; N525-K529 WeakPolarHBondContact O-CG 3.47Å; N525-K529 PolarHBondContact O-N 3.37Å; T526-K529 PolarHBondContact O-N 3.12Å; K529-Q532 PolarHBondContact O-N 2.95Å; K529-I533 WeakPolarHBondContact O-CG1 3.11Å; K529-I533 PolarHBondContact O-N 2.82Å; K529-I533 VanDerWaalsContact O-N 3.15Å
530	V	84.7	Confident	81.8	Confident	71 Å²	71	65.9 Å²	65.9	43%	0.43	33%	0.325	S	S	.	.	H	α-helix	trans	-65.9	-43	179.1	-178.5	0	0	0	0	110.6	L405 T526 Q532 I533 E534	L405-V530 HydrophobicContact CD1-CB 4.1Å; L405-V530 HydrophobicContact CD1-CG1 3.46Å; L405-V530 VanDerWaalsContact CD1-CG1 3.46Å; T526-V530 HydrophobicContact CG2-CG2 4.43Å; T526-V530 WeakPolarHBondContact O-CG2 3.3Å; T526-V530 PolarHBondContact O-N 2.95Å; V530-Q532 VanDerWaalsContact C-N 3.32Å; V530-Q532 PolarHBondContact O-N 3.01Å; V530-I533 PolarHBondContact O-N 3.11Å; V530-I533 VanDerWaalsContact O-N 3.16Å; V530-E534 PolarHBondContact O-N 3.26Å
531	G	82.9	Confident	82.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-60.2	-40	176.2	0	0	0	0	0	112.7	I527 Q528 I533 E534 D535	I527-G531 PolarHBondContact O-N 2.91Å; Q528-G531 PolarHBondContact O-N 2.98Å; G531-I533 PolarHBondContact O-N 3.04Å; G531-E534 PolarHBondContact O-N 3.42Å; G531-D535 WeakPolarHBondContact O-CB 3.48Å; G531-D535 PolarHBondContact O-N 2.93Å
532	Q	79.6	Confident	83.4	Confident	74 Å²	74	62.8 Å²	62.8	35%	0.346	31%	0.309	S	S	.	.	H	α-helix	trans	-62.2	-41.2	174.1	-75.3	173.3	-5.7	0	0	112.8	F408 Q528 K529 V530 F536	F408-Q532 HydrophobicContact CB-CG 4.41Å; F408-Q532 HydrophobicContact CD1-CG 4.17Å; F408-Q532 HydrophobicContact CD2-CG 3.76Å; F408-Q532 HydrophobicContact CE1-CG 4.42Å; F408-Q532 HydrophobicContact CE2-CG 4.03Å; F408-Q532 HydrophobicContact CG-CG 3.85Å; F408-Q532 HydrophobicContact CZ-CG 4.36Å; Q528-Q532 WeakPolarHBondContact O-CB 3.32Å; Q528-Q532 VanDerWaalsContact O-CG 3.28Å; Q528-Q532 WeakPolarHBondContact O-CG 3.38Å; Q528-Q532 PolarHBondContact O-N 3.31Å; K529-Q532 PolarHBondContact O-N 2.95Å; V530-Q532 VanDerWaalsContact C-N 3.32Å; V530-Q532 PolarHBondContact O-N 3.01Å; Q532-F536 WeakPolarHBondContact O-CB 3.31Å; Q532-F536 PolarHBondContact O-N 3.33Å
533	I	82.4	Confident	83.5	Confident	104 Å²	104	63.8 Å²	63.8	53%	0.533	32%	0.323	S	S	.	.	H	α-helix	trans	-66.3	-46.7	177.2	-66.4	166	0	0	0	110.3	K529 V530 G531 D535 F536 L537	K529-I533 WeakPolarHBondContact O-CG1 3.11Å; K529-I533 PolarHBondContact O-N 2.82Å; K529-I533 VanDerWaalsContact O-N 3.15Å; V530-I533 PolarHBondContact O-N 3.11Å; V530-I533 VanDerWaalsContact O-N 3.16Å; G531-I533 PolarHBondContact O-N 3.04Å; I533-D535 VanDerWaalsContact C-N 3.32Å; I533-D535 PolarHBondContact O-N 3.4Å; I533-F536 WeakPolarHBondContact O-CB 3.27Å; I533-F536 PolarHBondContact O-N 2.94Å; I533-L537 HydrophobicContact CG2-CD1 4.3Å; I533-L537 WeakPolarHBondContact O-CG 3.39Å; I533-L537 PolarHBondContact O-N 3.28Å
534	E	83.8	Confident	83.6	Confident	50 Å²	50	67.6 Å²	67.6	23%	0.234	34%	0.336	C	S	.	.	H	α-helix	trans	-59.3	-45.2	178.1	-172.4	179.3	-158.2	0	0	111	L405 V530 G531 F536 L537 Y538	L405-E534 VanDerWaalsContact CB-OE2 3.3Å; L405-E534 WeakPolarHBondContact CB-OE2 3.16Å; L405-E534 VanDerWaalsContact CD1-OE2 3.28Å; L405-E534 WeakPolarHBondContact CD1-OE2 3.41Å; L405-E534 WeakPolarHBondContact CG-OE2 3.45Å; V530-E534 PolarHBondContact O-N 3.26Å; G531-E534 PolarHBondContact O-N 3.42Å; E534-F536 VanDerWaalsContact C-N 3.33Å; E534-F536 PolarHBondContact O-N 3.44Å; E534-L537 WeakPolarHBondContact O-CB 3.42Å; E534-L537 PolarHBondContact O-N 3.5Å; E534-Y538 HydrophobicContact CG-CD2 3.86Å; E534-Y538 HydrophobicContact CG-CE2 3.54Å; E534-Y538 VanDerWaalsContact O-CD2 3.26Å; E534-Y538 WeakPolarHBondContact O-CD2 3.38Å; E534-Y538 PolarHBondContact O-N 3.07Å
535	D	79.8	Confident	83.7	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.016	35%	0.349	C	S	.	.	H	α-helix	trans	-60.3	-41.3	176.1	-95.1	20	0	0	0	112.9	R403 I407 F408 G531 I533 Y538 Q539	R403-D535 IonicContact CZ-OD1 2.72Å; R403-D535 IonicContact NH1-OD1 3.69Å; R403-D535 PolarHBondContact NH1-OD1 2.78Å; R403-D535 IonicContact NH1-OD2 3.55Å; I407-D535 WeakPolarHBondContact CA-OD2 3.39Å; I407-D535 VanDerWaalsContact CG2-OD2 3.28Å; I407-D535 WeakPolarHBondContact CG2-OD2 3.2Å; F408-D535 WeakPolarHBondContact CA-OD2 3.46Å; F408-D535 PolarHBondContact N-OD2 2.93Å; G531-D535 WeakPolarHBondContact O-CB 3.48Å; G531-D535 PolarHBondContact O-N 2.93Å; I533-D535 VanDerWaalsContact C-N 3.32Å; I533-D535 PolarHBondContact O-N 3.4Å; D535-Y538 PolarHBondContact O-N 3.01Å; D535-Q539 VanDerWaalsContact O-CG 3.28Å; D535-Q539 WeakPolarHBondContact O-CG 3.47Å; D535-Q539 PolarHBondContact O-N 3.26Å
536	F	81.3	Confident	84	Confident	72 Å²	72	72.8 Å²	72.8	32%	0.316	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-42.7	175.6	179.5	-109.4	0	0	0	111.6	Q532 I533 E534 Q539 L540	Q532-F536 WeakPolarHBondContact O-CB 3.31Å; Q532-F536 PolarHBondContact O-N 3.33Å; I533-F536 WeakPolarHBondContact O-CB 3.27Å; I533-F536 PolarHBondContact O-N 2.94Å; E534-F536 VanDerWaalsContact C-N 3.33Å; E534-F536 PolarHBondContact O-N 3.44Å; F536-Q539 PolarHBondContact O-N 3.48Å; F536-L540 HydrophobicContact CD1-CD1 3.88Å; F536-L540 HydrophobicContact CD1-CG 4.42Å; F536-L540 HydrophobicContact CE1-CD1 3.36Å; F536-L540 HydrophobicContact CE1-CG 4.06Å; F536-L540 HydrophobicContact CE2-CD1 4.45Å; F536-L540 HydrophobicContact CE2-CD2 4.44Å; F536-L540 HydrophobicContact CE2-CG 4.31Å; F536-L540 HydrophobicContact CZ-CD1 3.69Å; F536-L540 HydrophobicContact CZ-CD2 4.14Å; F536-L540 HydrophobicContact CZ-CG 3.99Å; F536-L540 WeakPolarHBondContact O-CG 3.34Å; F536-L540 PolarHBondContact O-N 2.94Å
537	L	84.6	Confident	84.3	Confident	103 Å²	103	72.6 Å²	72.6	54%	0.539	36%	0.358	S	S	.	.	H	α-helix	trans	-61.4	-44.7	176.1	-68.7	174.5	0	0	0	111.7	I533 E534 Q539 L540 E541	I533-L537 HydrophobicContact CG2-CD1 4.3Å; I533-L537 WeakPolarHBondContact O-CG 3.39Å; I533-L537 PolarHBondContact O-N 3.28Å; E534-L537 WeakPolarHBondContact O-CB 3.42Å; E534-L537 PolarHBondContact O-N 3.5Å; L537-Q539 VanDerWaalsContact C-N 3.32Å; L537-Q539 PolarHBondContact O-N 2.93Å; L537-L540 PolarHBondContact O-N 3.07Å; L537-E541 PolarHBondContact O-N 3.28Å
538	Y	82.9	Confident	84.6	Confident	86 Å²	86	77.2 Å²	77.2	34%	0.337	38%	0.377	S	S	.	.	H	α-helix	trans	-60.8	-40	175.5	-82.8	-59.3	0	0	0	112.7	R403 E534 D535 E541 D542	R403-Y538 HydrophobicContact CG-CE2 4.3Å; E534-Y538 HydrophobicContact CG-CD2 3.86Å; E534-Y538 HydrophobicContact CG-CE2 3.54Å; E534-Y538 VanDerWaalsContact O-CD2 3.26Å; E534-Y538 WeakPolarHBondContact O-CD2 3.38Å; E534-Y538 PolarHBondContact O-N 3.07Å; D535-Y538 PolarHBondContact O-N 3.01Å; Y538-E541 PolarHBondContact O-N 2.77Å; Y538-D542 PolarHBondContact O-N 3.01Å
539	Q	80.8	Confident	85	Confident	70 Å²	70	82.9 Å²	82.9	33%	0.327	40%	0.401	S	S	.	.	H	α-helix	trans	-66.7	-40.5	177.3	-71.1	177	35.5	0	0	112.1	H411 D535 F536 L537 S543	H411-Q539 PolarHBondContact O-OE1 3.17Å; D535-Q539 VanDerWaalsContact O-CG 3.28Å; D535-Q539 WeakPolarHBondContact O-CG 3.47Å; D535-Q539 PolarHBondContact O-N 3.26Å; F536-Q539 PolarHBondContact O-N 3.48Å; L537-Q539 VanDerWaalsContact C-N 3.32Å; L537-Q539 PolarHBondContact O-N 2.93Å; Q539-S543 VanDerWaalsContact O-CB 3.32Å; Q539-S543 WeakPolarHBondContact O-CB 3.47Å; Q539-S543 PolarHBondContact O-N 3.44Å
540	L	83.9	Confident	85.4	Confident	90 Å²	90	81.9 Å²	81.9	47%	0.471	40%	0.401	S	S	.	.	H	α-helix	trans	-62.4	-43.4	174.1	-74.1	179.5	0	0	0	111.5	F536 L537 S543 F544	F536-L540 HydrophobicContact CD1-CD1 3.88Å; F536-L540 HydrophobicContact CD1-CG 4.42Å; F536-L540 HydrophobicContact CE1-CD1 3.36Å; F536-L540 HydrophobicContact CE1-CG 4.06Å; F536-L540 HydrophobicContact CE2-CD1 4.45Å; F536-L540 HydrophobicContact CE2-CD2 4.44Å; F536-L540 HydrophobicContact CE2-CG 4.31Å; F536-L540 HydrophobicContact CZ-CD1 3.69Å; F536-L540 HydrophobicContact CZ-CD2 4.14Å; F536-L540 HydrophobicContact CZ-CG 3.99Å; F536-L540 WeakPolarHBondContact O-CG 3.34Å; F536-L540 PolarHBondContact O-N 2.94Å; L537-L540 PolarHBondContact O-N 3.07Å; L540-S543 PolarHBondContact O-N 3.01Å; L540-F544 VanDerWaalsContact O-CB 3.3Å; L540-F544 WeakPolarHBondContact O-CB 3.4Å; L540-F544 PolarHBondContact O-N 2.83Å
541	E	86.6	Confident	85.7	Confident	109 Å²	109	86.1 Å²	86.1	51%	0.509	41%	0.409	S	S	.	.	H	α-helix	trans	-61.7	-48.8	177.2	-173.7	179.3	-164	0	0	111.5	L537 Y538 S543 F544 L545	L537-E541 PolarHBondContact O-N 3.28Å; Y538-E541 PolarHBondContact O-N 2.77Å; E541-S543 PolarHBondContact O-N 3.04Å; E541-F544 WeakPolarHBondContact O-CB 3.27Å; E541-F544 PolarHBondContact O-N 3.33Å; E541-L545 HydrophobicContact CG-CD1 4.03Å; E541-L545 HydrophobicContact CG-CG 4.4Å; E541-L545 WeakPolarHBondContact O-CB 3.49Å; E541-L545 VanDerWaalsContact O-CG 3.31Å; E541-L545 WeakPolarHBondContact O-CG 3.26Å; E541-L545 PolarHBondContact O-N 3.07Å
542	D	84.4	Confident	86.1	Confident	76 Å²	76	89.3 Å²	89.3	41%	0.406	43%	0.429	S	S	.	.	H	α-helix	trans	-62	-42.9	178.6	-178.7	48.3	0	0	0	111.7	Y538 F544 L545 K546	Y538-D542 PolarHBondContact O-N 3.01Å; D542-F544 PolarHBondContact O-N 3.32Å; D542-L545 PolarHBondContact O-N 3.23Å; D542-K546 WeakPolarHBondContact O-CB 3.32Å; D542-K546 VanDerWaalsContact O-CG 3.3Å; D542-K546 WeakPolarHBondContact O-CG 3.39Å; D542-K546 PolarHBondContact O-N 2.66Å; D542-K546 WeakPolarHBondContact OD1-CE 3.28Å; D542-K546 IonicContact OD1-NZ 3.38Å; D542-K546 WeakPolarHBondContact OD2-CE 3.47Å; D542-K546 IonicContact OD2-NZ 3.79Å; D542-K546 PolarHBondContact OD2-NZ 2.96Å
543	S	85.3	Confident	86.6	Confident	68 Å²	68	88.3 Å²	88.3	48%	0.476	43%	0.433	S	S	.	.	H	α-helix	trans	-60.4	-44.4	174.5	-178.3	0	0	0	0	112.1	Q539 L540 E541 K546 T547	Q539-S543 VanDerWaalsContact O-CB 3.32Å; Q539-S543 WeakPolarHBondContact O-CB 3.47Å; Q539-S543 PolarHBondContact O-N 3.44Å; L540-S543 PolarHBondContact O-N 3.01Å; E541-S543 PolarHBondContact O-N 3.04Å; S543-K546 PolarHBondContact O-N 2.65Å; S543-T547 WeakPolarHBondContact O-CB 3.38Å; S543-T547 PolarHBondContact O-N 3.06Å; S543-T547 PolarHBondContact O-OG1 3Å
544	F	89.1	Confident	87	Confident	129 Å²	129	91 Å²	91	57%	0.566	44%	0.437	S	S	*	.	H	α-helix	trans	-62.2	-47	176.4	176	-98.9	0	0	0	111.5	L540 E541 D542 T547 K548	L540-F544 VanDerWaalsContact O-CB 3.3Å; L540-F544 WeakPolarHBondContact O-CB 3.4Å; L540-F544 PolarHBondContact O-N 2.83Å; E541-F544 WeakPolarHBondContact O-CB 3.27Å; E541-F544 PolarHBondContact O-N 3.33Å; D542-F544 PolarHBondContact O-N 3.32Å; F544-T547 PolarHBondContact O-N 3.25Å; F544-K548 HydrophobicContact CE1-CD 4.22Å; F544-K548 WeakPolarHBondContact O-CB 3.21Å; F544-K548 PolarHBondContact O-N 3.3Å
545	L	89.1	Confident	87.2	Confident	70 Å²	70	97.5 Å²	97.5	37%	0.366	46%	0.459	S	S	.	.	H	α-helix	trans	-63.6	-43	178.8	-72.2	174	0	0	0	112	E541 D542 K548 K549	E541-L545 HydrophobicContact CG-CD1 4.03Å; E541-L545 HydrophobicContact CG-CG 4.4Å; E541-L545 WeakPolarHBondContact O-CB 3.49Å; E541-L545 VanDerWaalsContact O-CG 3.31Å; E541-L545 WeakPolarHBondContact O-CG 3.26Å; E541-L545 PolarHBondContact O-N 3.07Å; D542-L545 PolarHBondContact O-N 3.23Å; L545-K548 PolarHBondContact O-N 3.09Å; L545-K549 WeakPolarHBondContact O-CB 3.32Å; L545-K549 WeakPolarHBondContact O-CG 3.45Å; L545-K549 PolarHBondContact O-N 2.94Å
546	K	88.5	Confident	87.6	Confident	123 Å²	123	103.3 Å²	103.3	54%	0.535	49%	0.486	S	S	.	.	H	α-helix	trans	-59.4	-46.4	173.6	-77.2	169.9	175.9	167.2	0	111.4	D542 S543 K548 K549 L550	D542-K546 WeakPolarHBondContact O-CB 3.32Å; D542-K546 VanDerWaalsContact O-CG 3.3Å; D542-K546 WeakPolarHBondContact O-CG 3.39Å; D542-K546 PolarHBondContact O-N 2.66Å; D542-K546 WeakPolarHBondContact OD1-CE 3.28Å; D542-K546 IonicContact OD1-NZ 3.38Å; D542-K546 WeakPolarHBondContact OD2-CE 3.47Å; D542-K546 IonicContact OD2-NZ 3.79Å; D542-K546 PolarHBondContact OD2-NZ 2.96Å; S543-K546 PolarHBondContact O-N 2.65Å; K546-K548 PolarHBondContact O-N 3.37Å; K546-K549 PolarHBondContact O-N 3.4Å; K546-L550 PolarHBondContact O-N 3.03Å
547	T	90.6	Very high	88	Confident	55 Å²	55	106.6 Å²	106.6	34%	0.337	50%	0.5	S	S	.	.	H	α-helix	trans	-64	-41.7	178.1	-58.6	0	0	0	0	111.6	S543 F544 L550 R551	S543-T547 WeakPolarHBondContact O-CB 3.38Å; S543-T547 PolarHBondContact O-N 3.06Å; S543-T547 PolarHBondContact O-OG1 3Å; F544-T547 PolarHBondContact O-N 3.25Å; T547-L550 PolarHBondContact O-N 3.42Å; T547-R551 VanDerWaalsContact O-CG 3.31Å; T547-R551 WeakPolarHBondContact O-CG 2.95Å; T547-R551 PolarHBondContact O-N 3.47Å
548	K	92.4	Very high	88.2	Confident	120 Å²	120	105.2 Å²	105.2	52%	0.522	50%	0.496	S	S	.	.	H	α-helix	trans	-62.8	-44.4	175.7	-174.2	178.5	178.8	-179.7	0	111.8	F544 L545 K546 R551 T552	F544-K548 HydrophobicContact CE1-CD 4.22Å; F544-K548 WeakPolarHBondContact O-CB 3.21Å; F544-K548 PolarHBondContact O-N 3.3Å; L545-K548 PolarHBondContact O-N 3.09Å; K546-K548 PolarHBondContact O-N 3.37Å; K548-R551 PolarHBondContact O-N 2.91Å; K548-T552 WeakPolarHBondContact O-CB 3.36Å; K548-T552 PolarHBondContact O-N 3.47Å; K548-T552 PolarHBondContact O-OG1 3.15Å
549	K	90.7	Very high	88.4	Confident	156 Å²	156	108.2 Å²	108.2	68%	0.678	51%	0.511	S	S	*	.	H	α-helix	trans	-59.1	-47.4	173.9	-75.2	176.8	-178.4	177.7	0	111.2	L545 K546 R551 T552 A553	L545-K549 WeakPolarHBondContact O-CB 3.32Å; L545-K549 WeakPolarHBondContact O-CG 3.45Å; L545-K549 PolarHBondContact O-N 2.94Å; K546-K549 PolarHBondContact O-N 3.4Å; K549-R551 PolarHBondContact O-N 3.32Å; K549-T552 PolarHBondContact O-N 2.95Å; K549-A553 PolarHBondContact O-N 3.13Å
550	L	90.3	Very high	88.5	Confident	90 Å²	90	111.2 Å²	111.2	47%	0.471	53%	0.526	S	S	.	.	H	α-helix	trans	-61.7	-44.4	178.7	-174.6	66.6	0	0	0	112.4	K546 T547 T552 A553 R554	K546-L550 PolarHBondContact O-N 3.03Å; T547-L550 PolarHBondContact O-N 3.42Å; L550-T552 VanDerWaalsContact C-N 3.29Å; L550-T552 PolarHBondContact O-N 3.33Å; L550-A553 PolarHBondContact O-N 3.31Å; L550-R554 WeakPolarHBondContact O-CB 3.17Å; L550-R554 VanDerWaalsContact O-CG 3.32Å; L550-R554 WeakPolarHBondContact O-CG 3.35Å; L550-R554 PolarHBondContact O-N 3.4Å
551	R	90.4	Very high	88.5	Confident	160 Å²	160	112.7 Å²	112.7	60%	0.604	53%	0.529	S	S	*	.	H	α-helix	trans	-60.5	-40.1	175.3	-73.2	175	-175.7	-178.6	3.5	111.6	T547 K548 K549 R554 R555	T547-R551 VanDerWaalsContact O-CG 3.31Å; T547-R551 WeakPolarHBondContact O-CG 2.95Å; T547-R551 PolarHBondContact O-N 3.47Å; K548-R551 PolarHBondContact O-N 2.91Å; K549-R551 PolarHBondContact O-N 3.32Å; R551-R554 PolarHBondContact O-N 3.3Å; R551-R555 WeakPolarHBondContact O-CG 3.3Å; R551-R555 PolarHBondContact O-N 2.95Å
552	T	91.6	Very high	88.2	Confident	68 Å²	68	116.1 Å²	116.1	42%	0.417	54%	0.537	S	S	.	.	H	α-helix	trans	-68.2	-44.7	179.2	-51.5	0	0	0	0	111.3	K548 K549 L550 R554 R555 Q556	K548-T552 WeakPolarHBondContact O-CB 3.36Å; K548-T552 PolarHBondContact O-N 3.47Å; K548-T552 PolarHBondContact O-OG1 3.15Å; K549-T552 PolarHBondContact O-N 2.95Å; L550-T552 VanDerWaalsContact C-N 3.29Å; L550-T552 PolarHBondContact O-N 3.33Å; T552-R554 PolarHBondContact O-N 3.26Å; T552-R555 PolarHBondContact O-N 2.8Å; T552-Q556 PolarHBondContact O-N 3.07Å
553	A	89.9	Confident	87.9	Confident	52 Å²	52	117.9 Å²	117.9	43%	0.43	55%	0.546	S	S	.	.	H	α-helix	trans	-61.3	-42.3	174.9	0	0	0	0	0	112.2	K549 L550 Q556 K557	K549-A553 PolarHBondContact O-N 3.13Å; L550-A553 PolarHBondContact O-N 3.31Å; A553-Q556 PolarHBondContact O-N 3.36Å; A553-K557 WeakPolarHBondContact O-CB 3.25Å; A553-K557 PolarHBondContact O-N 2.97Å
554	R	90.6	Very high	87.4	Confident	162 Å²	162	120.1 Å²	120.1	61%	0.611	55%	0.549	S	S	*	.	H	α-helix	trans	-60.3	-45.8	173.8	-73.7	176.7	-177.9	-177.4	0.8	111.5	L550 R551 T552 Q556 K557 T558	L550-R554 WeakPolarHBondContact O-CB 3.17Å; L550-R554 VanDerWaalsContact O-CG 3.32Å; L550-R554 WeakPolarHBondContact O-CG 3.35Å; L550-R554 PolarHBondContact O-N 3.4Å; R551-R554 PolarHBondContact O-N 3.3Å; T552-R554 PolarHBondContact O-N 3.26Å; R554-Q556 PolarHBondContact O-N 2.87Å; R554-K557 PolarHBondContact O-N 2.95Å; R554-T558 PolarHBondContact O-N 3.42Å; R554-T558 PolarHBondContact O-OG1 3.17Å
555	R	89.3	Confident	86.8	Confident	186 Å²	186	119.4 Å²	119.4	70%	0.702	55%	0.55	S	S	*	*	H	α-helix	trans	-61	-43.2	176.1	-74.8	176.3	178.3	-175.1	-1.2	112.2	R551 T552 T558 K559	R551-R555 WeakPolarHBondContact O-CG 3.3Å; R551-R555 PolarHBondContact O-N 2.95Å; T552-R555 PolarHBondContact O-N 2.8Å; R555-T558 PolarHBondContact O-N 3.29Å; R555-K559 WeakPolarHBondContact O-CG 3.15Å; R555-K559 PolarHBondContact O-N 3.44Å
556	Q	88.2	Confident	85.9	Confident	125 Å²	125	121 Å²	121	58%	0.584	56%	0.562	S	S	*	*	H	α-helix	trans	-64.2	-44	176.5	-76.1	-177.3	-21.5	0	0	112	T552 A553 R554 T558 K559 M560	T552-Q556 PolarHBondContact O-N 3.07Å; A553-Q556 PolarHBondContact O-N 3.36Å; R554-Q556 PolarHBondContact O-N 2.87Å; Q556-T558 VanDerWaalsContact C-N 3.34Å; Q556-T558 PolarHBondContact O-N 3.43Å; Q556-K559 PolarHBondContact O-N 2.78Å; Q556-M560 PolarHBondContact O-N 3.26Å
557	K	89.9	Confident	84.8	Confident	141 Å²	141	123 Å²	123	61%	0.613	57%	0.573	S	S	*	*	H	α-helix	trans	-60.3	-42.7	176.4	-169.4	173	-175.7	173.5	0	111.7	A553 R554 M560 K561	A553-K557 WeakPolarHBondContact O-CB 3.25Å; A553-K557 PolarHBondContact O-N 2.97Å; R554-K557 PolarHBondContact O-N 2.95Å; K557-M560 PolarHBondContact O-N 2.88Å; K557-K561 WeakPolarHBondContact O-CG 3.4Å; K557-K561 PolarHBondContact O-N 3.2Å
558	T	87.3	Confident	83.1	Confident	74 Å²	74	128.6 Å²	128.6	45%	0.454	60%	0.596	S	S	.	*	H	α-helix	trans	-66.2	-38.9	176	-53.9	0	0	0	0	112.2	R554 R555 Q556 K561 R562	R554-T558 PolarHBondContact O-N 3.42Å; R554-T558 PolarHBondContact O-OG1 3.17Å; R555-T558 PolarHBondContact O-N 3.29Å; Q556-T558 VanDerWaalsContact C-N 3.34Å; Q556-T558 PolarHBondContact O-N 3.43Å; T558-K561 PolarHBondContact O-N 3.48Å; T558-R562 WeakPolarHBondContact O-CG 3.49Å; T558-R562 PolarHBondContact O-N 2.74Å
559	K	87.4	Confident	81.2	Confident	148 Å²	148	129.5 Å²	129.5	64%	0.643	62%	0.617	S	S	*	*	H	α-helix	trans	-63.6	-45.6	174.7	-76	-176.4	177.5	-169.4	0	112.2	R555 Q556 K561 R562 L563	R555-K559 WeakPolarHBondContact O-CG 3.15Å; R555-K559 PolarHBondContact O-N 3.44Å; Q556-K559 PolarHBondContact O-N 2.78Å; K559-K561 PolarHBondContact O-N 3.13Å; K559-R562 PolarHBondContact O-N 3.31Å; K559-L563 WeakPolarHBondContact O-CG 3.31Å; K559-L563 PolarHBondContact O-N 3.26Å
560	M	83.6	Confident	80.7	Confident	133 Å²	133	128.2 Å²	128.2	66%	0.655	61%	0.614	S	S	*	*	H	α-helix	trans	-62	-42.2	175.9	-78.9	-164.8	178.1	0	0	112.2	Q556 K557 R562 L563 Q564	Q556-M560 PolarHBondContact O-N 3.26Å; K557-M560 PolarHBondContact O-N 2.88Å; M560-R562 VanDerWaalsContact C-N 3.33Å; M560-R562 PolarHBondContact O-N 3.21Å; M560-L563 PolarHBondContact O-N 2.97Å; M560-Q564 WeakPolarHBondContact O-CG 3.19Å; M560-Q564 PolarHBondContact O-N 3.5Å
561	K	84	Confident	80.2	Confident	121 Å²	121	130.2 Å²	130.2	53%	0.526	62%	0.622	S	S	.	*	H	α-helix	trans	-59.8	-41.9	175.1	-77.4	-174.8	173.2	-162.9	0	112.4	K557 T558 K559 Q564 I565	K557-K561 WeakPolarHBondContact O-CG 3.4Å; K557-K561 PolarHBondContact O-N 3.2Å; T558-K561 PolarHBondContact O-N 3.48Å; K559-K561 PolarHBondContact O-N 3.13Å; K561-Q564 PolarHBondContact O-N 3.32Å; K561-I565 WeakPolarHBondContact O-CD1 3.41Å; K561-I565 VanDerWaalsContact O-CG1 3.25Å; K561-I565 WeakPolarHBondContact O-CG1 3.15Å; K561-I565 PolarHBondContact O-N 3.1Å; K561-I565 VanDerWaalsContact O-N 3.1Å
562	R	79.4	Confident	79.6	Confident	181 Å²	181	128.5 Å²	128.5	68%	0.683	62%	0.623	S	S	*	*	H	α-helix	trans	-64.3	-41	175.8	-74.7	-177.9	-179.9	-177.6	-1.5	112.2	T558 K559 M560 I565 V566	T558-R562 WeakPolarHBondContact O-CG 3.49Å; T558-R562 PolarHBondContact O-N 2.74Å; K559-R562 PolarHBondContact O-N 3.31Å; M560-R562 VanDerWaalsContact C-N 3.33Å; M560-R562 PolarHBondContact O-N 3.21Å; R562-I565 PolarHBondContact O-N 2.79Å; R562-V566 VanDerWaalsContact O-CG2 3.31Å; R562-V566 WeakPolarHBondContact O-CG2 3.35Å; R562-V566 PolarHBondContact O-N 2.84Å; R562-V566 VanDerWaalsContact O-N 3.15Å
563	L	78.2	Confident	78.9	Confident	113 Å²	113	132.1 Å²	132.1	59%	0.592	64%	0.635	S	S	*	*	H	α-helix	trans	-67	-36.8	177.4	-71.6	165.8	0	0	0	112.5	K559 M560 V566 Q567	K559-L563 WeakPolarHBondContact O-CG 3.31Å; K559-L563 PolarHBondContact O-N 3.26Å; M560-L563 PolarHBondContact O-N 2.97Å; L563-V566 PolarHBondContact O-N 3.5Å; L563-Q567 PolarHBondContact O-N 3.27Å; L563-Q567 VanDerWaalsContact O-N 3.13Å
564	Q	74.2	Confident	78.2	Confident	116 Å²	116	137.1 Å²	137.1	54%	0.542	65%	0.648	S	S	.	*	H	α-helix	trans	-66.2	-39.5	174.6	-78.1	177.4	-26.4	0	0	112.5	M560 K561 V566 Q567 Q568	M560-Q564 WeakPolarHBondContact O-CG 3.19Å; M560-Q564 PolarHBondContact O-N 3.5Å; K561-Q564 PolarHBondContact O-N 3.32Å; Q564-V566 VanDerWaalsContact C-N 3.33Å; Q564-Q567 PolarHBondContact O-N 2.88Å; Q564-Q568 WeakPolarHBondContact O-CG 3.43Å; Q564-Q568 PolarHBondContact O-N 3.4Å
565	I	76.8	Confident	77.4	Confident	114 Å²	114	135.4 Å²	135.4	59%	0.585	65%	0.65	S	S	*	*	H	α-helix	trans	-64.3	-40.5	176.6	-67.8	163.5	0	0	0	110.6	K561 R562 Q567 Q568 S569	K561-I565 WeakPolarHBondContact O-CD1 3.41Å; K561-I565 VanDerWaalsContact O-CG1 3.25Å; K561-I565 WeakPolarHBondContact O-CG1 3.15Å; K561-I565 PolarHBondContact O-N 3.1Å; K561-I565 VanDerWaalsContact O-N 3.1Å; R562-I565 PolarHBondContact O-N 2.79Å; I565-Q567 VanDerWaalsContact C-N 3.29Å; I565-Q567 PolarHBondContact O-N 3.02Å; I565-Q568 PolarHBondContact O-N 3.19Å; I565-S569 PolarHBondContact O-N 3.18Å; I565-S569 PolarHBondContact O-OG 2.64Å
566	V	70.2	Confident	76.5	Confident	103 Å²	103	131.8 Å²	131.8	62%	0.624	65%	0.646	S	S	*	*	H	α-helix	trans	-71.2	-20.9	178	174.5	0	0	0	0	113.1	R562 L563 Q564 S569	R562-V566 VanDerWaalsContact O-CG2 3.31Å; R562-V566 WeakPolarHBondContact O-CG2 3.35Å; R562-V566 PolarHBondContact O-N 2.84Å; R562-V566 VanDerWaalsContact O-N 3.15Å; L563-V566 PolarHBondContact O-N 3.5Å; Q564-V566 VanDerWaalsContact C-N 3.33Å; V566-S569 PolarHBondContact O-OG 3.12Å
567	Q	65	Low	75.6	Confident	164 Å²	164	132.3 Å²	132.3	77%	0.766	65%	0.651	S	S	*	*	H	α-helix	trans	-89.5	-12.6	175	-79.5	-178.9	-29.3	0	0	113.8	L563 Q564 I565	L563-Q567 PolarHBondContact O-N 3.27Å; L563-Q567 VanDerWaalsContact O-N 3.13Å; Q564-Q567 PolarHBondContact O-N 2.88Å; I565-Q567 VanDerWaalsContact C-N 3.29Å; I565-Q567 PolarHBondContact O-N 3.02Å
568	Q	56.2	Low	74.5	Confident	173 Å²	173	131.6 Å²	131.6	81%	0.808	65%	0.654	S	S	*	*	H	α-helix	trans	-102.9	-10.7	178.7	-73.3	-177.9	-20.6	0	0	113.3	Q564 I565	Q564-Q568 WeakPolarHBondContact O-CG 3.43Å; Q564-Q568 PolarHBondContact O-N 3.4Å; I565-Q568 PolarHBondContact O-N 3.19Å
569	S	51.3	Low	73.3	Confident	139 Å²	139	136.8 Å²	136.8	97%	0.972	67%	0.672	S	S	*	*			trans	-92.4	0	163.9	55.7	0	0	0	0	110.1	I565 V566	I565-S569 PolarHBondContact O-N 3.18Å; I565-S569 PolarHBondContact O-OG 2.64Å; V566-S569 PolarHBondContact O-OG 3.12Å

Retrieved 569 of 569 residues in 280.7 ms (Link to these results)

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