A0A096MRA8_PAPAN Loading...

Wee1-like protein kinase

AlphaFold DB , UniProt , Accession A0A096MRA8, Species PAPAN (Papio anubis, Olive baboon), Gene WEE1, Length 646 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.5	Very low	40.9	Very low	246 Å²	246	164.3 Å²	164.3	100%	1.212	86%	0.863	S	S	*	*				0	134.3	0	-76.7	175.2	169.6	0	0	108.2
2	S	31.8	Very low	41.4	Very low	100 Å²	100	161.2 Å²	161.2	70%	0.699	86%	0.86	S	S	*	*			trans	-89.2	144.4	-175.9	38.6	0	0	0	0	111.5
3	F	36.2	Very low	41.6	Very low	212 Å²	212	167.1 Å²	167.1	93%	0.93	86%	0.863	S	S	*	*			trans	-134.3	98.6	154.8	-92.9	-77.4	0	0	0	110.2
4	L	36.7	Very low	41.9	Very low	161 Å²	161	164.5 Å²	164.5	84%	0.843	86%	0.862	S	S	*	*			trans	-68.8	142.2	157.1	-71.9	148.1	0	0	0	108.1
5	S	41.2	Very low	41.5	Very low	126 Å²	126	160.4 Å²	160.4	88%	0.881	86%	0.862	S	S	*	*			trans	-128.5	139.3	155.3	-162.5	0	0	0	0	109.9
6	R	37.7	Very low	41.2	Very low	230 Å²	230	155.6 Å²	155.6	87%	0.868	86%	0.861	S	S	*	*			trans	-84.6	148.2	-164	-72.6	171.5	162	-178.3	-7.1	112
7	Q	38.7	Very low	40.6	Very low	194 Å²	194	152.6 Å²	152.6	91%	0.907	86%	0.862	S	S	*	*			trans	-64.6	141.5	156	-65.2	175.3	-4.4	0	0	109.7
8	Q	40.3	Very low	40.3	Very low	184 Å²	184	150.1 Å²	150.1	86%	0.86	86%	0.863	S	S	*	*			trans	-111.3	135.8	162.9	-80.7	-173.8	-25	0	0	109.3
9	P	47.6	Very low	39.7	Very low	115 Å²	115	148.1 Å²	148.1	75%	0.747	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-81	157.6	173.5	33.9	-34.5	0	0	0	111.8
10	P	52.3	Low	39.6	Very low	119 Å²	119	147.6 Å²	147.6	77%	0.773	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-71.4	155.2	175.8	30.3	-35.3	0	0	0	112.8
11	P	51.4	Low	39.2	Very low	120 Å²	120	147.5 Å²	147.5	78%	0.779	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-72.8	158.9	-177.3	29.8	-35.8	0	0	0	113.9
12	P	47	Very low	39	Very low	127 Å²	127	146.8 Å²	146.8	83%	0.825	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-77.2	152.8	-172.6	31.6	-36.3	0	0	0	113.9
13	R	44.3	Very low	39.1	Very low	238 Å²	238	150.7 Å²	150.7	90%	0.898	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-79.4	138.5	168.3	-63.4	179.5	179.4	-176.6	-0.7	110.3
14	P	45.8	Very low	38.7	Very low	131 Å²	131	149.1 Å²	149.1	85%	0.851	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-71.7	146	164.4	31.2	-32.9	0	0	0	110.1
15	A	35.8	Very low	38.4	Very low	103 Å²	103	149.3 Å²	149.3	85%	0.851	84%	0.837	S	S	*	*			trans	-114.6	144.6	-177.2	0	0	0	0	0	112.1
16	G	35.9	Very low	37.8	Very low	83 Å²	83	149.9 Å²	149.9	86%	0.856	83%	0.829	S	S	*	*			trans	89.5	100.7	145.9	0	0	0	0	0	118.3
17	A	30.9	Very low	37.5	Very low	105 Å²	105	148.3 Å²	148.3	87%	0.868	83%	0.829	S	S	*	*			trans	-154.6	110.9	133.8	0	0	0	0	0	108.8
18	A	35.2	Very low	37.1	Very low	107 Å²	107	144 Å²	144	88%	0.884	82%	0.82	S	S	*	*			trans	-82.4	133.8	168.2	0	0	0	0	0	108.9
19	C	30.1	Very low	36.8	Very low	112 Å²	112	140.9 Å²	140.9	76%	0.757	82%	0.815	S	S	*	*			trans	-140.3	113.3	166.5	-165.7	0	0	0	0	109.7
20	T	37.2	Very low	35.8	Very low	138 Å²	138	142 Å²	142	85%	0.847	83%	0.825	S	S	*	*			trans	-81.8	116.5	175.1	39.5	0	0	0	0	109.7
21	L	30.6	Very low	34.9	Very low	146 Å²	146	141 Å²	141	76%	0.764	82%	0.82	S	S	*	*			trans	-116.7	85.6	174.8	-115.1	153.7	0	0	0	110.5	Q23	L21-Q23 PolarHBondContact O-N 3.39Å
22	R	32.3	Very low	33.8	Very low	232 Å²	232	142 Å²	142	88%	0.875	82%	0.819	S	S	*	*			trans	-62.5	112.4	158.7	-83.9	-179.4	164.2	-172.7	-5.8	107.9	K24	R22-K24 PolarHBondContact O-N 2.98Å
23	Q	33.2	Very low	32.9	Very low	182 Å²	182	140.9 Å²	140.9	85%	0.85	81%	0.813	S	S	*	*			trans	-79.9	108.3	160.7	-78.9	-175.1	-29.8	0	0	108.8	L21 L25	L21-Q23 PolarHBondContact O-N 3.39Å; Q23-L25 PolarHBondContact O-N 3.34Å
24	K	29.1	Very low	32.3	Very low	178 Å²	178	137.8 Å²	137.8	77%	0.774	81%	0.809	S	S	*	*			trans	-71.9	119.5	163.5	-69.8	179.7	175	-177	0	107.8	R22	R22-K24 PolarHBondContact O-N 2.98Å
25	L	30.5	Very low	31.7	Very low	165 Å²	165	140.3 Å²	140.3	86%	0.864	81%	0.809	S	S	*	*			trans	-81.5	119.6	154.9	-79.1	168.4	0	0	0	107.4	Q23	Q23-L25 PolarHBondContact O-N 3.34Å
26	I	28	Very low	31.5	Very low	138 Å²	138	145 Å²	145	71%	0.708	81%	0.814	S	S	*	*			trans	-89.8	114.7	178.9	-63.4	170.8	0	0	0	107
27	F	31.1	Very low	31.3	Very low	198 Å²	198	149.4 Å²	149.4	87%	0.868	81%	0.812	S	S	*	*			trans	-89.6	129.3	156.8	-84.9	-91.1	0	0	0	108
28	S	29.9	Very low	31.3	Very low	102 Å²	102	154.1 Å²	154.1	71%	0.713	82%	0.816	S	S	*	*			trans	-109.8	131.5	163.2	-66	0	0	0	0	108
29	P	35.3	Very low	31.2	Very low	119 Å²	119	157.2 Å²	157.2	77%	0.773	81%	0.812	S	S	*	*			trans	-82.5	155.3	174.7	34.6	-33.9	0	0	0	111
30	C	26.3	Very low	31.3	Very low	139 Å²	139	161.5 Å²	161.5	94%	0.939	82%	0.821	S	S	*	*			trans	-133.6	139.1	150.3	-84.8	0	0	0	0	107.3
31	S	32.3	Very low	31.1	Very low	97 Å²	97	163.4 Å²	163.4	68%	0.678	82%	0.821	S	S	*	*			trans	-103.2	-172.5	-170.2	55.2	0	0	0	0	111.6
32	D	29.9	Very low	31.3	Very low	142 Å²	142	165.9 Å²	165.9	76%	0.759	83%	0.828	S	S	*	*			trans	79.8	118.3	167.3	-39	-15	0	0	0	112.1
33	C	26.8	Very low	31.2	Very low	104 Å²	104	163.8 Å²	163.8	70%	0.703	83%	0.828	S	S	*	*			cis	-143.9	145.7	49.4	-67.3	0	0	0	0	115.4
34	E	31.4	Very low	31	Very low	172 Å²	172	158.5 Å²	158.5	80%	0.804	82%	0.823	S	S	*	*			trans	67.9	97	132.5	-65.3	164.9	-175.9	0	0	120.2
35	E	33.9	Very low	31.2	Very low	184 Å²	184	156.1 Å²	156.1	86%	0.86	83%	0.828	S	S	*	*				19.7	127.4	120.4	-64.4	168.5	-172.7	0	0	119.5
36	E	31.2	Very low	31.3	Very low	203 Å²	203	152.2 Å²	152.2	95%	0.949	83%	0.828	S	S	*	*				-153.9	132.8	123.9	-114	170.7	-162.4	0	0	109.1
37	E	32.4	Very low	31.6	Very low	175 Å²	175	154.9 Å²	154.9	82%	0.818	84%	0.837	S	S	*	*			trans	-98	140.1	-177.8	-62.3	173.2	139.3	0	0	110.1
38	E	31.3	Very low	31.8	Very low	204 Å²	204	150 Å²	150	95%	0.953	83%	0.828	S	S	*	*			trans	-130.1	115.9	154.1	-79	-167.5	149.9	0	0	109.1
39	E	31.9	Very low	32	Very low	171 Å²	171	151.5 Å²	151.5	80%	0.799	83%	0.833	S	S	*	*			trans	-82.2	134.7	173.7	-58.4	173.5	133.6	0	0	110
40	E	32.9	Very low	31.8	Very low	202 Å²	202	149 Å²	149	94%	0.944	83%	0.829	S	S	*	*			trans	-132.3	100	148.4	-78.8	-163.8	153.5	0	0	108.7
41	E	33	Very low	32.2	Very low	179 Å²	179	151.3 Å²	151.3	84%	0.836	83%	0.826	S	S	*	*			trans	-76.4	138.4	161	-64.1	-171.7	135.5	0	0	109.5
42	E	33.6	Very low	32.3	Very low	198 Å²	198	154 Å²	154	93%	0.925	83%	0.832	S	S	*	*			trans	-136.9	117.1	145.4	-143.3	-179.8	-154.2	0	0	110.3
43	E	31.1	Very low	32.5	Very low	188 Å²	188	153.4 Å²	153.4	88%	0.879	84%	0.839	S	S	*	*			trans	-67	153.1	174.1	-57.6	-175.5	117.4	0	0	111.2
44	G	30.2	Very low	32.7	Very low	71 Å²	71	152.6 Å²	152.6	73%	0.732	84%	0.84	S	S	*	*			trans	-165.6	29	-174.8	0	0	0	0	0	120
45	S	31.3	Very low	32.7	Very low	127 Å²	127	153.2 Å²	153.2	89%	0.888	84%	0.84	S	S	*	*			trans	26.1	123	156.4	64.9	0	0	0	0	121.4
46	G	33.6	Very low	32.6	Very low	83 Å²	83	152.6 Å²	152.6	86%	0.856	84%	0.837	S	S	*	*			trans	-178.8	69.1	167.3	0	0	0	0	0	116.7
47	H	33.8	Very low	33	Very low	195 Å²	195	151.8 Å²	151.8	90%	0.903	83%	0.834	S	S	*	*			trans	-69.5	155.8	168.2	-98.8	58	0	0	0	112.5
48	S	35.2	Very low	33.6	Very low	96 Å²	96	149.4 Å²	149.4	67%	0.671	83%	0.834	S	S	*	*				135.5	105.1	126.9	-142	0	0	0	0	115.8
49	T	34.4	Very low	33.6	Very low	133 Å²	133	147.6 Å²	147.6	82%	0.816	83%	0.83	S	S	*	*				48.5	141.3	123.6	65.2	0	0	0	0	122.6
50	G	31.2	Very low	34	Very low	67 Å²	67	145 Å²	145	69%	0.691	83%	0.831	S	S	*	*			trans	129.8	89.9	131.1	0	0	0	0	0	118.1
51	E	33.9	Very low	34.7	Very low	187 Å²	187	141.3 Å²	141.3	87%	0.874	82%	0.824	S	S	*	*				42.4	132.2	127.8	-60	178.6	146.8	0	0	122.8
52	D	35.3	Very low	34.9	Very low	152 Å²	152	140.7 Å²	140.7	81%	0.813	83%	0.826	S	S	*	*			trans	21.1	127.3	141	-65.4	-18.8	0	0	0	121.2
53	S	33.6	Very low	35.5	Very low	130 Å²	130	136.5 Å²	136.5	91%	0.909	82%	0.816	S	S	*	*				-179.2	156.4	111.7	-83.7	0	0	0	0	115.4
54	A	32.3	Very low	36.3	Very low	87 Å²	87	133.7 Å²	133.7	72%	0.719	81%	0.814	S	S	*	*			trans	-68.2	178.6	-172.9	0	0	0	0	0	118.1
55	F	29.9	Very low	36.7	Very low	185 Å²	185	134.7 Å²	134.7	81%	0.811	82%	0.816	S	S	*	*			trans	76.3	114.2	158.7	-107.6	-104.4	0	0	0	117.9
56	Q	32.7	Very low	36.8	Very low	171 Å²	171	140.5 Å²	140.5	80%	0.799	82%	0.818	S	S	*	*				-179.4	145.4	88.6	-136	130.7	32.4	0	0	111.6
57	E	40	Very low	36.9	Very low	187 Å²	187	141.7 Å²	141.7	87%	0.874	81%	0.813	S	S	*	*			trans	-75.3	153.1	165.2	-65.6	179.9	128.8	0	0	111
58	P	43.8	Very low	37.8	Very low	125 Å²	125	137.4 Å²	137.4	81%	0.812	80%	0.803	S	S	*	*			trans	-120.1	137.3	151.6	33.9	-24.1	0	0	0	113.3
59	D	32.5	Very low	37.6	Very low	166 Å²	166	139.8 Å²	139.8	89%	0.888	81%	0.813	S	S	*	*			trans	-62.6	158.4	-175.9	-86.1	-61.4	0	0	0	116.4
60	S	39.2	Very low	37.9	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	81%	0.814	S	S	*	*			trans	-83.7	144	165.8	-61.1	0	0	0	0	112.4
61	P	47.5	Very low	38.6	Very low	124 Å²	124	144.5 Å²	144.5	81%	0.805	82%	0.819	S	S	*	*			trans	-110.5	129.3	158	27.3	-14.2	0	0	0	112.8
62	L	38	Very low	38.4	Very low	167 Å²	167	138.5 Å²	138.5	87%	0.874	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-95.9	165.4	168.3	-86.6	173.9	0	0	0	111.1
63	P	46.2	Very low	39.7	Very low	110 Å²	110	137.1 Å²	137.1	71%	0.714	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-96.7	167.3	-152.3	38	-38.6	0	0	0	115.3
64	P	46.8	Very low	39.6	Very low	129 Å²	129	140.6 Å²	140.6	84%	0.838	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-90.7	137.1	166.4	34.9	-30.5	0	0	0	112.4
65	A	40.3	Very low	39.7	Very low	92 Å²	92	146.5 Å²	146.5	76%	0.76	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-98.1	149	167.6	0	0	0	0	0	111.2
66	R	32.8	Very low	39.9	Very low	248 Å²	248	146.6 Å²	146.6	94%	0.936	81%	0.807	S	S	*	*			trans	-171.8	120.4	154	-105.3	160.1	-161.8	-151.5	4.8	112.7
67	S	34.6	Very low	39.9	Very low	108 Å²	108	148.7 Å²	148.7	76%	0.755	81%	0.808	S	S	*	*			trans	-97.6	-178.4	145.3	62.1	0	0	0	0	107.4
68	P	53.3	Low	39.6	Very low	106 Å²	106	145.1 Å²	145.1	69%	0.688	80%	0.803	S	S	*	*			cis	-136.5	179.7	10.5	43.7	-26.6	0	0	0	115.6
69	T	30.6	Very low	40.1	Very low	146 Å²	146	145.3 Å²	145.3	90%	0.896	81%	0.805	S	S	*	*				-180	147.4	126.9	29.6	0	0	0	0	112.2
70	E	40.4	Very low	40.1	Very low	175 Å²	175	141.1 Å²	141.1	82%	0.818	80%	0.8	S	S	*	*			trans	-103	162.9	171.5	-140	-167.3	-122.3	0	0	109.9
71	P	45.8	Very low	39.7	Very low	123 Å²	123	145 Å²	145	80%	0.799	81%	0.806	S	S	*	*				-153.5	160.5	91.1	38.9	-20.4	0	0	0	117.1
72	G	30	Very low	39.1	Very low	61 Å²	61	143.3 Å²	143.3	63%	0.629	80%	0.802	S	S	*	*			trans	-98.7	-149.4	157.4	0	0	0	0	0	111.9
73	P	63.5	Low	39.9	Very low	124 Å²	124	141.9 Å²	141.9	81%	0.805	80%	0.803	S	S	*	*			cis	-132.3	178	-26.4	41.6	-27.5	0	0	0	112.7
74	E	31.3	Very low	39.1	Very low	202 Å²	202	140.3 Å²	140.3	94%	0.944	81%	0.806	S	S	*	*			trans	-165	174.3	142.6	-119.1	-177.1	-171.1	0	0	116.2
75	R	34.9	Very low	38.6	Very low	212 Å²	212	139.9 Å²	139.9	80%	0.8	81%	0.806	S	S	*	*			trans	-126.9	152.7	-161	-58.7	174.2	174.1	-155.4	4.1	113.6
76	R	34.5	Very low	39.5	Very low	186 Å²	186	141.4 Å²	141.4	70%	0.702	81%	0.809	S	S	*	*				153	140.7	112.2	-88.1	-172.2	-179.6	-146.2	-3.5	117.3
77	R	31.6	Very low	39.4	Very low	216 Å²	216	132.7 Å²	132.7	82%	0.815	80%	0.796	S	S	*	*			trans	85.9	122.5	138.7	-80	173.3	175.1	-169.5	-4.5	122.9
78	S	34.7	Very low	39.5	Very low	111 Å²	111	135.9 Å²	135.9	78%	0.776	80%	0.799	S	S	*	*			trans	-82	175.9	153.6	-33.8	0	0	0	0	111.8
79	P	53.7	Low	38.6	Very low	130 Å²	130	138.6 Å²	138.6	84%	0.844	81%	0.807	S	S	*	*				-156.1	154.3	97.6	39	-20.5	0	0	0	119.3
80	G	32.9	Very low	39	Very low	77 Å²	77	140.6 Å²	140.6	79%	0.794	81%	0.806	S	S	*	*			trans	69.1	164.1	146.1	0	0	0	0	0	120.9
81	Q	29.6	Very low	38.8	Very low	199 Å²	199	140.3 Å²	140.3	93%	0.93	81%	0.805	S	S	*	*			cis	-166.5	157	-23.8	-156	170.1	18.2	0	0	108.8
82	A	35.3	Very low	38.4	Very low	88 Å²	88	141.1 Å²	141.1	73%	0.727	80%	0.802	S	S	*	*			trans	-91.4	175.4	176.2	0	0	0	0	0	112.4
83	P	54.5	Low	38.6	Very low	136 Å²	136	143.7 Å²	143.7	88%	0.883	80%	0.801	S	S	*	*				-156.4	177.7	76.3	41.2	-20.7	0	0	0	117.9
84	G	29	Very low	37	Very low	77 Å²	77	144.9 Å²	144.9	79%	0.794	80%	0.8	S	S	*	*			trans	146.8	109.1	155	0	0	0	0	0	118.5
85	S	38	Very low	37.1	Very low	120 Å²	120	143 Å²	143	84%	0.839	80%	0.795	S	S	*	*			trans	-117	-164.6	172.1	-43.6	0	0	0	0	109.5
86	P	58.1	Low	38.2	Very low	125 Å²	125	138.9 Å²	138.9	81%	0.812	80%	0.796	S	S	*	*			cis	-144	-166.9	4.2	44.5	-23.2	0	0	0	117.4
87	G	30.2	Very low	38	Very low	64 Å²	64	134 Å²	134	66%	0.66	80%	0.803	S	S	*	*			trans	140.3	85.4	165	0	0	0	0	0	112.8
88	E	37.5	Very low	38	Very low	176 Å²	176	128 Å²	128	82%	0.822	80%	0.8	S	S	*	*				68.8	131.5	85.2	-66.5	-179.7	-175.3	0	0	113.4
89	L	33.8	Very low	37.7	Very low	163 Å²	163	128.5 Å²	128.5	85%	0.853	80%	0.802	S	S	*	*			cis	-140.4	164.1	37.4	-76.4	164.2	0	0	0	116.2
90	E	39.3	Very low	37.9	Very low	188 Å²	188	128.5 Å²	128.5	88%	0.879	80%	0.802	S	S	*	*			trans	-71.9	178	175.3	-78.4	175.9	145.3	0	0	114.2
91	E	37	Very low	37.7	Very low	169 Å²	169	128.6 Å²	128.6	79%	0.79	80%	0.803	S	S	*	*			cis	-141.9	-166	30.9	-147.4	-172.7	143.1	0	0	113.9
92	D	37.4	Very low	37.8	Very low	139 Å²	139	123.5 Å²	123.5	74%	0.743	80%	0.795	S	S	*	*			trans	-143.9	-149.7	-159.6	-175.7	29	0	0	0	112.1
93	L	33.2	Very low	37.7	Very low	115 Å²	115	126.4 Å²	126.4	60%	0.602	80%	0.798	S	S	*	*			trans	94.7	132.4	163.3	-44.5	-174.9	0	0	0	116.4
94	L	30.8	Very low	36.7	Very low	150 Å²	150	128 Å²	128	79%	0.785	79%	0.794	S	S	*	*			cis	-159.9	167.7	-6.1	-113.4	170.3	0	0	0	111.5
95	L	32	Very low	36.9	Very low	161 Å²	161	129.2 Å²	129.2	84%	0.843	80%	0.796	S	S	*	*			trans	-102.8	-153.2	-176.6	-70.8	165.2	0	0	0	112.5
96	P	58.9	Low	36.5	Very low	126 Å²	126	127.1 Å²	127.1	82%	0.818	79%	0.794	S	S	*	*				-128.6	-175.8	-83.8	40.6	-25.1	0	0	0	114.3
97	G	31	Very low	35.2	Very low	83 Å²	83	125.3 Å²	125.3	86%	0.856	80%	0.798	S	S	*	*			trans	161.9	146.2	156.3	0	0	0	0	0	120.9
98	A	30.3	Very low	35.2	Very low	90 Å²	90	126.2 Å²	126.2	74%	0.744	81%	0.807	S	S	*	*			trans	-83	152.9	-166	0	0	0	0	0	120.9
99	C	28.6	Very low	35.1	Very low	123 Å²	123	121.8 Å²	121.8	83%	0.831	80%	0.801	S	S	*	*			trans	55.6	178.4	138.3	-58.8	0	0	0	0	121.7
100	P	58.1	Low	35.1	Very low	130 Å²	130	123.4 Å²	123.4	84%	0.844	80%	0.804	S	S	*	*				-134.8	177.1	-69.1	42	-26.7	0	0	0	115.9
101	G	29	Very low	34.8	Very low	79 Å²	79	117.6 Å²	117.6	81%	0.814	79%	0.794	S	S	*	*			trans	106.6	163.5	165.6	0	0	0	0	0	115.1
102	A	32.2	Very low	34.5	Very low	91 Å²	91	117.4 Å²	117.4	75%	0.752	80%	0.799	S	S	*	*			cis	173.1	125	-18.9	0	0	0	0	0	106.3
103	D	32.5	Very low	34.1	Very low	150 Å²	150	114.8 Å²	114.8	80%	0.802	79%	0.791	S	S	*	*			trans	164.6	164.8	162	-95.7	-22.7	0	0	0	110.3
104	Q	33.5	Very low	33.9	Very low	170 Å²	170	119.5 Å²	119.5	79%	0.794	80%	0.801	S	S	*	*				-160.5	157	-55.5	-141.1	-177.7	110.7	0	0	109.4
105	A	33.4	Very low	34	Very low	101 Å²	101	119.9 Å²	119.9	84%	0.835	80%	0.799	S	S	*	*			trans	65.3	146	170.3	0	0	0	0	0	118.7
106	G	30.1	Very low	34.2	Very low	77 Å²	77	120.6 Å²	120.6	79%	0.794	80%	0.798	S	S	*	*			cis	172.8	154.9	-6.6	0	0	0	0	0	113.7
107	G	30.6	Very low	33	Very low	87 Å²	87	122.1 Å²	122.1	90%	0.897	79%	0.794	S	S	*	*			trans	86.7	124.9	179.4	0	0	0	0	0	113.6
108	G	30.5	Very low	32.9	Very low	82 Å²	82	122 Å²	122	85%	0.845	79%	0.792	S	S	*	*			cis	108.3	132.3	18.2	0	0	0	0	0	109.7
109	A	34.3	Very low	33	Very low	84 Å²	84	127.1 Å²	127.1	69%	0.694	80%	0.799	S	S	*	*			cis	-156.8	169	0.1	0	0	0	0	0	110.1
110	E	34.6	Very low	33.1	Very low	197 Å²	197	124.8 Å²	124.8	92%	0.921	80%	0.795	S	S	*	*			trans	38.6	136.9	146.7	-63.2	166.5	157.4	0	0	120.7
111	G	32.1	Very low	31.8	Very low	65 Å²	65	124 Å²	124	67%	0.67	79%	0.793	S	S	*	*			cis	172.9	-178.5	3.3	0	0	0	0	0	110.2
112	D	31.1	Very low	32	Very low	166 Å²	166	125.1 Å²	125.1	89%	0.888	79%	0.788	S	S	*	*			trans	37.3	151.4	152.6	-63	-6.9	0	0	0	123
113	S	29	Very low	32.1	Very low	83 Å²	83	126.4 Å²	126.4	58%	0.58	79%	0.791	S	S	*	*			cis	-178.3	167	-22.6	-166.5	0	0	0	0	109
114	W	30.5	Very low	33.3	Very low	214 Å²	214	125.1 Å²	125.1	81%	0.811	79%	0.791	S	S	*	*			trans	66.9	143.5	162.3	-60.2	105.4	0	0	0	122.5
115	E	31.7	Very low	33.1	Very low	159 Å²	159	123.5 Å²	123.5	74%	0.743	79%	0.793	S	S	*	*			trans	68.7	149.2	140.7	-79	163.7	-150.9	0	0	120.6
116	E	35.7	Very low	33.1	Very low	175 Å²	175	127.4 Å²	127.4	82%	0.818	79%	0.791	S	S	*	*			cis	-154.9	-159.8	-17	-147	-165.9	-161.7	0	0	110
117	E	34.5	Very low	33.2	Very low	158 Å²	158	128.7 Å²	128.7	74%	0.738	79%	0.788	S	S	*	*			trans	-72.2	166.5	-170.9	-57.8	-167.4	147.8	0	0	116.7
118	G	29.4	Very low	34.4	Very low	80 Å²	80	130.3 Å²	130.3	83%	0.825	78%	0.782	S	S	*	*			trans	-156.4	94.4	168.8	0	0	0	0	0	113.6
119	F	31.9	Very low	34.5	Very low	199 Å²	199	131 Å²	131	87%	0.873	78%	0.78	S	S	*	*			trans	-78.4	153.5	176.3	-105.4	-95.9	0	0	0	113.6
120	G	30.4	Very low	34.5	Very low	73 Å²	73	131.5 Å²	131.5	75%	0.753	78%	0.784	S	S	*	*			trans	-168.1	125.5	168.7	0	0	0	0	0	115.2
121	S	31	Very low	35.6	Very low	114 Å²	114	126.3 Å²	126.3	80%	0.797	77%	0.768	S	S	*	*			trans	-66.5	155.7	178.1	38.2	0	0	0	0	113.7
122	S	32.7	Very low	35.5	Very low	102 Å²	102	132.6 Å²	132.6	71%	0.713	77%	0.772	S	S	*	*			cis	89.6	79.4	35	91.6	0	0	0	0	117.7
123	S	34.8	Very low	35.4	Very low	118 Å²	118	132.5 Å²	132.5	83%	0.825	77%	0.765	S	S	*	*			trans	60.3	171.5	133.5	-58.3	0	0	0	0	121.9
124	P	57.3	Low	35.6	Very low	123 Å²	123	136.4 Å²	136.4	80%	0.799	78%	0.778	S	S	*	*			cis	-135	-144.8	-46.3	40	-21.2	0	0	0	112.4
125	V	30	Very low	35.4	Very low	137 Å²	137	129.1 Å²	129.1	83%	0.83	77%	0.769	S	S	*	*			trans	122	179	167.5	-176.9	0	0	0	0	113.9
126	K	32.4	Very low	35.4	Very low	183 Å²	183	128 Å²	128	80%	0.796	78%	0.779	S	S	*	*			trans	-164.5	157.6	-136.5	-132.1	173.4	-177.4	174.3	0	115.7
127	S	32.9	Very low	35.3	Very low	104 Å²	104	124.7 Å²	124.7	73%	0.727	78%	0.775	S	S	*	*			trans	71.6	166.5	151	-59.4	0	0	0	0	119.7
128	P	56.3	Low	35.2	Very low	121 Å²	121	126.6 Å²	126.6	79%	0.786	78%	0.782	S	S	*	*			cis	-140.5	161.5	-19.8	28.3	-5.1	0	0	0	119.1
129	A	31.8	Very low	35.5	Very low	95 Å²	95	127.8 Å²	127.8	79%	0.785	78%	0.777	S	S	*	*			trans	49.6	125.2	135	0	0	0	0	0	128.8
130	A	34	Very low	36.5	Very low	96 Å²	96	123.8 Å²	123.8	79%	0.793	77%	0.771	S	S	*	*			trans	64.7	-179.9	131.2	0	0	0	0	0	120.8
131	P	58.2	Low	36.7	Very low	88 Å²	88	126.9 Å²	126.9	57%	0.571	78%	0.775	S	S	*	*			cis	-145.6	-172	1.7	21	9.6	0	0	0	119
132	Y	29.8	Very low	36.8	Very low	196 Å²	196	132.4 Å²	132.4	77%	0.769	78%	0.778	S	S	*	*			trans	79.8	153.6	157.8	-51.5	-46.5	0	0	0	121
133	F	29.9	Very low	36.6	Very low	165 Å²	165	133.6 Å²	133.6	72%	0.724	79%	0.785	S	S	*	*			cis	-167.9	151.2	-18.9	-122.2	-59.2	0	0	0	110.5
134	L	31.8	Very low	36.4	Very low	165 Å²	165	131.9 Å²	131.9	86%	0.864	79%	0.787	S	S	*	*			trans	50.5	155.8	157.4	-72	143.5	0	0	0	120.3
135	G	27.9	Very low	35.1	Very low	61 Å²	61	129.6 Å²	129.6	63%	0.629	79%	0.786	S	S	*	*			cis	164.4	136.6	-9	0	0	0	0	0	113.1
136	S	30.1	Very low	36.1	Very low	134 Å²	134	129.7 Å²	129.7	94%	0.937	79%	0.789	S	S	*	*			trans	70.1	156.2	158.8	-57.6	0	0	0	0	122.6
137	S	34.3	Very low	36	Very low	107 Å²	107	124.7 Å²	124.7	75%	0.748	79%	0.789	S	S	*	*			trans	-99.5	164.6	-163.7	-27.7	0	0	0	0	116
138	F	31.4	Very low	36	Very low	198 Å²	198	127.9 Å²	127.9	87%	0.868	80%	0.798	S	S	*	*				168.3	126.5	125.4	-98.5	-66.2	0	0	0	115.6
139	S	37.1	Very low	34.8	Very low	105 Å²	105	126.7 Å²	126.7	73%	0.734	80%	0.798	S	S	*	*			trans	53.9	172.9	136	-73.9	0	0	0	0	121.6
140	P	53.3	Low	34.8	Very low	114 Å²	114	127.5 Å²	127.5	74%	0.74	80%	0.798	S	S	*	*			cis	-139.4	178.2	12.6	36.3	-13.6	0	0	0	118.1
141	V	33.2	Very low	35.9	Very low	139 Å²	139	127.7 Å²	127.7	84%	0.842	79%	0.792	S	S	*	*				173.3	152.2	113.8	159.8	0	0	0	0	111.5
142	R	32.7	Very low	34.6	Very low	229 Å²	229	135.2 Å²	135.2	86%	0.864	81%	0.809	S	S	*	*			trans	-83.8	159.5	-171	-61.3	167.4	161.4	173.8	-7.1	114.5
143	C	30.3	Very low	34.5	Very low	127 Å²	127	129 Å²	129	86%	0.858	80%	0.804	S	S	*	*				171.3	141.2	100.6	-93.9	0	0	0	0	114.8
144	G	30.6	Very low	34.4	Very low	83 Å²	83	127.9 Å²	127.9	86%	0.856	82%	0.815	S	S	*	*			trans	90.1	118.1	153.5	0	0	0	0	0	118.8
145	G	29.4	Very low	34.2	Very low	75 Å²	75	123.9 Å²	123.9	77%	0.773	81%	0.814	S	S	*	*			trans	-122.2	-156.6	151.8	0	0	0	0	0	108.7
146	P	51.4	Low	34.3	Very low	139 Å²	139	125.4 Å²	125.4	90%	0.903	82%	0.82	S	S	*	*			cis	-123.1	177.7	-15.4	40.3	-26.1	0	0	0	112.2
147	G	30.2	Very low	34.3	Very low	78 Å²	78	129.4 Å²	129.4	80%	0.804	82%	0.815	S	S	*	*			trans	171.8	139.1	170.8	0	0	0	0	0	113.9
148	D	31.5	Very low	34.2	Very low	171 Å²	171	135.1 Å²	135.1	91%	0.914	82%	0.82	S	S	*	*			trans	-87.2	173.1	-165.9	-119.7	-44.1	0	0	0	116
149	A	31	Very low	34.2	Very low	95 Å²	95	130.4 Å²	130.4	79%	0.785	82%	0.818	S	S	*	*			trans	84.5	119.7	156.3	0	0	0	0	0	121.7
150	S	33.1	Very low	33.9	Very low	112 Å²	112	128.7 Å²	128.7	78%	0.783	82%	0.816	S	S	*	*			trans	-74	179.2	149.7	-94.2	0	0	0	0	111.6
151	P	56.3	Low	33	Very low	101 Å²	101	132.7 Å²	132.7	66%	0.656	83%	0.825	S	S	*	*			cis	-139.8	-168.2	-7.2	22.9	4.1	0	0	0	115
152	R	32	Very low	32.9	Very low	246 Å²	246	129.8 Å²	129.8	93%	0.928	82%	0.823	S	S	*	*			trans	93.6	151.4	149.4	-51.6	-172.3	180	-145.4	-1.5	120.3
153	G	27.8	Very low	32.8	Very low	65 Å²	65	130.8 Å²	130.8	67%	0.67	83%	0.827	S	S	*	*			trans	110.5	105.3	166.3	0	0	0	0	0	112.6
154	C	26.8	Very low	32.8	Very low	142 Å²	142	130.2 Å²	130.2	96%	0.959	82%	0.824	S	S	*	*				46.3	120.7	69.7	-57.3	0	0	0	0	112.2
155	G	27.2	Very low	32.9	Very low	81 Å²	81	131.8 Å²	131.8	84%	0.835	82%	0.821	S	S	*	*			cis	136.4	107.8	7.5	0	0	0	0	0	110.6
156	A	31.1	Very low	33.4	Very low	93 Å²	93	134.3 Å²	134.3	77%	0.769	82%	0.824	S	S	*	*			trans	-163.4	117.1	174.9	0	0	0	0	0	107.9
157	R	30.6	Very low	32.6	Very low	217 Å²	217	137.2 Å²	137.2	82%	0.819	82%	0.817	S	S	*	*				80.4	117.2	77.2	-83.5	-173.3	171.8	-166.3	0.2	114.6
158	R	31.3	Very low	32.9	Very low	227 Å²	227	139.4 Å²	139.4	86%	0.857	82%	0.817	S	S	*	*			trans	66.8	157.7	141.4	-68.7	-175.9	173.8	-168.7	-3.6	117.4
159	A	32.3	Very low	32.9	Very low	99 Å²	99	136.2 Å²	136.2	82%	0.818	80%	0.8	S	S	*	*			cis	-170.1	172.8	-22	0	0	0	0	0	108.7
160	G	30.1	Very low	33	Very low	69 Å²	69	140.3 Å²	140.3	71%	0.711	80%	0.802	S	S	*	*			trans	109.5	148.2	166.2	0	0	0	0	0	114.1
161	E	34	Very low	33.2	Very low	198 Å²	198	141 Å²	141	93%	0.925	80%	0.804	S	S	*	*			cis	178.6	130.9	-14	-125.5	173.9	-171	0	0	107
162	G	31.2	Very low	32	Very low	78 Å²	78	139.4 Å²	139.4	80%	0.804	81%	0.806	S	S	*	*			trans	79.4	153.9	155.7	0	0	0	0	0	118.9
163	R	31	Very low	32.3	Very low	251 Å²	251	133 Å²	133	95%	0.947	79%	0.794	S	S	*	*			cis	-149.7	164.6	-2.8	-83.6	-174.3	168.1	-145.7	-1.2	111.5
164	C	29.1	Very low	32.8	Very low	115 Å²	115	135.6 Å²	135.6	78%	0.777	80%	0.799	S	S	*	*			trans	-31.4	137.6	-179.3	-57.9	0	0	0	0	123.6
165	S	34.3	Very low	33.5	Very low	116 Å²	116	134.7 Å²	134.7	81%	0.811	79%	0.792	S	S	*	*				68.9	152.7	123	-58.1	0	0	0	0	121.7
166	P	39.1	Very low	33.8	Very low	127 Å²	127	138.1 Å²	138.1	83%	0.825	79%	0.785	S	S	*	*			cis	-123.7	175.5	15.8	41	-26.5	0	0	0	117.1
167	R	33.8	Very low	33.9	Very low	201 Å²	201	143.5 Å²	143.5	76%	0.758	79%	0.792	S	S	*	*			trans	-77.5	162.7	175.5	-79.3	-170.6	174.8	-174.3	0.4	113.3	D169	R167-D169 WeakPolarHBondContact CD-OD1 3.48Å; R167-D169 IonicContact CZ-OD1 3.62Å; R167-D169 IonicContact NE-OD1 3.88Å; R167-D169 IonicContact NH1-OD1 2.68Å; R167-D169 PolarHBondContact NH1-OD1 3.21Å
168	P	36.5	Very low	34.1	Very low	123 Å²	123	139.7 Å²	139.7	80%	0.799	79%	0.792	S	S	*	*				-115.9	166.4	103.1	34.1	-34.3	0	0	0	114
169	D	32	Very low	34.3	Very low	104 Å²	104	138.5 Å²	138.5	56%	0.556	79%	0.794	S	S	*	*			trans	-85.2	-163.9	-169.6	-66.9	-65	0	0	0	114.8	R167	R167-D169 WeakPolarHBondContact CD-OD1 3.48Å; R167-D169 IonicContact CZ-OD1 3.62Å; R167-D169 IonicContact NE-OD1 3.88Å; R167-D169 IonicContact NH1-OD1 2.68Å; R167-D169 PolarHBondContact NH1-OD1 3.21Å
170	H	34.6	Very low	34.3	Very low	182 Å²	182	145.3 Å²	145.3	84%	0.843	80%	0.798	S	S	*	*			trans	78.6	85.3	-176.4	63.6	-104.9	0	0	0	119.3
171	P	35.9	Very low	34.4	Very low	126 Å²	126	151.4 Å²	151.4	82%	0.818	81%	0.805	S	S	*	*			trans	-99.6	131.9	156.6	34.7	-26.7	0	0	0	112.5
172	G	31.3	Very low	34.5	Very low	67 Å²	67	149.6 Å²	149.6	69%	0.691	80%	0.801	S	S	*	*			trans	-74.9	178.2	177.2	0	0	0	0	0	117.4
173	T	39	Very low	34.5	Very low	111 Å²	111	157.7 Å²	157.7	68%	0.681	81%	0.807	S	S	*	*			trans	42.7	103.2	142.8	-31.6	0	0	0	0	118.4
174	P	37.4	Very low	34.7	Very low	121 Å²	121	152.7 Å²	152.7	79%	0.786	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-75.3	135.9	169.2	31	-32.6	0	0	0	111.6
175	P	41.9	Very low	34.9	Very low	122 Å²	122	156.1 Å²	156.1	79%	0.792	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-87.4	155.4	-176.2	33.8	-35.7	0	0	0	114.4
176	H	33.7	Very low	34.7	Very low	153 Å²	153	156.9 Å²	156.9	71%	0.708	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-49.4	141.1	173.2	-85.5	-97.3	0	0	0	114.9
177	K	32.7	Very low	34.5	Very low	207 Å²	207	157.4 Å²	157.4	90%	0.9	80%	0.797	S	S	*	*			trans	-141.9	146.9	147.2	-75.7	-163.6	177.6	174.6	0	113.2
178	T	34.6	Very low	34.8	Very low	136 Å²	136	152.6 Å²	152.6	83%	0.834	79%	0.792	S	S	*	*			trans	-94.3	162.4	177.3	40.8	0	0	0	0	112.3
179	F	35	Very low	35	Very low	202 Å²	202	155.5 Å²	155.5	89%	0.886	79%	0.794	S	S	*	*			trans	-46.9	140	-172.9	-70.8	-98.5	0	0	0	117.6
180	R	32.3	Very low	35.3	Very low	242 Å²	242	156.6 Å²	156.6	91%	0.913	81%	0.805	S	S	*	*				178	130.7	119.4	-96.2	165.6	-172.4	-155.7	3	114.6
181	K	32.6	Very low	35.4	Very low	197 Å²	197	153.9 Å²	153.9	86%	0.857	80%	0.804	S	S	*	*			trans	43.1	115.4	153.5	-73.2	-173.9	173	-176.7	0	122.1
182	L	36.9	Very low	35.6	Very low	161 Å²	161	158.1 Å²	158.1	84%	0.843	81%	0.809	S	S	*	*			trans	42.6	111.5	134.2	-65.9	170.5	0	0	0	120.6
183	R	31	Very low	35.8	Very low	247 Å²	247	160 Å²	160	93%	0.932	81%	0.812	S	S	*	*				-174.5	144.5	116.2	-100.2	167.3	-171.8	-164.1	1.4	111
184	L	35.9	Very low	35.7	Very low	147 Å²	147	162.6 Å²	162.6	77%	0.77	82%	0.821	S	S	*	*			trans	-69.3	143.9	167	-78.2	77.3	0	0	0	109.7
185	F	31.8	Very low	36	Very low	186 Å²	186	165.3 Å²	165.3	82%	0.816	83%	0.827	S	S	*	*				-176.2	111.6	121.8	-95.1	-64.1	0	0	0	110
186	D	31.2	Very low	35.6	Very low	132 Å²	132	164.5 Å²	164.5	71%	0.706	83%	0.825	S	S	*	*			trans	44.2	109.2	130.4	-59.8	-8.8	0	0	0	121.1
187	T	34.5	Very low	35.6	Very low	138 Å²	138	167.3 Å²	167.3	85%	0.847	84%	0.835	S	S	*	*			trans	-156.3	153.2	135.7	4.1	0	0	0	0	108.6
188	P	40.5	Very low	35.6	Very low	101 Å²	101	161.9 Å²	161.9	66%	0.656	83%	0.829	S	S	*	*	S	Bend	trans	-84.1	171.4	-152.5	32.6	-36.7	0	0	0	115
189	H	40.9	Very low	35.4	Very low	183 Å²	183	167.6 Å²	167.6	85%	0.847	84%	0.835	S	S	*	*			trans	104.2	30.6	175.3	-54.8	83.9	0	0	0	117.7
190	T	37.7	Very low	35.1	Very low	128 Å²	128	161.2 Å²	161.2	79%	0.785	83%	0.827	S	S	*	*			trans	-90.4	130.3	154.1	21.6	0	0	0	0	111.1
191	P	36.4	Very low	35	Very low	125 Å²	125	157.5 Å²	157.5	81%	0.812	82%	0.823	S	S	*	*			trans	-70.3	140.3	175.4	27.7	-32.9	0	0	0	111.8	S193	P191-S193 PolarHBondContact O-N 3.01Å
192	K	40.8	Very low	34.8	Very low	215 Å²	215	155.1 Å²	155.1	94%	0.935	82%	0.819	S	S	*	*	S	Bend	trans	-88	103.2	-174.2	-65.1	177.2	179.7	177	0	112.1
193	S	35.9	Very low	34.5	Very low	106 Å²	106	153.5 Å²	153.5	74%	0.741	82%	0.822	S	S	*	*			trans	-147.1	8.9	160.3	67	0	0	0	0	116	P191	P191-S193 PolarHBondContact O-N 3.01Å
194	L	36.3	Very low	34.4	Very low	166 Å²	166	147.1 Å²	147.1	87%	0.869	82%	0.815	S	S	*	*	S	Bend	trans	-117.8	20.8	179.6	-95.6	170.9	0	0	0	115.4
195	L	43.4	Very low	34.2	Very low	177 Å²	177	145.7 Å²	145.7	93%	0.927	82%	0.817	S	S	*	*	S	Bend	trans	-140.6	67.8	171.6	-77.2	177.6	0	0	0	112.1
196	S	33.7	Very low	34.1	Very low	105 Å²	105	143.4 Å²	143.4	73%	0.734	82%	0.818	S	S	*	*			trans	-157.5	75.3	163.2	57.2	0	0	0	0	113.7
197	K	34.4	Very low	34.1	Very low	213 Å²	213	146.3 Å²	146.3	93%	0.926	83%	0.825	S	S	*	*	S	Bend	trans	-176.1	62.3	150.4	-104.9	162.8	-175.1	-179.8	0	112.6
198	A	32.4	Very low	33.9	Very low	93 Å²	93	148.1 Å²	148.1	77%	0.769	83%	0.828	S	S	*	*			trans	-155.9	71.3	165.7	0	0	0	0	0	111.7
199	R	30.3	Very low	33.4	Very low	255 Å²	255	155 Å²	155	96%	0.962	84%	0.841	S	S	*	*	S	Bend	trans	-179.7	116.8	146.6	-101	161.6	-163.3	-139.5	1.8	111.9
200	G	28.9	Very low	32.6	Very low	69 Å²	69	149.6 Å²	149.6	71%	0.711	84%	0.835	S	S	*	*			trans	50.6	104.4	146.2	0	0	0	0	0	120.7
201	I	30.4	Very low	32.2	Very low	164 Å²	164	149.1 Å²	149.1	84%	0.841	84%	0.837	S	S	*	*			trans	-130.8	103.5	130.2	-61.4	-177.5	0	0	0	107.7
202	D	27.1	Very low	32.1	Very low	146 Å²	146	147.5 Å²	147.5	78%	0.781	83%	0.828	S	S	*	*			trans	13.5	109.5	142	-45.7	-25.3	0	0	0	117.3	S204	D202-S204 PolarHBondContact O-N 3.42Å
203	S	30.4	Very low	31.7	Very low	128 Å²	128	145.6 Å²	145.6	90%	0.895	83%	0.827	S	S	*	*			trans	-80.2	103.5	169.4	-172.7	0	0	0	0	110.2
204	S	29.9	Very low	31.4	Very low	112 Å²	112	148.5 Å²	148.5	78%	0.783	83%	0.827	S	S	*	*			trans	-83.4	148.6	162.7	53.3	0	0	0	0	110.6	D202	D202-S204 PolarHBondContact O-N 3.42Å
205	S	30.7	Very low	31.1	Very low	117 Å²	117	148.8 Å²	148.8	82%	0.818	83%	0.826	S	S	*	*			trans	-79.2	127.9	-165.9	48.9	0	0	0	0	114.3
206	V	30.4	Very low	30.3	Very low	138 Å²	138	145.7 Å²	145.7	84%	0.836	81%	0.81	S	S	*	*			trans	-138.3	128.2	155.1	-174.5	0	0	0	0	110.4
207	K	30.8	Very low	30.2	Very low	193 Å²	193	146.7 Å²	146.7	84%	0.839	81%	0.812	S	S	*	*			trans	-88.1	140	172.2	-62	168.2	179.7	169.6	0	109.5
208	L	29.6	Very low	29.9	Very low	176 Å²	176	143.1 Å²	143.1	92%	0.921	80%	0.799	S	S	*	*			trans	-133.6	143.7	152.6	-78	178.8	0	0	0	111.3
209	R	29.9	Very low	30	Very low	246 Å²	246	147 Å²	147	93%	0.928	80%	0.798	S	S	*	*			trans	-106	159.8	-177.9	-68.8	179.6	174.9	-170.5	-1	110.4
210	G	26	Very low	29.9	Very low	70 Å²	70	140.4 Å²	140.4	72%	0.722	79%	0.792	S	S	*	*			trans	91.2	153.6	156.3	0	0	0	0	0	114.5
211	S	29	Very low	29.8	Very low	118 Å²	118	141 Å²	141	83%	0.825	80%	0.797	S	S	*	*			cis	-151.5	149.5	4.4	-62.9	0	0	0	0	111.1
212	S	33.8	Very low	29.6	Very low	90 Å²	90	143.2 Å²	143.2	63%	0.629	80%	0.801	S	S	*	*			trans	-66.5	142.5	158.9	167	0	0	0	0	109.8
213	L	31.5	Very low	29.7	Very low	175 Å²	175	147.8 Å²	147.8	92%	0.916	81%	0.807	S	S	*	*			trans	-135.8	132.6	150.3	-78.9	-178.9	0	0	0	110.1
214	F	29.9	Very low	29.4	Very low	167 Å²	167	151.1 Å²	151.1	73%	0.732	81%	0.808	S	S	*	*			trans	-82.3	159	177.1	-76.8	-117.2	0	0	0	111	D216	F214-D216 HydrophobicContact CD1-CB 4.47Å
215	M	30.6	Very low	29.5	Very low	173 Å²	173	156 Å²	156	85%	0.852	82%	0.816	S	S	*	*			trans	-140.4	105.5	133.3	-103.8	-88.1	78.4	0	0	107.9
216	D	27.3	Very low	29.4	Very low	111 Å²	111	157.4 Å²	157.4	59%	0.594	82%	0.815	S	S	*	*			trans	-106.2	146.9	172.9	-148.8	-17.7	0	0	0	107.7	F214	F214-D216 HydrophobicContact CD1-CB 4.47Å
217	T	30.4	Very low	29.6	Very low	127 Å²	127	156.8 Å²	156.8	78%	0.779	81%	0.811	S	S	*	*			trans	-151.2	106.8	170.5	-55	0	0	0	0	109.2
218	E	28.7	Very low	29.5	Very low	138 Å²	138	159 Å²	159	65%	0.645	81%	0.814	S	S	*	*			trans	-94.2	168.6	-173.1	-67	-165	115.8	0	0	114.6
219	K	33.5	Very low	29.6	Very low	174 Å²	174	159.2 Å²	159.2	76%	0.757	81%	0.81	S	S	*	*			trans	86.3	140.7	152.1	-47.8	-168.5	-173.3	171.9	0	117.6
220	S	29.2	Very low	29.7	Very low	117 Å²	117	153.4 Å²	153.4	82%	0.818	80%	0.802	S	S	*	*			cis	-171	140.6	-19	51.4	0	0	0	0	109.4
221	G	26.4	Very low	29.9	Very low	80 Å²	80	155.7 Å²	155.7	83%	0.825	80%	0.804	S	S	*	*			trans	-158.2	147.9	176.6	0	0	0	0	0	112.3
222	K	27.3	Very low	30.1	Very low	212 Å²	212	159.3 Å²	159.3	92%	0.922	81%	0.808	S	S	*	*			trans	-89.1	148.4	-165.1	-68.8	170.3	179.8	171.4	0	114.2
223	R	27.9	Very low	30.4	Very low	241 Å²	241	160.8 Å²	160.8	91%	0.909	81%	0.813	S	S	*	*			trans	-13.1	138	164.5	-62.2	176.5	176.5	179.9	-2.4	118.2
224	E	25.1	Very low	30.7	Very low	198 Å²	198	160 Å²	160	93%	0.925	81%	0.81	S	S	*	*				-154.7	170.4	115.4	-115.6	165.4	-158.6	0	0	111.5
225	F	32.4	Very low	31.6	Very low	214 Å²	214	157.3 Å²	157.3	94%	0.939	80%	0.802	S	S	*	*			trans	-78.8	132.4	-170.1	-106.8	-111.4	0	0	0	112.5
226	D	27.5	Very low	32.6	Very low	148 Å²	148	153.3 Å²	153.3	79%	0.791	78%	0.784	S	S	*	*			trans	-153.1	152.4	148.3	-159.6	9	0	0	0	112.4	R228	D226-R228 PolarHBondContact O-N 3.2Å
227	V	34.8	Very low	33.6	Very low	125 Å²	125	153.3 Å²	153.3	76%	0.758	79%	0.79	S	S	*	*			trans	-76.4	101.8	-171.1	178.7	0	0	0	0	110.7	Q229	V227-Q229 PolarHBondContact O-N 3.22Å; V227-Q229 VanDerWaalsContact O-N 3.15Å
228	R	28.1	Very low	34.4	Very low	238 Å²	238	155.5 Å²	155.5	90%	0.898	79%	0.789	S	S	*	*			trans	-76.3	104.7	171.1	-75.2	-163.6	171.6	-155.7	-3.3	111.7	D226 T230	D226-R228 PolarHBondContact O-N 3.2Å; R228-T230 PolarHBondContact O-N 2.81Å
229	Q	33	Very low	36	Very low	182 Å²	182	151.1 Å²	151.1	85%	0.85	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-47.5	126.7	158	-65.2	172.3	-8.1	0	0	109.8	V227	V227-Q229 PolarHBondContact O-N 3.22Å; V227-Q229 VanDerWaalsContact O-N 3.15Å
230	T	31.7	Very low	37.2	Very low	123 Å²	123	146.4 Å²	146.4	76%	0.755	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-66.9	141.4	163.5	48.2	0	0	0	0	109	R228 Q232	R228-T230 PolarHBondContact O-N 2.81Å; T230-Q232 PolarHBondContact O-N 3.13Å
231	P	30.6	Very low	37.9	Very low	119 Å²	119	146.9 Å²	146.9	77%	0.773	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-59.1	126.6	176.5	25.6	-33.5	0	0	0	109.5	V233	P231-V233 PolarHBondContact O-N 3.34Å
232	Q	33.3	Very low	38.8	Very low	194 Å²	194	145.4 Å²	145.4	91%	0.907	73%	0.729	S	S	*	*			trans	-61	110.1	174.9	-78.4	177.7	-53.1	0	0	108.9	T230 N234	T230-Q232 PolarHBondContact O-N 3.13Å; Q232-N234 PolarHBondContact O-N 3.47Å
233	V	39.2	Very low	39.9	Very low	120 Å²	120	140.7 Å²	140.7	73%	0.727	71%	0.713	S	S	*	*			trans	-62.5	124.3	164.7	-178	0	0	0	0	106.4	P231 I235	P231-V233 PolarHBondContact O-N 3.34Å; V233-I235 HydrophobicContact CB-CG1 4.46Å; V233-I235 HydrophobicContact CG1-CG1 4.27Å; V233-I235 PolarHBondContact O-N 3.34Å
234	N	37.1	Very low	40.9	Very low	160 Å²	160	133.6 Å²	133.6	86%	0.856	69%	0.693	S	S	*	*			trans	-73	81.6	-179.4	-168.1	11.5	0	0	0	109.7	Q232 N236	Q232-N234 PolarHBondContact O-N 3.47Å; N234-N236 PolarHBondContact O-N 3.11Å
235	I	49.1	Very low	41.8	Very low	110 Å²	110	130.3 Å²	130.3	56%	0.564	68%	0.681	S	S	*	*			trans	-76.4	119.8	177.7	-62.4	172.6	0	0	0	107.8	V233 P237	V233-I235 HydrophobicContact CB-CG1 4.46Å; V233-I235 HydrophobicContact CG1-CG1 4.27Å; V233-I235 PolarHBondContact O-N 3.34Å; I235-P237 WeakPolarHBondContact O-CD 3.43Å
236	N	52.8	Low	42.5	Very low	89 Å²	89	127.9 Å²	127.9	48%	0.476	67%	0.673	S	S	.	*			trans	-56.6	120.5	172.8	176.4	8.6	0	0	0	109.9	N234 F238 T239	N234-N236 PolarHBondContact O-N 3.11Å; N236-F238 PolarHBondContact O-N 3.13Å; N236-F238 WeakPolarHBondContact OD1-CD2 3.33Å; N236-F238 PolarHBondContact OD1-N 2.86Å; N236-T239 PolarHBondContact O-N 2.65Å; N236-T239 VanDerWaalsContact O-N 3.07Å; N236-T239 PolarHBondContact O-OG1 3.45Å
237	P	48.1	Very low	43	Very low	111 Å²	111	126.1 Å²	126.1	72%	0.721	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-6.1	-179.9	28	-35.6	0	0	0	113.7	I235	I235-P237 WeakPolarHBondContact O-CD 3.43Å
238	F	47.2	Very low	43.3	Very low	173 Å²	173	125.1 Å²	125.1	76%	0.759	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	17.6	174.5	-54	-71.2	0	0	0	113.6	N236 P240	N236-F238 PolarHBondContact O-N 3.13Å; N236-F238 WeakPolarHBondContact OD1-CD2 3.33Å; N236-F238 PolarHBondContact OD1-N 2.86Å; F238-P240 WeakPolarHBondContact O-CD 3.35Å
239	T	61.3	Low	43.9	Very low	46 Å²	46	116.7 Å²	116.7	28%	0.282	66%	0.657	S	S	.	*	S	Bend	trans	-71.6	120.2	168.2	-49.1	0	0	0	0	109	N236 L243	N236-T239 PolarHBondContact O-N 2.65Å; N236-T239 VanDerWaalsContact O-N 3.07Å; N236-T239 PolarHBondContact O-OG1 3.45Å; T239-L243 HydrophobicContact CG2-CB 4.31Å; T239-L243 HydrophobicContact CG2-CD1 4.34Å
240	P	58.1	Low	44.1	Very low	74 Å²	74	117.6 Å²	117.6	48%	0.481	66%	0.662	S	S	.	*			trans	-66.8	139	-178.7	26.6	-34.3	0	0	0	111.7	F238 S242 L243	F238-P240 WeakPolarHBondContact O-CD 3.35Å; P240-S242 PolarHBondContact O-N 2.9Å; P240-L243 HydrophobicContact CG-CD1 4.29Å; P240-L243 PolarHBondContact O-N 3.09Å
241	D	44.4	Very low	44.2	Very low	128 Å²	128	117.6 Å²	117.6	68%	0.684	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-53.1	-27.7	-174.5	-69.3	-42.1	0	0	0	114.4	L243 L244 L245	D241-L243 PolarHBondContact O-N 3.48Å; D241-L243 VanDerWaalsContact O-N 3.16Å; D241-L244 PolarHBondContact O-N 2.97Å; D241-L245 PolarHBondContact O-N 3.02Å
242	S	46.6	Very low	44.2	Very low	49 Å²	49	123.8 Å²	123.8	34%	0.343	67%	0.673	S	S	.	*	G	3₁₀ helix	trans	-57.8	-23.7	176	45.3	0	0	0	0	114.2	P240 H246	P240-S242 PolarHBondContact O-N 2.9Å; S242-H246 PolarHBondContact O-CD2 3.4Å
243	L	49.3	Very low	44.2	Very low	112 Å²	112	126.1 Å²	126.1	59%	0.586	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-87.1	-23.6	174.9	-73.6	171.1	0	0	0	113.7	T239 P240 D241	T239-L243 HydrophobicContact CG2-CB 4.31Å; T239-L243 HydrophobicContact CG2-CD1 4.34Å; P240-L243 HydrophobicContact CG-CD1 4.29Å; P240-L243 PolarHBondContact O-N 3.09Å; D241-L243 PolarHBondContact O-N 3.48Å; D241-L243 VanDerWaalsContact O-N 3.16Å
244	L	49.9	Very low	43.9	Very low	93 Å²	93	132.3 Å²	132.3	49%	0.487	68%	0.684	S	S	.	*	G	3₁₀ helix	trans	-77	-30.3	-178.9	-68.9	171.9	0	0	0	112.5	D241 H246 S247	D241-L244 PolarHBondContact O-N 2.97Å; L244-H246 PolarHBondContact O-N 3.27Å; L244-H246 VanDerWaalsContact O-N 3.11Å; L244-S247 PolarHBondContact O-N 2.88Å
245	L	43.7	Very low	43.7	Very low	129 Å²	129	134.2 Å²	134.2	68%	0.675	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-60.6	-18.8	179.6	-77.1	160.9	0	0	0	114.5	D241	D241-L245 PolarHBondContact O-N 3.02Å
246	H	47.1	Very low	42.7	Very low	162 Å²	162	139.9 Å²	139.9	75%	0.75	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-86.3	-8	-178.6	-73.3	-75.4	0	0	0	114.9	S242 L244	S242-H246 PolarHBondContact O-CD2 3.4Å; L244-H246 PolarHBondContact O-N 3.27Å; L244-H246 VanDerWaalsContact O-N 3.11Å
247	S	38	Very low	41.7	Very low	112 Å²	112	142.3 Å²	142.3	78%	0.783	72%	0.717	S	S	*	*	S	Bend	trans	-94.8	-12.5	179.5	-70.7	0	0	0	0	114.6	L244 G249	L244-S247 PolarHBondContact O-N 2.88Å; S247-G249 PolarHBondContact O-N 3.07Å
248	S	41.7	Very low	40.7	Very low	104 Å²	104	145.1 Å²	145.1	73%	0.727	71%	0.714	S	S	*	*	S	Bend	trans	-97.5	53	-177	53.1	0	0	0	0	113
249	G	39.9	Very low	40	Very low	60 Å²	60	146.5 Å²	146.5	62%	0.619	72%	0.715	S	S	*	*			trans	-132.6	9.4	-158.3	0	0	0	0	0	120	S247	S247-G249 PolarHBondContact O-N 3.07Å
250	Q	37	Very low	38.5	Very low	202 Å²	202	150.1 Å²	150.1	94%	0.944	73%	0.732	S	S	*	*			trans	-154.7	83.6	179.9	-121.5	166.1	67.4	0	0	116.5
251	C	34	Very low	37.2	Very low	122 Å²	122	152 Å²	152	82%	0.824	74%	0.739	S	S	*	*			trans	-151.8	86	151.4	-169.5	0	0	0	0	112.2
252	R	30	Very low	36.7	Very low	249 Å²	249	150.3 Å²	150.3	94%	0.94	74%	0.737	S	S	*	*			trans	-128.1	99.4	161.7	-80.7	-169.7	170.7	179.2	-1.9	110.5	R254	R252-R254 PolarHBondContact O-N 2.78Å
253	R	34.2	Very low	36	Very low	244 Å²	244	157.4 Å²	157.4	92%	0.921	76%	0.762	S	S	*	*			trans	-46.6	134.7	162.5	-75.7	172.6	158.3	176.8	-6.7	109.8
254	R	32.8	Very low	35.2	Very low	249 Å²	249	154.8 Å²	154.8	94%	0.94	76%	0.761	S	S	*	*			trans	-120.3	130.7	154.9	-93.6	-174	165.8	172.4	-4.1	110.7	R252	R252-R254 PolarHBondContact O-N 2.78Å
255	K	31.6	Very low	34.5	Very low	201 Å²	201	158.6 Å²	158.6	87%	0.874	78%	0.777	S	S	*	*			trans	-73.6	148.9	179	-85.1	178	170.7	178.4	0	110.7
256	R	28.2	Very low	34.1	Very low	229 Å²	229	159.1 Å²	159.1	86%	0.864	78%	0.78	S	S	*	*			trans	-57.8	129	159.1	179.2	-172.3	-167	177.8	4.9	111.3
257	T	32.6	Very low	33.8	Very low	140 Å²	140	160.1 Å²	160.1	86%	0.859	79%	0.787	S	S	*	*			trans	-141.5	156.9	151.4	40.2	0	0	0	0	108.5
258	Y	27.8	Very low	33.8	Very low	169 Å²	169	163.3 Å²	163.3	66%	0.663	79%	0.79	S	S	*	*			trans	-140.8	148.5	-158.9	-178.6	-88.9	0	0	0	108.3
259	W	30.8	Very low	33.5	Very low	202 Å²	202	162.8 Å²	162.8	77%	0.765	79%	0.792	S	S	*	*			trans	142.4	126.4	151.3	-79.7	117.3	0	0	0	114.6
260	N	31	Very low	33.2	Very low	122 Å²	122	164.9 Å²	164.9	65%	0.652	80%	0.798	S	S	*	*			trans	55.7	152.2	147	-83.4	29.1	0	0	0	121.4
261	D	30.3	Very low	33.3	Very low	115 Å²	115	163.3 Å²	163.3	62%	0.615	80%	0.796	S	S	*	*			cis	-156.7	162.7	4.5	-143.5	-40.6	0	0	0	111.8
262	S	33.8	Very low	33.6	Very low	92 Å²	92	166.8 Å²	166.8	64%	0.643	79%	0.793	S	S	*	*			trans	57.9	149	144	-70.3	0	0	0	0	121.9
263	F	31.6	Very low	34.1	Very low	198 Å²	198	164.5 Å²	164.5	87%	0.868	79%	0.793	S	S	*	*			cis	-170.8	159.9	-20.3	-133.3	-88.2	0	0	0	107.9
264	G	33.6	Very low	34.2	Very low	56 Å²	56	160.5 Å²	160.5	58%	0.577	79%	0.789	S	S	*	*			trans	96.2	121.4	171	0	0	0	0	0	115.2
265	E	35.5	Very low	34.3	Very low	174 Å²	174	157.1 Å²	157.1	81%	0.813	78%	0.784	S	S	*	*				69.4	124.2	68.7	-68.1	-178	175	0	0	111.1
266	D	33.7	Very low	34.4	Very low	140 Å²	140	154.7 Å²	154.7	75%	0.749	78%	0.78	S	S	*	*			cis	-160.7	179.7	11.4	-89	-32.1	0	0	0	112.6
267	M	42.6	Very low	34.7	Very low	182 Å²	182	151.3 Å²	151.3	90%	0.897	77%	0.774	S	S	*	*			trans	97.5	139.7	143.1	-140.9	69.9	171.5	0	0	120.1
268	E	36.1	Very low	34.9	Very low	179 Å²	179	150.1 Å²	150.1	84%	0.836	77%	0.767	S	S	*	*			trans	-92	167.2	-166.9	-56.2	177.3	119.6	0	0	115.4
269	A	35.7	Very low	35.1	Very low	94 Å²	94	152.6 Å²	152.6	78%	0.777	78%	0.775	S	S	*	*			trans	61.6	113	144	0	0	0	0	0	120.4
270	S	34.1	Very low	35.3	Very low	104 Å²	104	148.5 Å²	148.5	73%	0.727	77%	0.774	S	S	*	*				-159	135.7	128.2	28.6	0	0	0	0	111
271	D	39.1	Very low	35.7	Very low	169 Å²	169	147.3 Å²	147.3	90%	0.904	78%	0.782	S	S	*	*			trans	-67	135.7	174.2	-65.7	-59.3	0	0	0	111.2
272	Y	39.9	Very low	36.4	Very low	194 Å²	194	151.5 Å²	151.5	76%	0.761	80%	0.795	S	S	*	*			trans	-146.2	122.1	154.2	54.5	-89.2	0	0	0	110
273	E	40.8	Very low	36.8	Very low	201 Å²	201	157.5 Å²	157.5	94%	0.939	80%	0.803	S	S	*	*			trans	-64.8	136	171	-61.1	179.7	134.4	0	0	109.4
274	L	36.2	Very low	37.2	Very low	160 Å²	160	155.3 Å²	155.3	84%	0.838	80%	0.799	S	S	*	*			trans	-138.8	127.2	166.8	-166.9	71.5	0	0	0	109.7
275	E	36	Very low	37.5	Very low	179 Å²	179	158.5 Å²	158.5	84%	0.836	81%	0.807	S	S	*	*			trans	-67.1	142.1	-172.5	-60.5	172.7	127.7	0	0	112.4	E277	E275-E277 VanDerWaalsContact C-N 3.28Å; E275-E277 PolarHBondContact O-N 3Å
276	D	33.7	Very low	38.1	Very low	149 Å²	149	156.9 Å²	156.9	80%	0.797	80%	0.803	S	S	*	*			trans	-76.4	75	177.4	-173.5	26.9	0	0	0	111.4	T278	D276-T278 PolarHBondContact O-N 3.44Å
277	E	33.8	Very low	38.6	Very low	159 Å²	159	156.2 Å²	156.2	74%	0.743	80%	0.804	S	S	*	*			trans	-67.8	92.4	168.3	-95.1	-88.4	132.8	0	0	109.9	E275 R279	E275-E277 VanDerWaalsContact C-N 3.28Å; E275-E277 PolarHBondContact O-N 3Å; E277-R279 PolarHBondContact O-N 2.9Å
278	T	36.3	Very low	39.1	Very low	115 Å²	115	156.3 Å²	156.3	71%	0.706	80%	0.802	S	S	*	*			trans	-59.4	92.9	172.1	50.5	0	0	0	0	110.9	D276 P280	D276-T278 PolarHBondContact O-N 3.44Å; T278-P280 WeakPolarHBondContact O-CD 3.49Å
279	R	32.9	Very low	39.8	Very low	220 Å²	220	153.2 Å²	153.2	83%	0.83	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-59.5	119.4	178.5	-67.6	177.9	175.7	172.5	-2.1	110.4	E277	E277-R279 PolarHBondContact O-N 2.9Å
280	P	35.9	Very low	40.6	Very low	116 Å²	116	155.9 Å²	155.9	75%	0.753	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-63.2	152.2	171.1	27.3	-33.4	0	0	0	110	T278 K282	T278-P280 WeakPolarHBondContact O-CD 3.49Å; P280-K282 PolarHBondContact O-N 3.4Å
281	A	37.8	Very low	42	Very low	98 Å²	98	158.5 Å²	158.5	81%	0.81	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-49.7	134.3	-175.9	0	0	0	0	0	111.8	R283	A281-R283 PolarHBondContact O-N 3.4Å
282	K	44.6	Very low	43.9	Very low	203 Å²	203	158.7 Å²	158.7	88%	0.883	80%	0.797	S	S	*	*			trans	-59	103.6	-177	-70.7	-178.7	179.4	178.7	0	110.2	P280	P280-K282 PolarHBondContact O-N 3.4Å
283	R	42.8	Very low	46.3	Very low	218 Å²	218	150.5 Å²	150.5	82%	0.823	77%	0.768	S	S	*	*			trans	-50.2	137.3	171.8	-163.2	177.2	-161.5	145.1	0.8	109.3	A281 T285	A281-R283 PolarHBondContact O-N 3.4Å; R283-T285 PolarHBondContact O-N 3.35Å
284	I	40.3	Very low	48.8	Very low	151 Å²	151	145 Å²	145	77%	0.774	74%	0.739	S	S	*	*			trans	-68	99.7	168	-59.4	173.1	0	0	0	106.5	I286	I284-I286 HydrophobicContact CG2-CG1 4.31Å; I284-I286 PolarHBondContact O-N 2.85Å; I284-I286 VanDerWaalsContact O-N 3.1Å
285	T	39.7	Very low	51.6	Low	123 Å²	123	138.1 Å²	138.1	76%	0.755	70%	0.701	S	S	*	*			trans	-70.5	99.6	166	0.8	0	0	0	0	107.3	R283 T287	R283-T285 PolarHBondContact O-N 3.35Å; T285-T287 PolarHBondContact O-N 2.83Å; T285-T287 VanDerWaalsContact O-N 3.09Å
286	I	47.9	Very low	54.3	Low	141 Å²	141	133.9 Å²	133.9	72%	0.723	69%	0.688	S	S	*	*			trans	-65.7	108.7	167	-59.8	175.6	0	0	0	105.9	I284 E288	I284-I286 HydrophobicContact CG2-CG1 4.31Å; I284-I286 PolarHBondContact O-N 2.85Å; I284-I286 VanDerWaalsContact O-N 3.1Å; I286-E288 PolarHBondContact O-N 3.42Å
287	T	43.7	Very low	57.2	Low	125 Å²	125	130.2 Å²	130.2	77%	0.767	67%	0.671	S	S	*	*			trans	-71.5	102.3	176.7	46.4	0	0	0	0	109.4	T285 S289	T285-T287 PolarHBondContact O-N 2.83Å; T285-T287 VanDerWaalsContact O-N 3.09Å; T287-S289 PolarHBondContact O-N 3.36Å
288	E	53.4	Low	60.2	Low	184 Å²	184	125.7 Å²	125.7	86%	0.86	65%	0.65	S	S	*	*			trans	-52.2	129.4	169.5	-58.8	172.1	148.8	0	0	110.5	I286	I286-E288 PolarHBondContact O-N 3.42Å
289	S	51.3	Low	63.1	Low	114 Å²	114	120.4 Å²	120.4	80%	0.797	62%	0.617	S	S	*	*	S	Bend	trans	177	-17	153	35.4	0	0	0	0	115.8	T287	T287-S289 PolarHBondContact O-N 3.36Å
290	N	53.1	Low	66.2	Low	151 Å²	151	114.6 Å²	114.6	81%	0.807	60%	0.599	S	S	*	*	S	Bend	trans	-155.2	15.7	-179.5	-137.1	-8	0	0	0	119.2
291	M	62	Low	69.2	Low	158 Å²	158	113 Å²	113	78%	0.778	58%	0.582	S	S	*	*			trans	-90.3	112.4	166.8	-64.7	-162.8	103.9	0	0	109.2
292	K	79.5	Confident	72	Confident	173 Å²	173	112.1 Å²	112.1	75%	0.752	56%	0.563	S	S	*	*			trans	-62.9	134.9	169.1	-67.6	-179.8	178.2	177.2	0	108.6	T297	K292-T297 VanDerWaalsContact CB-OG1 3.22Å; K292-T297 WeakPolarHBondContact CB-OG1 3.18Å
293	S	89.9	Confident	74.5	Confident	22 Å²	22	106.8 Å²	106.8	15%	0.154	54%	0.541	C	S	.	.			trans	-54.3	144.4	178.6	115.5	0	0	0	0	110.6	Y295 T296 T297 E368	S293-Y295 VanDerWaalsContact C-N 3.32Å; S293-Y295 PolarHBondContact O-N 2.97Å; S293-Y295 PolarHBondContact OG-N 3.35Å; S293-T296 PolarHBondContact O-N 2.94Å; S293-T296 PolarHBondContact OG-N 3.5Å; S293-T296 PolarHBondContact OG-OG1 3.29Å; S293-T297 WeakPolarHBondContact O-CB 3.47Å; S293-T297 PolarHBondContact O-N 2.98Å; S293-T297 PolarHBondContact O-OG1 3.34Å; S293-E368 WeakPolarHBondContact CB-OE1 3.41Å; S293-E368 PolarHBondContact OG-OE1 2.84Å
294	R	93.6	Very high	77	Confident	86 Å²	86	101.2 Å²	101.2	33%	0.325	52%	0.523	S	S	.	.	H	α-helix	trans	-64.1	-42.8	-178.8	-178.3	-175.4	176.8	-143.9	-18.6	109.6	T296 T297 E298 S364 E368	R294-T296 VanDerWaalsContact C-N 3.35Å; R294-T296 PolarHBondContact O-N 2.94Å; R294-T297 PolarHBondContact O-N 3.35Å; R294-E298 HydrophobicContact CG-CG 4.15Å; R294-E298 VanDerWaalsContact CG-OE1 3.3Å; R294-E298 WeakPolarHBondContact CG-OE1 3.38Å; R294-E298 IonicContact CZ-OE1 3.42Å; R294-E298 IonicContact CZ-OE2 2.86Å; R294-E298 IonicContact NE-OE1 3.85Å; R294-E298 PolarHBondContact NE-OE1 2.95Å; R294-E298 IonicContact NE-OE2 3.76Å; R294-E298 PolarHBondContact NE-OE2 2.95Å; R294-E298 VanDerWaalsContact NE-OE2 3.08Å; R294-E298 IonicContact NH2-OE1 2.67Å; R294-E298 IonicContact NH2-OE2 3.01Å; R294-E298 PolarHBondContact NH2-OE2 3.28Å; R294-E298 WeakPolarHBondContact O-CB 3.32Å; R294-E298 PolarHBondContact O-N 3.45Å; R294-S364 PolarHBondContact NH1-OG 2.92Å; R294-E368 WeakPolarHBondContact CA-OE2 3.41Å; R294-E368 VanDerWaalsContact CB-OE2 3.31Å; R294-E368 WeakPolarHBondContact CB-OE2 3.46Å; R294-E368 PolarHBondContact N-OE2 3.04Å
295	Y	94.9	Very high	79.6	Confident	15 Å²	15	97.6 Å²	97.6	6%	0.059	51%	0.505	C	S	.	.	H	α-helix	trans	-52	-51.8	172.3	-178.4	-108.4	0	0	0	112	S293 T297 F299 E301 F314 C316 I327 E368 L373	S293-Y295 VanDerWaalsContact C-N 3.32Å; S293-Y295 PolarHBondContact O-N 2.97Å; S293-Y295 PolarHBondContact OG-N 3.35Å; Y295-T297 VanDerWaalsContact C-N 3.3Å; Y295-T297 PolarHBondContact O-N 2.96Å; Y295-F299 HydrophobicContact CD2-CD2 4.47Å; Y295-F299 WeakPolarHBondContact O-CA 3.48Å; Y295-F299 VanDerWaalsContact O-CB 3.31Å; Y295-F299 WeakPolarHBondContact O-CB 3.32Å; Y295-F299 PolarHBondContact O-N 3.33Å; Y295-E301 WeakPolarHBondContact CE1-OE2 3.42Å; Y295-E301 PolarHBondContact OH-OE2 2.83Å; Y295-F314 WeakPolarHBondContact OH-CB 3.32Å; Y295-C316 PolarHBondContact OH-SG 3.45Å; Y295-C316 VanDerWaalsContact OH-SG 3.36Å; Y295-I327 HydrophobicContact CD2-CD1 4.06Å; Y295-I327 HydrophobicContact CD2-CG2 4.08Å; Y295-I327 HydrophobicContact CE2-CB 4.09Å; Y295-I327 HydrophobicContact CE2-CD1 3.86Å; Y295-I327 HydrophobicContact CE2-CG2 3.82Å; Y295-E368 WeakPolarHBondContact CB-OE1 3.43Å; Y295-E368 PolarHBondContact N-OE2 2.88Å; Y295-L373 HydrophobicContact CD2-CD2 3.8Å; Y295-L373 HydrophobicContact CG-CD2 3.91Å
296	T	94.1	Very high	82	Confident	90 Å²	90	92.9 Å²	92.9	55%	0.552	48%	0.48	S	S	*	.	H	α-helix	trans	-67.4	-32.2	-177.3	-51.6	0	0	0	0	112.5	S293 R294	S293-T296 PolarHBondContact O-N 2.94Å; S293-T296 PolarHBondContact OG-N 3.5Å; S293-T296 PolarHBondContact OG-OG1 3.29Å; R294-T296 VanDerWaalsContact C-N 3.35Å; R294-T296 PolarHBondContact O-N 2.94Å
297	T	95	Very high	83.9	Confident	72 Å²	72	90.1 Å²	90.1	44%	0.442	47%	0.473	S	S	.	.	H	α-helix	trans	-83.9	-43.5	-176.1	-53.8	0	0	0	0	112.6	K292 S293 R294 Y295 R319	K292-T297 VanDerWaalsContact CB-OG1 3.22Å; K292-T297 WeakPolarHBondContact CB-OG1 3.18Å; S293-T297 WeakPolarHBondContact O-CB 3.47Å; S293-T297 PolarHBondContact O-N 2.98Å; S293-T297 PolarHBondContact O-OG1 3.34Å; R294-T297 PolarHBondContact O-N 3.35Å; Y295-T297 VanDerWaalsContact C-N 3.3Å; Y295-T297 PolarHBondContact O-N 2.96Å; T297-R319 VanDerWaalsContact O-CD 3.27Å; T297-R319 WeakPolarHBondContact O-CD 3.42Å
298	E	96.1	Very high	85.5	Confident	65 Å²	65	86 Å²	86	30%	0.304	46%	0.455	S	S	.	.	H	α-helix	trans	-87.2	-23.9	-177.5	-71.9	-179.2	-161.2	0	0	113.2	R294 R319	R294-E298 HydrophobicContact CG-CG 4.15Å; R294-E298 VanDerWaalsContact CG-OE1 3.3Å; R294-E298 WeakPolarHBondContact CG-OE1 3.38Å; R294-E298 IonicContact CZ-OE1 3.42Å; R294-E298 IonicContact CZ-OE2 2.86Å; R294-E298 IonicContact NE-OE1 3.85Å; R294-E298 PolarHBondContact NE-OE1 2.95Å; R294-E298 IonicContact NE-OE2 3.76Å; R294-E298 PolarHBondContact NE-OE2 2.95Å; R294-E298 VanDerWaalsContact NE-OE2 3.08Å; R294-E298 IonicContact NH2-OE1 2.67Å; R294-E298 IonicContact NH2-OE2 3.01Å; R294-E298 PolarHBondContact NH2-OE2 3.28Å; R294-E298 WeakPolarHBondContact O-CB 3.32Å; R294-E298 PolarHBondContact O-N 3.45Å; E298-R319 WeakPolarHBondContact O-CB 3.4Å; E298-R319 WeakPolarHBondContact O-CG 3.38Å; E298-R319 PolarHBondContact O-N 3.49Å
299	F	97.6	Very high	86.3	Confident	4 Å²	4	84.2 Å²	84.2	2%	0.018	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	159.3	-171.3	-55.7	-93	0	0	0	113.2	Y295 C316 V317 K318 R319 Y325 I327 W366 Q375	Y295-F299 HydrophobicContact CD2-CD2 4.47Å; Y295-F299 WeakPolarHBondContact O-CA 3.48Å; Y295-F299 VanDerWaalsContact O-CB 3.31Å; Y295-F299 WeakPolarHBondContact O-CB 3.32Å; Y295-F299 PolarHBondContact O-N 3.33Å; F299-C316 HydrophobicContact CB-CB 4.2Å; F299-C316 HydrophobicContact CD1-CB 4.27Å; F299-V317 CarbonylContact C-O 3.59Å; F299-V317 WeakPolarHBondContact CA-O 3.46Å; F299-K318 HydrophobicContact CD1-CB 3.65Å; F299-K318 HydrophobicContact CD1-CG 4.05Å; F299-K318 HydrophobicContact CE1-CB 3.58Å; F299-K318 HydrophobicContact CE1-CD 3.8Å; F299-K318 HydrophobicContact CE1-CG 3.71Å; F299-K318 HydrophobicContact CZ-CD 4.08Å; F299-K318 HydrophobicContact CZ-CG 4.23Å; F299-R319 PolarHBondContact O-NE 3.44Å; F299-R319 PolarHBondContact O-NH2 2.88Å; F299-Y325 HydrophobicContact CE1-CD2 4.38Å; F299-I327 HydrophobicContact CB-CD1 4.4Å; F299-I327 HydrophobicContact CD1-CD1 3.46Å; F299-I327 VanDerWaalsContact CD1-CD1 3.46Å; F299-I327 HydrophobicContact CD2-CD1 4.05Å; F299-I327 HydrophobicContact CE1-CD1 3.58Å; F299-I327 HydrophobicContact CE2-CD1 4.17Å; F299-I327 HydrophobicContact CG-CD1 3.7Å; F299-I327 HydrophobicContact CZ-CD1 3.94Å; F299-W366 HydrophobicContact CD2-CH2 4.39Å; F299-W366 AromaticContact CE2-CH2 3.58Å; F299-W366 HydrophobicContact CE2-CH2 3.58Å; F299-W366 HydrophobicContact CE2-CZ2 4.05Å; F299-W366 HydrophobicContact CE2-CZ3 4.46Å; F299-W366 AromaticContact CZ-CH2 3.99Å; F299-W366 HydrophobicContact CZ-CH2 3.99Å; F299-Q375 HydrophobicContact CE1-CG 4.37Å; F299-Q375 HydrophobicContact CZ-CG 4.41Å
300	H	97.6	Very high	87.4	Confident	98 Å²	98	81.7 Å²	81.7	45%	0.454	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	110.4	168.3	-179.5	39.6	0	0	0	108.3	L302 C316 V317	H300-L302 PolarHBondContact O-N 3.47Å; H300-C316 CarbonylContact O-C 3.55Å; H300-C316 VanDerWaalsContact O-CA 3.28Å; H300-C316 WeakPolarHBondContact O-CA 3.28Å; H300-V317 PolarHBondContact N-O 3.01Å; H300-V317 PolarHBondContact O-N 3.23Å
301	E	97.6	Very high	89	Confident	81 Å²	81	74.8 Å²	74.8	38%	0.379	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	125.6	174.4	-173.6	173.8	128.4	0	0	110.2	Y295 F314	Y295-E301 WeakPolarHBondContact CE1-OE2 3.42Å; Y295-E301 PolarHBondContact OH-OE2 2.83Å; E301-F314 HydrophobicContact CG-CB 4.15Å; E301-F314 HydrophobicContact CG-CD1 3.8Å; E301-F314 HydrophobicContact CG-CG 4.25Å; E301-F314 WeakPolarHBondContact OE1-CD1 3.4Å; E301-F314 WeakPolarHBondContact OE1-CE1 3.45Å
302	L	97.3	Very high	90.4	Very high	81 Å²	81	68 Å²	68	42%	0.424	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-53.5	177.4	-62.3	-177.3	0	0	0	111.6	H300 K315 V317	H300-L302 PolarHBondContact O-N 3.47Å; L302-K315 HydrophobicContact CB-CD 4.46Å; L302-K315 WeakPolarHBondContact CB-O 3.45Å; L302-K315 HydrophobicContact CD1-CD 4.12Å; L302-K315 HydrophobicContact CD1-CG 4.28Å; L302-K315 PolarHBondContact N-O 3.04Å; L302-V317 HydrophobicContact CD1-CG2 3.72Å; L302-V317 HydrophobicContact CD2-CG2 4.02Å; L302-V317 HydrophobicContact CG-CG2 3.96Å
303	E	96.6	Very high	91.2	Very high	90 Å²	90	61.8 Å²	61.8	42%	0.421	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	150.7	-175	59.7	-176.3	152.2	0	0	111.2	I305 F314 K315	E303-I305 HydrophobicContact CG-CG2 3.87Å; E303-I305 PolarHBondContact O-N 2.94Å; E303-F314 WeakPolarHBondContact O-CA 3.33Å; E303-K315 HydrophobicContact CG-CB 3.84Å; E303-K315 HydrophobicContact CG-CD 3.69Å; E303-K315 HydrophobicContact CG-CG 4.46Å; E303-K315 PolarHBondContact O-N 3.48Å; E303-K315 WeakPolarHBondContact OE1-CD 3.46Å; E303-K315 WeakPolarHBondContact OE1-CE 3.43Å; E303-K315 IonicContact OE1-NZ 3.42Å; E303-K315 PolarHBondContact OE1-NZ 3.24Å
304	K	96.2	Very high	91.5	Very high	102 Å²	102	61.3 Å²	61.3	44%	0.443	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	109.4	172.7	-179.6	170.8	164.3	167.7	0	109.6	G306 S307 S312 F314	K304-G306 WeakPolarHBondContact CE-O 3.31Å; K304-S307 VanDerWaalsContact CE-CB 3.47Å; K304-S307 PolarHBondContact NZ-OG 3.48Å; K304-S312 PolarHBondContact NZ-OG 2.87Å; K304-F314 HydrophobicContact CB-CD1 3.73Å; K304-F314 HydrophobicContact CB-CE1 3.72Å; K304-F314 HydrophobicContact CD-CE1 3.86Å; K304-F314 HydrophobicContact CD-CZ 4.13Å; K304-F314 HydrophobicContact CG-CD1 4.06Å; K304-F314 HydrophobicContact CG-CE1 3.85Å; K304-F314 HydrophobicContact CG-CZ 4.42Å
305	I	94.6	Very high	91.7	Very high	75 Å²	75	59 Å²	59	39%	0.385	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-15.8	-176.1	61.7	175.4	0	0	0	113.9	E303 V313 K315 A326 Y378	E303-I305 HydrophobicContact CG-CG2 3.87Å; E303-I305 PolarHBondContact O-N 2.94Å; I305-V313 HydrophobicContact CD1-CG1 3.95Å; I305-V313 HydrophobicContact CG1-CB 4.11Å; I305-V313 HydrophobicContact CG1-CG1 3.85Å; I305-V313 WeakPolarHBondContact CG1-O 3.43Å; I305-V313 PolarHBondContact N-O 3.34Å; I305-K315 HydrophobicContact CD1-CB 4.44Å; I305-K315 HydrophobicContact CG2-CB 3.79Å; I305-A326 HydrophobicContact CD1-CB 4.17Å; I305-Y378 HydrophobicContact CD1-CD2 4.18Å; I305-Y378 HydrophobicContact CD1-CE2 4.05Å
306	G	89.6	Confident	91.9	Very high	24 Å²	24	58.2 Å²	58.2	25%	0.247	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	153.1	-178.3	0	0	0	0	0	114	K304 S312 V313	K304-G306 WeakPolarHBondContact CE-O 3.31Å; G306-S312 WeakPolarHBondContact O-CA 3.43Å; G306-V313 PolarHBondContact N-O 2.96Å; G306-V313 PolarHBondContact O-N 3.34Å
307	S	87.9	Confident	92.1	Very high	82 Å²	82	55.6 Å²	55.6	57%	0.573	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153.3	114.9	177.6	-165.2	0	0	0	0	109.4	K304	K304-S307 VanDerWaalsContact CE-CB 3.47Å; K304-S307 PolarHBondContact NZ-OG 3.48Å
308	G	77.5	Confident	92.2	Very high	38 Å²	38	54.1 Å²	54.1	39%	0.392	29%	0.286	S	S	.	.			trans	-137.4	-168.8	-175	0	0	0	0	0	112.4	G311 K331	G308-G311 PolarHBondContact N-O 3Å; G308-K331 WeakPolarHBondContact O-CE 3.48Å; G308-K331 PolarHBondContact O-NZ 3.41Å
309	E	71.4	Confident	92.2	Very high	148 Å²	148	58 Å²	58	69%	0.692	30%	0.298	S	S	*	.	S	Bend	trans	-61.4	-48.8	172.3	-177.1	152.8	-154.2	0	0	110.9	G311	E309-G311 VanDerWaalsContact C-N 3.27Å; E309-G311 PolarHBondContact O-N 3.17Å
310	F	74.1	Confident	92.2	Very high	61 Å²	61	65 Å²	65	27%	0.268	34%	0.335	S	S	.	.	S	Bend	trans	-69.2	-11.2	-176.6	-48.2	-57.2	0	0	0	115.8	S330 N342	F310-S330 WeakPolarHBondContact O-CA 3.38Å; F310-N342 WeakPolarHBondContact CD1-ND2 3.33Å; F310-N342 WeakPolarHBondContact CE1-ND2 3.31Å
311	G	85.8	Confident	92.1	Very high	5 Å²	5	63.3 Å²	63.3	5%	0.052	33%	0.33	C	S	.	.			trans	159.7	-161	-174.1	0	0	0	0	0	117.1	G308 E309 R329 K331	G308-G311 PolarHBondContact N-O 3Å; E309-G311 VanDerWaalsContact C-N 3.27Å; E309-G311 PolarHBondContact O-N 3.17Å; G311-R329 CarbonylContact C-O 3.5Å; G311-R329 WeakPolarHBondContact CA-O 3.36Å; G311-K331 WeakPolarHBondContact O-CE 3.44Å
312	S	92.4	Very high	92	Very high	17 Å²	17	62 Å²	62	12%	0.119	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	144.8	161.2	-59.2	0	0	0	0	109	K304 G306 F314 R329	K304-S312 PolarHBondContact NZ-OG 2.87Å; G306-S312 WeakPolarHBondContact O-CA 3.43Å; S312-F314 VanDerWaalsContact CB-CE2 3.48Å; S312-R329 PolarHBondContact N-O 3.47Å; S312-R329 PolarHBondContact O-N 2.96Å
313	V	95.3	Very high	91.9	Very high	41 Å²	41	61 Å²	61	25%	0.248	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	130.7	176.4	-170.2	0	0	0	0	108.8	I305 G306 A326 I327 K328	I305-V313 HydrophobicContact CD1-CG1 3.95Å; I305-V313 HydrophobicContact CG1-CB 4.11Å; I305-V313 HydrophobicContact CG1-CG1 3.85Å; I305-V313 WeakPolarHBondContact CG1-O 3.43Å; I305-V313 PolarHBondContact N-O 3.34Å; G306-V313 PolarHBondContact N-O 2.96Å; G306-V313 PolarHBondContact O-N 3.34Å; V313-A326 HydrophobicContact CG1-CB 4.23Å; V313-I327 WeakPolarHBondContact CA-O 3.49Å; V313-K328 HydrophobicContact CG2-CB 4.14Å; V313-K328 HydrophobicContact CG2-CG 4.13Å
314	F	96.9	Very high	91.9	Very high	13 Å²	13	60.3 Å²	60.3	6%	0.057	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	140.8	-177	-60.3	-89.1	0	0	0	110.5	Y295 E301 E303 K304 S312 A326 I327	Y295-F314 WeakPolarHBondContact OH-CB 3.32Å; E301-F314 HydrophobicContact CG-CB 4.15Å; E301-F314 HydrophobicContact CG-CD1 3.8Å; E301-F314 HydrophobicContact CG-CG 4.25Å; E301-F314 WeakPolarHBondContact OE1-CD1 3.4Å; E301-F314 WeakPolarHBondContact OE1-CE1 3.45Å; E303-F314 WeakPolarHBondContact O-CA 3.33Å; K304-F314 HydrophobicContact CB-CD1 3.73Å; K304-F314 HydrophobicContact CB-CE1 3.72Å; K304-F314 HydrophobicContact CD-CE1 3.86Å; K304-F314 HydrophobicContact CD-CZ 4.13Å; K304-F314 HydrophobicContact CG-CD1 4.06Å; K304-F314 HydrophobicContact CG-CE1 3.85Å; K304-F314 HydrophobicContact CG-CZ 4.42Å; S312-F314 VanDerWaalsContact CB-CE2 3.48Å; F314-A326 CarbonylContact O-C 3.58Å; F314-A326 WeakPolarHBondContact O-CA 3.49Å; F314-I327 PolarHBondContact N-O 2.89Å; F314-I327 PolarHBondContact O-N 2.89Å
315	K	97.9	Very high	92	Very high	36 Å²	36	56.2 Å²	56.2	16%	0.157	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	122.3	167.3	179.1	-165.7	-170.6	-178	0	107.6	L302 E303 I305 I324 Y325 Y378	L302-K315 HydrophobicContact CB-CD 4.46Å; L302-K315 WeakPolarHBondContact CB-O 3.45Å; L302-K315 HydrophobicContact CD1-CD 4.12Å; L302-K315 HydrophobicContact CD1-CG 4.28Å; L302-K315 PolarHBondContact N-O 3.04Å; E303-K315 HydrophobicContact CG-CB 3.84Å; E303-K315 HydrophobicContact CG-CD 3.69Å; E303-K315 HydrophobicContact CG-CG 4.46Å; E303-K315 PolarHBondContact O-N 3.48Å; E303-K315 WeakPolarHBondContact OE1-CD 3.46Å; E303-K315 WeakPolarHBondContact OE1-CE 3.43Å; E303-K315 IonicContact OE1-NZ 3.42Å; E303-K315 PolarHBondContact OE1-NZ 3.24Å; I305-K315 HydrophobicContact CD1-CB 4.44Å; I305-K315 HydrophobicContact CG2-CB 3.79Å; K315-I324 HydrophobicContact CD-CG2 4.29Å; K315-I324 HydrophobicContact CG-CG2 3.52Å; K315-Y325 WeakPolarHBondContact CA-O 2.8Å; K315-Y378 HydrophobicContact CB-CD2 4.36Å; K315-Y378 HydrophobicContact CB-CE2 4.14Å; K315-Y378 HydrophobicContact CD-CE1 4.32Å; K315-Y378 HydrophobicContact CD-CE2 3.88Å; K315-Y378 VanDerWaalsContact CE-CZ 3.5Å; K315-Y378 WeakPolarHBondContact CE-OH 3.47Å; K315-Y378 HydrophobicContact CG-CD2 3.92Å; K315-Y378 HydrophobicContact CG-CE2 3.75Å; K315-Y378 HydrophobicContact CG-CG 4.4Å
316	C	98.1	Very high	92.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	140.2	-172.6	-55.5	0	0	0	0	110.4	Y295 F299 H300 I324 Y325 I327	Y295-C316 PolarHBondContact OH-SG 3.45Å; Y295-C316 VanDerWaalsContact OH-SG 3.36Å; F299-C316 HydrophobicContact CB-CB 4.2Å; F299-C316 HydrophobicContact CD1-CB 4.27Å; H300-C316 CarbonylContact O-C 3.55Å; H300-C316 VanDerWaalsContact O-CA 3.28Å; H300-C316 WeakPolarHBondContact O-CA 3.28Å; C316-I324 WeakPolarHBondContact O-CA 3.39Å; C316-Y325 PolarHBondContact N-O 2.91Å; C316-Y325 PolarHBondContact O-N 2.92Å; C316-I327 HydrophobicContact CB-CD1 3.82Å; C316-I327 HydrophobicContact CB-CG1 4.26Å
317	V	98.1	Very high	92.4	Very high	34 Å²	34	52.2 Å²	52.2	21%	0.206	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	127.7	164.2	-176.6	0	0	0	0	107.9	F299 H300 L302 C323 I324	F299-V317 CarbonylContact C-O 3.59Å; F299-V317 WeakPolarHBondContact CA-O 3.46Å; H300-V317 PolarHBondContact N-O 3.01Å; H300-V317 PolarHBondContact O-N 3.23Å; L302-V317 HydrophobicContact CD1-CG2 3.72Å; L302-V317 HydrophobicContact CD2-CG2 4.02Å; L302-V317 HydrophobicContact CG-CG2 3.96Å; V317-C323 WeakPolarHBondContact CA-O 3.41Å; V317-I324 HydrophobicContact CG2-CG1 4.49Å
318	K	97.6	Very high	92.7	Very high	41 Å²	41	49.7 Å²	49.7	18%	0.178	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	126.4	169.3	-177.6	173.2	159.5	-139.4	0	108.8	F299 L320 D321 G322 C323 Y325	F299-K318 HydrophobicContact CD1-CB 3.65Å; F299-K318 HydrophobicContact CD1-CG 4.05Å; F299-K318 HydrophobicContact CE1-CB 3.58Å; F299-K318 HydrophobicContact CE1-CD 3.8Å; F299-K318 HydrophobicContact CE1-CG 3.71Å; F299-K318 HydrophobicContact CZ-CD 4.08Å; F299-K318 HydrophobicContact CZ-CG 4.23Å; K318-L320 VanDerWaalsContact C-N 3.28Å; K318-L320 PolarHBondContact O-N 3.46Å; K318-D321 WeakPolarHBondContact CB-OD1 3.45Å; K318-D321 VanDerWaalsContact CD-OD2 3.28Å; K318-D321 WeakPolarHBondContact CD-OD2 3.32Å; K318-D321 WeakPolarHBondContact CE-OD2 3.29Å; K318-D321 IonicContact NZ-OD2 3.62Å; K318-D321 PolarHBondContact NZ-OD2 3.44Å; K318-G322 WeakPolarHBondContact O-CA 3.35Å; K318-G322 PolarHBondContact O-N 3.36Å; K318-C323 PolarHBondContact N-O 2.86Å; K318-Y325 HydrophobicContact CB-CD2 3.73Å; K318-Y325 HydrophobicContact CB-CE2 3.53Å; K318-Y325 HydrophobicContact CD-CE2 3.97Å; K318-Y325 HydrophobicContact CG-CE2 4.41Å
319	R	96.9	Very high	93.4	Very high	147 Å²	147	52 Å²	52	56%	0.555	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-26.2	-168.6	-64.6	173.6	-173	-83.3	-0.9	113.7	T297 E298 F299	T297-R319 VanDerWaalsContact O-CD 3.27Å; T297-R319 WeakPolarHBondContact O-CD 3.42Å; E298-R319 WeakPolarHBondContact O-CB 3.4Å; E298-R319 WeakPolarHBondContact O-CG 3.38Å; E298-R319 PolarHBondContact O-N 3.49Å; F299-R319 PolarHBondContact O-NE 3.44Å; F299-R319 PolarHBondContact O-NH2 2.88Å
320	L	96.2	Very high	94.1	Very high	152 Å²	152	45.8 Å²	45.8	80%	0.796	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-38.2	-176.3	-175.1	66.1	0	0	0	113.3	K318	K318-L320 VanDerWaalsContact C-N 3.28Å; K318-L320 PolarHBondContact O-N 3.46Å
321	D	95.9	Very high	94.2	Very high	62 Å²	62	48 Å²	48	33%	0.332	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-2.3	-174.6	55.5	35.6	0	0	0	113.7	K318 C323 Y325	K318-D321 WeakPolarHBondContact CB-OD1 3.45Å; K318-D321 VanDerWaalsContact CD-OD2 3.28Å; K318-D321 WeakPolarHBondContact CD-OD2 3.32Å; K318-D321 WeakPolarHBondContact CE-OD2 3.29Å; K318-D321 IonicContact NZ-OD2 3.62Å; K318-D321 PolarHBondContact NZ-OD2 3.44Å; D321-C323 PolarHBondContact O-N 2.91Å; D321-C323 PolarHBondContact O-SG 2.91Å; D321-C323 VanDerWaalsContact O-SG 3.4Å; D321-C323 WeakPolarHBondContact OD1-CB 3.22Å; D321-C323 PolarHBondContact OD1-N 3.29Å; D321-Y325 PolarHBondContact OD2-OH 3.23Å
322	G	94.9	Very high	93.3	Very high	52 Å²	52	52.6 Å²	52.6	54%	0.536	27%	0.269	S	S	.	.			trans	66.4	3.3	-179.2	0	0	0	0	0	114.7	K318	K318-G322 WeakPolarHBondContact O-CA 3.35Å; K318-G322 PolarHBondContact O-N 3.36Å
323	C	95.8	Very high	91.7	Very high	61 Å²	61	55.9 Å²	55.9	41%	0.412	29%	0.29	S	S	.	.			trans	-83.1	152.2	-173.1	-68.1	0	0	0	0	112	V317 K318 D321 Y325	V317-C323 WeakPolarHBondContact CA-O 3.41Å; K318-C323 PolarHBondContact N-O 2.86Å; D321-C323 PolarHBondContact O-N 2.91Å; D321-C323 PolarHBondContact O-SG 2.91Å; D321-C323 VanDerWaalsContact O-SG 3.4Å; D321-C323 WeakPolarHBondContact OD1-CB 3.22Å; D321-C323 PolarHBondContact OD1-N 3.29Å; C323-Y325 HydrophobicContact CB-CD2 4.47Å; C323-Y325 HydrophobicContact CB-CE2 3.6Å; C323-Y325 VanDerWaalsContact O-CD2 3.3Å; C323-Y325 WeakPolarHBondContact O-CD2 3.45Å; C323-Y325 WeakPolarHBondContact O-CE2 3.33Å
324	I	97.1	Very high	89.9	Confident	75 Å²	75	55.5 Å²	55.5	39%	0.385	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	130.5	179.6	-51.1	179.7	0	0	0	110	K315 C316 V317 Y378	K315-I324 HydrophobicContact CD-CG2 4.29Å; K315-I324 HydrophobicContact CG-CG2 3.52Å; C316-I324 WeakPolarHBondContact O-CA 3.39Å; V317-I324 HydrophobicContact CG2-CG1 4.49Å; I324-Y378 HydrophobicContact CB-CD1 4.23Å; I324-Y378 HydrophobicContact CB-CG 4.47Å; I324-Y378 HydrophobicContact CG2-CD1 3.6Å; I324-Y378 HydrophobicContact CG2-CD2 4.35Å; I324-Y378 HydrophobicContact CG2-CE1 4.26Å; I324-Y378 HydrophobicContact CG2-CG 3.64Å; I324-Y378 WeakPolarHBondContact O-CB 3.45Å
325	Y	97.8	Very high	88	Confident	16 Å²	16	59.3 Å²	59.3	6%	0.063	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	156.3	-179.4	-63.8	-84.4	0	0	0	111.6	F299 K315 C316 K318 D321 C323 F363 Q375	F299-Y325 HydrophobicContact CE1-CD2 4.38Å; K315-Y325 WeakPolarHBondContact CA-O 2.8Å; C316-Y325 PolarHBondContact N-O 2.91Å; C316-Y325 PolarHBondContact O-N 2.92Å; K318-Y325 HydrophobicContact CB-CD2 3.73Å; K318-Y325 HydrophobicContact CB-CE2 3.53Å; K318-Y325 HydrophobicContact CD-CE2 3.97Å; K318-Y325 HydrophobicContact CG-CE2 4.41Å; D321-Y325 PolarHBondContact OD2-OH 3.23Å; C323-Y325 HydrophobicContact CB-CD2 4.47Å; C323-Y325 HydrophobicContact CB-CE2 3.6Å; C323-Y325 VanDerWaalsContact O-CD2 3.3Å; C323-Y325 WeakPolarHBondContact O-CD2 3.45Å; C323-Y325 WeakPolarHBondContact O-CE2 3.33Å; Y325-F363 AromaticContact CD1-CD2 3.84Å; Y325-F363 HydrophobicContact CD1-CD2 3.84Å; Y325-F363 AromaticContact CD1-CE2 3.97Å; Y325-F363 HydrophobicContact CD1-CE2 3.97Å; Y325-F363 HydrophobicContact CD1-CG 4.27Å; Y325-F363 AromaticContact CE1-CD1 3.86Å; Y325-F363 HydrophobicContact CE1-CD1 3.86Å; Y325-F363 AromaticContact CE1-CD2 3.62Å; Y325-F363 HydrophobicContact CE1-CD2 3.62Å; Y325-F363 AromaticContact CE1-CE1 3.84Å; Y325-F363 HydrophobicContact CE1-CE1 3.84Å; Y325-F363 AromaticContact CE1-CE2 3.6Å; Y325-F363 HydrophobicContact CE1-CE2 3.6Å; Y325-F363 AromaticContact CE1-CG 3.74Å; Y325-F363 HydrophobicContact CE1-CG 3.74Å; Y325-F363 AromaticContact CE1-CZ 3.71Å; Y325-F363 HydrophobicContact CE1-CZ 3.71Å; Y325-Q375 HydrophobicContact CD1-CG 3.82Å; Y325-Q375 HydrophobicContact CG-CG 3.98Å; Y325-Q375 VanDerWaalsContact CG-NE2 3.32Å
326	A	97.6	Very high	86.3	Confident	15 Å²	15	60.6 Å²	60.6	12%	0.124	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	117.8	166	0	0	0	0	0	108.6	I305 V313 F314 N376	I305-A326 HydrophobicContact CD1-CB 4.17Å; V313-A326 HydrophobicContact CG1-CB 4.23Å; F314-A326 CarbonylContact O-C 3.58Å; F314-A326 WeakPolarHBondContact O-CA 3.49Å; A326-N376 PolarHBondContact N-O 3.1Å; A326-N376 PolarHBondContact O-N 3.38Å
327	I	96.3	Very high	85.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	113	-179.7	-57	-177.1	0	0	0	109.4	Y295 F299 V313 F314 C316 W366 L373 I374 Q375	Y295-I327 HydrophobicContact CD2-CD1 4.06Å; Y295-I327 HydrophobicContact CD2-CG2 4.08Å; Y295-I327 HydrophobicContact CE2-CB 4.09Å; Y295-I327 HydrophobicContact CE2-CD1 3.86Å; Y295-I327 HydrophobicContact CE2-CG2 3.82Å; F299-I327 HydrophobicContact CB-CD1 4.4Å; F299-I327 HydrophobicContact CD1-CD1 3.46Å; F299-I327 VanDerWaalsContact CD1-CD1 3.46Å; F299-I327 HydrophobicContact CD2-CD1 4.05Å; F299-I327 HydrophobicContact CE1-CD1 3.58Å; F299-I327 HydrophobicContact CE2-CD1 4.17Å; F299-I327 HydrophobicContact CG-CD1 3.7Å; F299-I327 HydrophobicContact CZ-CD1 3.94Å; V313-I327 WeakPolarHBondContact CA-O 3.49Å; F314-I327 PolarHBondContact N-O 2.89Å; F314-I327 PolarHBondContact O-N 2.89Å; C316-I327 HydrophobicContact CB-CD1 3.82Å; C316-I327 HydrophobicContact CB-CG1 4.26Å; I327-W366 HydrophobicContact CD1-CH2 4.46Å; I327-L373 HydrophobicContact CG2-CB 4.47Å; I327-L373 HydrophobicContact CG2-CD2 4.43Å; I327-I374 CarbonylContact C-O 3.54Å; I327-I374 WeakPolarHBondContact CA-O 3.06Å; I327-Q375 HydrophobicContact CG1-CB 4.33Å; I327-Q375 HydrophobicContact CG1-CG 4.26Å
328	K	93.4	Very high	83.9	Confident	29 Å²	29	64.5 Å²	64.5	13%	0.126	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	116.6	174.5	-176.7	-176.7	-167.8	178.8	0	107.8	V313 E346 L373 I374 D463	V313-K328 HydrophobicContact CG2-CB 4.14Å; V313-K328 HydrophobicContact CG2-CG 4.13Å; K328-E346 IonicContact NZ-OE1 3.23Å; K328-E346 PolarHBondContact NZ-OE1 3.21Å; K328-E346 VanDerWaalsContact NZ-OE1 3.09Å; K328-E346 IonicContact NZ-OE2 3.08Å; K328-E346 PolarHBondContact NZ-OE2 3.37Å; K328-L373 CarbonylContact O-C 3.51Å; K328-L373 VanDerWaalsContact O-CA 3.31Å; K328-L373 WeakPolarHBondContact O-CA 3.26Å; K328-I374 HydrophobicContact CB-CB 4.42Å; K328-I374 PolarHBondContact N-O 2.86Å; K328-I374 PolarHBondContact O-N 3.47Å; K328-D463 IonicContact NZ-OD1 2.69Å; K328-D463 PolarHBondContact NZ-OD1 3.19Å
329	R	91.4	Very high	82.5	Confident	88 Å²	88	63.9 Å²	63.9	33%	0.332	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.8	172.7	-171.4	173.4	82.9	-153.8	6.3	109.3	G311 S312 H371 L373	G311-R329 CarbonylContact C-O 3.5Å; G311-R329 WeakPolarHBondContact CA-O 3.36Å; S312-R329 PolarHBondContact N-O 3.47Å; S312-R329 PolarHBondContact O-N 2.96Å; R329-H371 HydrophobicContact CG-CB 3.99Å; R329-L373 HydrophobicContact CB-CG 4.25Å; R329-L373 HydrophobicContact CG-CD1 3.93Å; R329-L373 HydrophobicContact CG-CG 3.97Å
330	S	86.7	Confident	81.6	Confident	16 Å²	16	59.2 Å²	59.2	11%	0.112	35%	0.352	C	S	.	.			trans	-61.7	170.2	176.4	75	0	0	0	0	112	F310 K332 L334 H371 M372	F310-S330 WeakPolarHBondContact O-CA 3.38Å; S330-K332 PolarHBondContact OG-O 3.43Å; S330-L334 WeakPolarHBondContact OG-CD1 3.18Å; S330-H371 PolarHBondContact O-CD2 2.82Å; S330-H371 WeakPolarHBondContact OG-CA 3.32Å; S330-M372 PolarHBondContact N-O 3.26Å; S330-M372 PolarHBondContact OG-N 3.31Å
331	K	75.1	Confident	80.7	Confident	108 Å²	108	56.1 Å²	56.1	47%	0.47	33%	0.333	S	S	.	.	S	Bend	trans	-107.1	-12.5	-177.5	-96.6	173.8	178.1	-178.9	0	115.4	G308 G311	G308-K331 WeakPolarHBondContact O-CE 3.48Å; G308-K331 PolarHBondContact O-NZ 3.41Å; G311-K331 WeakPolarHBondContact O-CE 3.44Å
332	K	68.8	Low	80	Confident	101 Å²	101	53.3 Å²	53.3	44%	0.439	32%	0.318	S	S	.	.	S	Bend	trans	-133.1	149	-171.8	-61.1	177.3	-162.6	146	0	109.6	S330 L334 D339	S330-K332 PolarHBondContact OG-O 3.43Å; K332-L334 WeakPolarHBondContact O-CG 3.28Å; K332-D339 WeakPolarHBondContact CD-OD2 3.43Å; K332-D339 WeakPolarHBondContact CE-OD2 2.99Å; K332-D339 IonicContact NZ-OD2 3.52Å; K332-D339 PolarHBondContact NZ-OD2 3.4Å
333	P	57	Low	79.2	Confident	86 Å²	86	51.3 Å²	51.3	56%	0.558	30%	0.297	S	S	*	.			trans	-56.5	138.8	159.1	-28	38.1	0	0	0	112.4	D370	P333-D370 WeakPolarHBondContact CA-O 3.26Å; P333-D370 HydrophobicContact CB-CB 3.65Å; P333-D370 HydrophobicContact CG-CB 4.02Å
334	L	58.1	Low	78.7	Confident	34 Å²	34	52.8 Å²	52.8	18%	0.178	30%	0.3	C	S	.	.			trans	-119.3	107.7	-165.7	-70.4	153	0	0	0	112.2	S330 K332 S337 D339 E340 M372	S330-L334 WeakPolarHBondContact OG-CD1 3.18Å; K332-L334 WeakPolarHBondContact O-CG 3.28Å; L334-S337 WeakPolarHBondContact CD2-OG 3.38Å; L334-D339 HydrophobicContact CD2-CB 3.89Å; L334-E340 HydrophobicContact CB-CB 4.29Å; L334-E340 HydrophobicContact CB-CG 4.12Å; L334-E340 HydrophobicContact CD2-CB 3.6Å; L334-E340 HydrophobicContact CD2-CG 4.27Å; L334-E340 HydrophobicContact CG-CB 4.49Å; L334-M372 HydrophobicContact CD1-CB 3.86Å; L334-M372 HydrophobicContact CD1-CG 3.51Å
335	A	58.1	Low	78.1	Confident	92 Å²	92	51.3 Å²	51.3	76%	0.76	29%	0.29	S	S	*	.	S	Bend	trans	-149.6	110.3	158.1	0	0	0	0	0	109.2	E340	A335-E340 VanDerWaalsContact C-OE2 3.3Å; A335-E340 WeakPolarHBondContact CA-OE2 3.19Å; A335-E340 PolarHBondContact N-OE2 2.89Å
336	G	61.9	Low	77.6	Confident	64 Å²	64	50.8 Å²	50.8	66%	0.66	29%	0.288	S	S	*	.	S	Bend	trans	79.9	13.8	174.2	0	0	0	0	0	116.6	E340	G336-E340 PolarHBondContact N-OE2 3.2Å
337	S	72.9	Confident	77.1	Confident	34 Å²	34	51.7 Å²	51.7	24%	0.238	29%	0.292	C	S	.	.			trans	-96.8	158	-178.2	82.2	0	0	0	0	113.4	L334 D339 E340 Q341	L334-S337 WeakPolarHBondContact CD2-OG 3.38Å; S337-D339 PolarHBondContact O-N 2.97Å; S337-E340 WeakPolarHBondContact O-CA 3.49Å; S337-E340 WeakPolarHBondContact O-CB 3.48Å; S337-E340 PolarHBondContact O-N 3.37Å; S337-E340 PolarHBondContact OG-N 2.91Å; S337-Q341 PolarHBondContact O-N 2.95Å; S337-Q341 PolarHBondContact O-OE1 2.84Å
338	V	71.8	Confident	76.8	Confident	81 Å²	81	57 Å²	57	49%	0.491	31%	0.313	S	S	.	.	H	α-helix	trans	-57.5	-36.7	175.7	-178.2	0	0	0	0	111.5	E340 Q341 N342	V338-E340 PolarHBondContact O-N 3.25Å; V338-Q341 PolarHBondContact O-N 3.12Å; V338-N342 WeakPolarHBondContact O-CB 3.46Å; V338-N342 PolarHBondContact O-N 2.93Å
339	D	69.4	Low	76.5	Confident	28 Å²	28	55.6 Å²	55.6	15%	0.15	31%	0.307	C	S	.	.	H	α-helix	trans	-59.2	-30.7	175.1	-60.9	-52.2	0	0	0	112.2	K332 L334 S337 A343	K332-D339 WeakPolarHBondContact CD-OD2 3.43Å; K332-D339 WeakPolarHBondContact CE-OD2 2.99Å; K332-D339 IonicContact NZ-OD2 3.52Å; K332-D339 PolarHBondContact NZ-OD2 3.4Å; L334-D339 HydrophobicContact CD2-CB 3.89Å; S337-D339 PolarHBondContact O-N 2.97Å; D339-A343 WeakPolarHBondContact O-CB 3.4Å; D339-A343 PolarHBondContact O-N 2.99Å; D339-A343 VanDerWaalsContact O-N 3.08Å
340	E	77	Confident	76.3	Confident	49 Å²	49	51.9 Å²	51.9	23%	0.229	29%	0.293	C	S	.	.	H	α-helix	trans	-75.2	-47.7	176.7	-164.1	-175.8	162.2	0	0	111.5	L334 A335 G336 S337 V338 N342 A343 L344	L334-E340 HydrophobicContact CB-CB 4.29Å; L334-E340 HydrophobicContact CB-CG 4.12Å; L334-E340 HydrophobicContact CD2-CB 3.6Å; L334-E340 HydrophobicContact CD2-CG 4.27Å; L334-E340 HydrophobicContact CG-CB 4.49Å; A335-E340 VanDerWaalsContact C-OE2 3.3Å; A335-E340 WeakPolarHBondContact CA-OE2 3.19Å; A335-E340 PolarHBondContact N-OE2 2.89Å; G336-E340 PolarHBondContact N-OE2 3.2Å; S337-E340 WeakPolarHBondContact O-CA 3.49Å; S337-E340 WeakPolarHBondContact O-CB 3.48Å; S337-E340 PolarHBondContact O-N 3.37Å; S337-E340 PolarHBondContact OG-N 2.91Å; V338-E340 PolarHBondContact O-N 3.25Å; E340-N342 PolarHBondContact O-N 3.48Å; E340-A343 PolarHBondContact O-N 3.42Å; E340-L344 HydrophobicContact CG-CD1 4.1Å; E340-L344 HydrophobicContact CG-CG 4.49Å; E340-L344 WeakPolarHBondContact O-CB 3.42Å; E340-L344 VanDerWaalsContact O-CG 3.29Å; E340-L344 WeakPolarHBondContact O-CG 3.33Å; E340-L344 PolarHBondContact O-N 3.46Å
341	Q	78.7	Confident	76.2	Confident	87 Å²	87	55 Å²	55	41%	0.407	32%	0.32	S	S	.	.	H	α-helix	trans	-60.4	-36.9	174.7	-71.3	107.4	35.3	0	0	111	S337 V338 L344 R345	S337-Q341 PolarHBondContact O-N 2.95Å; S337-Q341 PolarHBondContact O-OE1 2.84Å; V338-Q341 PolarHBondContact O-N 3.12Å; Q341-L344 PolarHBondContact O-N 3.05Å; Q341-R345 WeakPolarHBondContact O-CB 3.14Å; Q341-R345 VanDerWaalsContact O-CG 3.25Å; Q341-R345 WeakPolarHBondContact O-CG 3.35Å; Q341-R345 PolarHBondContact O-N 2.89Å
342	N	80	Confident	76.9	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-64.4	-46.6	175.8	-155.5	31.2	0	0	0	112.3	F310 V338 E340 R345 E346 G465	F310-N342 WeakPolarHBondContact CD1-ND2 3.33Å; F310-N342 WeakPolarHBondContact CE1-ND2 3.31Å; V338-N342 WeakPolarHBondContact O-CB 3.46Å; V338-N342 PolarHBondContact O-N 2.93Å; E340-N342 PolarHBondContact O-N 3.48Å; N342-R345 PolarHBondContact O-N 3.36Å; N342-R345 PolarHBondContact OD1-NH2 3.4Å; N342-E346 PolarHBondContact O-N 2.78Å; N342-G465 WeakPolarHBondContact OD1-CA 3.34Å; N342-G465 PolarHBondContact OD1-O 2.86Å
343	A	79.3	Confident	77.7	Confident	11 Å²	11	47.3 Å²	47.3	9%	0.091	29%	0.29	C	S	.	.	H	α-helix	trans	-64.8	-39.9	175.8	0	0	0	0	0	112.6	D339 E340 E346 V347 M372	D339-A343 WeakPolarHBondContact O-CB 3.4Å; D339-A343 PolarHBondContact O-N 2.99Å; D339-A343 VanDerWaalsContact O-N 3.08Å; E340-A343 PolarHBondContact O-N 3.42Å; A343-E346 PolarHBondContact O-N 3.24Å; A343-V347 WeakPolarHBondContact O-CG2 3.46Å; A343-V347 PolarHBondContact O-N 3.18Å; A343-M372 HydrophobicContact CB-CB 4.37Å; A343-M372 HydrophobicContact CB-CG 4.45Å
344	L	83.8	Confident	79	Confident	91 Å²	91	45 Å²	45	48%	0.476	28%	0.282	S	S	.	.	H	α-helix	trans	-67.5	-37.4	176.1	-70.6	172.8	0	0	0	112	E340 Q341 Y348	E340-L344 HydrophobicContact CG-CD1 4.1Å; E340-L344 HydrophobicContact CG-CG 4.49Å; E340-L344 WeakPolarHBondContact O-CB 3.42Å; E340-L344 VanDerWaalsContact O-CG 3.29Å; E340-L344 WeakPolarHBondContact O-CG 3.33Å; E340-L344 PolarHBondContact O-N 3.46Å; Q341-L344 PolarHBondContact O-N 3.05Å; L344-Y348 WeakPolarHBondContact O-CB 3.46Å; L344-Y348 PolarHBondContact O-N 3.02Å
345	R	86.1	Confident	80.4	Confident	44 Å²	44	50.5 Å²	50.5	17%	0.166	31%	0.307	C	S	.	.	H	α-helix	trans	-64.1	-43.3	171.4	-75.8	-177	-47.1	-126.5	4.2	111.5	Q341 N342 Y348 A349 G465 E476	Q341-R345 WeakPolarHBondContact O-CB 3.14Å; Q341-R345 VanDerWaalsContact O-CG 3.25Å; Q341-R345 WeakPolarHBondContact O-CG 3.35Å; Q341-R345 PolarHBondContact O-N 2.89Å; N342-R345 PolarHBondContact O-N 3.36Å; N342-R345 PolarHBondContact OD1-NH2 3.4Å; R345-Y348 PolarHBondContact O-N 2.95Å; R345-A349 WeakPolarHBondContact O-CB 3.34Å; R345-A349 PolarHBondContact O-N 2.64Å; R345-G465 WeakPolarHBondContact CB-O 3.42Å; R345-G465 PolarHBondContact NE-O 3.01Å; R345-G465 PolarHBondContact NH2-O 2.67Å; R345-E476 IonicContact CZ-OE2 2.74Å; R345-E476 IonicContact NH1-OE2 2.68Å; R345-E476 PolarHBondContact NH1-OE2 2.69Å; R345-E476 IonicContact NH2-OE2 3.36Å; R345-E476 PolarHBondContact NH2-OE2 3.36Å
346	E	87.3	Confident	82.1	Confident	5 Å²	5	47.9 Å²	47.9	2%	0.023	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-47.1	176.2	-173.8	173.3	-172.2	0	0	111.5	K328 N342 A343 A349 H350 I374 L464	K328-E346 IonicContact NZ-OE1 3.23Å; K328-E346 PolarHBondContact NZ-OE1 3.21Å; K328-E346 VanDerWaalsContact NZ-OE1 3.09Å; K328-E346 IonicContact NZ-OE2 3.08Å; K328-E346 PolarHBondContact NZ-OE2 3.37Å; N342-E346 PolarHBondContact O-N 2.78Å; A343-E346 PolarHBondContact O-N 3.24Å; E346-A349 PolarHBondContact O-N 3.2Å; E346-H350 WeakPolarHBondContact O-CB 3.47Å; E346-H350 PolarHBondContact O-CD2 3.15Å; E346-H350 PolarHBondContact O-N 3.19Å; E346-I374 HydrophobicContact CB-CD1 4.19Å; E346-I374 HydrophobicContact CG-CD1 3.94Å; E346-I374 WeakPolarHBondContact OE2-CD1 3.38Å; E346-L464 HydrophobicContact CG-CB 4.3Å
347	V	86.8	Confident	83.7	Confident	35 Å²	35	48.8 Å²	48.8	21%	0.212	28%	0.275	C	S	.	.	H	α-helix	trans	-64.8	-44.1	176	173.6	0	0	0	0	111.9	A343 H350 A351 A365 I374	A343-V347 WeakPolarHBondContact O-CG2 3.46Å; A343-V347 PolarHBondContact O-N 3.18Å; V347-H350 PolarHBondContact O-N 2.84Å; V347-A351 PolarHBondContact O-N 3.35Å; V347-A365 HydrophobicContact CG2-CB 3.57Å; V347-I374 HydrophobicContact CG2-CD1 4.12Å; V347-I374 HydrophobicContact CG2-CG1 4.29Å
348	Y	88.7	Confident	84.8	Confident	110 Å²	110	48 Å²	48	43%	0.431	27%	0.268	S	S	.	.	H	α-helix	trans	-64.1	-43.3	177.3	175.9	-86.7	0	0	0	111.9	L344 R345 H350 A351 V352 R469	L344-Y348 WeakPolarHBondContact O-CB 3.46Å; L344-Y348 PolarHBondContact O-N 3.02Å; R345-Y348 PolarHBondContact O-N 2.95Å; Y348-H350 VanDerWaalsContact C-N 3.34Å; Y348-H350 PolarHBondContact O-N 3.11Å; Y348-A351 PolarHBondContact O-N 3.44Å; Y348-A351 VanDerWaalsContact O-N 3.15Å; Y348-V352 HydrophobicContact CD1-CG2 4.35Å; Y348-V352 HydrophobicContact CE1-CG2 3.64Å; Y348-V352 HydrophobicContact CE2-CG2 4.27Å; Y348-V352 PolarHBondContact O-N 3.36Å; Y348-V352 VanDerWaalsContact O-N 3.09Å; Y348-V352 WeakPolarHBondContact OH-CG2 3.31Å; Y348-R469 PolarHBondContact OH-NH2 3.15Å
349	A	87.9	Confident	86	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.5	-45.5	176.4	0	0	0	0	0	110.5	R345 E346 A351 V352 L353 L464 V467	R345-A349 WeakPolarHBondContact O-CB 3.34Å; R345-A349 PolarHBondContact O-N 2.64Å; E346-A349 PolarHBondContact O-N 3.2Å; A349-A351 VanDerWaalsContact C-N 3.34Å; A349-A351 PolarHBondContact O-N 3.16Å; A349-V352 PolarHBondContact O-N 3.44Å; A349-L353 HydrophobicContact CB-CD1 4.43Å; A349-L353 WeakPolarHBondContact O-CB 3.46Å; A349-L353 VanDerWaalsContact O-CG 3.27Å; A349-L353 WeakPolarHBondContact O-CG 3.42Å; A349-L353 PolarHBondContact O-N 3.25Å; A349-L464 HydrophobicContact CB-CB 3.98Å; A349-L464 HydrophobicContact CB-CD1 4.09Å; A349-V467 HydrophobicContact CB-CB 3.78Å; A349-V467 HydrophobicContact CB-CG1 3.66Å; A349-V467 HydrophobicContact CB-CG2 4.21Å
350	H	86.2	Confident	87.3	Confident	10 Å²	10	43.6 Å²	43.6	5%	0.046	24%	0.242	C	C	.	.	H	α-helix	trans	-67.2	-28	174.5	-79	-57.3	0	0	0	114.5	E346 V347 Y348 L353 V360 Y362 L464	E346-H350 WeakPolarHBondContact O-CB 3.47Å; E346-H350 PolarHBondContact O-CD2 3.15Å; E346-H350 PolarHBondContact O-N 3.19Å; V347-H350 PolarHBondContact O-N 2.84Å; Y348-H350 VanDerWaalsContact C-N 3.34Å; Y348-H350 PolarHBondContact O-N 3.11Å; H350-L353 CarbonylContact O-C 3.57Å; H350-L353 VanDerWaalsContact O-O 3.07Å; H350-V360 PolarHBondContact CE1-O 2.67Å; H350-V360 VanDerWaalsContact CE1-O 3.29Å; H350-Y362 HydrophobicContact CB-CD1 3.89Å; H350-Y362 HydrophobicContact CB-CD2 3.96Å; H350-Y362 HydrophobicContact CB-CG 3.56Å; H350-Y362 AromaticContact CD2-CD2 3.84Å; H350-Y362 AromaticContact CG-CD2 3.97Å; H350-Y362 AromaticContact CG-CG 3.75Å; H350-Y362 WeakPolarHBondContact ND1-CB 3.44Å; H350-L464 WeakPolarHBondContact CE1-CD1 3.4Å; H350-L464 WeakPolarHBondContact ND1-CD1 3.5Å
351	A	86.1	Confident	88.1	Confident	81 Å²	81	46 Å²	46	67%	0.669	25%	0.249	S	C	*	.	H	α-helix	trans	-71.5	-31	173.7	0	0	0	0	0	112.7	V347 Y348 A349	V347-A351 PolarHBondContact O-N 3.35Å; Y348-A351 PolarHBondContact O-N 3.44Å; Y348-A351 VanDerWaalsContact O-N 3.15Å; A349-A351 VanDerWaalsContact C-N 3.34Å; A349-A351 PolarHBondContact O-N 3.16Å
352	V	88.6	Confident	88.8	Confident	41 Å²	41	44.8 Å²	44.8	25%	0.248	24%	0.241	C	C	.	.	H	α-helix	trans	-83.8	-42	174.3	177.8	0	0	0	0	111.6	Y348 A349 G354 M420 L422	Y348-V352 HydrophobicContact CD1-CG2 4.35Å; Y348-V352 HydrophobicContact CE1-CG2 3.64Å; Y348-V352 HydrophobicContact CE2-CG2 4.27Å; Y348-V352 PolarHBondContact O-N 3.36Å; Y348-V352 VanDerWaalsContact O-N 3.09Å; Y348-V352 WeakPolarHBondContact OH-CG2 3.31Å; A349-V352 PolarHBondContact O-N 3.44Å; V352-G354 PolarHBondContact O-N 2.86Å; V352-G354 VanDerWaalsContact O-N 3.15Å; V352-M420 HydrophobicContact CG1-CB 4.34Å; V352-M420 HydrophobicContact CG1-CE 3.92Å; V352-L422 HydrophobicContact CB-CD1 4.17Å; V352-L422 HydrophobicContact CG1-CD1 3.87Å
353	L	86.7	Confident	89.4	Confident	7 Å²	7	48.3 Å²	48.3	4%	0.037	26%	0.256	C	S	.	.	S	Bend	trans	-84	86	178.4	-63.7	166.4	0	0	0	109.4	A349 H350 Y416 I417 M420 L422 L464	A349-L353 HydrophobicContact CB-CD1 4.43Å; A349-L353 WeakPolarHBondContact O-CB 3.46Å; A349-L353 VanDerWaalsContact O-CG 3.27Å; A349-L353 WeakPolarHBondContact O-CG 3.42Å; A349-L353 PolarHBondContact O-N 3.25Å; H350-L353 CarbonylContact O-C 3.57Å; H350-L353 VanDerWaalsContact O-O 3.07Å; L353-Y416 HydrophobicContact CB-CE1 4.25Å; L353-Y416 HydrophobicContact CD2-CD1 4.12Å; L353-Y416 HydrophobicContact CD2-CE1 3.76Å; L353-I417 HydrophobicContact CD1-CG1 4.17Å; L353-I417 HydrophobicContact CD2-CB 4.37Å; L353-I417 HydrophobicContact CD2-CG1 3.99Å; L353-M420 HydrophobicContact CD2-CB 4.16Å; L353-M420 HydrophobicContact CD2-CG 4.02Å; L353-L422 HydrophobicContact CD1-CD1 4.08Å; L353-L422 HydrophobicContact CD2-CD1 4.08Å; L353-L422 HydrophobicContact CG-CD1 3.85Å; L353-L464 HydrophobicContact CD1-CD1 3.79Å
354	G	82.9	Confident	90	Very high	39 Å²	39	49 Å²	49	40%	0.402	26%	0.26	S	S	.	.			trans	-57.1	-175.9	165.7	0	0	0	0	0	113.6	V352 H356 Y416	V352-G354 PolarHBondContact O-N 2.86Å; V352-G354 VanDerWaalsContact O-N 3.15Å; G354-H356 PolarHBondContact O-N 3.1Å; G354-Y416 WeakPolarHBondContact CA-OH 3.47Å; G354-Y416 PolarHBondContact N-OH 2.78Å; G354-Y416 PolarHBondContact O-OH 3.42Å; G354-Y416 VanDerWaalsContact O-OH 3.13Å
355	Q	88.2	Confident	90.4	Very high	148 Å²	148	45.8 Å²	45.8	69%	0.692	25%	0.247	S	C	*	.			trans	-66.2	123.1	-171	-173.6	177	-14.8	0	0	112.8
356	H	93.9	Very high	90.7	Very high	38 Å²	38	45 Å²	45	18%	0.176	24%	0.244	C	C	.	.			trans	-138.7	139	172.3	-179.4	-102.9	0	0	0	111	G354 H358 V359 R412 Y416	G354-H356 PolarHBondContact O-N 3.1Å; H356-H358 AromaticContact CE1-CD2 3.92Å; H356-H358 PolarHBondContact ND1-N 2.99Å; H356-H358 PolarHBondContact O-N 3.23Å; H356-H358 VanDerWaalsContact O-N 3.09Å; H356-V359 HydrophobicContact CB-CB 4.46Å; H356-V359 HydrophobicContact CB-CG2 4.38Å; H356-V359 PolarHBondContact O-N 3.02Å; H356-V359 VanDerWaalsContact O-N 3.11Å; H356-V359 VanDerWaalsContact O-O 3.05Å; H356-R412 PolarHBondContact CE1-O 2.73Å; H356-Y416 HydrophobicContact CB-CD1 3.44Å; H356-Y416 VanDerWaalsContact CB-CD1 3.44Å; H356-Y416 HydrophobicContact CB-CE1 3.53Å; H356-Y416 HydrophobicContact CB-CG 3.96Å; H356-Y416 AromaticContact CD2-CG 3.88Å; H356-Y416 AromaticContact CG-CD1 3.64Å; H356-Y416 AromaticContact CG-CG 3.74Å
357	S	95	Very high	90.7	Very high	82 Å²	82	48.2 Å²	48.2	57%	0.573	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-27.7	-171.2	-51.2	0	0	0	0	114.8	K460	S357-K460 WeakPolarHBondContact O-CE 3.44Å; S357-K460 VanDerWaalsContact O-CG 3.28Å; S357-K460 WeakPolarHBondContact O-CG 3.3Å; S357-K460 PolarHBondContact O-NZ 2.81Å
358	H	97.1	Very high	90.8	Very high	19 Å²	19	47.8 Å²	47.8	9%	0.088	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	19.7	-178.8	-54.9	-63.6	0	0	0	113.7	H356 Q409 F459 I461	H356-H358 AromaticContact CE1-CD2 3.92Å; H356-H358 PolarHBondContact ND1-N 2.99Å; H356-H358 PolarHBondContact O-N 3.23Å; H356-H358 VanDerWaalsContact O-N 3.09Å; H358-Q409 WeakPolarHBondContact CB-O 3.44Å; H358-Q409 PolarHBondContact CD2-O 2.74Å; H358-Q409 PolarHBondContact CE1-OE1 3.47Å; H358-Q409 VanDerWaalsContact CG-O 3.23Å; H358-Q409 PolarHBondContact ND1-OE1 3.07Å; H358-F459 WeakPolarHBondContact CA-O 3.29Å; H358-F459 PolarHBondContact ND1-O 3.36Å; H358-I461 PolarHBondContact O-N 3.1Å
359	V	96.6	Very high	90.6	Very high	5 Å²	5	48.4 Å²	48.4	3%	0.03	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-123.1	143.5	166.2	179.7	0	0	0	0	107.4	H356 R361 Y416 I417 I461	H356-V359 HydrophobicContact CB-CB 4.46Å; H356-V359 HydrophobicContact CB-CG2 4.38Å; H356-V359 PolarHBondContact O-N 3.02Å; H356-V359 VanDerWaalsContact O-N 3.11Å; H356-V359 VanDerWaalsContact O-O 3.05Å; V359-R361 PolarHBondContact O-N 3.21Å; V359-Y416 HydrophobicContact CG2-CD1 4.07Å; V359-I417 HydrophobicContact CG2-CD1 4.19Å; V359-I417 HydrophobicContact CG2-CG1 4.22Å; V359-I461 CarbonylContact C-O 3.55Å; V359-I461 WeakPolarHBondContact CA-O 3.33Å
360	V	96.1	Very high	90.3	Very high	10 Å²	10	53.8 Å²	53.8	6%	0.061	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-64.6	119.5	176.6	172	0	0	0	0	108.7	H350 Y362 N376 E377 F433 K460 I461	H350-V360 PolarHBondContact CE1-O 2.67Å; H350-V360 VanDerWaalsContact CE1-O 3.29Å; V360-Y362 PolarHBondContact O-N 3.23Å; V360-N376 HydrophobicContact CG1-CB 3.88Å; V360-E377 VanDerWaalsContact CA-OE1 3.27Å; V360-E377 WeakPolarHBondContact CA-OE1 3.16Å; V360-E377 HydrophobicContact CG1-CG 4.02Å; V360-F433 HydrophobicContact CG2-CB 4.25Å; V360-F433 HydrophobicContact CG2-CD2 3.68Å; V360-F433 HydrophobicContact CG2-CE2 4.46Å; V360-F433 HydrophobicContact CG2-CG 4.24Å; V360-K460 HydrophobicContact CG2-CB 3.88Å; V360-I461 WeakPolarHBondContact CG2-O 3.37Å; V360-I461 PolarHBondContact N-O 3.01Å
361	R	93.8	Very high	90.2	Very high	101 Å²	101	55.5 Å²	55.5	38%	0.381	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-68.5	128.2	179.6	178	175.5	179.6	157.9	5.9	110.8	V359 F363 N376 E377	V359-R361 PolarHBondContact O-N 3.21Å; R361-F363 HydrophobicContact CB-CE2 4.37Å; R361-F363 HydrophobicContact CG-CD2 4.37Å; R361-F363 HydrophobicContact CG-CE2 3.87Å; R361-F363 HydrophobicContact CG-CZ 4.04Å; R361-N376 CarbonylContact O-C 3.6Å; R361-N376 WeakPolarHBondContact O-CA 3.41Å; R361-E377 HydrophobicContact CB-CB 4.23Å; R361-E377 HydrophobicContact CB-CG 4.13Å; R361-E377 PolarHBondContact N-OE1 3.23Å; R361-E377 PolarHBondContact O-N 3.31Å
362	Y	93.2	Very high	90.2	Very high	61 Å²	61	53.4 Å²	53.4	24%	0.239	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	151.3	168.5	166.8	-93.9	0	0	0	111.8	H350 V360 S364 A365 I374 N376	H350-Y362 HydrophobicContact CB-CD1 3.89Å; H350-Y362 HydrophobicContact CB-CD2 3.96Å; H350-Y362 HydrophobicContact CB-CG 3.56Å; H350-Y362 AromaticContact CD2-CD2 3.84Å; H350-Y362 AromaticContact CG-CD2 3.97Å; H350-Y362 AromaticContact CG-CG 3.75Å; H350-Y362 WeakPolarHBondContact ND1-CB 3.44Å; V360-Y362 PolarHBondContact O-N 3.23Å; Y362-S364 VanDerWaalsContact CE2-C 3.46Å; Y362-S364 WeakPolarHBondContact CE2-O 3.48Å; Y362-A365 HydrophobicContact CE2-CB 3.9Å; Y362-A365 WeakPolarHBondContact OH-CB 3.4Å; Y362-A365 PolarHBondContact OH-N 2.61Å; Y362-I374 HydrophobicContact CD2-CG2 4.04Å; Y362-I374 HydrophobicContact CE2-CG2 4.12Å; Y362-N376 WeakPolarHBondContact CA-OD1 3.35Å
363	F	92.5	Very high	90.4	Very high	76 Å²	76	51.4 Å²	51.4	33%	0.333	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	-47.1	176.9	-69.8	-93.1	0	0	0	113.3	Y325 R361 Q375 E377	Y325-F363 AromaticContact CD1-CD2 3.84Å; Y325-F363 HydrophobicContact CD1-CD2 3.84Å; Y325-F363 AromaticContact CD1-CE2 3.97Å; Y325-F363 HydrophobicContact CD1-CE2 3.97Å; Y325-F363 HydrophobicContact CD1-CG 4.27Å; Y325-F363 AromaticContact CE1-CD1 3.86Å; Y325-F363 HydrophobicContact CE1-CD1 3.86Å; Y325-F363 AromaticContact CE1-CD2 3.62Å; Y325-F363 HydrophobicContact CE1-CD2 3.62Å; Y325-F363 AromaticContact CE1-CE1 3.84Å; Y325-F363 HydrophobicContact CE1-CE1 3.84Å; Y325-F363 AromaticContact CE1-CE2 3.6Å; Y325-F363 HydrophobicContact CE1-CE2 3.6Å; Y325-F363 AromaticContact CE1-CG 3.74Å; Y325-F363 HydrophobicContact CE1-CG 3.74Å; Y325-F363 AromaticContact CE1-CZ 3.71Å; Y325-F363 HydrophobicContact CE1-CZ 3.71Å; R361-F363 HydrophobicContact CB-CE2 4.37Å; R361-F363 HydrophobicContact CG-CD2 4.37Å; R361-F363 HydrophobicContact CG-CE2 3.87Å; R361-F363 HydrophobicContact CG-CZ 4.04Å; F363-Q375 HydrophobicContact CB-CG 4.14Å; F363-Q375 PolarHBondContact N-O 3.37Å; F363-E377 HydrophobicContact CE2-CB 3.92Å
364	S	93.1	Very high	90.7	Very high	25 Å²	25	51.3 Å²	51.3	18%	0.175	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	153.4	-174.5	-166.8	0	0	0	0	111	R294 Y362 Q375	R294-S364 PolarHBondContact NH1-OG 2.92Å; Y362-S364 VanDerWaalsContact CE2-C 3.46Å; Y362-S364 WeakPolarHBondContact CE2-O 3.48Å; S364-Q375 PolarHBondContact N-O 3Å; S364-Q375 WeakPolarHBondContact O-CB 3.24Å; S364-Q375 PolarHBondContact O-N 3.12Å
365	A	91.9	Very high	91.3	Very high	25 Å²	25	49.7 Å²	49.7	21%	0.207	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	149.7	163.9	0	0	0	0	0	109.6	V347 Y362 L373 I374	V347-A365 HydrophobicContact CG2-CB 3.57Å; Y362-A365 HydrophobicContact CE2-CB 3.9Å; Y362-A365 WeakPolarHBondContact OH-CB 3.4Å; Y362-A365 PolarHBondContact OH-N 2.61Å; A365-L373 CarbonylContact C-O 3.54Å; A365-L373 WeakPolarHBondContact CA-O 3.25Å; A365-L373 WeakPolarHBondContact CB-O 3.37Å; A365-I374 HydrophobicContact CB-CG1 4.08Å
366	W	91.4	Very high	91.7	Very high	26 Å²	26	43.4 Å²	43.4	10%	0.098	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	165.9	176.3	65.7	101.3	0	0	0	110.6	F299 I327 E368 L373 Q375	F299-W366 HydrophobicContact CD2-CH2 4.39Å; F299-W366 AromaticContact CE2-CH2 3.58Å; F299-W366 HydrophobicContact CE2-CH2 3.58Å; F299-W366 HydrophobicContact CE2-CZ2 4.05Å; F299-W366 HydrophobicContact CE2-CZ3 4.46Å; F299-W366 AromaticContact CZ-CH2 3.99Å; F299-W366 HydrophobicContact CZ-CH2 3.99Å; I327-W366 HydrophobicContact CD1-CH2 4.46Å; W366-E368 PolarHBondContact NE1-OE2 3.39Å; W366-L373 HydrophobicContact CD2-CB 4.06Å; W366-L373 HydrophobicContact CE3-CB 4.42Å; W366-L373 HydrophobicContact CH2-CB 4.33Å; W366-L373 HydrophobicContact CH2-CD2 4.47Å; W366-L373 HydrophobicContact CZ2-CB 3.96Å; W366-L373 HydrophobicContact CZ2-CD2 3.59Å; W366-L373 HydrophobicContact CZ2-CG 4.42Å; W366-L373 PolarHBondContact N-O 3.01Å; W366-L373 PolarHBondContact O-N 3.32Å; W366-Q375 HydrophobicContact CZ3-CB 4.04Å
367	A	87.9	Confident	91.7	Very high	73 Å²	73	43.4 Å²	43.4	60%	0.603	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	135.4	168.7	0	0	0	0	0	109.6	H371 M372	A367-H371 VanDerWaalsContact CA-O 3.28Å; A367-H371 WeakPolarHBondContact CA-O 3.41Å; A367-M372 HydrophobicContact CB-SD 3.9Å
368	E	88.1	Confident	91.8	Very high	26 Å²	26	42.2 Å²	42.2	12%	0.121	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	145.1	167	58.9	174.9	-122.2	0	0	109.8	S293 R294 Y295 W366 D370 H371 L373	S293-E368 WeakPolarHBondContact CB-OE1 3.41Å; S293-E368 PolarHBondContact OG-OE1 2.84Å; R294-E368 WeakPolarHBondContact CA-OE2 3.41Å; R294-E368 VanDerWaalsContact CB-OE2 3.31Å; R294-E368 WeakPolarHBondContact CB-OE2 3.46Å; R294-E368 PolarHBondContact N-OE2 3.04Å; Y295-E368 WeakPolarHBondContact CB-OE1 3.43Å; Y295-E368 PolarHBondContact N-OE2 2.88Å; W366-E368 PolarHBondContact NE1-OE2 3.39Å; E368-D370 VanDerWaalsContact C-N 3.25Å; E368-D370 PolarHBondContact O-N 3.17Å; E368-H371 PolarHBondContact N-O 2.68Å; E368-H371 WeakPolarHBondContact O-CA 3.43Å; E368-H371 WeakPolarHBondContact O-CB 3.36Å; E368-H371 PolarHBondContact O-N 2.75Å; E368-L373 HydrophobicContact CG-CD1 3.62Å; E368-L373 HydrophobicContact CG-CD2 4.08Å; E368-L373 HydrophobicContact CG-CG 4.5Å
369	D	84.7	Confident	91.7	Very high	123 Å²	123	41.8 Å²	41.8	66%	0.658	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	42	179.5	-51.3	-27	0	0	0	113.6	H371	D369-H371 PolarHBondContact O-CE1 2.96Å; D369-H371 VanDerWaalsContact O-CE1 3.31Å; D369-H371 PolarHBondContact O-N 2.75Å; D369-H371 VanDerWaalsContact O-N 3.12Å; D369-H371 PolarHBondContact O-ND1 2.69Å
370	D	82.3	Confident	91.6	Very high	113 Å²	113	45.6 Å²	45.6	60%	0.604	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	4.9	-170.2	-65.5	-30.8	0	0	0	116.7	P333 E368	P333-D370 WeakPolarHBondContact CA-O 3.26Å; P333-D370 HydrophobicContact CB-CB 3.65Å; P333-D370 HydrophobicContact CG-CB 4.02Å; E368-D370 VanDerWaalsContact C-N 3.25Å; E368-D370 PolarHBondContact O-N 3.17Å
371	H	84.4	Confident	91.5	Very high	46 Å²	46	45.8 Å²	45.8	21%	0.213	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	143.8	177.1	-60.6	88.3	0	0	0	111.8	R329 S330 A367 E368 D369 L373	R329-H371 HydrophobicContact CG-CB 3.99Å; S330-H371 PolarHBondContact O-CD2 2.82Å; S330-H371 WeakPolarHBondContact OG-CA 3.32Å; A367-H371 VanDerWaalsContact CA-O 3.28Å; A367-H371 WeakPolarHBondContact CA-O 3.41Å; E368-H371 PolarHBondContact N-O 2.68Å; E368-H371 WeakPolarHBondContact O-CA 3.43Å; E368-H371 WeakPolarHBondContact O-CB 3.36Å; E368-H371 PolarHBondContact O-N 2.75Å; D369-H371 PolarHBondContact O-CE1 2.96Å; D369-H371 VanDerWaalsContact O-CE1 3.31Å; D369-H371 PolarHBondContact O-N 2.75Å; D369-H371 VanDerWaalsContact O-N 3.12Å; D369-H371 PolarHBondContact O-ND1 2.69Å; H371-L373 HydrophobicContact CB-CD1 3.99Å; H371-L373 WeakPolarHBondContact O-CD1 3.33Å
372	M	86.9	Confident	91.6	Very high	37 Å²	37	42.3 Å²	42.3	18%	0.182	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	130.9	167.5	-77.4	-66.3	-67.4	0	0	109.6	S330 L334 A343 A367	S330-M372 PolarHBondContact N-O 3.26Å; S330-M372 PolarHBondContact OG-N 3.31Å; L334-M372 HydrophobicContact CD1-CB 3.86Å; L334-M372 HydrophobicContact CD1-CG 3.51Å; A343-M372 HydrophobicContact CB-CB 4.37Å; A343-M372 HydrophobicContact CB-CG 4.45Å; A367-M372 HydrophobicContact CB-SD 3.9Å
373	L	92.3	Very high	91.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	132.4	176.9	-73.1	74.9	0	0	0	109.5	Y295 I327 K328 R329 A365 W366 E368 H371	Y295-L373 HydrophobicContact CD2-CD2 3.8Å; Y295-L373 HydrophobicContact CG-CD2 3.91Å; I327-L373 HydrophobicContact CG2-CB 4.47Å; I327-L373 HydrophobicContact CG2-CD2 4.43Å; K328-L373 CarbonylContact O-C 3.51Å; K328-L373 VanDerWaalsContact O-CA 3.31Å; K328-L373 WeakPolarHBondContact O-CA 3.26Å; R329-L373 HydrophobicContact CB-CG 4.25Å; R329-L373 HydrophobicContact CG-CD1 3.93Å; R329-L373 HydrophobicContact CG-CG 3.97Å; A365-L373 CarbonylContact C-O 3.54Å; A365-L373 WeakPolarHBondContact CA-O 3.25Å; A365-L373 WeakPolarHBondContact CB-O 3.37Å; W366-L373 HydrophobicContact CD2-CB 4.06Å; W366-L373 HydrophobicContact CE3-CB 4.42Å; W366-L373 HydrophobicContact CH2-CB 4.33Å; W366-L373 HydrophobicContact CH2-CD2 4.47Å; W366-L373 HydrophobicContact CZ2-CB 3.96Å; W366-L373 HydrophobicContact CZ2-CD2 3.59Å; W366-L373 HydrophobicContact CZ2-CG 4.42Å; W366-L373 PolarHBondContact N-O 3.01Å; W366-L373 PolarHBondContact O-N 3.32Å; E368-L373 HydrophobicContact CG-CD1 3.62Å; E368-L373 HydrophobicContact CG-CD2 4.08Å; E368-L373 HydrophobicContact CG-CG 4.5Å; H371-L373 HydrophobicContact CB-CD1 3.99Å; H371-L373 WeakPolarHBondContact O-CD1 3.33Å
374	I	92.7	Very high	92	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	121.6	178.5	-59.7	176.5	0	0	0	108.4	I327 K328 E346 V347 Y362 A365	I327-I374 CarbonylContact C-O 3.54Å; I327-I374 WeakPolarHBondContact CA-O 3.06Å; K328-I374 HydrophobicContact CB-CB 4.42Å; K328-I374 PolarHBondContact N-O 2.86Å; K328-I374 PolarHBondContact O-N 3.47Å; E346-I374 HydrophobicContact CB-CD1 4.19Å; E346-I374 HydrophobicContact CG-CD1 3.94Å; E346-I374 WeakPolarHBondContact OE2-CD1 3.38Å; V347-I374 HydrophobicContact CG2-CD1 4.12Å; V347-I374 HydrophobicContact CG2-CG1 4.29Å; Y362-I374 HydrophobicContact CD2-CG2 4.04Å; Y362-I374 HydrophobicContact CE2-CG2 4.12Å; A365-I374 HydrophobicContact CB-CG1 4.08Å
375	Q	95.5	Very high	92.2	Very high	5 Å²	5	36.4 Å²	36.4	2%	0.023	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	112.8	179.3	-179.1	-163.3	-0.7	0	0	110.5	F299 Y325 I327 F363 S364 W366	F299-Q375 HydrophobicContact CE1-CG 4.37Å; F299-Q375 HydrophobicContact CZ-CG 4.41Å; Y325-Q375 HydrophobicContact CD1-CG 3.82Å; Y325-Q375 HydrophobicContact CG-CG 3.98Å; Y325-Q375 VanDerWaalsContact CG-NE2 3.32Å; I327-Q375 HydrophobicContact CG1-CB 4.33Å; I327-Q375 HydrophobicContact CG1-CG 4.26Å; F363-Q375 HydrophobicContact CB-CG 4.14Å; F363-Q375 PolarHBondContact N-O 3.37Å; S364-Q375 PolarHBondContact N-O 3Å; S364-Q375 WeakPolarHBondContact O-CB 3.24Å; S364-Q375 PolarHBondContact O-N 3.12Å; W366-Q375 HydrophobicContact CZ3-CB 4.04Å
376	N	95.5	Very high	92.4	Very high	15 Å²	15	39.7 Å²	39.7	8%	0.08	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	166.3	178.5	-71.3	-15.2	0	0	0	111.4	A326 V360 R361 Y362	A326-N376 PolarHBondContact N-O 3.1Å; A326-N376 PolarHBondContact O-N 3.38Å; V360-N376 HydrophobicContact CG1-CB 3.88Å; R361-N376 CarbonylContact O-C 3.6Å; R361-N376 WeakPolarHBondContact O-CA 3.41Å; Y362-N376 WeakPolarHBondContact CA-OD1 3.35Å
377	E	94.9	Very high	92.7	Very high	39 Å²	39	39.1 Å²	39.1	18%	0.182	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	143.8	172.1	70.1	-175.7	147.7	0	0	111.4	V360 R361 F363 K460	V360-E377 VanDerWaalsContact CA-OE1 3.27Å; V360-E377 WeakPolarHBondContact CA-OE1 3.16Å; V360-E377 HydrophobicContact CG1-CG 4.02Å; R361-E377 HydrophobicContact CB-CB 4.23Å; R361-E377 HydrophobicContact CB-CG 4.13Å; R361-E377 PolarHBondContact N-OE1 3.23Å; R361-E377 PolarHBondContact O-N 3.31Å; F363-E377 HydrophobicContact CE2-CB 3.92Å; E377-K460 WeakPolarHBondContact OE1-CD 3.31Å; E377-K460 WeakPolarHBondContact OE1-CE 3.35Å; E377-K460 IonicContact OE1-NZ 3.55Å; E377-K460 PolarHBondContact OE1-NZ 3.18Å; E377-K460 IonicContact OE2-NZ 3.17Å; E377-K460 PolarHBondContact OE2-NZ 3.25Å
378	Y	96.5	Very high	93.1	Very high	56 Å²	56	37.1 Å²	37.1	22%	0.22	21%	0.207	C	C	.	.			trans	-85.2	117.8	173.8	176.7	-108.7	0	0	0	111.4	I305 K315 I324 N380	I305-Y378 HydrophobicContact CD1-CD2 4.18Å; I305-Y378 HydrophobicContact CD1-CE2 4.05Å; K315-Y378 HydrophobicContact CB-CD2 4.36Å; K315-Y378 HydrophobicContact CB-CE2 4.14Å; K315-Y378 HydrophobicContact CD-CE1 4.32Å; K315-Y378 HydrophobicContact CD-CE2 3.88Å; K315-Y378 VanDerWaalsContact CE-CZ 3.5Å; K315-Y378 WeakPolarHBondContact CE-OH 3.47Å; K315-Y378 HydrophobicContact CG-CD2 3.92Å; K315-Y378 HydrophobicContact CG-CE2 3.75Å; K315-Y378 HydrophobicContact CG-CG 4.4Å; I324-Y378 HydrophobicContact CB-CD1 4.23Å; I324-Y378 HydrophobicContact CB-CG 4.47Å; I324-Y378 HydrophobicContact CG2-CD1 3.6Å; I324-Y378 HydrophobicContact CG2-CD2 4.35Å; I324-Y378 HydrophobicContact CG2-CE1 4.26Å; I324-Y378 HydrophobicContact CG2-CG 3.64Å; I324-Y378 WeakPolarHBondContact O-CB 3.45Å; Y378-N380 HydrophobicContact CD1-CB 4.3Å; Y378-N380 HydrophobicContact CE1-CB 3.79Å
379	C	96.2	Very high	93.5	Very high	10 Å²	10	39.6 Å²	39.6	7%	0.068	23%	0.227	C	C	.	.			trans	-90.4	101.8	173.2	-70.8	0	0	0	0	110.4	G381 G382 F433 I434	C379-G381 PolarHBondContact O-N 3.37Å; C379-G381 VanDerWaalsContact O-N 3.14Å; C379-G382 PolarHBondContact O-N 3.09Å; C379-F433 HydrophobicContact CB-CB 3.67Å; C379-F433 HydrophobicContact CB-CG 4.46Å; C379-I434 CarbonylContact C-O 3.58Å; C379-I434 WeakPolarHBondContact CB-O 3.49Å
380	N	94.1	Very high	94	Very high	85 Å²	85	37.6 Å²	37.6	46%	0.455	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-12.7	-173.7	66.4	-20.4	0	0	0	115.9	Y378 S435 R436	Y378-N380 HydrophobicContact CD1-CB 4.3Å; Y378-N380 HydrophobicContact CE1-CB 3.79Å; N380-S435 WeakPolarHBondContact OD1-CA 3.36Å; N380-R436 PolarHBondContact ND2-O 2.99Å; N380-R436 PolarHBondContact OD1-N 2.68Å
381	G	93.6	Very high	94.6	Very high	15 Å²	15	33.7 Å²	33.7	16%	0.155	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	3.5	176.8	0	0	0	0	0	115	C379 I434	C379-G381 PolarHBondContact O-N 3.37Å; C379-G381 VanDerWaalsContact O-N 3.14Å; G381-I434 WeakPolarHBondContact CA-O 3.48Å; G381-I434 PolarHBondContact N-O 2.98Å
382	G	95.3	Very high	95	Very high	28 Å²	28	38.8 Å²	38.8	29%	0.289	21%	0.211	S	C	.	.			trans	74.5	-159.3	-176.8	0	0	0	0	0	113.2	C379 F433 I434	C379-G382 PolarHBondContact O-N 3.09Å; G382-F433 WeakPolarHBondContact O-CA 3.29Å; G382-I434 PolarHBondContact O-N 2.92Å
383	S	97.3	Very high	95.3	Very high	10 Å²	10	45.2 Å²	45.2	7%	0.07	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-89.1	161.9	170.5	75.1	0	0	0	0	111.9	A385 D386 A387 I432	S383-A385 PolarHBondContact O-N 3.28Å; S383-A385 PolarHBondContact OG-N 2.83Å; S383-D386 WeakPolarHBondContact CA-OD2 3.3Å; S383-D386 VanDerWaalsContact CB-OD2 3.31Å; S383-D386 WeakPolarHBondContact CB-OD2 3.25Å; S383-D386 PolarHBondContact N-OD2 3.39Å; S383-D386 WeakPolarHBondContact O-CB 3.29Å; S383-D386 PolarHBondContact O-N 3.03Å; S383-D386 PolarHBondContact OG-N 3.13Å; S383-D386 PolarHBondContact OG-OD2 2.81Å; S383-A387 PolarHBondContact O-N 3.3Å; S383-I432 CarbonylContact C-O 3.54Å; S383-I432 WeakPolarHBondContact CA-O 3.41Å
384	L	98	Very high	95.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-29.7	170.3	178.2	66.6	0	0	0	111.2	D386 A387 I388 F398 L406 P429 I432 F459 T506	L384-D386 VanDerWaalsContact C-N 3.31Å; L384-D386 PolarHBondContact O-N 3.39Å; L384-A387 PolarHBondContact O-N 3.03Å; L384-I388 HydrophobicContact CD1-CD1 4.23Å; L384-I388 HydrophobicContact CD1-CG1 4.2Å; L384-I388 HydrophobicContact CD2-CD1 4.39Å; L384-I388 HydrophobicContact CG-CD1 3.84Å; L384-I388 HydrophobicContact CG-CG1 4.26Å; L384-I388 WeakPolarHBondContact O-CB 3.42Å; L384-I388 WeakPolarHBondContact O-CG1 3.47Å; L384-I388 PolarHBondContact O-N 3.15Å; L384-F398 HydrophobicContact CD1-CE2 3.82Å; L384-F398 HydrophobicContact CD1-CZ 3.91Å; L384-L406 HydrophobicContact CD1-CD2 4.32Å; L384-L406 HydrophobicContact CD2-CD1 3.88Å; L384-L406 HydrophobicContact CD2-CD2 3.8Å; L384-L406 HydrophobicContact CD2-CG 4.5Å; L384-P429 CarbonylContact C-O 3.5Å; L384-P429 HydrophobicContact CB-CB 4.37Å; L384-P429 WeakPolarHBondContact CB-O 3.27Å; L384-P429 HydrophobicContact CD2-CB 4.38Å; L384-P429 HydrophobicContact CG-CB 4.25Å; L384-P429 PolarHBondContact N-O 2.8Å; L384-I432 HydrophobicContact CB-CB 4.11Å; L384-I432 HydrophobicContact CB-CG2 4.27Å; L384-I432 HydrophobicContact CD2-CB 4.38Å; L384-I432 HydrophobicContact CD2-CD1 4.18Å; L384-I432 HydrophobicContact CD2-CG2 4.42Å; L384-I432 PolarHBondContact N-O 3.11Å; L384-F459 HydrophobicContact CD1-CE1 4.32Å; L384-T506 HydrophobicContact CD2-CG2 3.88Å
385	A	97.4	Very high	95.3	Very high	27 Å²	27	57 Å²	57	22%	0.223	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-39.8	172.5	0	0	0	0	0	112.1	S383 S389 P429	S383-A385 PolarHBondContact O-N 3.28Å; S383-A385 PolarHBondContact OG-N 2.83Å; A385-S389 WeakPolarHBondContact O-CB 3.24Å; A385-S389 PolarHBondContact O-N 3.06Å; A385-S389 PolarHBondContact O-OG 3.42Å; A385-P429 HydrophobicContact CB-CB 3.92Å; A385-P429 PolarHBondContact N-O 3.07Å
386	D	96.2	Very high	95.3	Very high	95 Å²	95	59.4 Å²	59.4	51%	0.508	31%	0.31	S	S	.	.	H	α-helix	trans	-66.6	-45	177.6	-53.5	-51.8	0	0	0	110.7	S383 L384 S389 E390	S383-D386 WeakPolarHBondContact CA-OD2 3.3Å; S383-D386 VanDerWaalsContact CB-OD2 3.31Å; S383-D386 WeakPolarHBondContact CB-OD2 3.25Å; S383-D386 PolarHBondContact N-OD2 3.39Å; S383-D386 WeakPolarHBondContact O-CB 3.29Å; S383-D386 PolarHBondContact O-N 3.03Å; S383-D386 PolarHBondContact OG-N 3.13Å; S383-D386 PolarHBondContact OG-OD2 2.81Å; L384-D386 VanDerWaalsContact C-N 3.31Å; L384-D386 PolarHBondContact O-N 3.39Å; D386-S389 PolarHBondContact O-N 3.26Å; D386-E390 PolarHBondContact O-N 2.93Å
387	A	96.7	Very high	95.2	Very high	14 Å²	14	63.2 Å²	63.2	12%	0.116	32%	0.324	C	S	.	.	H	α-helix	trans	-64.7	-38.8	177.5	0	0	0	0	0	113.1	S383 L384 N391 F398 I434	S383-A387 PolarHBondContact O-N 3.3Å; L384-A387 PolarHBondContact O-N 3.03Å; A387-N391 VanDerWaalsContact O-CB 3.3Å; A387-N391 WeakPolarHBondContact O-CB 3.48Å; A387-N391 PolarHBondContact O-N 3.13Å; A387-F398 HydrophobicContact CB-CE2 4.35Å; A387-F398 HydrophobicContact CB-CZ 3.95Å; A387-I434 HydrophobicContact CB-CD1 3.72Å
388	I	97.2	Very high	95.3	Very high	31 Å²	31	62.4 Å²	62.4	16%	0.159	32%	0.32	C	S	.	.	H	α-helix	trans	-65.4	-41.6	173	-69.6	170.9	0	0	0	110.9	L384 N391 Y392 F398 P429 C509 A510	L384-I388 HydrophobicContact CD1-CD1 4.23Å; L384-I388 HydrophobicContact CD1-CG1 4.2Å; L384-I388 HydrophobicContact CD2-CD1 4.39Å; L384-I388 HydrophobicContact CG-CD1 3.84Å; L384-I388 HydrophobicContact CG-CG1 4.26Å; L384-I388 WeakPolarHBondContact O-CB 3.42Å; L384-I388 WeakPolarHBondContact O-CG1 3.47Å; L384-I388 PolarHBondContact O-N 3.15Å; I388-N391 PolarHBondContact O-N 3.17Å; I388-Y392 WeakPolarHBondContact O-CB 3.48Å; I388-Y392 PolarHBondContact O-N 3.35Å; I388-F398 HydrophobicContact CG1-CE2 4.05Å; I388-P429 HydrophobicContact CD1-CB 4Å; I388-P429 HydrophobicContact CD1-CG 4.07Å; I388-C509 HydrophobicContact CD1-CB 4.09Å; I388-A510 HydrophobicContact CD1-CB 3.96Å; I388-A510 HydrophobicContact CG1-CB 4.33Å
389	S	96.1	Very high	95.2	Very high	77 Å²	77	66.7 Å²	66.7	54%	0.538	34%	0.34	S	S	.	.	H	α-helix	trans	-65.9	-40.7	179.8	-58.8	0	0	0	0	111.9	A385 D386 Y392 R393	A385-S389 WeakPolarHBondContact O-CB 3.24Å; A385-S389 PolarHBondContact O-N 3.06Å; A385-S389 PolarHBondContact O-OG 3.42Å; D386-S389 PolarHBondContact O-N 3.26Å; S389-Y392 PolarHBondContact O-N 3.15Å; S389-R393 PolarHBondContact O-N 3.18Å
390	E	95.4	Very high	95.2	Very high	81 Å²	81	68.2 Å²	68.2	38%	0.379	35%	0.346	S	S	.	.	H	α-helix	trans	-66.4	-44.8	173.5	178.3	58.1	-169.4	0	0	111.7	D386 Y392 R393 I394	D386-E390 PolarHBondContact O-N 2.93Å; E390-Y392 VanDerWaalsContact C-N 3.32Å; E390-Y392 PolarHBondContact O-N 3.25Å; E390-R393 WeakPolarHBondContact O-CB 3.43Å; E390-R393 PolarHBondContact O-N 3.16Å; E390-R393 VanDerWaalsContact O-N 3.08Å; E390-R393 IonicContact OE1-CZ 3.58Å; E390-R393 IonicContact OE1-NE 3.63Å; E390-R393 IonicContact OE1-NH2 2.67Å; E390-R393 PolarHBondContact OE1-NH2 3.35Å; E390-R393 IonicContact OE2-CZ 2.68Å; E390-R393 IonicContact OE2-NE 3.5Å; E390-R393 PolarHBondContact OE2-NE 3.33Å; E390-R393 IonicContact OE2-NH2 2.66Å; E390-R393 PolarHBondContact OE2-NH2 3.14Å; E390-I394 WeakPolarHBondContact O-CG1 3.25Å; E390-I394 PolarHBondContact O-N 3.19Å
391	N	94.6	Very high	95.2	Very high	31 Å²	31	67.8 Å²	67.8	17%	0.166	35%	0.354	C	S	.	.	H	α-helix	trans	-55.5	-46.5	173.7	-85.3	-10.4	0	0	0	111.6	A387 I388 R393 I394 M395 S396 F398	A387-N391 VanDerWaalsContact O-CB 3.3Å; A387-N391 WeakPolarHBondContact O-CB 3.48Å; A387-N391 PolarHBondContact O-N 3.13Å; I388-N391 PolarHBondContact O-N 3.17Å; N391-R393 VanDerWaalsContact C-N 3.32Å; N391-R393 PolarHBondContact O-N 3.36Å; N391-I394 CarbonylContact O-C 3.46Å; N391-I394 WeakPolarHBondContact O-CG1 3.33Å; N391-I394 PolarHBondContact O-N 3.02Å; N391-M395 PolarHBondContact O-N 2.89Å; N391-M395 VanDerWaalsContact O-N 3.08Å; N391-S396 CarbonylContact C-O 3.58Å; N391-S396 VanDerWaalsContact C-O 3.27Å; N391-S396 WeakPolarHBondContact CB-O 3.27Å; N391-S396 PolarHBondContact O-N 3.49Å; N391-S396 VanDerWaalsContact O-O 3.04Å; N391-F398 WeakPolarHBondContact ND2-CD2 3.18Å; N391-F398 WeakPolarHBondContact ND2-CE2 3.24Å
392	Y	92	Very high	95.3	Very high	154 Å²	154	71.3 Å²	71.3	60%	0.604	37%	0.366	S	S	*	.	H	α-helix	trans	-60.6	-39.8	175.7	-162.2	-91	0	0	0	112.1	I388 S389 E390 I394 M395	I388-Y392 WeakPolarHBondContact O-CB 3.48Å; I388-Y392 PolarHBondContact O-N 3.35Å; S389-Y392 PolarHBondContact O-N 3.15Å; E390-Y392 VanDerWaalsContact C-N 3.32Å; E390-Y392 PolarHBondContact O-N 3.25Å; Y392-I394 VanDerWaalsContact C-N 3.35Å; Y392-I394 PolarHBondContact O-N 3.34Å; Y392-M395 PolarHBondContact O-N 3.03Å
393	R	93.9	Very high	95.4	Very high	171 Å²	171	70 Å²	70	65%	0.645	35%	0.352	S	S	*	.	H	α-helix	trans	-64.1	-36.2	176.7	-168.1	-169.7	70.4	78.4	-0	112.9	S389 E390 N391	S389-R393 PolarHBondContact O-N 3.18Å; E390-R393 WeakPolarHBondContact O-CB 3.43Å; E390-R393 PolarHBondContact O-N 3.16Å; E390-R393 VanDerWaalsContact O-N 3.08Å; E390-R393 IonicContact OE1-CZ 3.58Å; E390-R393 IonicContact OE1-NE 3.63Å; E390-R393 IonicContact OE1-NH2 2.67Å; E390-R393 PolarHBondContact OE1-NH2 3.35Å; E390-R393 IonicContact OE2-CZ 2.68Å; E390-R393 IonicContact OE2-NE 3.5Å; E390-R393 PolarHBondContact OE2-NE 3.33Å; E390-R393 IonicContact OE2-NH2 2.66Å; E390-R393 PolarHBondContact OE2-NH2 3.14Å; N391-R393 VanDerWaalsContact C-N 3.32Å; N391-R393 PolarHBondContact O-N 3.36Å
394	I	94.6	Very high	95.3	Very high	88 Å²	88	71.4 Å²	71.4	45%	0.451	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	9.2	179.5	70.2	177.1	0	0	0	113.4	E390 N391 Y392 S396	E390-I394 WeakPolarHBondContact O-CG1 3.25Å; E390-I394 PolarHBondContact O-N 3.19Å; N391-I394 CarbonylContact O-C 3.46Å; N391-I394 WeakPolarHBondContact O-CG1 3.33Å; N391-I394 PolarHBondContact O-N 3.02Å; Y392-I394 VanDerWaalsContact C-N 3.35Å; Y392-I394 PolarHBondContact O-N 3.34Å; I394-S396 PolarHBondContact O-N 2.87Å
395	M	91.3	Very high	95.2	Very high	166 Å²	166	73 Å²	73	82%	0.818	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	36.7	-176.3	-59.8	-61.3	-60.5	0	0	113.7	N391 Y392	N391-M395 PolarHBondContact O-N 2.89Å; N391-M395 VanDerWaalsContact O-N 3.08Å; Y392-M395 PolarHBondContact O-N 3.03Å
396	S	94.1	Very high	95.2	Very high	55 Å²	55	71.8 Å²	71.8	39%	0.385	36%	0.356	S	S	.	.			trans	-115.9	171.9	174.9	-168.7	0	0	0	0	110.7	N391 I394	N391-S396 CarbonylContact C-O 3.58Å; N391-S396 VanDerWaalsContact C-O 3.27Å; N391-S396 WeakPolarHBondContact CB-O 3.27Å; N391-S396 PolarHBondContact O-N 3.49Å; N391-S396 VanDerWaalsContact O-O 3.04Å; I394-S396 PolarHBondContact O-N 2.87Å
397	Y	93.9	Very high	95.3	Very high	94 Å²	94	67.3 Å²	67.3	37%	0.369	33%	0.332	S	S	.	.			trans	-155.6	161.3	174.1	38.4	-106.3	0	0	0	109.7	K399 P535 Q536	Y397-K399 PolarHBondContact O-N 3.37Å; Y397-P535 HydrophobicContact CD1-CG 4.48Å; Y397-Q536 HydrophobicContact CD2-CB 4.16Å; Y397-Q536 VanDerWaalsContact CD2-CD 3.45Å; Y397-Q536 HydrophobicContact CD2-CG 4.22Å; Y397-Q536 HydrophobicContact CE2-CB 3.51Å; Y397-Q536 HydrophobicContact CE2-CG 4.06Å
398	F	96.2	Very high	95.3	Very high	22 Å²	22	66.7 Å²	66.7	10%	0.096	33%	0.326	C	S	.	.			trans	-64.8	130.1	174.9	-70.4	-85.5	0	0	0	109.8	L384 A387 I388 N391 E402 L403 A510 Q536	L384-F398 HydrophobicContact CD1-CE2 3.82Å; L384-F398 HydrophobicContact CD1-CZ 3.91Å; A387-F398 HydrophobicContact CB-CE2 4.35Å; A387-F398 HydrophobicContact CB-CZ 3.95Å; I388-F398 HydrophobicContact CG1-CE2 4.05Å; N391-F398 WeakPolarHBondContact ND2-CD2 3.18Å; N391-F398 WeakPolarHBondContact ND2-CE2 3.24Å; F398-E402 HydrophobicContact CB-CB 4.21Å; F398-E402 HydrophobicContact CD1-CB 3.94Å; F398-L403 HydrophobicContact CB-CD2 3.67Å; F398-L403 HydrophobicContact CB-CG 4.01Å; F398-A510 HydrophobicContact CD2-CB 3.96Å; F398-A510 WeakPolarHBondContact CD2-O 3.49Å; F398-A510 PolarHBondContact N-O 3.49Å; F398-Q536 PolarHBondContact O-NE2 3.38Å; F398-Q536 PolarHBondContact O-OE1 3.18Å
399	K	96.2	Very high	95.3	Very high	147 Å²	147	65.7 Å²	65.7	64%	0.639	32%	0.321	S	S	*	.			trans	-73.5	160.3	176.8	-61.8	175.9	-177.5	174.6	0	110.3	Y397 A401 E402 L403	Y397-K399 PolarHBondContact O-N 3.37Å; K399-A401 PolarHBondContact O-N 3.09Å; K399-A401 VanDerWaalsContact O-N 3.08Å; K399-E402 PolarHBondContact N-OE2 3.29Å; K399-E402 WeakPolarHBondContact O-CA 3.34Å; K399-E402 WeakPolarHBondContact O-CB 3.44Å; K399-E402 PolarHBondContact O-N 3.06Å; K399-L403 WeakPolarHBondContact O-CG 3.41Å; K399-L403 PolarHBondContact O-N 3.23Å
400	E	95.9	Very high	95.5	Very high	42 Å²	42	62 Å²	62	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-50.3	-40	-178.3	-171.7	178.4	143.2	0	0	114.3	E402 L403 K404 L538 S539 F542	E400-E402 VanDerWaalsContact C-N 3.34Å; E400-E402 PolarHBondContact O-N 3.02Å; E400-L403 PolarHBondContact O-N 3.4Å; E400-K404 HydrophobicContact CG-CD 4.03Å; E400-K404 HydrophobicContact CG-CG 4.37Å; E400-K404 WeakPolarHBondContact O-CB 3.42Å; E400-K404 VanDerWaalsContact O-CG 3.25Å; E400-K404 WeakPolarHBondContact O-CG 3.43Å; E400-K404 PolarHBondContact O-N 2.82Å; E400-K404 WeakPolarHBondContact OE1-CE 3.47Å; E400-K404 IonicContact OE1-NZ 2.69Å; E400-K404 PolarHBondContact OE1-NZ 2.94Å; E400-L538 HydrophobicContact CB-CD2 3.87Å; E400-L538 HydrophobicContact CG-CD2 4.12Å; E400-L538 WeakPolarHBondContact OE2-CA 3.28Å; E400-S539 WeakPolarHBondContact OE1-CB 3.36Å; E400-S539 PolarHBondContact OE1-OG 2.95Å; E400-S539 PolarHBondContact OE2-N 2.96Å; E400-F542 HydrophobicContact CG-CD1 3.87Å; E400-F542 HydrophobicContact CG-CE1 4.28Å; E400-F542 HydrophobicContact CG-CG 4.45Å
401	A	93.1	Very high	95.6	Very high	76 Å²	76	58.1 Å²	58.1	63%	0.628	28%	0.277	S	S	*	.	H	α-helix	trans	-62.5	-39.1	177.4	0	0	0	0	0	112.8	K399 D405	K399-A401 PolarHBondContact O-N 3.09Å; K399-A401 VanDerWaalsContact O-N 3.08Å; A401-D405 PolarHBondContact O-N 3.39Å; A401-D405 VanDerWaalsContact O-N 3.07Å
402	E	95	Very high	95.8	Very high	88 Å²	88	60.4 Å²	60.4	41%	0.411	28%	0.284	S	S	.	.	H	α-helix	trans	-74	-38.8	178	-56.8	171.4	113.4	0	0	110.9	F398 K399 E400 K404 D405 L406	F398-E402 HydrophobicContact CB-CB 4.21Å; F398-E402 HydrophobicContact CD1-CB 3.94Å; K399-E402 PolarHBondContact N-OE2 3.29Å; K399-E402 WeakPolarHBondContact O-CA 3.34Å; K399-E402 WeakPolarHBondContact O-CB 3.44Å; K399-E402 PolarHBondContact O-N 3.06Å; E400-E402 VanDerWaalsContact C-N 3.34Å; E400-E402 PolarHBondContact O-N 3.02Å; E402-K404 VanDerWaalsContact C-N 3.34Å; E402-D405 PolarHBondContact O-N 3.47Å; E402-L406 WeakPolarHBondContact O-CB 3.34Å; E402-L406 PolarHBondContact O-N 3.07Å
403	L	97.6	Very high	96.1	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-40.4	173.6	-64.7	173.6	0	0	0	112	F398 K399 E400 L407 V507 A510 A511 L538 F542	F398-L403 HydrophobicContact CB-CD2 3.67Å; F398-L403 HydrophobicContact CB-CG 4.01Å; K399-L403 WeakPolarHBondContact O-CG 3.41Å; K399-L403 PolarHBondContact O-N 3.23Å; E400-L403 PolarHBondContact O-N 3.4Å; L403-L407 WeakPolarHBondContact O-CB 3.48Å; L403-L407 PolarHBondContact O-N 3.47Å; L403-V507 HydrophobicContact CB-CG1 4.16Å; L403-V507 HydrophobicContact CD2-CG1 4.12Å; L403-A510 HydrophobicContact CD2-CB 3.61Å; L403-A511 HydrophobicContact CD1-CB 3.62Å; L403-A511 HydrophobicContact CD2-CB 4.11Å; L403-L538 HydrophobicContact CD1-CD1 4.38Å; L403-L538 HydrophobicContact CD1-CD2 3.86Å; L403-F542 HydrophobicContact CB-CE1 3.81Å; L403-F542 HydrophobicContact CB-CZ 3.81Å; L403-F542 HydrophobicContact CD1-CE1 4.25Å
404	K	96.9	Very high	96.3	Very high	41 Å²	41	44.9 Å²	44.9	18%	0.178	22%	0.224	C	C	.	.	H	α-helix	trans	-65.7	-42.1	174.7	-77.1	174.1	167.4	-179.8	0	112	E400 E402 L407 L408 F542 V568 L569	E400-K404 HydrophobicContact CG-CD 4.03Å; E400-K404 HydrophobicContact CG-CG 4.37Å; E400-K404 WeakPolarHBondContact O-CB 3.42Å; E400-K404 VanDerWaalsContact O-CG 3.25Å; E400-K404 WeakPolarHBondContact O-CG 3.43Å; E400-K404 PolarHBondContact O-N 2.82Å; E400-K404 WeakPolarHBondContact OE1-CE 3.47Å; E400-K404 IonicContact OE1-NZ 2.69Å; E400-K404 PolarHBondContact OE1-NZ 2.94Å; E402-K404 VanDerWaalsContact C-N 3.34Å; K404-L407 PolarHBondContact O-N 3.3Å; K404-L408 VanDerWaalsContact O-CB 3.26Å; K404-L408 WeakPolarHBondContact O-CB 3.27Å; K404-L408 PolarHBondContact O-N 2.75Å; K404-F542 HydrophobicContact CD-CD2 4.48Å; K404-F542 HydrophobicContact CG-CD2 3.78Å; K404-F542 HydrophobicContact CG-CE1 4.42Å; K404-F542 HydrophobicContact CG-CE2 3.58Å; K404-F542 HydrophobicContact CG-CG 4.29Å; K404-F542 HydrophobicContact CG-CZ 3.94Å; K404-V568 WeakPolarHBondContact CD-O 3.37Å; K404-V568 WeakPolarHBondContact CE-O 3.02Å; K404-V568 PolarHBondContact NZ-O 3.18Å; K404-L569 HydrophobicContact CB-CD2 4.13Å; K404-L569 HydrophobicContact CG-CD2 3.93Å
405	D	94.8	Very high	96.5	Very high	34 Å²	34	44.9 Å²	44.9	18%	0.182	22%	0.218	C	C	.	.	H	α-helix	trans	-68.9	-42.3	177.3	-166.5	52	0	0	0	111.9	A401 E402 L407 L408 Q409 R574	A401-D405 PolarHBondContact O-N 3.39Å; A401-D405 VanDerWaalsContact O-N 3.07Å; E402-D405 PolarHBondContact O-N 3.47Å; D405-L407 PolarHBondContact O-N 3.32Å; D405-L408 PolarHBondContact O-N 2.61Å; D405-Q409 WeakPolarHBondContact O-CB 3.46Å; D405-Q409 VanDerWaalsContact O-CG 3.26Å; D405-Q409 WeakPolarHBondContact O-CG 3.28Å; D405-Q409 PolarHBondContact O-N 2.73Å; D405-Q409 PolarHBondContact OD2-NE2 3.37Å; D405-R574 IonicContact OD1-CZ 3.72Å; D405-R574 IonicContact OD1-NH1 2.64Å; D405-R574 PolarHBondContact OD1-NH1 3.36Å; D405-R574 IonicContact OD1-NH2 2.78Å; D405-R574 PolarHBondContact OD1-NH2 3.26Å; D405-R574 IonicContact OD2-NH2 3.4Å
406	L	97.7	Very high	96.8	Very high	1 Å²	1	39 Å²	39	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-52.7	-53.8	169.6	169.6	64.3	0	0	0	111.3	L384 E402 L408 Q409 V410 I432 F459 V507 A510	L384-L406 HydrophobicContact CD1-CD2 4.32Å; L384-L406 HydrophobicContact CD2-CD1 3.88Å; L384-L406 HydrophobicContact CD2-CD2 3.8Å; L384-L406 HydrophobicContact CD2-CG 4.5Å; E402-L406 WeakPolarHBondContact O-CB 3.34Å; E402-L406 PolarHBondContact O-N 3.07Å; L406-L408 VanDerWaalsContact C-N 3.33Å; L406-L408 PolarHBondContact O-N 2.87Å; L406-Q409 PolarHBondContact O-N 2.74Å; L406-V410 HydrophobicContact CD1-CG2 3.75Å; L406-V410 WeakPolarHBondContact O-CB 3.47Å; L406-V410 VanDerWaalsContact O-CG2 3.27Å; L406-V410 WeakPolarHBondContact O-CG2 3.46Å; L406-V410 PolarHBondContact O-N 2.77Å; L406-I432 HydrophobicContact CD1-CG2 4.38Å; L406-F459 HydrophobicContact CB-CD2 4.26Å; L406-F459 HydrophobicContact CB-CE2 3.95Å; L406-F459 HydrophobicContact CB-CZ 4.2Å; L406-F459 HydrophobicContact CD1-CB 4.31Å; L406-F459 HydrophobicContact CD1-CD1 3.64Å; L406-F459 HydrophobicContact CD1-CD2 4.03Å; L406-F459 HydrophobicContact CD1-CE1 3.88Å; L406-F459 HydrophobicContact CD1-CE2 4.24Å; L406-F459 HydrophobicContact CD1-CG 3.72Å; L406-F459 HydrophobicContact CD1-CZ 4.17Å; L406-V507 HydrophobicContact CD2-CG2 4.16Å; L406-V507 HydrophobicContact CG-CG2 4.34Å; L406-A510 HydrophobicContact CD2-CB 3.71Å
407	L	98.4	Very high	97	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.4	-41.8	-179.3	-178.3	55.4	0	0	0	112	L403 K404 D405 G411 L503 V507 F542 L545 L546 M549 L563 L569	L403-L407 WeakPolarHBondContact O-CB 3.48Å; L403-L407 PolarHBondContact O-N 3.47Å; K404-L407 PolarHBondContact O-N 3.3Å; D405-L407 PolarHBondContact O-N 3.32Å; L407-G411 WeakPolarHBondContact O-CA 3.45Å; L407-G411 PolarHBondContact O-N 2.65Å; L407-L503 HydrophobicContact CD1-CD1 4.27Å; L407-L503 HydrophobicContact CD1-CD2 3.74Å; L407-L503 HydrophobicContact CD1-CG 3.69Å; L407-V507 HydrophobicContact CB-CG2 4.03Å; L407-V507 HydrophobicContact CD1-CG2 4.08Å; L407-F542 HydrophobicContact CD2-CE2 3.79Å; L407-F542 HydrophobicContact CD2-CZ 4.46Å; L407-L545 HydrophobicContact CD2-CD2 4.1Å; L407-L546 HydrophobicContact CD2-CD2 4.2Å; L407-M549 HydrophobicContact CD1-CE 3.63Å; L407-M549 HydrophobicContact CD1-SD 4.08Å; L407-M549 HydrophobicContact CD2-SD 4.14Å; L407-L563 HydrophobicContact CD1-CD1 4.27Å; L407-L563 HydrophobicContact CD1-CD2 3.97Å; L407-L563 HydrophobicContact CD2-CD1 4.21Å; L407-L563 HydrophobicContact CG-CD1 4.25Å; L407-L569 HydrophobicContact CD2-CD1 4.02Å; L407-L569 HydrophobicContact CD2-CD2 3.97Å; L407-L569 HydrophobicContact CG-CD1 3.94Å; L407-L569 HydrophobicContact CG-CD2 4.43Å
408	L	97.3	Very high	97.1	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-70.3	-43.1	179.7	179	56.1	0	0	0	112.5	K404 D405 L406 R412 V564 L569	K404-L408 VanDerWaalsContact O-CB 3.26Å; K404-L408 WeakPolarHBondContact O-CB 3.27Å; K404-L408 PolarHBondContact O-N 2.75Å; D405-L408 PolarHBondContact O-N 2.61Å; L406-L408 VanDerWaalsContact C-N 3.33Å; L406-L408 PolarHBondContact O-N 2.87Å; L408-R412 VanDerWaalsContact O-CG 3.24Å; L408-R412 WeakPolarHBondContact O-CG 3.33Å; L408-R412 PolarHBondContact O-N 2.9Å; L408-V564 HydrophobicContact CD1-CB 3.85Å; L408-V564 HydrophobicContact CD1-CG1 4.12Å; L408-L569 HydrophobicContact CB-CB 4.4Å; L408-L569 HydrophobicContact CB-CD1 4.41Å; L408-L569 HydrophobicContact CD2-CB 4.48Å
409	Q	97.3	Very high	97.2	Very high	10 Å²	10	36.1 Å²	36.1	5%	0.047	18%	0.18	C	C	.	.	H	α-helix	trans	-65.2	-49.4	178.4	-73.5	-159.1	46.3	0	0	111.3	H358 D405 L406 R412 G413 V457 I458 F459	H358-Q409 WeakPolarHBondContact CB-O 3.44Å; H358-Q409 PolarHBondContact CD2-O 2.74Å; H358-Q409 PolarHBondContact CE1-OE1 3.47Å; H358-Q409 VanDerWaalsContact CG-O 3.23Å; H358-Q409 PolarHBondContact ND1-OE1 3.07Å; D405-Q409 WeakPolarHBondContact O-CB 3.46Å; D405-Q409 VanDerWaalsContact O-CG 3.26Å; D405-Q409 WeakPolarHBondContact O-CG 3.28Å; D405-Q409 PolarHBondContact O-N 2.73Å; D405-Q409 PolarHBondContact OD2-NE2 3.37Å; L406-Q409 PolarHBondContact O-N 2.74Å; Q409-R412 WeakPolarHBondContact O-CB 3.27Å; Q409-R412 PolarHBondContact O-N 2.95Å; Q409-G413 PolarHBondContact O-N 3.44Å; Q409-G413 VanDerWaalsContact O-N 3.16Å; Q409-V457 PolarHBondContact NE2-O 3.27Å; Q409-I458 VanDerWaalsContact OE1-CA 3.27Å; Q409-F459 HydrophobicContact CB-CB 4.17Å; Q409-F459 HydrophobicContact CB-CD2 4.2Å; Q409-F459 HydrophobicContact CG-CD2 4.39Å
410	V	98.6	Very high	97.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-69.2	-37	179.3	-177.8	0	0	0	0	110.8	L406 R412 G413 L414 I432 F459 I461 L503	L406-V410 HydrophobicContact CD1-CG2 3.75Å; L406-V410 WeakPolarHBondContact O-CB 3.47Å; L406-V410 VanDerWaalsContact O-CG2 3.27Å; L406-V410 WeakPolarHBondContact O-CG2 3.46Å; L406-V410 PolarHBondContact O-N 2.77Å; V410-R412 VanDerWaalsContact C-N 3.28Å; V410-R412 PolarHBondContact O-N 3Å; V410-G413 WeakPolarHBondContact O-CA 3.46Å; V410-G413 PolarHBondContact O-N 3.27Å; V410-L414 PolarHBondContact O-N 2.83Å; V410-I432 HydrophobicContact CG1-CD1 4.01Å; V410-I432 HydrophobicContact CG2-CD1 3.95Å; V410-I432 HydrophobicContact CG2-CG2 4.02Å; V410-F459 HydrophobicContact CG2-CB 3.98Å; V410-I461 HydrophobicContact CG1-CD1 3.94Å; V410-I461 HydrophobicContact CG1-CG1 3.91Å; V410-L503 HydrophobicContact CB-CD1 3.86Å; V410-L503 HydrophobicContact CB-CD2 4.42Å; V410-L503 HydrophobicContact CG1-CD1 3.51Å; V410-L503 HydrophobicContact CG1-CD2 4.13Å; V410-L503 HydrophobicContact CG1-CG 4.46Å
411	G	98.5	Very high	97.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.1	-35.2	171.5	0	0	0	0	0	113.4	L407 R415	L407-G411 WeakPolarHBondContact O-CA 3.45Å; L407-G411 PolarHBondContact O-N 2.65Å; G411-R415 WeakPolarHBondContact O-CB 3.48Å; G411-R415 PolarHBondContact O-N 2.99Å
412	R	98.1	Very high	97.3	Very high	78 Å²	78	30.8 Å²	30.8	29%	0.294	15%	0.154	S	C	.	.	H	α-helix	trans	-67.4	-38.2	171.8	-72.4	163.5	177.7	-172.6	-2.6	111.8	H356 L408 Q409 V410 Y416 V564	H356-R412 PolarHBondContact CE1-O 2.73Å; L408-R412 VanDerWaalsContact O-CG 3.24Å; L408-R412 WeakPolarHBondContact O-CG 3.33Å; L408-R412 PolarHBondContact O-N 2.9Å; Q409-R412 WeakPolarHBondContact O-CB 3.27Å; Q409-R412 PolarHBondContact O-N 2.95Å; V410-R412 VanDerWaalsContact C-N 3.28Å; V410-R412 PolarHBondContact O-N 3Å; R412-Y416 PolarHBondContact O-N 3.03Å; R412-V564 HydrophobicContact CB-CG1 4.41Å; R412-V564 HydrophobicContact CG-CB 4.32Å; R412-V564 HydrophobicContact CG-CG1 3.77Å
413	G	98.1	Very high	97.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.1	-51.9	172.3	0	0	0	0	0	112.2	Q409 V410 R415 Y416 I417	Q409-G413 PolarHBondContact O-N 3.44Å; Q409-G413 VanDerWaalsContact O-N 3.16Å; V410-G413 WeakPolarHBondContact O-CA 3.46Å; V410-G413 PolarHBondContact O-N 3.27Å; G413-R415 PolarHBondContact O-N 2.83Å; G413-Y416 WeakPolarHBondContact O-CB 3.37Å; G413-Y416 PolarHBondContact O-N 2.92Å; G413-Y416 VanDerWaalsContact O-N 3.15Å; G413-I417 WeakPolarHBondContact O-CG1 3.45Å; G413-I417 PolarHBondContact O-N 3.1Å
414	L	98.6	Very high	97.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.6	-43.2	175.8	-73.7	-176.6	0	0	0	112.4	V410 Y416 I417 H418 H424 I427 I461 D499 I500 L503 A560	V410-L414 PolarHBondContact O-N 2.83Å; L414-Y416 PolarHBondContact O-N 2.84Å; L414-I417 PolarHBondContact O-N 3.43Å; L414-I417 VanDerWaalsContact O-N 3.17Å; L414-H418 WeakPolarHBondContact O-CB 3.4Å; L414-H418 PolarHBondContact O-CD2 2.77Å; L414-H418 PolarHBondContact O-N 3.39Å; L414-H424 HydrophobicContact CD2-CB 4.31Å; L414-I427 HydrophobicContact CD2-CD1 3.82Å; L414-I427 HydrophobicContact CD2-CG1 4.03Å; L414-I461 HydrophobicContact CD2-CD1 3.96Å; L414-I461 HydrophobicContact CG-CD1 3.99Å; L414-D499 HydrophobicContact CD1-CB 3.9Å; L414-D499 HydrophobicContact CD2-CB 3.81Å; L414-I500 HydrophobicContact CD1-CD1 4.35Å; L414-L503 HydrophobicContact CD1-CB 4.25Å; L414-L503 HydrophobicContact CD1-CD2 3.68Å; L414-A560 HydrophobicContact CB-CB 3.93Å
415	R	98.3	Very high	97.4	Very high	88 Å²	88	25.4 Å²	25.4	33%	0.332	13%	0.129	S	C	.	.	H	α-helix	trans	-56.2	-39.9	176.4	-179.2	-168.1	66.8	168.6	3.7	111.8	G411 G413 S419 A560 M561	G411-R415 WeakPolarHBondContact O-CB 3.48Å; G411-R415 PolarHBondContact O-N 2.99Å; G413-R415 PolarHBondContact O-N 2.83Å; R415-S419 WeakPolarHBondContact O-CB 3.43Å; R415-S419 PolarHBondContact O-N 2.9Å; R415-S419 PolarHBondContact O-OG 3.16Å; R415-A560 HydrophobicContact CB-CB 3.89Å; R415-M561 HydrophobicContact CG-CB 4.39Å; R415-M561 HydrophobicContact CG-CE 4.08Å; R415-M561 HydrophobicContact CG-SD 4.47Å
416	Y	98	Very high	97.5	Very high	43 Å²	43	24 Å²	24	17%	0.169	12%	0.122	C	C	.	.	H	α-helix	trans	-66.2	-51	175.7	174	-115.2	0	0	0	111.4	L353 G354 H356 V359 R412 G413 L414 H418 S419 M420	L353-Y416 HydrophobicContact CB-CE1 4.25Å; L353-Y416 HydrophobicContact CD2-CD1 4.12Å; L353-Y416 HydrophobicContact CD2-CE1 3.76Å; G354-Y416 WeakPolarHBondContact CA-OH 3.47Å; G354-Y416 PolarHBondContact N-OH 2.78Å; G354-Y416 PolarHBondContact O-OH 3.42Å; G354-Y416 VanDerWaalsContact O-OH 3.13Å; H356-Y416 HydrophobicContact CB-CD1 3.44Å; H356-Y416 VanDerWaalsContact CB-CD1 3.44Å; H356-Y416 HydrophobicContact CB-CE1 3.53Å; H356-Y416 HydrophobicContact CB-CG 3.96Å; H356-Y416 AromaticContact CD2-CG 3.88Å; H356-Y416 AromaticContact CG-CD1 3.64Å; H356-Y416 AromaticContact CG-CG 3.74Å; V359-Y416 HydrophobicContact CG2-CD1 4.07Å; R412-Y416 PolarHBondContact O-N 3.03Å; G413-Y416 WeakPolarHBondContact O-CB 3.37Å; G413-Y416 PolarHBondContact O-N 2.92Å; G413-Y416 VanDerWaalsContact O-N 3.15Å; L414-Y416 PolarHBondContact O-N 2.84Å; Y416-H418 PolarHBondContact O-N 3.49Å; Y416-S419 PolarHBondContact O-N 3.23Å; Y416-S419 VanDerWaalsContact O-N 3.13Å; Y416-S419 PolarHBondContact O-OG 3.44Å; Y416-M420 HydrophobicContact CE2-CG 4.24Å; Y416-M420 PolarHBondContact O-N 3.32Å
417	I	97.5	Very high	97.5	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-56.7	-48.5	178.3	-63.8	167.6	0	0	0	111.2	L353 V359 G413 L414 S419 M420 L422 I461	L353-I417 HydrophobicContact CD1-CG1 4.17Å; L353-I417 HydrophobicContact CD2-CB 4.37Å; L353-I417 HydrophobicContact CD2-CG1 3.99Å; V359-I417 HydrophobicContact CG2-CD1 4.19Å; V359-I417 HydrophobicContact CG2-CG1 4.22Å; G413-I417 WeakPolarHBondContact O-CG1 3.45Å; G413-I417 PolarHBondContact O-N 3.1Å; L414-I417 PolarHBondContact O-N 3.43Å; L414-I417 VanDerWaalsContact O-N 3.17Å; I417-S419 VanDerWaalsContact C-N 3.32Å; I417-S419 PolarHBondContact O-N 3.3Å; I417-M420 PolarHBondContact O-N 3.3Å; I417-M420 VanDerWaalsContact O-N 3.09Å; I417-L422 CarbonylContact C-O 3.48Å; I417-L422 HydrophobicContact CG2-CB 3.83Å; I417-L422 PolarHBondContact O-N 3.13Å; I417-I461 HydrophobicContact CD1-CD1 4.04Å; I417-I461 HydrophobicContact CD1-CG2 4.24Å
418	H	97.8	Very high	97.5	Very high	28 Å²	28	25.4 Å²	25.4	13%	0.13	13%	0.128	C	C	.	.	H	α-helix	trans	-63.5	-34.9	178.4	-62.4	171.9	0	0	0	112.5	L414 Y416 M420 S421 L422 P496 D499	L414-H418 WeakPolarHBondContact O-CB 3.4Å; L414-H418 PolarHBondContact O-CD2 2.77Å; L414-H418 PolarHBondContact O-N 3.39Å; Y416-H418 PolarHBondContact O-N 3.49Å; H418-M420 PolarHBondContact O-N 3.43Å; H418-S421 PolarHBondContact O-N 3.27Å; H418-S421 VanDerWaalsContact O-N 3.1Å; H418-L422 WeakPolarHBondContact CA-O 3.44Å; H418-L422 PolarHBondContact CD2-O 3.46Å; H418-P496 PolarHBondContact CE1-O 2.82Å; H418-P496 VanDerWaalsContact CE1-O 3.23Å; H418-D499 IonicContact CD2-OD2 3.93Å; H418-D499 IonicContact CE1-OD2 2.77Å; H418-D499 IonicContact NE2-OD2 2.63Å; H418-D499 PolarHBondContact NE2-OD2 3.34Å
419	S	96.8	Very high	97.5	Very high	82 Å²	82	25.9 Å²	25.9	57%	0.573	13%	0.131	S	C	*	.	H	α-helix	trans	-67.2	-24.3	175.3	71.1	0	0	0	0	113.5	R415 Y416 I417 S421	R415-S419 WeakPolarHBondContact O-CB 3.43Å; R415-S419 PolarHBondContact O-N 2.9Å; R415-S419 PolarHBondContact O-OG 3.16Å; Y416-S419 PolarHBondContact O-N 3.23Å; Y416-S419 VanDerWaalsContact O-N 3.13Å; Y416-S419 PolarHBondContact O-OG 3.44Å; I417-S419 VanDerWaalsContact C-N 3.32Å; I417-S419 PolarHBondContact O-N 3.3Å; S419-S421 PolarHBondContact O-N 3.4Å
420	M	96.3	Very high	97.5	Very high	78 Å²	78	27.7 Å²	27.7	38%	0.384	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	13.2	173.1	-60.4	-56.6	-66.2	0	0	113.1	V352 L353 Y416 I417 H418 L422	V352-M420 HydrophobicContact CG1-CB 4.34Å; V352-M420 HydrophobicContact CG1-CE 3.92Å; L353-M420 HydrophobicContact CD2-CB 4.16Å; L353-M420 HydrophobicContact CD2-CG 4.02Å; Y416-M420 HydrophobicContact CE2-CG 4.24Å; Y416-M420 PolarHBondContact O-N 3.32Å; I417-M420 PolarHBondContact O-N 3.3Å; I417-M420 VanDerWaalsContact O-N 3.09Å; H418-M420 PolarHBondContact O-N 3.43Å; M420-L422 HydrophobicContact CB-CD1 4.45Å; M420-L422 PolarHBondContact O-N 3.05Å
421	S	95.8	Very high	97.4	Very high	71 Å²	71	28 Å²	28	50%	0.497	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	27	-175.4	-56.6	0	0	0	0	114.9	H418 S419 I470	H418-S421 PolarHBondContact O-N 3.27Å; H418-S421 VanDerWaalsContact O-N 3.1Å; S419-S421 PolarHBondContact O-N 3.4Å; S421-I470 PolarHBondContact O-N 2.76Å
422	L	96.2	Very high	97.4	Very high	4 Å²	4	28 Å²	28	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	161.5	176.5	-64.6	174.6	0	0	0	110.9	V352 L353 I417 H418 M420 V467 T468 R469	V352-L422 HydrophobicContact CB-CD1 4.17Å; V352-L422 HydrophobicContact CG1-CD1 3.87Å; L353-L422 HydrophobicContact CD1-CD1 4.08Å; L353-L422 HydrophobicContact CD2-CD1 4.08Å; L353-L422 HydrophobicContact CG-CD1 3.85Å; I417-L422 CarbonylContact C-O 3.48Å; I417-L422 HydrophobicContact CG2-CB 3.83Å; I417-L422 PolarHBondContact O-N 3.13Å; H418-L422 WeakPolarHBondContact CA-O 3.44Å; H418-L422 PolarHBondContact CD2-O 3.46Å; M420-L422 HydrophobicContact CB-CD1 4.45Å; M420-L422 PolarHBondContact O-N 3.05Å; L422-V467 HydrophobicContact CB-CG1 4.08Å; L422-V467 HydrophobicContact CD1-CG1 4.06Å; L422-V467 HydrophobicContact CD2-CG1 4.04Å; L422-V467 HydrophobicContact CG-CG1 4.28Å; L422-T468 WeakPolarHBondContact CA-O 3.44Å; L422-R469 HydrophobicContact CD2-CG 3.93Å
423	V	97.3	Very high	97.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	152.7	170.3	-74.1	0	0	0	0	109.9	M425 V467 T468 I470 L495 P496	V423-M425 HydrophobicContact CB-CG 4.39Å; V423-M425 HydrophobicContact CB-SD 4.23Å; V423-M425 HydrophobicContact CG2-CG 3.86Å; V423-M425 HydrophobicContact CG2-SD 3.84Å; V423-V467 VanDerWaalsContact O-CA 3.3Å; V423-V467 WeakPolarHBondContact O-CA 3.42Å; V423-T468 HydrophobicContact CG2-CG2 3.69Å; V423-T468 WeakPolarHBondContact CG2-O 3.37Å; V423-T468 PolarHBondContact N-O 3.47Å; V423-T468 PolarHBondContact O-N 3.11Å; V423-I470 HydrophobicContact CG1-CD1 4.27Å; V423-I470 HydrophobicContact CG1-CG1 3.76Å; V423-L495 HydrophobicContact CB-CB 4.37Å; V423-L495 HydrophobicContact CG1-CB 3.92Å; V423-L495 HydrophobicContact CG2-CB 4.02Å; V423-L495 HydrophobicContact CG2-CD1 4.03Å; V423-P496 HydrophobicContact CG1-CB 4.19Å; V423-P496 HydrophobicContact CG1-CG 3.69Å
424	H	97.4	Very high	97.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.146	C	C	.	.			trans	-87.3	-38.4	-173.9	-170.3	-82.8	0	0	0	113.5	L414 D426 I427 I461 G462 D499	L414-H424 HydrophobicContact CD2-CB 4.31Å; H424-D426 PolarHBondContact CE1-O 3.07Å; H424-D426 VanDerWaalsContact ND1-C 3.31Å; H424-D426 PolarHBondContact ND1-N 3.47Å; H424-D426 PolarHBondContact ND1-O 2.94Å; H424-D426 PolarHBondContact O-N 3.29Å; H424-I427 HydrophobicContact CB-CD1 3.86Å; H424-I427 HydrophobicContact CB-CG1 3.92Å; H424-I427 VanDerWaalsContact CG-CD1 3.49Å; H424-I427 WeakPolarHBondContact ND1-CD1 3.37Å; H424-I427 PolarHBondContact ND1-N 2.89Å; H424-I461 WeakPolarHBondContact CD2-CG2 3.32Å; H424-I461 VanDerWaalsContact NE2-CG2 3.29Å; H424-I461 WeakPolarHBondContact NE2-CG2 3.18Å; H424-G462 PolarHBondContact NE2-O 3.38Å; H424-D499 WeakPolarHBondContact CB-OD1 3.36Å; H424-D499 PolarHBondContact N-OD1 2.77Å; H424-D499 PolarHBondContact N-OD2 2.71Å
425	M	96.3	Very high	97.1	Very high	15 Å²	15	28.4 Å²	28.4	7%	0.074	15%	0.154	C	C	.	.	S	Bend	trans	65	-21.7	176.9	-58.7	-57.2	-62.3	0	0	117.1	V423 H466 T468 V475 V487 L495 D499	V423-M425 HydrophobicContact CB-CG 4.39Å; V423-M425 HydrophobicContact CB-SD 4.23Å; V423-M425 HydrophobicContact CG2-CG 3.86Å; V423-M425 HydrophobicContact CG2-SD 3.84Å; M425-H466 HydrophobicContact CB-CB 4.06Å; M425-T468 HydrophobicContact CG-CG2 4.24Å; M425-V475 HydrophobicContact CE-CG1 3.92Å; M425-V475 HydrophobicContact CE-CG2 4.27Å; M425-V487 HydrophobicContact CE-CG1 3.69Å; M425-V487 HydrophobicContact CE-CG2 4.23Å; M425-L495 HydrophobicContact CE-CD2 3.81Å; M425-L495 HydrophobicContact SD-CB 4.22Å; M425-L495 HydrophobicContact SD-CD1 4.29Å; M425-L495 HydrophobicContact SD-CD2 3.91Å; M425-L495 HydrophobicContact SD-CG 4.37Å; M425-D499 PolarHBondContact N-OD1 3.38Å
426	D	96.2	Very high	96.7	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.021	16%	0.162	C	C	.	.			trans	-126.3	50.9	178.1	-165.6	40.3	0	0	0	113	H424 K428 N431 H466 D479	H424-D426 PolarHBondContact CE1-O 3.07Å; H424-D426 VanDerWaalsContact ND1-C 3.31Å; H424-D426 PolarHBondContact ND1-N 3.47Å; H424-D426 PolarHBondContact ND1-O 2.94Å; H424-D426 PolarHBondContact O-N 3.29Å; D426-K428 PolarHBondContact O-N 3.35Å; D426-K428 WeakPolarHBondContact OD1-CE 3.47Å; D426-K428 IonicContact OD1-NZ 2.85Å; D426-K428 PolarHBondContact OD1-NZ 3.35Å; D426-K428 WeakPolarHBondContact OD2-CE 3.21Å; D426-K428 IonicContact OD2-NZ 3.39Å; D426-K428 PolarHBondContact OD2-NZ 2.86Å; D426-N431 PolarHBondContact O-ND2 2.99Å; D426-N431 PolarHBondContact OD2-ND2 3.01Å; D426-H466 HydrophobicContact CB-CB 4.01Å; D426-D479 PolarHBondContact OD1-N 3.04Å; D426-D479 VanDerWaalsContact OD1-N 3.15Å
427	I	98.6	Very high	95.8	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.015	17%	0.171	C	C	.	.			trans	-75.6	117.6	174.3	-65.4	-68.3	0	0	0	110.1	L414 H424 I461 D499 A502 L503	L414-I427 HydrophobicContact CD2-CD1 3.82Å; L414-I427 HydrophobicContact CD2-CG1 4.03Å; H424-I427 HydrophobicContact CB-CD1 3.86Å; H424-I427 HydrophobicContact CB-CG1 3.92Å; H424-I427 VanDerWaalsContact CG-CD1 3.49Å; H424-I427 WeakPolarHBondContact ND1-CD1 3.37Å; H424-I427 PolarHBondContact ND1-N 2.89Å; I427-I461 HydrophobicContact CD1-CD1 4.21Å; I427-I461 HydrophobicContact CD1-CG1 4.43Å; I427-I461 HydrophobicContact CD1-CG2 3.85Å; I427-D499 HydrophobicContact CG1-CB 4.37Å; I427-A502 HydrophobicContact CB-CB 3.92Å; I427-A502 HydrophobicContact CG2-CB 4.31Å; I427-A502 WeakPolarHBondContact O-CB 3.29Å; I427-L503 HydrophobicContact CG2-CB 4.19Å
428	K	98.1	Very high	94	Very high	28 Å²	28	35.7 Å²	35.7	12%	0.122	20%	0.201	C	C	.	.	S	Bend	trans	-161.1	164.3	178.8	61.5	-168.4	178.3	-152.4	0	110.8	D426 S430 N431 I432 D479 F482 T506	D426-K428 PolarHBondContact O-N 3.35Å; D426-K428 WeakPolarHBondContact OD1-CE 3.47Å; D426-K428 IonicContact OD1-NZ 2.85Å; D426-K428 PolarHBondContact OD1-NZ 3.35Å; D426-K428 WeakPolarHBondContact OD2-CE 3.21Å; D426-K428 IonicContact OD2-NZ 3.39Å; D426-K428 PolarHBondContact OD2-NZ 2.86Å; K428-S430 VanDerWaalsContact C-N 3.25Å; K428-S430 VanDerWaalsContact CE-OG 3.23Å; K428-S430 WeakPolarHBondContact CE-OG 3.3Å; K428-S430 WeakPolarHBondContact CG-OG 3.14Å; K428-S430 PolarHBondContact O-N 2.98Å; K428-S430 VanDerWaalsContact O-N 3.11Å; K428-N431 WeakPolarHBondContact CE-ND2 3.49Å; K428-N431 VanDerWaalsContact CE-OD1 3.25Å; K428-N431 WeakPolarHBondContact CE-OD1 3.48Å; K428-N431 HydrophobicContact CG-CB 4.25Å; K428-N431 PolarHBondContact O-N 3.04Å; K428-I432 PolarHBondContact O-N 2.88Å; K428-D479 HydrophobicContact CD-CB 3.72Å; K428-F482 HydrophobicContact CB-CD1 4.35Å; K428-F482 HydrophobicContact CB-CD2 3.64Å; K428-F482 HydrophobicContact CB-CE1 4.4Å; K428-F482 HydrophobicContact CB-CE2 3.68Å; K428-F482 HydrophobicContact CB-CG 4.01Å; K428-F482 HydrophobicContact CB-CZ 4.08Å; K428-T506 WeakPolarHBondContact CA-OG1 3.45Å
429	P	98.4	Very high	91.9	Very high	12 Å²	12	37.9 Å²	37.9	8%	0.078	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-54.3	-30.7	-178.7	-27.4	32.6	0	0	0	116.2	L384 A385 I388 N431 F482 T506 C509	L384-P429 CarbonylContact C-O 3.5Å; L384-P429 HydrophobicContact CB-CB 4.37Å; L384-P429 WeakPolarHBondContact CB-O 3.27Å; L384-P429 HydrophobicContact CD2-CB 4.38Å; L384-P429 HydrophobicContact CG-CB 4.25Å; L384-P429 PolarHBondContact N-O 2.8Å; A385-P429 HydrophobicContact CB-CB 3.92Å; A385-P429 PolarHBondContact N-O 3.07Å; I388-P429 HydrophobicContact CD1-CB 4Å; I388-P429 HydrophobicContact CD1-CG 4.07Å; P429-N431 PolarHBondContact O-N 3.02Å; P429-F482 HydrophobicContact CG-CE1 4.48Å; P429-F482 HydrophobicContact CG-CZ 4.15Å; P429-T506 HydrophobicContact CG-CG2 3.99Å; P429-C509 HydrophobicContact CG-CB 4.14Å
430	S	96.2	Very high	89.6	Confident	48 Å²	48	39.2 Å²	39.2	34%	0.336	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-71.7	-20.1	178.8	57.5	0	0	0	0	113.6	K428	K428-S430 VanDerWaalsContact C-N 3.25Å; K428-S430 VanDerWaalsContact CE-OG 3.23Å; K428-S430 WeakPolarHBondContact CE-OG 3.3Å; K428-S430 WeakPolarHBondContact CG-OG 3.14Å; K428-S430 PolarHBondContact O-N 2.98Å; K428-S430 VanDerWaalsContact O-N 3.11Å
431	N	97.1	Very high	87	Confident	6 Å²	6	39.1 Å²	39.1	3%	0.032	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-106.4	4.8	-173	-61.4	19.2	0	0	0	111.5	D426 K428 P429 G462 D463	D426-N431 PolarHBondContact O-ND2 2.99Å; D426-N431 PolarHBondContact OD2-ND2 3.01Å; K428-N431 WeakPolarHBondContact CE-ND2 3.49Å; K428-N431 VanDerWaalsContact CE-OD1 3.25Å; K428-N431 WeakPolarHBondContact CE-OD1 3.48Å; K428-N431 HydrophobicContact CG-CB 4.25Å; K428-N431 PolarHBondContact O-N 3.04Å; P429-N431 PolarHBondContact O-N 3.02Å; N431-G462 PolarHBondContact O-N 3.49Å; N431-D463 HydrophobicContact CB-CB 4.42Å
432	I	98.4	Very high	84.6	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	116.8	170.6	-61.1	174.5	0	0	0	107.3	S383 L384 L406 V410 K428 F459 K460 T506	S383-I432 CarbonylContact C-O 3.54Å; S383-I432 WeakPolarHBondContact CA-O 3.41Å; L384-I432 HydrophobicContact CB-CB 4.11Å; L384-I432 HydrophobicContact CB-CG2 4.27Å; L384-I432 HydrophobicContact CD2-CB 4.38Å; L384-I432 HydrophobicContact CD2-CD1 4.18Å; L384-I432 HydrophobicContact CD2-CG2 4.42Å; L384-I432 PolarHBondContact N-O 3.11Å; L406-I432 HydrophobicContact CD1-CG2 4.38Å; V410-I432 HydrophobicContact CG1-CD1 4.01Å; V410-I432 HydrophobicContact CG2-CD1 3.95Å; V410-I432 HydrophobicContact CG2-CG2 4.02Å; K428-I432 PolarHBondContact O-N 2.88Å; I432-F459 HydrophobicContact CG2-CB 4.1Å; I432-F459 HydrophobicContact CG2-CD1 4.16Å; I432-K460 CarbonylContact C-O 3.57Å; I432-K460 WeakPolarHBondContact CA-O 3.43Å; I432-T506 HydrophobicContact CD1-CG2 3.52Å
433	F	97.9	Very high	82.2	Confident	61 Å²	61	45 Å²	45	27%	0.268	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	149	-177.5	-63.6	-86.3	0	0	0	111.5	V360 C379 G382 F459 K460	V360-F433 HydrophobicContact CG2-CB 4.25Å; V360-F433 HydrophobicContact CG2-CD2 3.68Å; V360-F433 HydrophobicContact CG2-CE2 4.46Å; V360-F433 HydrophobicContact CG2-CG 4.24Å; C379-F433 HydrophobicContact CB-CB 3.67Å; C379-F433 HydrophobicContact CB-CG 4.46Å; G382-F433 WeakPolarHBondContact O-CA 3.29Å; F433-F459 WeakPolarHBondContact O-CA 3.43Å; F433-K460 PolarHBondContact N-O 2.9Å; F433-K460 PolarHBondContact O-N 3.16Å
434	I	97.3	Very high	79.5	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.015	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	121.3	-176.2	-55.9	179.3	0	0	0	109	C379 G381 G382 A387 R436 V457 F459	C379-I434 CarbonylContact C-O 3.58Å; C379-I434 WeakPolarHBondContact CB-O 3.49Å; G381-I434 WeakPolarHBondContact CA-O 3.48Å; G381-I434 PolarHBondContact N-O 2.98Å; G382-I434 PolarHBondContact O-N 2.92Å; A387-I434 HydrophobicContact CB-CD1 3.72Å; I434-R436 HydrophobicContact CG2-CG 4.03Å; I434-V457 HydrophobicContact CG2-CG1 3.65Å; I434-F459 HydrophobicContact CD1-CE1 4.08Å; I434-F459 HydrophobicContact CG1-CD1 3.98Å; I434-F459 HydrophobicContact CG1-CE1 3.91Å
435	S	94	Very high	77.3	Confident	23 Å²	23	58.2 Å²	58.2	16%	0.161	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.2	166.4	-178.1	0	0	0	0	108.7	N380 I458	N380-S435 WeakPolarHBondContact OD1-CA 3.36Å; S435-I458 PolarHBondContact N-O 3.4Å; S435-I458 PolarHBondContact O-N 3.08Å
436	R	90.1	Very high	75.1	Confident	135 Å²	135	66.3 Å²	66.3	51%	0.509	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	115	176.5	-56.8	-175.4	-170.8	-167.3	3.5	108	N380 I434	N380-R436 PolarHBondContact ND2-O 2.99Å; N380-R436 PolarHBondContact OD1-N 2.68Å; I434-R436 HydrophobicContact CG2-CG 4.03Å
437	T	79.1	Confident	72.8	Confident	59 Å²	59	69.8 Å²	69.8	36%	0.362	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	111.4	172.7	-48	0	0	0	0	108.5	I439 K456	T437-I439 HydrophobicContact CG2-CG1 4.18Å; T437-I439 PolarHBondContact O-N 3.28Å; T437-K456 PolarHBondContact N-O 3.44Å; T437-K456 VanDerWaalsContact N-O 3.16Å; T437-K456 PolarHBondContact O-N 3.37Å
438	S	59.8	Low	70	Confident	89 Å²	89	77 Å²	77	62%	0.622	46%	0.457	S	S	*	.			trans	-69.8	108.7	156.3	52.4	0	0	0	0	106.7	P440	S438-P440 WeakPolarHBondContact O-CD 3.32Å
439	I	52.7	Low	67.6	Low	75 Å²	75	85.6 Å²	85.6	39%	0.385	50%	0.498	S	S	.	.			trans	-81.2	110	167	-60.2	170.9	0	0	0	105.1	T437 N441 K456	T437-I439 HydrophobicContact CG2-CG1 4.18Å; T437-I439 PolarHBondContact O-N 3.28Å; I439-N441 PolarHBondContact O-N 2.77Å; I439-K456 HydrophobicContact CD1-CD 4.44Å
440	P	48.8	Very low	64.9	Low	110 Å²	110	92.6 Å²	92.6	71%	0.714	54%	0.535	S	S	*	.			trans	-65.8	126.3	161.5	28.8	-31.5	0	0	0	107.1	S438 A442	S438-P440 WeakPolarHBondContact O-CD 3.32Å; P440-A442 VanDerWaalsContact C-N 3.29Å; P440-A442 PolarHBondContact O-N 3.27Å
441	N	42.3	Very low	62.3	Low	76 Å²	76	95.5 Å²	95.5	41%	0.406	55%	0.547	S	S	.	.			trans	-65.7	93.8	168.8	-81.3	-0.6	0	0	0	108.4	I439 D451	I439-N441 PolarHBondContact O-N 2.77Å; N441-D451 PolarHBondContact ND2-OD2 2.94Å
442	A	44.9	Very low	60	Low	95 Å²	95	105.8 Å²	105.8	79%	0.785	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	126.5	159.8	0	0	0	0	0	107.5	P440	P440-A442 VanDerWaalsContact C-N 3.29Å; P440-A442 PolarHBondContact O-N 3.27Å
443	A	44.5	Very low	57.4	Low	104 Å²	104	108.4 Å²	108.4	86%	0.86	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	80.8	52.6	-179.3	0	0	0	0	0	118
444	S	42.3	Very low	55.3	Low	74 Å²	74	109 Å²	109	52%	0.517	62%	0.619	S	S	.	*			trans	-135.2	78.4	149.3	56.8	0	0	0	0	109.8	E446	S444-E446 VanDerWaalsContact C-N 3.31Å
445	E	50.7	Low	53.6	Low	203 Å²	203	113.6 Å²	113.6	95%	0.949	64%	0.643	S	S	*	*			trans	-86.6	1.1	171.7	-69.7	-157.1	154.8	0	0	113.2
446	E	49.7	Very low	53.1	Low	184 Å²	184	118.3 Å²	118.3	86%	0.86	66%	0.661	S	S	*	*	S	Bend	trans	-102.4	127.7	167.5	-64.1	-167	163.3	0	0	109.1	S444	S444-E446 VanDerWaalsContact C-N 3.31Å
447	G	48	Very low	53.1	Low	78 Å²	78	114.3 Å²	114.3	80%	0.804	65%	0.652	S	S	*	*			trans	-85.8	123.6	-162.2	0	0	0	0	0	114.2
448	D	39.4	Very low	53.9	Low	153 Å²	153	113.2 Å²	113.2	82%	0.818	64%	0.643	S	S	*	*			trans	-129.4	121.9	152.1	-85.1	-45.1	0	0	0	107.6	D450	D448-D450 PolarHBondContact O-N 2.89Å
449	E	48.1	Very low	55.7	Low	210 Å²	210	109.2 Å²	109.2	98%	0.981	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	22.6	-169.6	-68.7	-165	133.4	0	0	115.4
450	D	41.9	Very low	57.9	Low	158 Å²	158	106.5 Å²	106.5	85%	0.845	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	7.8	-170.5	-111	-23.2	0	0	0	115.9	D448 W452	D448-D450 PolarHBondContact O-N 2.89Å; D450-W452 PolarHBondContact O-N 2.85Å
451	D	42.2	Very low	60.2	Low	110 Å²	110	101.2 Å²	101.2	59%	0.588	57%	0.566	S	S	*	*			trans	-81.7	82.2	174.5	-160.2	16.2	0	0	0	112.4	N441 A453	N441-D451 PolarHBondContact ND2-OD2 2.94Å; D451-A453 PolarHBondContact O-N 2.88Å
452	W	47.6	Very low	62.7	Low	221 Å²	221	97.7 Å²	97.7	84%	0.837	55%	0.547	S	S	*	.			trans	-59.5	102	174.6	178.4	-91.4	0	0	0	111	D450 S454	D450-W452 PolarHBondContact O-N 2.85Å; W452-S454 PolarHBondContact O-N 2.84Å
453	A	44.9	Very low	64.9	Low	56 Å²	56	94.6 Å²	94.6	46%	0.463	52%	0.517	S	S	.	.			trans	-34.2	103.8	178.9	0	0	0	0	0	112.2	D451 N455	D451-A453 PolarHBondContact O-N 2.88Å; A453-N455 VanDerWaalsContact C-N 3.31Å; A453-N455 PolarHBondContact O-N 2.8Å
454	S	52.8	Low	67.2	Low	74 Å²	74	89.6 Å²	89.6	52%	0.517	48%	0.476	S	S	.	.			trans	-73.8	85.3	-167.3	56.6	0	0	0	0	110.7	W452 K456	W452-S454 PolarHBondContact O-N 2.84Å; S454-K456 VanDerWaalsContact C-N 3.3Å; S454-K456 PolarHBondContact O-N 2.95Å
455	N	62.6	Low	69.3	Low	98 Å²	98	86.1 Å²	86.1	52%	0.524	45%	0.451	S	S	.	.			trans	-58.7	87.9	179.7	-85.3	-58.2	0	0	0	110.8	A453 V457	A453-N455 VanDerWaalsContact C-N 3.31Å; A453-N455 PolarHBondContact O-N 2.8Å; N455-V457 PolarHBondContact O-N 2.9Å
456	K	81.9	Confident	71.2	Confident	123 Å²	123	77.1 Å²	77.1	54%	0.535	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	110.8	-173.8	-172.4	175.3	179.8	177.8	0	109.4	T437 I439 S454 I458	T437-K456 PolarHBondContact N-O 3.44Å; T437-K456 VanDerWaalsContact N-O 3.16Å; T437-K456 PolarHBondContact O-N 3.37Å; I439-K456 HydrophobicContact CD1-CD 4.44Å; S454-K456 VanDerWaalsContact C-N 3.3Å; S454-K456 PolarHBondContact O-N 2.95Å; K456-I458 HydrophobicContact CG-CG1 4.45Å
457	V	91.8	Very high	73.3	Confident	51 Å²	51	68.7 Å²	68.7	31%	0.309	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.2	175.9	-173.8	0	0	0	0	109.2	Q409 I434 N455 F459	Q409-V457 PolarHBondContact NE2-O 3.27Å; I434-V457 HydrophobicContact CG2-CG1 3.65Å; N455-V457 PolarHBondContact O-N 2.9Å; V457-F459 HydrophobicContact CG1-CE1 4.12Å; V457-F459 HydrophobicContact CG1-CE2 3.99Å; V457-F459 HydrophobicContact CG1-CZ 3.74Å
458	I	95.4	Very high	75.4	Confident	35 Å²	35	65.5 Å²	65.5	18%	0.179	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	122.8	176.5	-56.8	177.4	0	0	0	109	Q409 S435 K456 K460	Q409-I458 VanDerWaalsContact OE1-CA 3.27Å; S435-I458 PolarHBondContact N-O 3.4Å; S435-I458 PolarHBondContact O-N 3.08Å; K456-I458 HydrophobicContact CG-CG1 4.45Å; I458-K460 HydrophobicContact CG2-CG 4.36Å
459	F	97.6	Very high	78	Confident	6 Å²	6	64 Å²	64	3%	0.026	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	134.5	175	-59.6	-77.7	0	0	0	110.6	H358 L384 L406 Q409 V410 I432 F433 I434 V457	H358-F459 WeakPolarHBondContact CA-O 3.29Å; H358-F459 PolarHBondContact ND1-O 3.36Å; L384-F459 HydrophobicContact CD1-CE1 4.32Å; L406-F459 HydrophobicContact CB-CD2 4.26Å; L406-F459 HydrophobicContact CB-CE2 3.95Å; L406-F459 HydrophobicContact CB-CZ 4.2Å; L406-F459 HydrophobicContact CD1-CB 4.31Å; L406-F459 HydrophobicContact CD1-CD1 3.64Å; L406-F459 HydrophobicContact CD1-CD2 4.03Å; L406-F459 HydrophobicContact CD1-CE1 3.88Å; L406-F459 HydrophobicContact CD1-CE2 4.24Å; L406-F459 HydrophobicContact CD1-CG 3.72Å; L406-F459 HydrophobicContact CD1-CZ 4.17Å; Q409-F459 HydrophobicContact CB-CB 4.17Å; Q409-F459 HydrophobicContact CB-CD2 4.2Å; Q409-F459 HydrophobicContact CG-CD2 4.39Å; V410-F459 HydrophobicContact CG2-CB 3.98Å; I432-F459 HydrophobicContact CG2-CB 4.1Å; I432-F459 HydrophobicContact CG2-CD1 4.16Å; F433-F459 WeakPolarHBondContact O-CA 3.43Å; I434-F459 HydrophobicContact CD1-CE1 4.08Å; I434-F459 HydrophobicContact CG1-CD1 3.98Å; I434-F459 HydrophobicContact CG1-CE1 3.91Å; V457-F459 HydrophobicContact CG1-CE1 4.12Å; V457-F459 HydrophobicContact CG1-CE2 3.99Å; V457-F459 HydrophobicContact CG1-CZ 3.74Å
460	K	98.1	Very high	80.1	Confident	17 Å²	17	56.5 Å²	56.5	7%	0.074	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	129.5	-175.8	-75.6	156.8	170.3	-74.8	0	111.1	S357 V360 E377 I432 F433 I458	S357-K460 WeakPolarHBondContact O-CE 3.44Å; S357-K460 VanDerWaalsContact O-CG 3.28Å; S357-K460 WeakPolarHBondContact O-CG 3.3Å; S357-K460 PolarHBondContact O-NZ 2.81Å; V360-K460 HydrophobicContact CG2-CB 3.88Å; E377-K460 WeakPolarHBondContact OE1-CD 3.31Å; E377-K460 WeakPolarHBondContact OE1-CE 3.35Å; E377-K460 IonicContact OE1-NZ 3.55Å; E377-K460 PolarHBondContact OE1-NZ 3.18Å; E377-K460 IonicContact OE2-NZ 3.17Å; E377-K460 PolarHBondContact OE2-NZ 3.25Å; I432-K460 CarbonylContact C-O 3.57Å; I432-K460 WeakPolarHBondContact CA-O 3.43Å; F433-K460 PolarHBondContact N-O 2.9Å; F433-K460 PolarHBondContact O-N 3.16Å; I458-K460 HydrophobicContact CG2-CG 4.36Å
461	I	98.3	Very high	82.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	129.7	174.2	-57.9	172.9	0	0	0	109.5	H358 V359 V360 V410 L414 I417 H424 I427	H358-I461 PolarHBondContact O-N 3.1Å; V359-I461 CarbonylContact C-O 3.55Å; V359-I461 WeakPolarHBondContact CA-O 3.33Å; V360-I461 WeakPolarHBondContact CG2-O 3.37Å; V360-I461 PolarHBondContact N-O 3.01Å; V410-I461 HydrophobicContact CG1-CD1 3.94Å; V410-I461 HydrophobicContact CG1-CG1 3.91Å; L414-I461 HydrophobicContact CD2-CD1 3.96Å; L414-I461 HydrophobicContact CG-CD1 3.99Å; I417-I461 HydrophobicContact CD1-CD1 4.04Å; I417-I461 HydrophobicContact CD1-CG2 4.24Å; H424-I461 WeakPolarHBondContact CD2-CG2 3.32Å; H424-I461 VanDerWaalsContact NE2-CG2 3.29Å; H424-I461 WeakPolarHBondContact NE2-CG2 3.18Å; I427-I461 HydrophobicContact CD1-CD1 4.21Å; I427-I461 HydrophobicContact CD1-CG1 4.43Å; I427-I461 HydrophobicContact CD1-CG2 3.85Å
462	G	95.1	Very high	84.5	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.01	27%	0.272	C	S	.	.			trans	-139.9	-172.3	174.8	0	0	0	0	0	112.8	H424 N431	H424-G462 PolarHBondContact NE2-O 3.38Å; N431-G462 PolarHBondContact O-N 3.49Å
463	D	91.1	Very high	86.3	Confident	30 Å²	30	43.4 Å²	43.4	16%	0.16	25%	0.246	C	C	.	.			trans	58.2	66.6	-170.3	-157	20.5	0	0	0	113.2	K328 N431 G465	K328-D463 IonicContact NZ-OD1 2.69Å; K328-D463 PolarHBondContact NZ-OD1 3.19Å; N431-D463 HydrophobicContact CB-CB 4.42Å; D463-G465 PolarHBondContact O-N 3.27Å; D463-G465 VanDerWaalsContact O-N 3.09Å
464	L	90.8	Very high	88.2	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-78.9	16.5	-172.8	-55.8	-169.9	0	0	0	114.3	E346 A349 H350 L353 H466 V467	E346-L464 HydrophobicContact CG-CB 4.3Å; A349-L464 HydrophobicContact CB-CB 3.98Å; A349-L464 HydrophobicContact CB-CD1 4.09Å; H350-L464 WeakPolarHBondContact CE1-CD1 3.4Å; H350-L464 WeakPolarHBondContact ND1-CD1 3.5Å; L353-L464 HydrophobicContact CD1-CD1 3.79Å; L464-H466 PolarHBondContact O-N 2.94Å; L464-V467 HydrophobicContact CB-CG2 3.75Å; L464-V467 HydrophobicContact CD2-CG2 4.04Å; L464-V467 HydrophobicContact CG-CG2 4.39Å; L464-V467 VanDerWaalsContact O-CB 3.27Å; L464-V467 WeakPolarHBondContact O-CB 3.44Å; L464-V467 WeakPolarHBondContact O-CG2 3.36Å; L464-V467 PolarHBondContact O-N 2.79Å; L464-V467 VanDerWaalsContact O-N 3.12Å
465	G	87.7	Confident	89.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-61.1	-39.6	-175.5	0	0	0	0	0	113.8	N342 R345 D463 V467	N342-G465 WeakPolarHBondContact OD1-CA 3.34Å; N342-G465 PolarHBondContact OD1-O 2.86Å; R345-G465 WeakPolarHBondContact CB-O 3.42Å; R345-G465 PolarHBondContact NE-O 3.01Å; R345-G465 PolarHBondContact NH2-O 2.67Å; D463-G465 PolarHBondContact O-N 3.27Å; D463-G465 VanDerWaalsContact O-N 3.09Å; G465-V467 VanDerWaalsContact C-N 3.25Å; G465-V467 PolarHBondContact O-N 3.39Å
466	H	89.9	Confident	90.7	Very high	15 Å²	15	43.9 Å²	43.9	7%	0.069	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-81.8	3.2	178.5	-66.8	-100	0	0	0	113.7	M425 D426 L464 T468 E476	M425-H466 HydrophobicContact CB-CB 4.06Å; D426-H466 HydrophobicContact CB-CB 4.01Å; L464-H466 PolarHBondContact O-N 2.94Å; H466-T468 PolarHBondContact O-N 3.19Å; H466-E476 IonicContact CE1-OE1 2.86Å; H466-E476 PolarHBondContact ND1-O 2.81Å; H466-E476 VanDerWaalsContact ND1-O 3.14Å
467	V	93.9	Very high	91	Very high	7 Å²	7	42.9 Å²	42.9	4%	0.042	23%	0.227	C	C	.	.			trans	-64.3	130.5	-178.9	170.1	0	0	0	0	110.9	A349 L422 V423 L464 G465	A349-V467 HydrophobicContact CB-CB 3.78Å; A349-V467 HydrophobicContact CB-CG1 3.66Å; A349-V467 HydrophobicContact CB-CG2 4.21Å; L422-V467 HydrophobicContact CB-CG1 4.08Å; L422-V467 HydrophobicContact CD1-CG1 4.06Å; L422-V467 HydrophobicContact CD2-CG1 4.04Å; L422-V467 HydrophobicContact CG-CG1 4.28Å; V423-V467 VanDerWaalsContact O-CA 3.3Å; V423-V467 WeakPolarHBondContact O-CA 3.42Å; L464-V467 HydrophobicContact CB-CG2 3.75Å; L464-V467 HydrophobicContact CD2-CG2 4.04Å; L464-V467 HydrophobicContact CG-CG2 4.39Å; L464-V467 VanDerWaalsContact O-CB 3.27Å; L464-V467 WeakPolarHBondContact O-CB 3.44Å; L464-V467 WeakPolarHBondContact O-CG2 3.36Å; L464-V467 PolarHBondContact O-N 2.79Å; L464-V467 VanDerWaalsContact O-N 3.12Å; G465-V467 VanDerWaalsContact C-N 3.25Å; G465-V467 PolarHBondContact O-N 3.39Å
468	T	93.1	Very high	90.8	Very high	11 Å²	11	41.1 Å²	41.1	7%	0.067	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	163.3	-179.9	-156.2	0	0	0	0	111.6	L422 V423 M425 H466 Q474 V475 L495	L422-T468 WeakPolarHBondContact CA-O 3.44Å; V423-T468 HydrophobicContact CG2-CG2 3.69Å; V423-T468 WeakPolarHBondContact CG2-O 3.37Å; V423-T468 PolarHBondContact N-O 3.47Å; V423-T468 PolarHBondContact O-N 3.11Å; M425-T468 HydrophobicContact CG-CG2 4.24Å; H466-T468 PolarHBondContact O-N 3.19Å; T468-Q474 VanDerWaalsContact CB-O 3.32Å; T468-Q474 WeakPolarHBondContact CB-O 3.48Å; T468-Q474 PolarHBondContact OG1-N 3.37Å; T468-Q474 PolarHBondContact OG1-O 3.09Å; T468-V475 HydrophobicContact CG2-CG2 4.29Å; T468-L495 HydrophobicContact CG2-CD1 4.27Å
469	R	93.4	Very high	90.8	Very high	120 Å²	120	41.1 Å²	41.1	45%	0.453	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	140.3	179.4	-70	-175.9	177.9	-159.9	2.3	110.7	Y348 L422 S471 S472 P473	Y348-R469 PolarHBondContact OH-NH2 3.15Å; L422-R469 HydrophobicContact CD2-CG 3.93Å; R469-S471 VanDerWaalsContact C-N 3.34Å; R469-S471 PolarHBondContact O-N 3.35Å; R469-S472 CarbonylContact O-C 3.6Å; R469-P473 WeakPolarHBondContact O-CA 3.3Å
470	I	91.8	Very high	90.8	Very high	54 Å²	54	43 Å²	43	28%	0.277	23%	0.233	S	C	.	.	S	Bend	trans	-62.5	-40.8	176.8	-61.4	169.4	0	0	0	111.6	S421 V423 P496	S421-I470 PolarHBondContact O-N 2.76Å; V423-I470 HydrophobicContact CG1-CD1 4.27Å; V423-I470 HydrophobicContact CG1-CG1 3.76Å; I470-P496 HydrophobicContact CD1-CG 3.6Å; I470-P496 HydrophobicContact CG1-CG 4.04Å
471	S	89.6	Confident	90.8	Very high	103 Å²	103	45.7 Å²	45.7	72%	0.72	24%	0.243	S	C	*	.	S	Bend	trans	-81	-17.3	-173.7	55.2	0	0	0	0	115.2	R469	R469-S471 VanDerWaalsContact C-N 3.34Å; R469-S471 PolarHBondContact O-N 3.35Å
472	S	87.3	Confident	90.8	Very high	63 Å²	63	46.1 Å²	46.1	44%	0.441	25%	0.245	S	C	.	.	S	Bend	trans	-145.7	67.4	-177.5	64.4	0	0	0	0	109.1	R469 Q474	R469-S472 CarbonylContact O-C 3.6Å; S472-Q474 PolarHBondContact O-N 3.29Å
473	P	85	Confident	90.9	Very high	47 Å²	47	46.6 Å²	46.6	31%	0.305	25%	0.247	S	C	.	.			trans	-72.5	116.2	-167.3	28.8	-35.1	0	0	0	111.4	R469 V475 Y492 L495	R469-P473 WeakPolarHBondContact O-CA 3.3Å; P473-V475 HydrophobicContact CB-CG2 4.03Å; P473-Y492 HydrophobicContact CB-CD2 4.49Å; P473-Y492 HydrophobicContact CG-CD2 4.19Å; P473-Y492 HydrophobicContact CG-CG 4.45Å; P473-L495 HydrophobicContact CB-CD1 3.63Å
474	Q	84.3	Confident	91.2	Very high	148 Å²	148	45.2 Å²	45.2	69%	0.692	24%	0.24	S	C	*	.			trans	-99.1	94.9	160	-67.1	-177.4	-2.2	0	0	106.4	T468 S472	T468-Q474 VanDerWaalsContact CB-O 3.32Å; T468-Q474 WeakPolarHBondContact CB-O 3.48Å; T468-Q474 PolarHBondContact OG1-N 3.37Å; T468-Q474 PolarHBondContact OG1-O 3.09Å; S472-Q474 PolarHBondContact O-N 3.29Å
475	V	83.8	Confident	91.6	Very high	34 Å²	34	47.2 Å²	47.2	21%	0.206	25%	0.251	C	S	.	.			trans	-93.7	128.6	-174.8	171.7	0	0	0	0	110	M425 T468 P473 V487 Y492 L495	M425-V475 HydrophobicContact CE-CG1 3.92Å; M425-V475 HydrophobicContact CE-CG2 4.27Å; T468-V475 HydrophobicContact CG2-CG2 4.29Å; P473-V475 HydrophobicContact CB-CG2 4.03Å; V475-V487 HydrophobicContact CG1-CG1 4.09Å; V475-Y492 HydrophobicContact CB-CE1 4.06Å; V475-Y492 HydrophobicContact CB-CE2 4.24Å; V475-Y492 HydrophobicContact CG1-CE1 3.98Å; V475-Y492 HydrophobicContact CG2-CD1 3.99Å; V475-Y492 HydrophobicContact CG2-CD2 4.25Å; V475-Y492 HydrophobicContact CG2-CE1 4.03Å; V475-Y492 HydrophobicContact CG2-CE2 4.28Å; V475-Y492 HydrophobicContact CG2-CG 4.11Å; V475-L495 HydrophobicContact CG2-CD1 3.88Å; V475-L495 HydrophobicContact CG2-CD2 4.32Å
476	E	85.4	Confident	92	Very high	56 Å²	56	47.7 Å²	47.7	26%	0.262	25%	0.253	S	S	.	.			trans	-113.5	122.9	163.7	-174.9	175.1	156.4	0	0	106.6	R345 H466 G478	R345-E476 IonicContact CZ-OE2 2.74Å; R345-E476 IonicContact NH1-OE2 2.68Å; R345-E476 PolarHBondContact NH1-OE2 2.69Å; R345-E476 IonicContact NH2-OE2 3.36Å; R345-E476 PolarHBondContact NH2-OE2 3.36Å; H466-E476 IonicContact CE1-OE1 2.86Å; H466-E476 PolarHBondContact ND1-O 2.81Å; H466-E476 VanDerWaalsContact ND1-O 3.14Å; E476-G478 PolarHBondContact O-N 2.87Å
477	E	87.3	Confident	92.3	Very high	102 Å²	102	47 Å²	47	48%	0.477	25%	0.25	S	C	.	.			trans	-57.8	126.2	-175.3	-69.6	-177	-168.1	0	0	111.5	L483	E477-L483 HydrophobicContact CB-CD2 4.44Å; E477-L483 HydrophobicContact CG-CD2 4.41Å
478	G	88.6	Confident	92.4	Very high	14 Å²	14	50.3 Å²	50.3	14%	0.144	27%	0.267	C	S	.	.			trans	-76.7	-166.6	173.5	0	0	0	0	0	112.9	E476 S480	E476-G478 PolarHBondContact O-N 2.87Å; G478-S480 PolarHBondContact O-N 3.2Å
479	D	94.8	Very high	92.5	Very high	36 Å²	36	56 Å²	56	19%	0.193	29%	0.293	C	S	.	.			trans	-59.8	119.4	-178.4	-167.9	-53.3	0	0	0	112.9	D426 K428 R481 F482 L483	D426-D479 PolarHBondContact OD1-N 3.04Å; D426-D479 VanDerWaalsContact OD1-N 3.15Å; K428-D479 HydrophobicContact CD-CB 3.72Å; D479-R481 PolarHBondContact O-N 2.93Å; D479-R481 VanDerWaalsContact OD1-CB 3.27Å; D479-R481 WeakPolarHBondContact OD1-CB 3.34Å; D479-R481 WeakPolarHBondContact OD1-CG 3.45Å; D479-R481 IonicContact OD1-CZ 2.75Å; D479-R481 PolarHBondContact OD1-N 3.17Å; D479-R481 IonicContact OD1-NE 2.99Å; D479-R481 PolarHBondContact OD1-NE 3.22Å; D479-R481 IonicContact OD1-NH2 3.51Å; D479-R481 IonicContact OD2-CZ 3.72Å; D479-R481 IonicContact OD2-NE 2.67Å; D479-R481 PolarHBondContact OD2-NE 3.21Å; D479-R481 IonicContact OD2-NH2 3.73Å; D479-R481 PolarHBondContact OD2-NH2 3.35Å; D479-F482 HydrophobicContact CB-CD2 4.09Å; D479-F482 PolarHBondContact O-N 2.97Å; D479-L483 PolarHBondContact O-N 3.34Å
480	S	97.1	Very high	92.6	Very high	44 Å²	44	57.3 Å²	57.3	31%	0.308	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-25	-174.2	81.5	0	0	0	0	114	G478 F482 R518 W523 R527	G478-S480 PolarHBondContact O-N 3.2Å; S480-F482 VanDerWaalsContact C-N 3.28Å; S480-F482 PolarHBondContact O-N 3.39Å; S480-R518 PolarHBondContact OG-O 3.47Å; S480-W523 PolarHBondContact O-NE1 3Å; S480-R527 PolarHBondContact O-NH2 3.46Å
481	R	98.1	Very high	92.7	Very high	74 Å²	74	58 Å²	58	28%	0.279	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-33.1	176.7	-63.1	175	-71	169.3	-0.5	112.3	D479 L516 R518 R527	D479-R481 PolarHBondContact O-N 2.93Å; D479-R481 VanDerWaalsContact OD1-CB 3.27Å; D479-R481 WeakPolarHBondContact OD1-CB 3.34Å; D479-R481 WeakPolarHBondContact OD1-CG 3.45Å; D479-R481 IonicContact OD1-CZ 2.75Å; D479-R481 PolarHBondContact OD1-N 3.17Å; D479-R481 IonicContact OD1-NE 2.99Å; D479-R481 PolarHBondContact OD1-NE 3.22Å; D479-R481 IonicContact OD1-NH2 3.51Å; D479-R481 IonicContact OD2-CZ 3.72Å; D479-R481 IonicContact OD2-NE 2.67Å; D479-R481 PolarHBondContact OD2-NE 3.21Å; D479-R481 IonicContact OD2-NH2 3.73Å; D479-R481 PolarHBondContact OD2-NH2 3.35Å; R481-L516 HydrophobicContact CB-CB 4.05Å; R481-L516 WeakPolarHBondContact CD-O 3.48Å; R481-L516 HydrophobicContact CG-CB 4.46Å; R481-R518 HydrophobicContact CG-CG 3.83Å; R481-R527 VanDerWaalsContact C-NH2 3.32Å; R481-R527 PolarHBondContact O-NH2 2.75Å
482	F	98.5	Very high	93	Very high	9 Å²	9	56.2 Å²	56.2	4%	0.039	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-14.5	-177.3	-58.6	-87.9	0	0	0	112.8	K428 P429 D479 S480 A484 F501 A502 L505 L516	K428-F482 HydrophobicContact CB-CD1 4.35Å; K428-F482 HydrophobicContact CB-CD2 3.64Å; K428-F482 HydrophobicContact CB-CE1 4.4Å; K428-F482 HydrophobicContact CB-CE2 3.68Å; K428-F482 HydrophobicContact CB-CG 4.01Å; K428-F482 HydrophobicContact CB-CZ 4.08Å; P429-F482 HydrophobicContact CG-CE1 4.48Å; P429-F482 HydrophobicContact CG-CZ 4.15Å; D479-F482 HydrophobicContact CB-CD2 4.09Å; D479-F482 PolarHBondContact O-N 2.97Å; S480-F482 VanDerWaalsContact C-N 3.28Å; S480-F482 PolarHBondContact O-N 3.39Å; F482-A484 PolarHBondContact O-N 3.46Å; F482-F501 VanDerWaalsContact O-CD1 3.29Å; F482-F501 WeakPolarHBondContact O-CD1 3.41Å; F482-F501 WeakPolarHBondContact O-CE1 3.47Å; F482-A502 HydrophobicContact CB-CB 4.08Å; F482-L505 HydrophobicContact CD1-CB 3.83Å; F482-L505 HydrophobicContact CE1-CB 4.2Å; F482-L516 HydrophobicContact CD1-CD1 4.18Å; F482-L516 HydrophobicContact CE1-CD1 3.67Å; F482-L516 HydrophobicContact CZ-CD1 3.93Å
483	L	98.1	Very high	93.4	Very high	11 Å²	11	57.9 Å²	57.9	6%	0.058	29%	0.294	C	S	.	.			trans	-60.1	127.8	-178.9	-170.3	65.8	0	0	0	113.1	E477 D479 V487 L488 R527	E477-L483 HydrophobicContact CB-CD2 4.44Å; E477-L483 HydrophobicContact CG-CD2 4.41Å; D479-L483 PolarHBondContact O-N 3.34Å; L483-V487 HydrophobicContact CD1-CB 3.87Å; L483-V487 HydrophobicContact CD1-CG1 3.73Å; L483-L488 HydrophobicContact CD2-CB 4.18Å; L483-L488 HydrophobicContact CD2-CD1 4.35Å; L483-R527 VanDerWaalsContact O-CZ 3.27Å; L483-R527 PolarHBondContact O-NE 3.41Å; L483-R527 PolarHBondContact O-NH2 3.46Å
484	A	97.8	Very high	94	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.008	29%	0.291	C	S	.	.			trans	-78.5	150.6	176.1	0	0	0	0	0	111.6	F482 E486 V487 L488 A498 F501	F482-A484 PolarHBondContact O-N 3.46Å; A484-E486 VanDerWaalsContact C-N 3.33Å; A484-E486 WeakPolarHBondContact CB-OE1 3.33Å; A484-E486 WeakPolarHBondContact CB-OE2 3.28Å; A484-E486 PolarHBondContact O-N 3.45Å; A484-V487 HydrophobicContact CB-CG2 4.48Å; A484-V487 PolarHBondContact O-N 3.47Å; A484-L488 PolarHBondContact O-N 3.03Å; A484-A498 HydrophobicContact CB-CB 4.26Å; A484-F501 HydrophobicContact CB-CB 4.04Å; A484-F501 HydrophobicContact CB-CD1 3.68Å; A484-F501 HydrophobicContact CB-CD2 4.22Å; A484-F501 HydrophobicContact CB-CE1 4.18Å; A484-F501 HydrophobicContact CB-CG 3.73Å
485	N	97.3	Very high	94.6	Very high	42 Å²	42	51.2 Å²	51.2	23%	0.225	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-36.8	-170.7	-162.8	77.1	0	0	0	113.1	V487 L488 Q489 R527	N485-V487 VanDerWaalsContact C-N 3.26Å; N485-V487 PolarHBondContact O-N 3.3Å; N485-L488 PolarHBondContact O-N 2.89Å; N485-Q489 PolarHBondContact ND2-NE2 2.77Å; N485-Q489 VanDerWaalsContact ND2-NE2 3.17Å; N485-Q489 PolarHBondContact ND2-OE1 3.44Å; N485-Q489 WeakPolarHBondContact O-CG 3.44Å; N485-Q489 PolarHBondContact O-N 3.29Å; N485-R527 HydrophobicContact CB-CB 4.01Å; N485-R527 HydrophobicContact CB-CG 3.8Å
486	E	97.3	Very high	95.3	Very high	10 Å²	10	50.9 Å²	50.9	5%	0.047	26%	0.257	C	S	.	.	H	α-helix	trans	-64.9	-30.5	-179.4	70.4	-76.8	-179.1	0	0	112.6	A484 Q489 E490 N491 P554 R557	A484-E486 VanDerWaalsContact C-N 3.33Å; A484-E486 WeakPolarHBondContact CB-OE1 3.33Å; A484-E486 WeakPolarHBondContact CB-OE2 3.28Å; A484-E486 PolarHBondContact O-N 3.45Å; E486-Q489 CarbonylContact O-C 3.27Å; E486-Q489 PolarHBondContact O-N 3.47Å; E486-E490 PolarHBondContact O-N 3.12Å; E486-N491 HydrophobicContact CB-CB 4.31Å; E486-N491 WeakPolarHBondContact O-CA 3.3Å; E486-N491 WeakPolarHBondContact O-CB 3.41Å; E486-N491 PolarHBondContact O-N 3.2Å; E486-P554 HydrophobicContact CB-CG 4.18Å; E486-P554 HydrophobicContact CG-CG 3.69Å; E486-R557 IonicContact OE1-CZ 2.81Å; E486-R557 IonicContact OE1-NH1 3.92Å; E486-R557 PolarHBondContact OE1-NH1 2.91Å; E486-R557 IonicContact OE1-NH2 3.67Å; E486-R557 PolarHBondContact OE1-NH2 2.79Å; E486-R557 IonicContact OE2-CZ 3.09Å; E486-R557 IonicContact OE2-NH1 2.65Å; E486-R557 IonicContact OE2-NH2 2.73Å; E486-R557 PolarHBondContact OE2-NH2 2.93Å
487	V	96.7	Very high	95.9	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	25%	0.252	C	S	.	.	H	α-helix	trans	-71.5	-41.1	177.2	-175.7	0	0	0	0	110.6	M425 V475 L483 A484 N485 Q489 E490 Y492 L495 A498	M425-V487 HydrophobicContact CE-CG1 3.69Å; M425-V487 HydrophobicContact CE-CG2 4.23Å; V475-V487 HydrophobicContact CG1-CG1 4.09Å; L483-V487 HydrophobicContact CD1-CB 3.87Å; L483-V487 HydrophobicContact CD1-CG1 3.73Å; A484-V487 HydrophobicContact CB-CG2 4.48Å; A484-V487 PolarHBondContact O-N 3.47Å; N485-V487 VanDerWaalsContact C-N 3.26Å; N485-V487 PolarHBondContact O-N 3.3Å; V487-Q489 PolarHBondContact O-N 3.2Å; V487-E490 PolarHBondContact O-N 3.5Å; V487-E490 VanDerWaalsContact O-N 3.08Å; V487-Y492 HydrophobicContact CG1-CE1 4.16Å; V487-L495 HydrophobicContact CG2-CD2 4.26Å; V487-A498 HydrophobicContact CG2-CB 3.59Å
488	L	94.7	Very high	96.5	Very high	76 Å²	76	45.4 Å²	45.4	40%	0.398	23%	0.232	S	C	.	.	H	α-helix	trans	-66.2	-23	173.2	-176.4	65	0	0	0	112.6	L483 A484 N485 E490 W523	L483-L488 HydrophobicContact CD2-CB 4.18Å; L483-L488 HydrophobicContact CD2-CD1 4.35Å; A484-L488 PolarHBondContact O-N 3.03Å; N485-L488 PolarHBondContact O-N 2.89Å; L488-E490 VanDerWaalsContact C-N 3.28Å; L488-W523 HydrophobicContact CD2-CH2 3.61Å; L488-W523 HydrophobicContact CD2-CZ2 4.1Å; L488-W523 HydrophobicContact CD2-CZ3 4.35Å
489	Q	95.3	Very high	96.9	Very high	132 Å²	132	44.8 Å²	44.8	62%	0.617	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	14.2	173.1	-69.4	176.9	-37.4	0	0	113	N485 E486 V487 N491	N485-Q489 PolarHBondContact ND2-NE2 2.77Å; N485-Q489 VanDerWaalsContact ND2-NE2 3.17Å; N485-Q489 PolarHBondContact ND2-OE1 3.44Å; N485-Q489 WeakPolarHBondContact O-CG 3.44Å; N485-Q489 PolarHBondContact O-N 3.29Å; E486-Q489 CarbonylContact O-C 3.27Å; E486-Q489 PolarHBondContact O-N 3.47Å; V487-Q489 PolarHBondContact O-N 3.2Å; Q489-N491 PolarHBondContact O-N 2.87Å
490	E	95.1	Very high	97.1	Very high	147 Å²	147	43 Å²	43	69%	0.687	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	17	-178.7	-54	-177	149.7	0	0	114.4	E486 V487 L488 Y492	E486-E490 PolarHBondContact O-N 3.12Å; V487-E490 PolarHBondContact O-N 3.5Å; V487-E490 VanDerWaalsContact O-N 3.08Å; L488-E490 VanDerWaalsContact C-N 3.28Å; E490-Y492 PolarHBondContact O-N 3.36Å
491	N	95.7	Very high	97.2	Very high	69 Å²	69	41 Å²	41	37%	0.369	20%	0.202	S	C	.	.			trans	-88.2	92.9	176.9	-178.5	0.5	0	0	0	110.8	E486 Q489 T493	E486-N491 HydrophobicContact CB-CB 4.31Å; E486-N491 WeakPolarHBondContact O-CA 3.3Å; E486-N491 WeakPolarHBondContact O-CB 3.41Å; E486-N491 PolarHBondContact O-N 3.2Å; Q489-N491 PolarHBondContact O-N 2.87Å; N491-T493 VanDerWaalsContact C-N 3.34Å; N491-T493 PolarHBondContact O-N 2.98Å; N491-T493 VanDerWaalsContact OD1-CB 3.31Å; N491-T493 WeakPolarHBondContact OD1-CB 3.48Å; N491-T493 PolarHBondContact OD1-N 2.91Å; N491-T493 PolarHBondContact OD1-OG1 3.34Å
492	Y	95.9	Very high	97.3	Very high	65 Å²	65	37.8 Å²	37.8	26%	0.255	19%	0.192	S	C	.	.			trans	-91.5	14.1	-177.9	-49.7	-36.5	0	0	0	114.3	P473 V475 V487 E490 H494 L495	P473-Y492 HydrophobicContact CB-CD2 4.49Å; P473-Y492 HydrophobicContact CG-CD2 4.19Å; P473-Y492 HydrophobicContact CG-CG 4.45Å; V475-Y492 HydrophobicContact CB-CE1 4.06Å; V475-Y492 HydrophobicContact CB-CE2 4.24Å; V475-Y492 HydrophobicContact CG1-CE1 3.98Å; V475-Y492 HydrophobicContact CG2-CD1 3.99Å; V475-Y492 HydrophobicContact CG2-CD2 4.25Å; V475-Y492 HydrophobicContact CG2-CE1 4.03Å; V475-Y492 HydrophobicContact CG2-CE2 4.28Å; V475-Y492 HydrophobicContact CG2-CG 4.11Å; V487-Y492 HydrophobicContact CG1-CE1 4.16Å; E490-Y492 PolarHBondContact O-N 3.36Å; Y492-H494 VanDerWaalsContact C-N 3.26Å; Y492-H494 PolarHBondContact O-N 3.16Å; Y492-L495 HydrophobicContact CD1-CD2 3.79Å; Y492-L495 HydrophobicContact CG-CD2 4.21Å
493	T	95.6	Very high	97.3	Very high	98 Å²	98	37.4 Å²	37.4	60%	0.601	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-30.8	-177.3	-47.6	0	0	0	0	112.9	N491	N491-T493 VanDerWaalsContact C-N 3.34Å; N491-T493 PolarHBondContact O-N 2.98Å; N491-T493 VanDerWaalsContact OD1-CB 3.31Å; N491-T493 WeakPolarHBondContact OD1-CB 3.48Å; N491-T493 PolarHBondContact OD1-N 2.91Å; N491-T493 PolarHBondContact OD1-OG1 3.34Å
494	H	96.7	Very high	97.3	Very high	53 Å²	53	36.9 Å²	36.9	25%	0.245	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.4	37.7	-173.7	-53.2	-70.3	0	0	0	113.7	Y492 P496 K497 P554 E555	Y492-H494 VanDerWaalsContact C-N 3.26Å; Y492-H494 PolarHBondContact O-N 3.16Å; H494-P496 VanDerWaalsContact C-N 3.3Å; H494-P496 WeakPolarHBondContact O-CD 3.42Å; H494-K497 HydrophobicContact CB-CB 4.36Å; H494-K497 HydrophobicContact CB-CG 4.01Å; H494-K497 VanDerWaalsContact O-CB 3.25Å; H494-K497 WeakPolarHBondContact O-CB 3.18Å; H494-K497 PolarHBondContact O-N 3.33Å; H494-P554 HydrophobicContact CB-CB 3.91Å; H494-E555 IonicContact CE1-OE1 2.64Å; H494-E555 PolarHBondContact CE1-OE1 2.98Å; H494-E555 IonicContact NE2-OE1 2.79Å
495	L	97.2	Very high	97.4	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46	-38.1	-177.6	-67.4	-176.9	0	0	0	116.2	V423 M425 T468 P473 V475 V487 Y492 K497 A498	V423-L495 HydrophobicContact CB-CB 4.37Å; V423-L495 HydrophobicContact CG1-CB 3.92Å; V423-L495 HydrophobicContact CG2-CB 4.02Å; V423-L495 HydrophobicContact CG2-CD1 4.03Å; M425-L495 HydrophobicContact CE-CD2 3.81Å; M425-L495 HydrophobicContact SD-CB 4.22Å; M425-L495 HydrophobicContact SD-CD1 4.29Å; M425-L495 HydrophobicContact SD-CD2 3.91Å; M425-L495 HydrophobicContact SD-CG 4.37Å; T468-L495 HydrophobicContact CG2-CD1 4.27Å; P473-L495 HydrophobicContact CB-CD1 3.63Å; V475-L495 HydrophobicContact CG2-CD1 3.88Å; V475-L495 HydrophobicContact CG2-CD2 4.32Å; V487-L495 HydrophobicContact CG2-CD2 4.26Å; Y492-L495 HydrophobicContact CD1-CD2 3.79Å; Y492-L495 HydrophobicContact CG-CD2 4.21Å; L495-K497 PolarHBondContact O-N 3.44Å; L495-A498 VanDerWaalsContact O-CB 3.3Å; L495-A498 WeakPolarHBondContact O-CB 3.35Å; L495-A498 PolarHBondContact O-N 2.92Å
496	P	98.4	Very high	97.4	Very high	28 Å²	28	34.8 Å²	34.8	18%	0.182	18%	0.176	C	C	.	.	H	α-helix	trans	-57.6	-22.6	175.5	-27.4	36.5	0	0	0	114.6	H418 V423 I470 H494 I500	H418-P496 PolarHBondContact CE1-O 2.82Å; H418-P496 VanDerWaalsContact CE1-O 3.23Å; V423-P496 HydrophobicContact CG1-CB 4.19Å; V423-P496 HydrophobicContact CG1-CG 3.69Å; I470-P496 HydrophobicContact CD1-CG 3.6Å; I470-P496 HydrophobicContact CG1-CG 4.04Å; H494-P496 VanDerWaalsContact C-N 3.3Å; H494-P496 WeakPolarHBondContact O-CD 3.42Å; P496-I500 WeakPolarHBondContact O-CG1 3.46Å
497	K	98.6	Very high	97.5	Very high	34 Å²	34	34.3 Å²	34.3	15%	0.148	17%	0.174	C	C	.	.	H	α-helix	trans	-83.2	-15.9	177.4	-53.6	-61.1	-161.8	77.5	0	112.8	H494 L495 F501 P554 E555 R557	H494-K497 HydrophobicContact CB-CB 4.36Å; H494-K497 HydrophobicContact CB-CG 4.01Å; H494-K497 VanDerWaalsContact O-CB 3.25Å; H494-K497 WeakPolarHBondContact O-CB 3.18Å; H494-K497 PolarHBondContact O-N 3.33Å; L495-K497 PolarHBondContact O-N 3.44Å; K497-F501 PolarHBondContact O-N 2.79Å; K497-F501 VanDerWaalsContact O-N 3.16Å; K497-P554 HydrophobicContact CB-CB 3.83Å; K497-P554 HydrophobicContact CG-CB 4.23Å; K497-P554 VanDerWaalsContact CG-O 3.29Å; K497-P554 WeakPolarHBondContact CG-O 3.33Å; K497-P554 PolarHBondContact NZ-O 2.89Å; K497-E555 PolarHBondContact NZ-O 3.32Å; K497-R557 HydrophobicContact CD-CB 4.33Å; K497-R557 WeakPolarHBondContact CE-O 3.41Å; K497-R557 PolarHBondContact NZ-O 3.27Å; K497-R557 WeakPolarHBondContact O-CD 3.41Å; K497-R557 PolarHBondContact O-NH1 2.77Å
498	A	98.4	Very high	97.6	Very high	8 Å²	8	34.3 Å²	34.3	7%	0.066	17%	0.173	C	C	.	.	H	α-helix	trans	-72.4	-42.3	170.2	0	0	0	0	0	110.8	A484 V487 L495 I500 F501 A502	A484-A498 HydrophobicContact CB-CB 4.26Å; V487-A498 HydrophobicContact CG2-CB 3.59Å; L495-A498 VanDerWaalsContact O-CB 3.3Å; L495-A498 WeakPolarHBondContact O-CB 3.35Å; L495-A498 PolarHBondContact O-N 2.92Å; A498-I500 PolarHBondContact O-N 3.25Å; A498-F501 WeakPolarHBondContact O-CB 3.41Å; A498-F501 PolarHBondContact O-N 2.86Å; A498-A502 WeakPolarHBondContact O-CB 3.42Å; A498-A502 PolarHBondContact O-N 3.13Å
499	D	98.7	Very high	97.8	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-58.5	-36.6	172.5	-71.3	-25.2	0	0	0	112	L414 H418 H424 M425 I427 L503	L414-D499 HydrophobicContact CD1-CB 3.9Å; L414-D499 HydrophobicContact CD2-CB 3.81Å; H418-D499 IonicContact CD2-OD2 3.93Å; H418-D499 IonicContact CE1-OD2 2.77Å; H418-D499 IonicContact NE2-OD2 2.63Å; H418-D499 PolarHBondContact NE2-OD2 3.34Å; H424-D499 WeakPolarHBondContact CB-OD1 3.36Å; H424-D499 PolarHBondContact N-OD1 2.77Å; H424-D499 PolarHBondContact N-OD2 2.71Å; M425-D499 PolarHBondContact N-OD1 3.38Å; I427-D499 HydrophobicContact CG1-CB 4.37Å; D499-L503 VanDerWaalsContact O-CB 3.24Å; D499-L503 WeakPolarHBondContact O-CB 3.25Å; D499-L503 PolarHBondContact O-N 3.45Å
500	I	98.9	Very high	97.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-68.3	-43.5	177	-64	-70.3	0	0	0	111.5	L414 P496 A498 L503 A504 M549 R557 P558 A560 L563	L414-I500 HydrophobicContact CD1-CD1 4.35Å; P496-I500 WeakPolarHBondContact O-CG1 3.46Å; A498-I500 PolarHBondContact O-N 3.25Å; I500-L503 PolarHBondContact O-N 2.93Å; I500-A504 PolarHBondContact O-N 2.81Å; I500-M549 HydrophobicContact CG2-CB 3.94Å; I500-M549 HydrophobicContact CG2-CE 3.95Å; I500-M549 HydrophobicContact CG2-CG 3.83Å; I500-M549 WeakPolarHBondContact O-CE 3.48Å; I500-R557 HydrophobicContact CG2-CB 4.27Å; I500-P558 WeakPolarHBondContact CG1-O 3.34Å; I500-P558 HydrophobicContact CG2-CG 4.37Å; I500-A560 HydrophobicContact CD1-CB 4.11Å; I500-L563 HydrophobicContact CD1-CD2 4.02Å
501	F	98.9	Very high	98	Very high	1 Å²	1	18.3 Å²	18.3	0%	0.004	10%	0.099	C	C	.	.	H	α-helix	trans	-60.1	-48.1	174.5	177.3	-80.8	0	0	0	111.1	F482 A484 K497 A498 L503 A504 L505 I526 R527 M549 I550	F482-F501 VanDerWaalsContact O-CD1 3.29Å; F482-F501 WeakPolarHBondContact O-CD1 3.41Å; F482-F501 WeakPolarHBondContact O-CE1 3.47Å; A484-F501 HydrophobicContact CB-CB 4.04Å; A484-F501 HydrophobicContact CB-CD1 3.68Å; A484-F501 HydrophobicContact CB-CD2 4.22Å; A484-F501 HydrophobicContact CB-CE1 4.18Å; A484-F501 HydrophobicContact CB-CG 3.73Å; K497-F501 PolarHBondContact O-N 2.79Å; K497-F501 VanDerWaalsContact O-N 3.16Å; A498-F501 WeakPolarHBondContact O-CB 3.41Å; A498-F501 PolarHBondContact O-N 2.86Å; F501-L503 PolarHBondContact O-N 2.85Å; F501-A504 PolarHBondContact O-N 2.98Å; F501-L505 HydrophobicContact CD1-CD1 4.04Å; F501-L505 HydrophobicContact CE1-CD1 3.4Å; F501-L505 HydrophobicContact CE1-CG 4.32Å; F501-L505 HydrophobicContact CZ-CD1 3.92Å; F501-L505 PolarHBondContact O-N 3.07Å; F501-I526 HydrophobicContact CZ-CG2 4.18Å; F501-R527 HydrophobicContact CE2-CG 4.43Å; F501-R527 HydrophobicContact CZ-CG 3.9Å; F501-M549 WeakPolarHBondContact CA-O 3.45Å; F501-I550 HydrophobicContact CD2-CB 3.9Å; F501-I550 HydrophobicContact CD2-CG2 4.13Å; F501-I550 HydrophobicContact CE2-CB 3.85Å; F501-I550 HydrophobicContact CE2-CG2 4.24Å
502	A	98.8	Very high	98.1	Very high	7 Å²	7	16 Å²	16	6%	0.058	9%	0.091	C	C	.	.	H	α-helix	trans	-64.1	-37	178.4	0	0	0	0	0	112.7	I427 F482 A498 L505 T506	I427-A502 HydrophobicContact CB-CB 3.92Å; I427-A502 HydrophobicContact CG2-CB 4.31Å; I427-A502 WeakPolarHBondContact O-CB 3.29Å; F482-A502 HydrophobicContact CB-CB 4.08Å; A498-A502 WeakPolarHBondContact O-CB 3.42Å; A498-A502 PolarHBondContact O-N 3.13Å; A502-L505 PolarHBondContact O-N 3.45Å; A502-T506 WeakPolarHBondContact O-CB 3.38Å; A502-T506 PolarHBondContact O-N 3.4Å; A502-T506 PolarHBondContact O-OG1 2.78Å
503	L	98.9	Very high	98.1	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-64.9	-42.3	174.4	178.3	53.7	0	0	0	112.4	L407 V410 L414 I427 D499 I500 F501 L505 T506 V507 M549 L563	L407-L503 HydrophobicContact CD1-CD1 4.27Å; L407-L503 HydrophobicContact CD1-CD2 3.74Å; L407-L503 HydrophobicContact CD1-CG 3.69Å; V410-L503 HydrophobicContact CB-CD1 3.86Å; V410-L503 HydrophobicContact CB-CD2 4.42Å; V410-L503 HydrophobicContact CG1-CD1 3.51Å; V410-L503 HydrophobicContact CG1-CD2 4.13Å; V410-L503 HydrophobicContact CG1-CG 4.46Å; L414-L503 HydrophobicContact CD1-CB 4.25Å; L414-L503 HydrophobicContact CD1-CD2 3.68Å; I427-L503 HydrophobicContact CG2-CB 4.19Å; D499-L503 VanDerWaalsContact O-CB 3.24Å; D499-L503 WeakPolarHBondContact O-CB 3.25Å; D499-L503 PolarHBondContact O-N 3.45Å; I500-L503 PolarHBondContact O-N 2.93Å; F501-L503 PolarHBondContact O-N 2.85Å; L503-L505 PolarHBondContact O-N 3.28Å; L503-T506 WeakPolarHBondContact O-CB 3.4Å; L503-T506 PolarHBondContact O-N 2.95Å; L503-V507 HydrophobicContact CD1-CG2 4.33Å; L503-V507 WeakPolarHBondContact O-CG2 2.98Å; L503-V507 PolarHBondContact O-N 2.93Å; L503-M549 HydrophobicContact CB-CE 4.22Å; L503-M549 HydrophobicContact CD2-CE 4.36Å; L503-M549 HydrophobicContact CG-CE 4.11Å; L503-L563 HydrophobicContact CD2-CD2 4Å
504	A	98.8	Very high	98.1	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61.1	-46.5	175.8	0	0	0	0	0	111.7	I500 F501 T506 V507 V508 L546 M549 I550	I500-A504 PolarHBondContact O-N 2.81Å; F501-A504 PolarHBondContact O-N 2.98Å; A504-T506 VanDerWaalsContact C-N 3.26Å; A504-T506 PolarHBondContact O-N 3.49Å; A504-V507 PolarHBondContact O-N 3.08Å; A504-V507 VanDerWaalsContact O-N 3.16Å; A504-V508 VanDerWaalsContact O-CG2 3.3Å; A504-V508 WeakPolarHBondContact O-CG2 3.38Å; A504-V508 PolarHBondContact O-N 3.41Å; A504-L546 HydrophobicContact CB-CD2 4.33Å; A504-M549 HydrophobicContact CB-CB 3.56Å; A504-M549 HydrophobicContact CB-CE 3.83Å; A504-M549 HydrophobicContact CB-CG 4.5Å; A504-M549 HydrophobicContact CB-SD 4.22Å; A504-I550 HydrophobicContact CB-CG2 3.64Å
505	L	98.8	Very high	98	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.1	-32.9	175.5	-66.9	-176.4	0	0	0	112.7	F482 F501 A502 L503 V508 C509 L516 I526 P532 I550	F482-L505 HydrophobicContact CD1-CB 3.83Å; F482-L505 HydrophobicContact CE1-CB 4.2Å; F501-L505 HydrophobicContact CD1-CD1 4.04Å; F501-L505 HydrophobicContact CE1-CD1 3.4Å; F501-L505 HydrophobicContact CE1-CG 4.32Å; F501-L505 HydrophobicContact CZ-CD1 3.92Å; F501-L505 PolarHBondContact O-N 3.07Å; A502-L505 PolarHBondContact O-N 3.45Å; L503-L505 PolarHBondContact O-N 3.28Å; L505-V508 PolarHBondContact O-N 3.29Å; L505-C509 PolarHBondContact O-N 3.29Å; L505-C509 PolarHBondContact O-SG 3.17Å; L505-C509 VanDerWaalsContact O-SG 3.4Å; L505-L516 HydrophobicContact CB-CD1 3.94Å; L505-L516 HydrophobicContact CD1-CD1 4.47Å; L505-I526 HydrophobicContact CD1-CG2 4.02Å; L505-I526 HydrophobicContact CD2-CG2 3.72Å; L505-I526 HydrophobicContact CG-CG2 4.48Å; L505-P532 HydrophobicContact CD2-CG 4.15Å; L505-I550 HydrophobicContact CD2-CG2 4.07Å; L505-I550 HydrophobicContact CG-CG2 4.14Å
506	T	98.8	Very high	98.1	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.4	-41.1	173.1	-63.6	0	0	0	0	112.4	L384 K428 P429 I432 A502 L503 A504 C509 A510	L384-T506 HydrophobicContact CD2-CG2 3.88Å; K428-T506 WeakPolarHBondContact CA-OG1 3.45Å; P429-T506 HydrophobicContact CG-CG2 3.99Å; I432-T506 HydrophobicContact CD1-CG2 3.52Å; A502-T506 WeakPolarHBondContact O-CB 3.38Å; A502-T506 PolarHBondContact O-N 3.4Å; A502-T506 PolarHBondContact O-OG1 2.78Å; L503-T506 WeakPolarHBondContact O-CB 3.4Å; L503-T506 PolarHBondContact O-N 2.95Å; A504-T506 VanDerWaalsContact C-N 3.26Å; A504-T506 PolarHBondContact O-N 3.49Å; T506-C509 PolarHBondContact O-N 3.06Å; T506-A510 PolarHBondContact O-N 2.88Å; T506-A510 VanDerWaalsContact O-N 3.12Å
507	V	98.8	Very high	98	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-69.7	-35.9	174	176.1	0	0	0	0	111.5	L403 L406 L407 L503 A504 C509 A510 A511 F542 L546	L403-V507 HydrophobicContact CB-CG1 4.16Å; L403-V507 HydrophobicContact CD2-CG1 4.12Å; L406-V507 HydrophobicContact CD2-CG2 4.16Å; L406-V507 HydrophobicContact CG-CG2 4.34Å; L407-V507 HydrophobicContact CB-CG2 4.03Å; L407-V507 HydrophobicContact CD1-CG2 4.08Å; L503-V507 HydrophobicContact CD1-CG2 4.33Å; L503-V507 WeakPolarHBondContact O-CG2 2.98Å; L503-V507 PolarHBondContact O-N 2.93Å; A504-V507 PolarHBondContact O-N 3.08Å; A504-V507 VanDerWaalsContact O-N 3.16Å; V507-C509 PolarHBondContact O-N 3.37Å; V507-A510 CarbonylContact O-C 3.51Å; V507-A510 WeakPolarHBondContact O-CB 3.44Å; V507-A510 PolarHBondContact O-N 3.36Å; V507-A510 VanDerWaalsContact O-N 3.13Å; V507-A511 PolarHBondContact O-N 3.24Å; V507-F542 HydrophobicContact CG1-CZ 4.06Å; V507-L546 HydrophobicContact CB-CD2 4.05Å; V507-L546 HydrophobicContact CG1-CD1 4.34Å; V507-L546 HydrophobicContact CG1-CD2 3.91Å
508	V	98.6	Very high	97.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.1	-40.8	173.7	170.6	0	0	0	0	111.6	A504 L505 A511 A513 L531 P532 I534 L546	A504-V508 VanDerWaalsContact O-CG2 3.3Å; A504-V508 WeakPolarHBondContact O-CG2 3.38Å; A504-V508 PolarHBondContact O-N 3.41Å; L505-V508 PolarHBondContact O-N 3.29Å; V508-A511 PolarHBondContact O-N 3.34Å; V508-A513 HydrophobicContact CG1-CB 3.51Å; V508-A513 VanDerWaalsContact O-CB 3.27Å; V508-A513 WeakPolarHBondContact O-CB 3.31Å; V508-A513 PolarHBondContact O-N 3.05Å; V508-L531 HydrophobicContact CG2-CD1 3.67Å; V508-L531 HydrophobicContact CG2-CG 4.12Å; V508-P532 HydrophobicContact CG1-CB 3.8Å; V508-P532 HydrophobicContact CG1-CG 3.87Å; V508-I534 HydrophobicContact CG1-CG1 4.26Å; V508-I534 HydrophobicContact CG2-CD1 4.33Å; V508-L546 HydrophobicContact CG2-CD1 4.49Å
509	C	98.4	Very high	97.9	Very high	18 Å²	18	29.8 Å²	29.8	12%	0.122	16%	0.157	C	C	.	.	H	α-helix	trans	-61	-44.1	170.1	-68.4	0	0	0	0	112	I388 P429 L505 T506 V507 A511 G512 L516	I388-C509 HydrophobicContact CD1-CB 4.09Å; P429-C509 HydrophobicContact CG-CB 4.14Å; L505-C509 PolarHBondContact O-N 3.29Å; L505-C509 PolarHBondContact O-SG 3.17Å; L505-C509 VanDerWaalsContact O-SG 3.4Å; T506-C509 PolarHBondContact O-N 3.06Å; V507-C509 PolarHBondContact O-N 3.37Å; C509-A511 PolarHBondContact O-N 2.93Å; C509-G512 PolarHBondContact O-N 3.05Å; C509-L516 VanDerWaalsContact SG-CD1 3.57Å
510	A	98.2	Very high	97.8	Very high	2 Å²	2	31.3 Å²	31.3	2%	0.017	17%	0.173	C	C	.	.	H	α-helix	trans	-63	-29.9	177.3	0	0	0	0	0	112.9	I388 F398 L403 L406 T506 V507 G512	I388-A510 HydrophobicContact CD1-CB 3.96Å; I388-A510 HydrophobicContact CG1-CB 4.33Å; F398-A510 HydrophobicContact CD2-CB 3.96Å; F398-A510 WeakPolarHBondContact CD2-O 3.49Å; F398-A510 PolarHBondContact N-O 3.49Å; L403-A510 HydrophobicContact CD2-CB 3.61Å; L406-A510 HydrophobicContact CD2-CB 3.71Å; T506-A510 PolarHBondContact O-N 2.88Å; T506-A510 VanDerWaalsContact O-N 3.12Å; V507-A510 CarbonylContact O-C 3.51Å; V507-A510 WeakPolarHBondContact O-CB 3.44Å; V507-A510 PolarHBondContact O-N 3.36Å; V507-A510 VanDerWaalsContact O-N 3.13Å; A510-G512 PolarHBondContact O-N 3.13Å
511	A	98	Very high	97.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-1	175.4	0	0	0	0	0	113.9	L403 V507 V508 C509 I534 Q536	L403-A511 HydrophobicContact CD1-CB 3.62Å; L403-A511 HydrophobicContact CD2-CB 4.11Å; V507-A511 PolarHBondContact O-N 3.24Å; V508-A511 PolarHBondContact O-N 3.34Å; C509-A511 PolarHBondContact O-N 2.93Å; A511-I534 HydrophobicContact CB-CD1 4.19Å; A511-I534 HydrophobicContact CB-CG1 4.3Å; A511-I534 HydrophobicContact CB-CG2 3.74Å; A511-Q536 PolarHBondContact O-NE2 3.36Å
512	G	96.5	Very high	97.7	Very high	20 Å²	20	43 Å²	43	21%	0.206	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.7	16.5	176.9	0	0	0	0	0	114.9	C509 A510 P535	C509-G512 PolarHBondContact O-N 3.05Å; A510-G512 PolarHBondContact O-N 3.13Å; G512-P535 VanDerWaalsContact C-CD 3.5Å; G512-P535 VanDerWaalsContact O-CD 3.3Å; G512-P535 WeakPolarHBondContact O-CD 3.33Å; G512-P535 VanDerWaalsContact O-CG 3.27Å; G512-P535 WeakPolarHBondContact O-CG 3.3Å
513	A	96.5	Very high	97.7	Very high	10 Å²	10	43 Å²	43	8%	0.083	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-60.4	155.1	173.8	0	0	0	0	0	112.4	V508 R533	V508-A513 HydrophobicContact CG1-CB 3.51Å; V508-A513 VanDerWaalsContact O-CB 3.27Å; V508-A513 WeakPolarHBondContact O-CB 3.31Å; V508-A513 PolarHBondContact O-N 3.05Å; A513-R533 WeakPolarHBondContact CB-O 3.38Å
514	E	94.6	Very high	97.6	Very high	149 Å²	149	47.4 Å²	47.4	70%	0.696	25%	0.25	S	S	*	.	P	Polyproline II helix	trans	-59	156	175.2	-70.6	-177.8	-169	0	0	112.3	L516	E514-L516 PolarHBondContact O-N 3.04Å; E514-L516 VanDerWaalsContact O-N 3.12Å
515	P	95.8	Very high	97.6	Very high	112 Å²	112	51 Å²	51	73%	0.727	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-53.3	119	179.6	-27.3	35.6	0	0	0	112.5
516	L	97.8	Very high	97.6	Very high	12 Å²	12	51.4 Å²	51.4	6%	0.063	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-58.2	138.3	-174.3	-64.1	179.2	0	0	0	112.3	R481 F482 L505 C509 E514 I526 P532	R481-L516 HydrophobicContact CB-CB 4.05Å; R481-L516 WeakPolarHBondContact CD-O 3.48Å; R481-L516 HydrophobicContact CG-CB 4.46Å; F482-L516 HydrophobicContact CD1-CD1 4.18Å; F482-L516 HydrophobicContact CE1-CD1 3.67Å; F482-L516 HydrophobicContact CZ-CD1 3.93Å; L505-L516 HydrophobicContact CB-CD1 3.94Å; L505-L516 HydrophobicContact CD1-CD1 4.47Å; C509-L516 VanDerWaalsContact SG-CD1 3.57Å; E514-L516 PolarHBondContact O-N 3.04Å; E514-L516 VanDerWaalsContact O-N 3.12Å; L516-I526 HydrophobicContact CD2-CD1 4.38Å; L516-P532 HydrophobicContact CD2-CB 4.29Å; L516-P532 HydrophobicContact CD2-CG 3.82Å
517	P	97.8	Very high	97.6	Very high	25 Å²	25	51.9 Å²	51.9	16%	0.162	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-64.9	145.5	-179.9	29.2	-36.8	0	0	0	110.9	Q522 W523 I526	P517-Q522 HydrophobicContact CB-CB 4.14Å; P517-Q522 HydrophobicContact CG-CB 3.89Å; P517-W523 HydrophobicContact CB-CB 4.29Å; P517-W523 HydrophobicContact CG-CB 4.13Å; P517-I526 HydrophobicContact CG-CD1 3.81Å
518	R	97	Very high	97.5	Very high	173 Å²	173	57.3 Å²	57.3	65%	0.653	30%	0.296	S	S	*	.	S	Bend	trans	-85.2	-23.7	176.2	-65.7	-174.5	-179	-155.7	-0.5	113.2	S480 R481	S480-R518 PolarHBondContact OG-O 3.47Å; R481-R518 HydrophobicContact CG-CG 3.83Å
519	N	96.7	Very high	97.5	Very high	95 Å²	95	57.9 Å²	57.9	51%	0.508	30%	0.303	S	S	.	.	S	Bend	trans	-169.5	-179.2	-174.4	53.9	13.6	0	0	0	109.4	W523	N519-W523 VanDerWaalsContact C-CB 3.44Å
520	G	97.1	Very high	97.5	Very high	33 Å²	33	63.6 Å²	63.6	34%	0.34	32%	0.322	S	S	.	.	S	Bend	trans	86	-173.2	175.3	0	0	0	0	0	114.8	Q522 W523 H524	G520-Q522 PolarHBondContact O-N 3.36Å; G520-W523 WeakPolarHBondContact O-CA 3.49Å; G520-W523 VanDerWaalsContact O-CB 3.26Å; G520-W523 WeakPolarHBondContact O-CB 3.38Å; G520-W523 PolarHBondContact O-N 2.86Å; G520-H524 PolarHBondContact O-CD2 3.12Å; G520-H524 VanDerWaalsContact O-CD2 3.27Å; G520-H524 PolarHBondContact O-N 2.87Å; G520-H524 VanDerWaalsContact O-N 3.14Å
521	D	97.9	Very high	97.4	Very high	116 Å²	116	65.4 Å²	65.4	62%	0.62	33%	0.331	S	S	*	.	H	α-helix	trans	-60	-45.7	-169.1	-54.7	-44.7	0	0	0	112.5	W523 H524 E525	D521-W523 PolarHBondContact O-N 3.37Å; D521-H524 PolarHBondContact O-N 3.47Å; D521-E525 WeakPolarHBondContact O-CG 3.33Å; D521-E525 PolarHBondContact O-N 3.38Å
522	Q	97.8	Very high	97.4	Very high	130 Å²	130	66.5 Å²	66.5	61%	0.607	34%	0.338	S	S	*	.	H	α-helix	trans	-58.8	-32.4	174.7	-66.4	-178.2	-33.6	0	0	112.9	P517 G520 I526	P517-Q522 HydrophobicContact CB-CB 4.14Å; P517-Q522 HydrophobicContact CG-CB 3.89Å; G520-Q522 PolarHBondContact O-N 3.36Å; Q522-I526 WeakPolarHBondContact O-CD1 3.4Å; Q522-I526 WeakPolarHBondContact O-CG1 3.13Å; Q522-I526 PolarHBondContact O-N 2.8Å
523	W	98.4	Very high	97.4	Very high	9 Å²	9	76.3 Å²	76.3	3%	0.034	37%	0.369	C	S	.	.	H	α-helix	trans	-67.5	-45.5	174.9	-177.2	100.3	0	0	0	110.5	S480 L488 P517 N519 G520 D521 I526 R527	S480-W523 PolarHBondContact O-NE1 3Å; L488-W523 HydrophobicContact CD2-CH2 3.61Å; L488-W523 HydrophobicContact CD2-CZ2 4.1Å; L488-W523 HydrophobicContact CD2-CZ3 4.35Å; P517-W523 HydrophobicContact CB-CB 4.29Å; P517-W523 HydrophobicContact CG-CB 4.13Å; N519-W523 VanDerWaalsContact C-CB 3.44Å; G520-W523 WeakPolarHBondContact O-CA 3.49Å; G520-W523 VanDerWaalsContact O-CB 3.26Å; G520-W523 WeakPolarHBondContact O-CB 3.38Å; G520-W523 PolarHBondContact O-N 2.86Å; D521-W523 PolarHBondContact O-N 3.37Å; W523-I526 PolarHBondContact O-N 3.34Å; W523-R527 VanDerWaalsContact CE2-CZ 3.42Å; W523-R527 VanDerWaalsContact CE2-NE 3.33Å; W523-R527 HydrophobicContact CE3-CG 4.48Å; W523-R527 HydrophobicContact CH2-CG 3.96Å; W523-R527 HydrophobicContact CZ2-CG 4.31Å; W523-R527 VanDerWaalsContact CZ2-NE 3.35Å; W523-R527 HydrophobicContact CZ3-CG 4.06Å; W523-R527 WeakPolarHBondContact O-CD 3.27Å; W523-R527 PolarHBondContact O-N 2.88Å; W523-R527 PolarHBondContact O-NH1 3.29Å
524	H	98	Very high	97.4	Very high	91 Å²	91	77.3 Å²	77.3	42%	0.421	37%	0.372	S	S	.	.	H	α-helix	trans	-65.8	-39.3	177.5	-70.1	-67.5	0	0	0	112.5	G520 D521 I526 R527 Q528	G520-H524 PolarHBondContact O-CD2 3.12Å; G520-H524 VanDerWaalsContact O-CD2 3.27Å; G520-H524 PolarHBondContact O-N 2.87Å; G520-H524 VanDerWaalsContact O-N 3.14Å; D521-H524 PolarHBondContact O-N 3.47Å; H524-I526 VanDerWaalsContact C-N 3.3Å; H524-I526 PolarHBondContact O-N 2.85Å; H524-R527 CarbonylContact O-C 3.52Å; H524-R527 WeakPolarHBondContact O-CA 3.13Å; H524-R527 PolarHBondContact O-N 3.36Å; H524-Q528 WeakPolarHBondContact O-CG 3.48Å; H524-Q528 PolarHBondContact O-N 2.94Å
525	E	98.4	Very high	97.5	Very high	75 Å²	75	73.8 Å²	73.8	35%	0.35	36%	0.363	S	S	.	.	H	α-helix	trans	-56.9	-41.9	175.5	-77.2	-168.3	-131.5	0	0	112.6	D521 R527 Q528 R530	D521-E525 WeakPolarHBondContact O-CG 3.33Å; D521-E525 PolarHBondContact O-N 3.38Å; E525-R527 VanDerWaalsContact C-N 3.31Å; E525-R527 PolarHBondContact O-N 3.14Å; E525-Q528 WeakPolarHBondContact O-CB 3.42Å; E525-Q528 PolarHBondContact O-N 3.01Å; E525-Q528 VanDerWaalsContact O-N 3.13Å; E525-R530 VanDerWaalsContact CD-NH1 3.28Å; E525-R530 VanDerWaalsContact O-CB 3.31Å; E525-R530 WeakPolarHBondContact O-CB 3.25Å; E525-R530 WeakPolarHBondContact O-CG 3.48Å; E525-R530 PolarHBondContact O-N 3.45Å; E525-R530 IonicContact OE2-CZ 3.7Å; E525-R530 IonicContact OE2-NH1 2.77Å; E525-R530 PolarHBondContact OE2-NH1 3.44Å
526	I	98.5	Very high	97.4	Very high	9 Å²	9	69.8 Å²	69.8	5%	0.046	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-41.7	174.8	-65.9	166.1	0	0	0	110.8	F501 L505 L516 P517 Q522 W523 H524 Q528 G529 R530 P532	F501-I526 HydrophobicContact CZ-CG2 4.18Å; L505-I526 HydrophobicContact CD1-CG2 4.02Å; L505-I526 HydrophobicContact CD2-CG2 3.72Å; L505-I526 HydrophobicContact CG-CG2 4.48Å; L516-I526 HydrophobicContact CD2-CD1 4.38Å; P517-I526 HydrophobicContact CG-CD1 3.81Å; Q522-I526 WeakPolarHBondContact O-CD1 3.4Å; Q522-I526 WeakPolarHBondContact O-CG1 3.13Å; Q522-I526 PolarHBondContact O-N 2.8Å; W523-I526 PolarHBondContact O-N 3.34Å; H524-I526 VanDerWaalsContact C-N 3.3Å; H524-I526 PolarHBondContact O-N 2.85Å; I526-Q528 PolarHBondContact O-N 2.8Å; I526-G529 PolarHBondContact O-N 3.23Å; I526-R530 WeakPolarHBondContact CA-O 3.43Å; I526-P532 HydrophobicContact CD1-CG 3.86Å; I526-P532 HydrophobicContact CG1-CG 3.96Å
527	R	98.4	Very high	97.4	Very high	11 Å²	11	76 Å²	76	4%	0.042	37%	0.373	C	S	.	.	H	α-helix	trans	-74.3	-12.6	178.4	-79.3	76.2	-172	162.7	2.4	113	S480 R481 L483 N485 F501 W523 H524 E525 P552	S480-R527 PolarHBondContact O-NH2 3.46Å; R481-R527 VanDerWaalsContact C-NH2 3.32Å; R481-R527 PolarHBondContact O-NH2 2.75Å; L483-R527 VanDerWaalsContact O-CZ 3.27Å; L483-R527 PolarHBondContact O-NE 3.41Å; L483-R527 PolarHBondContact O-NH2 3.46Å; N485-R527 HydrophobicContact CB-CB 4.01Å; N485-R527 HydrophobicContact CB-CG 3.8Å; F501-R527 HydrophobicContact CE2-CG 4.43Å; F501-R527 HydrophobicContact CZ-CG 3.9Å; W523-R527 VanDerWaalsContact CE2-CZ 3.42Å; W523-R527 VanDerWaalsContact CE2-NE 3.33Å; W523-R527 HydrophobicContact CE3-CG 4.48Å; W523-R527 HydrophobicContact CH2-CG 3.96Å; W523-R527 HydrophobicContact CZ2-CG 4.31Å; W523-R527 VanDerWaalsContact CZ2-NE 3.35Å; W523-R527 HydrophobicContact CZ3-CG 4.06Å; W523-R527 WeakPolarHBondContact O-CD 3.27Å; W523-R527 PolarHBondContact O-N 2.88Å; W523-R527 PolarHBondContact O-NH1 3.29Å; H524-R527 CarbonylContact O-C 3.52Å; H524-R527 WeakPolarHBondContact O-CA 3.13Å; H524-R527 PolarHBondContact O-N 3.36Å; E525-R527 VanDerWaalsContact C-N 3.31Å; E525-R527 PolarHBondContact O-N 3.14Å; R527-P552 WeakPolarHBondContact O-CG 3.48Å
528	Q	98.1	Very high	97.3	Very high	113 Å²	113	75.8 Å²	75.8	53%	0.528	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	6.9	165.2	-66.3	171.1	13.8	0	0	112.8	H524 E525 I526 P552	H524-Q528 WeakPolarHBondContact O-CG 3.48Å; H524-Q528 PolarHBondContact O-N 2.94Å; E525-Q528 WeakPolarHBondContact O-CB 3.42Å; E525-Q528 PolarHBondContact O-N 3.01Å; E525-Q528 VanDerWaalsContact O-N 3.13Å; I526-Q528 PolarHBondContact O-N 2.8Å; Q528-P552 VanDerWaalsContact C-CG 3.44Å
529	G	97.4	Very high	97.3	Very high	13 Å²	13	69.4 Å²	69.4	13%	0.134	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	15.5	178.8	0	0	0	0	0	114.4	I526	I526-G529 PolarHBondContact O-N 3.23Å
530	R	98.1	Very high	97.3	Very high	138 Å²	138	70.9 Å²	70.9	52%	0.521	36%	0.356	S	S	.	.			trans	-84.6	113.1	173	-56.4	-176.1	-174.8	173.9	2.1	109.3	E525 I526	E525-R530 VanDerWaalsContact CD-NH1 3.28Å; E525-R530 VanDerWaalsContact O-CB 3.31Å; E525-R530 WeakPolarHBondContact O-CB 3.25Å; E525-R530 WeakPolarHBondContact O-CG 3.48Å; E525-R530 PolarHBondContact O-N 3.45Å; E525-R530 IonicContact OE2-CZ 3.7Å; E525-R530 IonicContact OE2-NH1 2.77Å; E525-R530 PolarHBondContact OE2-NH1 3.44Å; I526-R530 WeakPolarHBondContact CA-O 3.43Å
531	L	97.1	Very high	97.3	Very high	39 Å²	39	73.8 Å²	73.8	20%	0.204	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-66.4	134.1	179.1	-160	69.9	0	0	0	109.9	V508 I534 T543 L546 I550	V508-L531 HydrophobicContact CG2-CD1 3.67Å; V508-L531 HydrophobicContact CG2-CG 4.12Å; L531-I534 HydrophobicContact CD2-CD1 4.17Å; L531-T543 HydrophobicContact CD2-CG2 4.1Å; L531-L546 HydrophobicContact CD1-CB 4.06Å; L531-L546 HydrophobicContact CD2-CB 4.08Å; L531-I550 HydrophobicContact CB-CD1 4.26Å; L531-I550 HydrophobicContact CD1-CD1 3.73Å; L531-I550 HydrophobicContact CD1-CG1 4.22Å
532	P	97.5	Very high	97.3	Very high	24 Å²	24	68.3 Å²	68.3	16%	0.156	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-56	153.1	172.9	-23.1	31.2	0	0	0	112.1	L505 V508 L516 I526 I534	L505-P532 HydrophobicContact CD2-CG 4.15Å; V508-P532 HydrophobicContact CG1-CB 3.8Å; V508-P532 HydrophobicContact CG1-CG 3.87Å; L516-P532 HydrophobicContact CD2-CB 4.29Å; L516-P532 HydrophobicContact CD2-CG 3.82Å; I526-P532 HydrophobicContact CD1-CG 3.86Å; I526-P532 HydrophobicContact CG1-CG 3.96Å; P532-I534 PolarHBondContact O-N 3.33Å
533	R	96.8	Very high	97.3	Very high	226 Å²	226	63.7 Å²	63.7	85%	0.853	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-65.9	124.8	179.5	-173.5	177.6	-176.8	166.6	1.4	110.8	A513	A513-R533 WeakPolarHBondContact CB-O 3.38Å
534	I	97	Very high	97.3	Very high	30 Å²	30	67 Å²	67	15%	0.154	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-100.8	132.7	174.5	-63.4	173.1	0	0	0	108.1	V508 A511 L531 P532 Q536 L538	V508-I534 HydrophobicContact CG1-CG1 4.26Å; V508-I534 HydrophobicContact CG2-CD1 4.33Å; A511-I534 HydrophobicContact CB-CD1 4.19Å; A511-I534 HydrophobicContact CB-CG1 4.3Å; A511-I534 HydrophobicContact CB-CG2 3.74Å; L531-I534 HydrophobicContact CD2-CD1 4.17Å; P532-I534 PolarHBondContact O-N 3.33Å; I534-Q536 HydrophobicContact CG2-CG 3.54Å; I534-Q536 PolarHBondContact O-N 3.39Å; I534-L538 HydrophobicContact CD1-CD1 3.72Å; I534-L538 HydrophobicContact CG2-CD1 4.17Å; I534-L538 HydrophobicContact CG2-CG 4.48Å
535	P	95.5	Very high	97.3	Very high	76 Å²	76	62.8 Å²	62.8	49%	0.494	31%	0.308	S	S	.	.	S	Bend	trans	-82.3	5.7	-176	35.2	-39.5	0	0	0	114.5	Y397 G512	Y397-P535 HydrophobicContact CD1-CG 4.48Å; G512-P535 VanDerWaalsContact C-CD 3.5Å; G512-P535 VanDerWaalsContact O-CD 3.3Å; G512-P535 WeakPolarHBondContact O-CD 3.33Å; G512-P535 VanDerWaalsContact O-CG 3.27Å; G512-P535 WeakPolarHBondContact O-CG 3.3Å
536	Q	94.8	Very high	97.4	Very high	28 Å²	28	59.2 Å²	59.2	13%	0.131	29%	0.292	C	S	.	.	S	Bend	trans	-126.2	154.5	-179.9	61.7	173.8	-57.5	0	0	111.4	Y397 F398 A511 I534 L538	Y397-Q536 HydrophobicContact CD2-CB 4.16Å; Y397-Q536 VanDerWaalsContact CD2-CD 3.45Å; Y397-Q536 HydrophobicContact CD2-CG 4.22Å; Y397-Q536 HydrophobicContact CE2-CB 3.51Å; Y397-Q536 HydrophobicContact CE2-CG 4.06Å; F398-Q536 PolarHBondContact O-NE2 3.38Å; F398-Q536 PolarHBondContact O-OE1 3.18Å; A511-Q536 PolarHBondContact O-NE2 3.36Å; I534-Q536 HydrophobicContact CG2-CG 3.54Å; I534-Q536 PolarHBondContact O-N 3.39Å; Q536-L538 HydrophobicContact CG-CD2 4.1Å; Q536-L538 HydrophobicContact CG-CG 4.37Å
537	V	96.4	Very high	97.3	Very high	143 Å²	143	62.9 Å²	62.9	87%	0.867	31%	0.307	S	S	*	.			trans	-78.7	122.1	174.4	-178.1	0	0	0	0	108.9
538	L	97.1	Very high	97.4	Very high	19 Å²	19	64.6 Å²	64.6	10%	0.099	32%	0.319	C	S	.	.			trans	-112.7	154.2	170.8	-59.2	178.7	0	0	0	109.2	E400 L403 I534 Q536 F542	E400-L538 HydrophobicContact CB-CD2 3.87Å; E400-L538 HydrophobicContact CG-CD2 4.12Å; E400-L538 WeakPolarHBondContact OE2-CA 3.28Å; L403-L538 HydrophobicContact CD1-CD1 4.38Å; L403-L538 HydrophobicContact CD1-CD2 3.86Å; I534-L538 HydrophobicContact CD1-CD1 3.72Å; I534-L538 HydrophobicContact CG2-CD1 4.17Å; I534-L538 HydrophobicContact CG2-CG 4.48Å; Q536-L538 HydrophobicContact CG-CD2 4.1Å; Q536-L538 HydrophobicContact CG-CG 4.37Å; L538-F542 HydrophobicContact CB-CD1 4.34Å; L538-F542 HydrophobicContact CD1-CD1 4.02Å; L538-F542 HydrophobicContact CD1-CE1 4.15Å; L538-F542 HydrophobicContact CD2-CD1 4.46Å
539	S	97	Very high	97.4	Very high	40 Å²	40	59.2 Å²	59.2	28%	0.28	29%	0.294	S	S	.	.			trans	-58.8	145.9	173.3	65.6	0	0	0	0	111.6	E400 E541 F542 T543	E400-S539 WeakPolarHBondContact OE1-CB 3.36Å; E400-S539 PolarHBondContact OE1-OG 2.95Å; E400-S539 PolarHBondContact OE2-N 2.96Å; S539-E541 VanDerWaalsContact C-N 3.3Å; S539-E541 PolarHBondContact O-N 3Å; S539-F542 PolarHBondContact O-N 2.64Å; S539-F542 WeakPolarHBondContact OG-CB 3.4Å; S539-T543 PolarHBondContact O-N 3.33Å; S539-T543 PolarHBondContact O-OG1 2.79Å
540	Q	96.8	Very high	97.4	Very high	126 Å²	126	58.6 Å²	58.6	59%	0.589	29%	0.287	S	S	*	.	H	α-helix	trans	-61.2	-39.8	-179.1	-167.9	66.3	29.1	0	0	111.6	F542 T543 E544	Q540-F542 VanDerWaalsContact C-N 3.3Å; Q540-F542 PolarHBondContact O-N 3.36Å; Q540-T543 PolarHBondContact O-N 3.27Å; Q540-E544 HydrophobicContact CG-CG 4.33Å; Q540-E544 PolarHBondContact NE2-OE1 2.63Å; Q540-E544 WeakPolarHBondContact O-CG 3.31Å; Q540-E544 PolarHBondContact O-N 2.95Å
541	E	96.6	Very high	97.5	Very high	94 Å²	94	54 Å²	54	44%	0.439	27%	0.272	S	S	.	.	H	α-helix	trans	-59.8	-40.2	177.5	-165.6	-167.1	174.2	0	0	111.5	S539 L545 H566 S567 V568	S539-E541 VanDerWaalsContact C-N 3.3Å; S539-E541 PolarHBondContact O-N 3Å; E541-L545 PolarHBondContact O-N 3.15Å; E541-L545 VanDerWaalsContact O-N 3.14Å; E541-H566 IonicContact OE1-CE1 3.51Å; E541-S567 WeakPolarHBondContact OE1-CB 3.22Å; E541-S567 PolarHBondContact OE1-OG 3.21Å; E541-V568 HydrophobicContact CB-CB 4.45Å; E541-V568 HydrophobicContact CB-CG2 3.71Å; E541-V568 VanDerWaalsContact CD-CB 3.41Å; E541-V568 VanDerWaalsContact CD-CG2 3.45Å; E541-V568 HydrophobicContact CG-CB 3.78Å; E541-V568 HydrophobicContact CG-CG2 3.6Å; E541-V568 WeakPolarHBondContact OE1-CB 3.46Å; E541-V568 PolarHBondContact OE1-N 3.39Å; E541-V568 WeakPolarHBondContact OE2-CG2 3.38Å
542	F	97.9	Very high	97.5	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-74.8	-37.6	179.2	-173.2	-125.4	0	0	0	111.8	E400 L403 K404 L407 V507 L538 S539 Q540 L545 L546 V568 L569	E400-F542 HydrophobicContact CG-CD1 3.87Å; E400-F542 HydrophobicContact CG-CE1 4.28Å; E400-F542 HydrophobicContact CG-CG 4.45Å; L403-F542 HydrophobicContact CB-CE1 3.81Å; L403-F542 HydrophobicContact CB-CZ 3.81Å; L403-F542 HydrophobicContact CD1-CE1 4.25Å; K404-F542 HydrophobicContact CD-CD2 4.48Å; K404-F542 HydrophobicContact CG-CD2 3.78Å; K404-F542 HydrophobicContact CG-CE1 4.42Å; K404-F542 HydrophobicContact CG-CE2 3.58Å; K404-F542 HydrophobicContact CG-CG 4.29Å; K404-F542 HydrophobicContact CG-CZ 3.94Å; L407-F542 HydrophobicContact CD2-CE2 3.79Å; L407-F542 HydrophobicContact CD2-CZ 4.46Å; V507-F542 HydrophobicContact CG1-CZ 4.06Å; L538-F542 HydrophobicContact CB-CD1 4.34Å; L538-F542 HydrophobicContact CD1-CD1 4.02Å; L538-F542 HydrophobicContact CD1-CE1 4.15Å; L538-F542 HydrophobicContact CD2-CD1 4.46Å; S539-F542 PolarHBondContact O-N 2.64Å; S539-F542 WeakPolarHBondContact OG-CB 3.4Å; Q540-F542 VanDerWaalsContact C-N 3.3Å; Q540-F542 PolarHBondContact O-N 3.36Å; F542-L545 PolarHBondContact O-N 2.77Å; F542-L546 HydrophobicContact CD1-CD1 4.37Å; F542-L546 HydrophobicContact CE1-CD1 4.05Å; F542-L546 HydrophobicContact CZ-CD1 4.28Å; F542-L546 WeakPolarHBondContact O-CG 3.2Å; F542-L546 PolarHBondContact O-N 3.43Å; F542-V568 HydrophobicContact CB-CG2 3.91Å; F542-V568 HydrophobicContact CD2-CG1 4.27Å; F542-L569 HydrophobicContact CD2-CD2 4.14Å; F542-L569 HydrophobicContact CE2-CD2 3.88Å
543	T	98.2	Very high	97.6	Very high	34 Å²	34	56.9 Å²	56.9	21%	0.209	29%	0.289	C	S	.	.	H	α-helix	trans	-65.7	-43.5	177	-54.9	0	0	0	0	111.8	L531 S539 Q540 L545 L546 K547	L531-T543 HydrophobicContact CD2-CG2 4.1Å; S539-T543 PolarHBondContact O-N 3.33Å; S539-T543 PolarHBondContact O-OG1 2.79Å; Q540-T543 PolarHBondContact O-N 3.27Å; T543-L545 VanDerWaalsContact C-N 3.35Å; T543-L546 PolarHBondContact O-N 2.96Å; T543-K547 WeakPolarHBondContact O-CB 3.3Å; T543-K547 PolarHBondContact O-N 3.11Å
544	E	98.1	Very high	97.7	Very high	77 Å²	77	46.8 Å²	46.8	36%	0.36	25%	0.252	S	S	.	.	H	α-helix	trans	-68	-32.3	175	-68.2	-59.1	150.5	0	0	112.1	Q540 K547 V548	Q540-E544 HydrophobicContact CG-CG 4.33Å; Q540-E544 PolarHBondContact NE2-OE1 2.63Å; Q540-E544 WeakPolarHBondContact O-CG 3.31Å; Q540-E544 PolarHBondContact O-N 2.95Å; E544-K547 PolarHBondContact O-N 3.09Å; E544-K547 IonicContact OE1-NZ 2.68Å; E544-K547 PolarHBondContact OE1-NZ 3.06Å; E544-K547 IonicContact OE2-NZ 3.13Å; E544-K547 PolarHBondContact OE2-NZ 2.98Å; E544-V548 PolarHBondContact O-N 2.83Å
545	L	98.6	Very high	97.7	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-61.2	-49.1	170.5	176.7	58.8	0	0	0	111.7	L407 E541 F542 T543 K547 V548 M549 P558 L563 H566 V568 L569	L407-L545 HydrophobicContact CD2-CD2 4.1Å; E541-L545 PolarHBondContact O-N 3.15Å; E541-L545 VanDerWaalsContact O-N 3.14Å; F542-L545 PolarHBondContact O-N 2.77Å; T543-L545 VanDerWaalsContact C-N 3.35Å; L545-K547 VanDerWaalsContact C-N 3.26Å; L545-K547 PolarHBondContact O-N 3.46Å; L545-V548 HydrophobicContact CD1-CG1 4.24Å; L545-V548 VanDerWaalsContact O-CG1 3.31Å; L545-V548 WeakPolarHBondContact O-CG1 3.41Å; L545-V548 PolarHBondContact O-N 3.16Å; L545-M549 HydrophobicContact CD1-CG 4.31Å; L545-M549 HydrophobicContact CD1-SD 4.33Å; L545-M549 HydrophobicContact CG-SD 4.22Å; L545-M549 VanDerWaalsContact O-CG 3.28Å; L545-M549 WeakPolarHBondContact O-CG 3.42Å; L545-M549 PolarHBondContact O-N 2.97Å; L545-P558 HydrophobicContact CD1-CG 4.42Å; L545-L563 HydrophobicContact CD1-CD1 4.11Å; L545-L563 HydrophobicContact CD2-CD1 4.08Å; L545-L563 HydrophobicContact CG-CD1 4.42Å; L545-H566 HydrophobicContact CD2-CB 4.4Å; L545-V568 HydrophobicContact CB-CG1 4.35Å; L545-V568 HydrophobicContact CD2-CG1 3.39Å; L545-V568 HydrophobicContact CG-CG1 4.49Å; L545-L569 HydrophobicContact CD2-CD1 4.2Å; L545-L569 HydrophobicContact CD2-CD2 4.09Å; L545-L569 HydrophobicContact CD2-CG 4.07Å
546	L	98.6	Very high	97.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61	-37.1	177	-68.1	174.9	0	0	0	111.8	L407 A504 V507 V508 L531 F542 T543 M549 I550	L407-L546 HydrophobicContact CD2-CD2 4.2Å; A504-L546 HydrophobicContact CB-CD2 4.33Å; V507-L546 HydrophobicContact CB-CD2 4.05Å; V507-L546 HydrophobicContact CG1-CD1 4.34Å; V507-L546 HydrophobicContact CG1-CD2 3.91Å; V508-L546 HydrophobicContact CG2-CD1 4.49Å; L531-L546 HydrophobicContact CD1-CB 4.06Å; L531-L546 HydrophobicContact CD2-CB 4.08Å; F542-L546 HydrophobicContact CD1-CD1 4.37Å; F542-L546 HydrophobicContact CE1-CD1 4.05Å; F542-L546 HydrophobicContact CZ-CD1 4.28Å; F542-L546 WeakPolarHBondContact O-CG 3.2Å; F542-L546 PolarHBondContact O-N 3.43Å; T543-L546 PolarHBondContact O-N 2.96Å; L546-M549 HydrophobicContact CD2-SD 4.5Å; L546-M549 PolarHBondContact O-N 3.01Å; L546-I550 PolarHBondContact O-N 2.92Å
547	K	98.4	Very high	98	Very high	86 Å²	86	53.8 Å²	53.8	37%	0.374	27%	0.271	S	S	.	.	H	α-helix	trans	-69.9	-40.3	178.6	-174.8	170	154	-140.9	0	113.3	T543 E544 L545 M549 I550 H551	T543-K547 WeakPolarHBondContact O-CB 3.3Å; T543-K547 PolarHBondContact O-N 3.11Å; E544-K547 PolarHBondContact O-N 3.09Å; E544-K547 IonicContact OE1-NZ 2.68Å; E544-K547 PolarHBondContact OE1-NZ 3.06Å; E544-K547 IonicContact OE2-NZ 3.13Å; E544-K547 PolarHBondContact OE2-NZ 2.98Å; L545-K547 VanDerWaalsContact C-N 3.26Å; L545-K547 PolarHBondContact O-N 3.46Å; K547-M549 VanDerWaalsContact C-N 3.32Å; K547-I550 WeakPolarHBondContact O-CG1 3.27Å; K547-I550 PolarHBondContact O-N 2.8Å; K547-H551 PolarHBondContact O-N 2.73Å
548	V	98.6	Very high	98.1	Very high	47 Å²	47	48.1 Å²	48.1	29%	0.285	24%	0.237	S	C	.	.	H	α-helix	trans	-71.4	-27.8	174.1	72.5	0	0	0	0	112.2	E544 L545 I550 H551 R556	E544-V548 PolarHBondContact O-N 2.83Å; L545-V548 HydrophobicContact CD1-CG1 4.24Å; L545-V548 VanDerWaalsContact O-CG1 3.31Å; L545-V548 WeakPolarHBondContact O-CG1 3.41Å; L545-V548 PolarHBondContact O-N 3.16Å; V548-I550 VanDerWaalsContact C-N 3.29Å; V548-I550 PolarHBondContact O-N 3.09Å; V548-H551 VanDerWaalsContact O-CB 3.25Å; V548-H551 WeakPolarHBondContact O-CB 3.4Å; V548-H551 PolarHBondContact O-N 3.49Å; V548-R556 WeakPolarHBondContact CG2-O 3.41Å
549	M	98.8	Very high	98.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.6	-26.6	171.9	-72.4	172.5	68.5	0	0	113.6	L407 I500 F501 L503 A504 L545 L546 K547 R557 P558 L563	L407-M549 HydrophobicContact CD1-CE 3.63Å; L407-M549 HydrophobicContact CD1-SD 4.08Å; L407-M549 HydrophobicContact CD2-SD 4.14Å; I500-M549 HydrophobicContact CG2-CB 3.94Å; I500-M549 HydrophobicContact CG2-CE 3.95Å; I500-M549 HydrophobicContact CG2-CG 3.83Å; I500-M549 WeakPolarHBondContact O-CE 3.48Å; F501-M549 WeakPolarHBondContact CA-O 3.45Å; L503-M549 HydrophobicContact CB-CE 4.22Å; L503-M549 HydrophobicContact CD2-CE 4.36Å; L503-M549 HydrophobicContact CG-CE 4.11Å; A504-M549 HydrophobicContact CB-CB 3.56Å; A504-M549 HydrophobicContact CB-CE 3.83Å; A504-M549 HydrophobicContact CB-CG 4.5Å; A504-M549 HydrophobicContact CB-SD 4.22Å; L545-M549 HydrophobicContact CD1-CG 4.31Å; L545-M549 HydrophobicContact CD1-SD 4.33Å; L545-M549 HydrophobicContact CG-SD 4.22Å; L545-M549 VanDerWaalsContact O-CG 3.28Å; L545-M549 WeakPolarHBondContact O-CG 3.42Å; L545-M549 PolarHBondContact O-N 2.97Å; L546-M549 HydrophobicContact CD2-SD 4.5Å; L546-M549 PolarHBondContact O-N 3.01Å; K547-M549 VanDerWaalsContact C-N 3.32Å; M549-R557 VanDerWaalsContact O-CD 3.24Å; M549-R557 WeakPolarHBondContact O-CD 3.39Å; M549-R557 WeakPolarHBondContact O-CG 3.43Å; M549-P558 HydrophobicContact CG-CG 3.77Å; M549-L563 HydrophobicContact CE-CD1 4.28Å; M549-L563 HydrophobicContact CE-CD2 4.02Å; M549-L563 HydrophobicContact SD-CD1 3.73Å
550	I	98.7	Very high	98.3	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	15.7	173.4	65.7	159.8	0	0	0	113.9	F501 A504 L505 L531 L546 K547 V548	F501-I550 HydrophobicContact CD2-CB 3.9Å; F501-I550 HydrophobicContact CD2-CG2 4.13Å; F501-I550 HydrophobicContact CE2-CB 3.85Å; F501-I550 HydrophobicContact CE2-CG2 4.24Å; A504-I550 HydrophobicContact CB-CG2 3.64Å; L505-I550 HydrophobicContact CD2-CG2 4.07Å; L505-I550 HydrophobicContact CG-CG2 4.14Å; L531-I550 HydrophobicContact CB-CD1 4.26Å; L531-I550 HydrophobicContact CD1-CD1 3.73Å; L531-I550 HydrophobicContact CD1-CG1 4.22Å; L546-I550 PolarHBondContact O-N 2.92Å; K547-I550 WeakPolarHBondContact O-CG1 3.27Å; K547-I550 PolarHBondContact O-N 2.8Å; V548-I550 VanDerWaalsContact C-N 3.29Å; V548-I550 PolarHBondContact O-N 3.09Å
551	H	98.8	Very high	98.3	Very high	42 Å²	42	46.3 Å²	46.3	19%	0.194	23%	0.232	C	C	.	.			trans	-58.3	139.8	-177.1	-173.3	-84.7	0	0	0	111.9	K547 V548 D553 R556 R557	K547-H551 PolarHBondContact O-N 2.73Å; V548-H551 VanDerWaalsContact O-CB 3.25Å; V548-H551 WeakPolarHBondContact O-CB 3.4Å; V548-H551 PolarHBondContact O-N 3.49Å; H551-D553 PolarHBondContact ND1-N 3.39Å; H551-D553 VanDerWaalsContact ND1-N 3.13Å; H551-D553 PolarHBondContact ND1-O 3.49Å; H551-D553 VanDerWaalsContact ND1-O 3.1Å; H551-D553 PolarHBondContact O-N 2.99Å; H551-R556 HydrophobicContact CB-CB 4.45Å; H551-R556 PolarHBondContact CD2-NH1 3.31Å; H551-R556 PolarHBondContact NE2-NH1 2.81Å; H551-R557 HydrophobicContact CB-CG 4.2Å; H551-R557 PolarHBondContact O-NE 2.89Å; H551-R557 PolarHBondContact O-NH2 2.94Å
552	P	98.4	Very high	98.3	Very high	57 Å²	57	44 Å²	44	37%	0.37	23%	0.229	S	C	.	.	S	Bend	trans	-54.9	-53.7	-177.1	-28	35	0	0	0	113.1	R527 Q528 P554 R557	R527-P552 WeakPolarHBondContact O-CG 3.48Å; Q528-P552 VanDerWaalsContact C-CG 3.44Å; P552-P554 WeakPolarHBondContact O-CD 3.3Å; P552-R557 PolarHBondContact O-NH2 3.26Å; P552-R557 VanDerWaalsContact O-NH2 3.11Å
553	D	98.5	Very high	98.3	Very high	66 Å²	66	44 Å²	44	35%	0.353	23%	0.229	S	C	.	.	S	Bend	trans	-66.4	119.1	170.3	170	11.7	0	0	0	110.3	H551 E555 R556	H551-D553 PolarHBondContact ND1-N 3.39Å; H551-D553 VanDerWaalsContact ND1-N 3.13Å; H551-D553 PolarHBondContact ND1-O 3.49Å; H551-D553 VanDerWaalsContact ND1-O 3.1Å; H551-D553 PolarHBondContact O-N 2.99Å; D553-E555 VanDerWaalsContact C-N 3.31Å; D553-E555 PolarHBondContact O-N 3.4Å; D553-E555 WeakPolarHBondContact OD1-CB 3.47Å; D553-E555 PolarHBondContact OD1-N 3.11Å; D553-R556 WeakPolarHBondContact OD2-CG 3.46Å
554	P	98.5	Very high	98.2	Very high	13 Å²	13	43 Å²	43	8%	0.084	22%	0.222	C	C	.	.	S	Bend	trans	-64.1	-28	178.2	-19.3	32.2	0	0	0	114.2	E486 H494 K497 P552 R556 R557	E486-P554 HydrophobicContact CB-CG 4.18Å; E486-P554 HydrophobicContact CG-CG 3.69Å; H494-P554 HydrophobicContact CB-CB 3.91Å; K497-P554 HydrophobicContact CB-CB 3.83Å; K497-P554 HydrophobicContact CG-CB 4.23Å; K497-P554 VanDerWaalsContact CG-O 3.29Å; K497-P554 WeakPolarHBondContact CG-O 3.33Å; K497-P554 PolarHBondContact NZ-O 2.89Å; P552-P554 WeakPolarHBondContact O-CD 3.3Å; P554-R556 VanDerWaalsContact C-N 3.34Å; P554-R556 PolarHBondContact O-N 3.49Å; P554-R557 WeakPolarHBondContact O-CB 3.42Å; P554-R557 PolarHBondContact O-N 3.08Å
555	E	97.9	Very high	98	Very high	124 Å²	124	46 Å²	46	58%	0.579	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-40	-178	-65.7	-153.3	148.1	0	0	111.4	H494 K497 D553 R557	H494-E555 IonicContact CE1-OE1 2.64Å; H494-E555 PolarHBondContact CE1-OE1 2.98Å; H494-E555 IonicContact NE2-OE1 2.79Å; K497-E555 PolarHBondContact NZ-O 3.32Å; D553-E555 VanDerWaalsContact C-N 3.31Å; D553-E555 PolarHBondContact O-N 3.4Å; D553-E555 WeakPolarHBondContact OD1-CB 3.47Å; D553-E555 PolarHBondContact OD1-N 3.11Å; E555-R557 VanDerWaalsContact C-N 3.27Å; E555-R557 PolarHBondContact O-N 2.85Å
556	R	98.3	Very high	97.7	Very high	153 Å²	153	48.8 Å²	48.8	58%	0.577	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-19.6	176.6	-69.3	-167.4	68.6	-154	4.1	114.9	V548 H551 D553 P554	V548-R556 WeakPolarHBondContact CG2-O 3.41Å; H551-R556 HydrophobicContact CB-CB 4.45Å; H551-R556 PolarHBondContact CD2-NH1 3.31Å; H551-R556 PolarHBondContact NE2-NH1 2.81Å; D553-R556 WeakPolarHBondContact OD2-CG 3.46Å; P554-R556 VanDerWaalsContact C-N 3.34Å; P554-R556 PolarHBondContact O-N 3.49Å
557	R	98.6	Very high	97.4	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.015	27%	0.271	C	S	.	.	S	Bend	trans	-68.6	138	174.8	-54.9	176.6	-163.4	153.6	13.4	109.5	E486 K497 I500 M549 H551 P552 P554 E555	E486-R557 IonicContact OE1-CZ 2.81Å; E486-R557 IonicContact OE1-NH1 3.92Å; E486-R557 PolarHBondContact OE1-NH1 2.91Å; E486-R557 IonicContact OE1-NH2 3.67Å; E486-R557 PolarHBondContact OE1-NH2 2.79Å; E486-R557 IonicContact OE2-CZ 3.09Å; E486-R557 IonicContact OE2-NH1 2.65Å; E486-R557 IonicContact OE2-NH2 2.73Å; E486-R557 PolarHBondContact OE2-NH2 2.93Å; K497-R557 HydrophobicContact CD-CB 4.33Å; K497-R557 WeakPolarHBondContact CE-O 3.41Å; K497-R557 PolarHBondContact NZ-O 3.27Å; K497-R557 WeakPolarHBondContact O-CD 3.41Å; K497-R557 PolarHBondContact O-NH1 2.77Å; I500-R557 HydrophobicContact CG2-CB 4.27Å; M549-R557 VanDerWaalsContact O-CD 3.24Å; M549-R557 WeakPolarHBondContact O-CD 3.39Å; M549-R557 WeakPolarHBondContact O-CG 3.43Å; H551-R557 HydrophobicContact CB-CG 4.2Å; H551-R557 PolarHBondContact O-NE 2.89Å; H551-R557 PolarHBondContact O-NH2 2.94Å; P552-R557 PolarHBondContact O-NH2 3.26Å; P552-R557 VanDerWaalsContact O-NH2 3.11Å; P554-R557 WeakPolarHBondContact O-CB 3.42Å; P554-R557 PolarHBondContact O-N 3.08Å; E555-R557 VanDerWaalsContact C-N 3.27Å; E555-R557 PolarHBondContact O-N 2.85Å
558	P	98.5	Very high	97.1	Very high	24 Å²	24	48.6 Å²	48.6	16%	0.156	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-62.1	147.9	177.4	26.8	-34.6	0	0	0	111.2	I500 L545 M549 A562	I500-P558 WeakPolarHBondContact CG1-O 3.34Å; I500-P558 HydrophobicContact CG2-CG 4.37Å; L545-P558 HydrophobicContact CD1-CG 4.42Å; M549-P558 HydrophobicContact CG-CG 3.77Å; P558-A562 HydrophobicContact CB-CB 4.19Å
559	S	98.7	Very high	96.7	Very high	54 Å²	54	46.6 Å²	46.6	38%	0.378	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-71.5	159.5	165.9	68.6	0	0	0	0	110.3	M561 A562 L563	S559-M561 PolarHBondContact O-N 3.4Å; S559-M561 VanDerWaalsContact O-N 3.16Å; S559-A562 PolarHBondContact O-N 2.61Å; S559-A562 PolarHBondContact OG-N 3.35Å; S559-L563 WeakPolarHBondContact O-CB 3.42Å; S559-L563 PolarHBondContact O-N 3.3Å
560	A	98.3	Very high	95.9	Very high	3 Å²	3	49.6 Å²	49.6	3%	0.025	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-30.6	175.4	0	0	0	0	0	112.7	L414 R415 I500 V564	L414-A560 HydrophobicContact CB-CB 3.93Å; R415-A560 HydrophobicContact CB-CB 3.89Å; I500-A560 HydrophobicContact CD1-CB 4.11Å; A560-V564 WeakPolarHBondContact O-CG1 3.47Å; A560-V564 PolarHBondContact O-N 2.9Å
561	M	97.2	Very high	94.3	Very high	91 Å²	91	52.5 Å²	52.5	45%	0.448	28%	0.28	S	S	.	.	H	α-helix	trans	-67.4	-41.1	172.5	179.7	63	77.6	0	0	112.9	R415 S559 K565	R415-M561 HydrophobicContact CG-CB 4.39Å; R415-M561 HydrophobicContact CG-CE 4.08Å; R415-M561 HydrophobicContact CG-SD 4.47Å; S559-M561 PolarHBondContact O-N 3.4Å; S559-M561 VanDerWaalsContact O-N 3.16Å; M561-K565 WeakPolarHBondContact O-CG 3.41Å
562	A	97.4	Very high	92.1	Very high	46 Å²	46	53.4 Å²	53.4	38%	0.38	29%	0.294	S	S	.	.	H	α-helix	trans	-69.9	-42.2	176.3	0	0	0	0	0	111.2	P558 S559 V564 K565 H566	P558-A562 HydrophobicContact CB-CB 4.19Å; S559-A562 PolarHBondContact O-N 2.61Å; S559-A562 PolarHBondContact OG-N 3.35Å; A562-V564 PolarHBondContact O-N 2.82Å; A562-K565 PolarHBondContact O-N 3.2Å; A562-K565 VanDerWaalsContact O-N 3.1Å; A562-H566 PolarHBondContact O-N 3.06Å
563	L	97.3	Very high	89.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-54.5	-51.8	178.7	178.9	64.1	0	0	0	112	L407 I500 L503 L545 M549 S559 K565 H566 L569	L407-L563 HydrophobicContact CD1-CD1 4.27Å; L407-L563 HydrophobicContact CD1-CD2 3.97Å; L407-L563 HydrophobicContact CD2-CD1 4.21Å; L407-L563 HydrophobicContact CG-CD1 4.25Å; I500-L563 HydrophobicContact CD1-CD2 4.02Å; L503-L563 HydrophobicContact CD2-CD2 4Å; L545-L563 HydrophobicContact CD1-CD1 4.11Å; L545-L563 HydrophobicContact CD2-CD1 4.08Å; L545-L563 HydrophobicContact CG-CD1 4.42Å; M549-L563 HydrophobicContact CE-CD1 4.28Å; M549-L563 HydrophobicContact CE-CD2 4.02Å; M549-L563 HydrophobicContact SD-CD1 3.73Å; S559-L563 WeakPolarHBondContact O-CB 3.42Å; S559-L563 PolarHBondContact O-N 3.3Å; L563-K565 PolarHBondContact O-N 2.91Å; L563-K565 VanDerWaalsContact O-N 3.1Å; L563-H566 VanDerWaalsContact O-CB 3.31Å; L563-H566 WeakPolarHBondContact O-CB 2.97Å; L563-H566 PolarHBondContact O-N 3.24Å; L563-L569 HydrophobicContact CD1-CD1 4Å; L563-L569 HydrophobicContact CG-CD1 4.34Å
564	V	95.6	Very high	87.8	Confident	11 Å²	11	58 Å²	58	7%	0.067	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-6.8	-178.3	-57.3	0	0	0	0	114.5	L408 R412 A560 A562	L408-V564 HydrophobicContact CD1-CB 3.85Å; L408-V564 HydrophobicContact CD1-CG1 4.12Å; R412-V564 HydrophobicContact CB-CG1 4.41Å; R412-V564 HydrophobicContact CG-CB 4.32Å; R412-V564 HydrophobicContact CG-CG1 3.77Å; A560-V564 WeakPolarHBondContact O-CG1 3.47Å; A560-V564 PolarHBondContact O-N 2.9Å; A562-V564 PolarHBondContact O-N 2.82Å
565	K	93.7	Very high	85.8	Confident	142 Å²	142	59.8 Å²	59.8	62%	0.617	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-1.9	174.6	-67.7	-176.5	177.6	-174.2	0	112.9	M561 A562 L563	M561-K565 WeakPolarHBondContact O-CG 3.41Å; A562-K565 PolarHBondContact O-N 3.2Å; A562-K565 VanDerWaalsContact O-N 3.1Å; L563-K565 PolarHBondContact O-N 2.91Å; L563-K565 VanDerWaalsContact O-N 3.1Å
566	H	93.4	Very high	83.9	Confident	61 Å²	61	57.5 Å²	57.5	28%	0.282	32%	0.32	S	S	.	.			trans	-67.9	132	-176.3	-163.6	-68	0	0	0	111.6	E541 L545 A562 L563 V568 L569 L570	E541-H566 IonicContact OE1-CE1 3.51Å; L545-H566 HydrophobicContact CD2-CB 4.4Å; A562-H566 PolarHBondContact O-N 3.06Å; L563-H566 VanDerWaalsContact O-CB 3.31Å; L563-H566 WeakPolarHBondContact O-CB 2.97Å; L563-H566 PolarHBondContact O-N 3.24Å; H566-V568 VanDerWaalsContact C-N 3.33Å; H566-V568 VanDerWaalsContact ND1-CG1 3.34Å; H566-V568 WeakPolarHBondContact ND1-CG1 3.45Å; H566-V568 PolarHBondContact ND1-N 3.14Å; H566-V568 PolarHBondContact O-N 2.83Å; H566-L569 PolarHBondContact O-N 2.82Å; H566-L570 PolarHBondContact O-N 3.23Å
567	S	91.6	Very high	82.2	Confident	73 Å²	73	53.3 Å²	53.3	51%	0.51	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-43.7	-54.2	-178.9	43.5	0	0	0	0	113.1	E541 L569 L570	E541-S567 WeakPolarHBondContact OE1-CB 3.22Å; E541-S567 PolarHBondContact OE1-OG 3.21Å; S567-L569 PolarHBondContact O-N 2.88Å; S567-L570 PolarHBondContact O-N 2.97Å
568	V	92.9	Very high	80.5	Confident	9 Å²	9	57.9 Å²	57.9	6%	0.055	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-54.1	-22.9	-178.7	87.6	0	0	0	0	116	K404 E541 F542 L545 H566	K404-V568 WeakPolarHBondContact CD-O 3.37Å; K404-V568 WeakPolarHBondContact CE-O 3.02Å; K404-V568 PolarHBondContact NZ-O 3.18Å; E541-V568 HydrophobicContact CB-CB 4.45Å; E541-V568 HydrophobicContact CB-CG2 3.71Å; E541-V568 VanDerWaalsContact CD-CB 3.41Å; E541-V568 VanDerWaalsContact CD-CG2 3.45Å; E541-V568 HydrophobicContact CG-CB 3.78Å; E541-V568 HydrophobicContact CG-CG2 3.6Å; E541-V568 WeakPolarHBondContact OE1-CB 3.46Å; E541-V568 PolarHBondContact OE1-N 3.39Å; E541-V568 WeakPolarHBondContact OE2-CG2 3.38Å; F542-V568 HydrophobicContact CB-CG2 3.91Å; F542-V568 HydrophobicContact CD2-CG1 4.27Å; L545-V568 HydrophobicContact CB-CG1 4.35Å; L545-V568 HydrophobicContact CD2-CG1 3.39Å; L545-V568 HydrophobicContact CG-CG1 4.49Å; H566-V568 VanDerWaalsContact C-N 3.33Å; H566-V568 VanDerWaalsContact ND1-CG1 3.34Å; H566-V568 WeakPolarHBondContact ND1-CG1 3.45Å; H566-V568 PolarHBondContact ND1-N 3.14Å; H566-V568 PolarHBondContact O-N 2.83Å
569	L	90.1	Very high	79.1	Confident	6 Å²	6	61.3 Å²	61.3	3%	0.031	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-97.1	-16.5	178.5	-53.4	-172.1	0	0	0	112.7	K404 L407 L408 F542 L545 L563 H566 S567 S571	K404-L569 HydrophobicContact CB-CD2 4.13Å; K404-L569 HydrophobicContact CG-CD2 3.93Å; L407-L569 HydrophobicContact CD2-CD1 4.02Å; L407-L569 HydrophobicContact CD2-CD2 3.97Å; L407-L569 HydrophobicContact CG-CD1 3.94Å; L407-L569 HydrophobicContact CG-CD2 4.43Å; L408-L569 HydrophobicContact CB-CB 4.4Å; L408-L569 HydrophobicContact CB-CD1 4.41Å; L408-L569 HydrophobicContact CD2-CB 4.48Å; F542-L569 HydrophobicContact CD2-CD2 4.14Å; F542-L569 HydrophobicContact CE2-CD2 3.88Å; L545-L569 HydrophobicContact CD2-CD1 4.2Å; L545-L569 HydrophobicContact CD2-CD2 4.09Å; L545-L569 HydrophobicContact CD2-CG 4.07Å; L563-L569 HydrophobicContact CD1-CD1 4Å; L563-L569 HydrophobicContact CG-CD1 4.34Å; H566-L569 PolarHBondContact O-N 2.82Å; S567-L569 PolarHBondContact O-N 2.88Å; L569-S571 PolarHBondContact O-N 3.47Å; L569-S571 VanDerWaalsContact O-N 3.12Å
570	L	81.6	Confident	78	Confident	62 Å²	62	62.2 Å²	62.2	33%	0.325	35%	0.353	S	S	.	.			trans	-85.5	79.3	176.9	-60.4	178.5	0	0	0	109.7	H566 S567 K575	H566-L570 PolarHBondContact O-N 3.23Å; S567-L570 PolarHBondContact O-N 2.97Å; L570-K575 WeakPolarHBondContact O-CE 3.26Å
571	S	64.4	Low	77.1	Confident	62 Å²	62	69.3 Å²	69.3	43%	0.434	38%	0.379	S	S	.	.			trans	-46.3	141.5	166.7	176.7	0	0	0	0	110.6	L569 S573 R574 K575	L569-S571 PolarHBondContact O-N 3.47Å; L569-S571 VanDerWaalsContact O-N 3.12Å; S571-S573 PolarHBondContact O-N 2.8Å; S571-S573 VanDerWaalsContact O-N 3.11Å; S571-S573 PolarHBondContact OG-N 2.8Å; S571-S573 PolarHBondContact OG-OG 2.87Å; S571-R574 PolarHBondContact O-N 3.33Å; S571-K575 PolarHBondContact O-N 3.48Å
572	A	52.3	Low	76.4	Confident	60 Å²	60	69.2 Å²	69.2	50%	0.496	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-52.4	-34.6	176.7	0	0	0	0	0	112.5	R574 K575 L580	A572-R574 PolarHBondContact O-N 2.85Å; A572-K575 PolarHBondContact O-N 3.15Å; A572-L580 HydrophobicContact CB-CD2 4.46Å
573	S	51.4	Low	75.6	Confident	104 Å²	104	70.6 Å²	70.6	73%	0.727	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-65.6	-11.4	174.9	58.8	0	0	0	0	115.7	S571	S571-S573 PolarHBondContact O-N 2.8Å; S571-S573 VanDerWaalsContact O-N 3.11Å; S571-S573 PolarHBondContact OG-N 2.8Å; S571-S573 PolarHBondContact OG-OG 2.87Å
574	R	55.6	Low	75.2	Confident	115 Å²	115	75.1 Å²	75.1	43%	0.434	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-115.1	1.8	176.7	-69	-174.2	175.6	167.3	4.6	113.2	D405 S571 A572	D405-R574 IonicContact OD1-CZ 3.72Å; D405-R574 IonicContact OD1-NH1 2.64Å; D405-R574 PolarHBondContact OD1-NH1 3.36Å; D405-R574 IonicContact OD1-NH2 2.78Å; D405-R574 PolarHBondContact OD1-NH2 3.26Å; D405-R574 IonicContact OD2-NH2 3.4Å; S571-R574 PolarHBondContact O-N 3.33Å; A572-R574 PolarHBondContact O-N 2.85Å
575	K	56.5	Low	75	Confident	52 Å²	52	79.1 Å²	79.1	23%	0.226	42%	0.423	C	S	.	.	S	Bend	trans	-74.4	134	171.5	-66	-173.8	-169.1	-168.9	0	107.9	L570 S571 A572 Q579 L580 E583	L570-K575 WeakPolarHBondContact O-CE 3.26Å; S571-K575 PolarHBondContact O-N 3.48Å; A572-K575 PolarHBondContact O-N 3.15Å; K575-Q579 HydrophobicContact CB-CB 4.09Å; K575-Q579 HydrophobicContact CB-CG 4.18Å; K575-Q579 HydrophobicContact CD-CG 4.34Å; K575-Q579 HydrophobicContact CG-CG 4.33Å; K575-L580 HydrophobicContact CB-CD1 4.48Å; K575-L580 HydrophobicContact CB-CD2 3.82Å; K575-L580 HydrophobicContact CB-CG 3.75Å; K575-L580 HydrophobicContact CD-CD2 4.07Å; K575-L580 HydrophobicContact CG-CD2 4.48Å; K575-E583 WeakPolarHBondContact CD-OE2 3.36Å; K575-E583 IonicContact NZ-OE1 2.71Å; K575-E583 PolarHBondContact NZ-OE1 3.42Å; K575-E583 IonicContact NZ-OE2 3.39Å; K575-E583 PolarHBondContact NZ-OE2 2.78Å
576	S	59	Low	74.9	Confident	76 Å²	76	75.2 Å²	75.2	53%	0.531	42%	0.417	S	S	.	.			trans	-54.2	149.6	170.9	172.7	0	0	0	0	109.7	E578 Q579 L580	S576-E578 PolarHBondContact O-N 3.33Å; S576-E578 PolarHBondContact OG-N 3.23Å; S576-Q579 WeakPolarHBondContact O-CA 3.33Å; S576-Q579 WeakPolarHBondContact O-CB 3.46Å; S576-Q579 PolarHBondContact O-N 3.24Å; S576-L580 PolarHBondContact O-N 3.25Å
577	A	62.8	Low	74.8	Confident	64 Å²	64	76.5 Å²	76.5	53%	0.529	42%	0.423	S	S	.	.	H	α-helix	trans	-50.8	-33	173.3	0	0	0	0	0	111.9	R581	A577-R581 VanDerWaalsContact O-CG 3.28Å; A577-R581 WeakPolarHBondContact O-CG 3.46Å; A577-R581 PolarHBondContact O-N 3.27Å
578	E	62.8	Low	74.9	Confident	100 Å²	100	78.9 Å²	78.9	47%	0.467	43%	0.425	S	S	.	.	H	α-helix	trans	-70.6	-42	175.2	-165.9	54.2	-149.7	0	0	112.9	S576 L580 R581 I582	S576-E578 PolarHBondContact O-N 3.33Å; S576-E578 PolarHBondContact OG-N 3.23Å; E578-L580 VanDerWaalsContact C-N 3.31Å; E578-L580 PolarHBondContact O-N 2.87Å; E578-R581 WeakPolarHBondContact O-CB 3.48Å; E578-R581 PolarHBondContact O-N 3.25Å; E578-R581 IonicContact OE2-NH1 2.79Å; E578-I582 HydrophobicContact CG-CD1 4.37Å; E578-I582 WeakPolarHBondContact O-CG1 3.19Å; E578-I582 PolarHBondContact O-N 3.23Å
579	Q	69.2	Low	74.9	Confident	97 Å²	97	85.7 Å²	85.7	45%	0.453	45%	0.454	S	S	.	.	H	α-helix	trans	-63.3	-39.3	175.8	-165.8	79.1	41.4	0	0	111.2	K575 S576 I582 E583	K575-Q579 HydrophobicContact CB-CB 4.09Å; K575-Q579 HydrophobicContact CB-CG 4.18Å; K575-Q579 HydrophobicContact CD-CG 4.34Å; K575-Q579 HydrophobicContact CG-CG 4.33Å; S576-Q579 WeakPolarHBondContact O-CA 3.33Å; S576-Q579 WeakPolarHBondContact O-CB 3.46Å; S576-Q579 PolarHBondContact O-N 3.24Å; Q579-I582 PolarHBondContact O-N 2.69Å; Q579-E583 PolarHBondContact O-N 2.8Å; Q579-E583 VanDerWaalsContact O-N 3.12Å
580	L	74.9	Confident	75.1	Confident	72 Å²	72	90.4 Å²	90.4	38%	0.377	47%	0.474	S	S	.	.	H	α-helix	trans	-65.9	-39.2	174.2	-70.2	171.2	0	0	0	112.1	A572 K575 S576 E578 L584	A572-L580 HydrophobicContact CB-CD2 4.46Å; K575-L580 HydrophobicContact CB-CD1 4.48Å; K575-L580 HydrophobicContact CB-CD2 3.82Å; K575-L580 HydrophobicContact CB-CG 3.75Å; K575-L580 HydrophobicContact CD-CD2 4.07Å; K575-L580 HydrophobicContact CG-CD2 4.48Å; S576-L580 PolarHBondContact O-N 3.25Å; E578-L580 VanDerWaalsContact C-N 3.31Å; E578-L580 PolarHBondContact O-N 2.87Å; L580-L584 WeakPolarHBondContact O-CB 3.45Å; L580-L584 PolarHBondContact O-N 2.96Å
581	R	80	Confident	75.6	Confident	152 Å²	152	91.4 Å²	91.4	57%	0.574	48%	0.48	S	S	*	.	H	α-helix	trans	-63.5	-43.8	174.2	-77.3	168.2	177.2	169.5	-2.4	112.3	A577 E578 L584 N585	A577-R581 VanDerWaalsContact O-CG 3.28Å; A577-R581 WeakPolarHBondContact O-CG 3.46Å; A577-R581 PolarHBondContact O-N 3.27Å; E578-R581 WeakPolarHBondContact O-CB 3.48Å; E578-R581 PolarHBondContact O-N 3.25Å; E578-R581 IonicContact OE2-NH1 2.79Å; R581-L584 PolarHBondContact O-N 2.89Å; R581-N585 WeakPolarHBondContact O-CB 3.48Å; R581-N585 PolarHBondContact O-N 3.05Å; R581-N585 PolarHBondContact O-ND2 3.36Å
582	I	81.3	Confident	77	Confident	90 Å²	90	91.8 Å²	91.8	46%	0.462	48%	0.482	S	S	.	.	H	α-helix	trans	-60.7	-48.4	178	-68.1	164.4	0	0	0	110.5	E578 Q579 N585 A586	E578-I582 HydrophobicContact CG-CD1 4.37Å; E578-I582 WeakPolarHBondContact O-CG1 3.19Å; E578-I582 PolarHBondContact O-N 3.23Å; Q579-I582 PolarHBondContact O-N 2.69Å; I582-N585 PolarHBondContact O-N 3.14Å; I582-A586 WeakPolarHBondContact O-CB 3.36Å; I582-A586 PolarHBondContact O-N 3.08Å
583	E	82.2	Confident	79.1	Confident	74 Å²	74	93.3 Å²	93.3	35%	0.346	48%	0.481	S	S	.	.	H	α-helix	trans	-65.1	-43.1	177.7	-72.2	178.2	-175	0	0	112.6	K575 Q579 N585 A586 E587	K575-E583 WeakPolarHBondContact CD-OE2 3.36Å; K575-E583 IonicContact NZ-OE1 2.71Å; K575-E583 PolarHBondContact NZ-OE1 3.42Å; K575-E583 IonicContact NZ-OE2 3.39Å; K575-E583 PolarHBondContact NZ-OE2 2.78Å; Q579-E583 PolarHBondContact O-N 2.8Å; Q579-E583 VanDerWaalsContact O-N 3.12Å; E583-N585 VanDerWaalsContact C-N 3.3Å; E583-N585 PolarHBondContact O-N 3.23Å; E583-A586 PolarHBondContact O-N 2.67Å; E583-E587 PolarHBondContact O-N 3.17Å
584	L	88.5	Confident	81.1	Confident	95 Å²	95	93.3 Å²	93.3	50%	0.497	47%	0.473	S	S	.	.	H	α-helix	trans	-60.3	-40.5	176.2	-179	65	0	0	0	111.6	L580 R581 K588	L580-L584 WeakPolarHBondContact O-CB 3.45Å; L580-L584 PolarHBondContact O-N 2.96Å; R581-L584 PolarHBondContact O-N 2.89Å; L584-K588 HydrophobicContact CG-CD 4.23Å; L584-K588 VanDerWaalsContact O-CB 3.32Å; L584-K588 WeakPolarHBondContact O-CB 3.4Å; L584-K588 WeakPolarHBondContact O-CG 3.31Å; L584-K588 PolarHBondContact O-N 2.86Å
585	N	90.4	Very high	82.9	Confident	96 Å²	96	94.2 Å²	94.2	51%	0.513	48%	0.482	S	S	.	.	H	α-helix	trans	-70.4	-38.2	177.7	-71.7	-17.1	0	0	0	111.9	R581 I582 E583 K588 F589	R581-N585 WeakPolarHBondContact O-CB 3.48Å; R581-N585 PolarHBondContact O-N 3.05Å; R581-N585 PolarHBondContact O-ND2 3.36Å; I582-N585 PolarHBondContact O-N 3.14Å; E583-N585 VanDerWaalsContact C-N 3.3Å; E583-N585 PolarHBondContact O-N 3.23Å; N585-K588 PolarHBondContact O-N 2.97Å; N585-F589 WeakPolarHBondContact O-CB 3.23Å; N585-F589 PolarHBondContact O-N 3.12Å
586	A	92.2	Very high	84.6	Confident	59 Å²	59	98.3 Å²	98.3	49%	0.488	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-45.3	174.1	0	0	0	0	0	112.1	I582 E583 F589 K590	I582-A586 WeakPolarHBondContact O-CB 3.36Å; I582-A586 PolarHBondContact O-N 3.08Å; E583-A586 PolarHBondContact O-N 2.67Å; A586-F589 PolarHBondContact O-N 2.94Å; A586-K590 PolarHBondContact O-N 3.36Å
587	E	92.1	Very high	86.3	Confident	89 Å²	89	98.8 Å²	98.8	42%	0.416	49%	0.493	S	S	.	.	H	α-helix	trans	-75.2	-29.3	178	-74.6	-63.3	160	0	0	113	E583 K590 N591	E583-E587 PolarHBondContact O-N 3.17Å; E587-K590 PolarHBondContact O-N 2.86Å; E587-K590 IonicContact OE1-NZ 3.81Å; E587-K590 PolarHBondContact OE1-NZ 2.85Å; E587-K590 WeakPolarHBondContact OE2-CD 3.28Å; E587-K590 IonicContact OE2-NZ 3.4Å; E587-K590 PolarHBondContact OE2-NZ 2.91Å; E587-N591 WeakPolarHBondContact O-CB 3.27Å; E587-N591 PolarHBondContact O-N 3.06Å; E587-N591 PolarHBondContact O-ND2 2.99Å
588	K	91.9	Very high	87.8	Confident	123 Å²	123	100.5 Å²	100.5	54%	0.535	49%	0.493	S	S	.	.	H	α-helix	trans	-60.8	-44.3	166.6	-80.6	172.9	177.5	179	0	111.6	L584 N585 N591 S592	L584-K588 HydrophobicContact CG-CD 4.23Å; L584-K588 VanDerWaalsContact O-CB 3.32Å; L584-K588 WeakPolarHBondContact O-CB 3.4Å; L584-K588 WeakPolarHBondContact O-CG 3.31Å; L584-K588 PolarHBondContact O-N 2.86Å; N585-K588 PolarHBondContact O-N 2.97Å; K588-N591 PolarHBondContact O-N 2.9Å; K588-S592 WeakPolarHBondContact O-CB 3.42Å; K588-S592 PolarHBondContact O-N 3.47Å
589	F	94.6	Very high	89.2	Confident	152 Å²	152	101.8 Å²	101.8	67%	0.667	50%	0.497	S	S	*	.	H	α-helix	trans	-62.6	-46.4	176.8	179.5	-97.3	0	0	0	111.8	N585 A586 N591 S592 L593	N585-F589 WeakPolarHBondContact O-CB 3.23Å; N585-F589 PolarHBondContact O-N 3.12Å; A586-F589 PolarHBondContact O-N 2.94Å; F589-N591 PolarHBondContact O-N 2.8Å; F589-S592 WeakPolarHBondContact O-CB 3.09Å; F589-S592 PolarHBondContact O-N 3.49Å; F589-L593 PolarHBondContact O-N 2.89Å
590	K	94.1	Very high	90.4	Very high	105 Å²	105	102.2 Å²	102.2	46%	0.457	50%	0.498	S	S	.	.	H	α-helix	trans	-61	-43.9	177.1	-165.2	-163.2	-161.3	176.2	0	112.3	A586 E587 L593 L594	A586-K590 PolarHBondContact O-N 3.36Å; E587-K590 PolarHBondContact O-N 2.86Å; E587-K590 IonicContact OE1-NZ 3.81Å; E587-K590 PolarHBondContact OE1-NZ 2.85Å; E587-K590 WeakPolarHBondContact OE2-CD 3.28Å; E587-K590 IonicContact OE2-NZ 3.4Å; E587-K590 PolarHBondContact OE2-NZ 2.91Å; K590-L593 PolarHBondContact O-N 2.83Å; K590-L594 WeakPolarHBondContact O-CG 3.31Å; K590-L594 PolarHBondContact O-N 3.38Å
591	N	91.3	Very high	91.1	Very high	83 Å²	83	101.7 Å²	101.7	44%	0.444	50%	0.504	S	S	.	.	H	α-helix	trans	-64	-40.6	174.7	-82.5	-66.6	0	0	0	112.2	E587 K588 F589 L593 L594 Q595	E587-N591 WeakPolarHBondContact O-CB 3.27Å; E587-N591 PolarHBondContact O-N 3.06Å; E587-N591 PolarHBondContact O-ND2 2.99Å; K588-N591 PolarHBondContact O-N 2.9Å; F589-N591 PolarHBondContact O-N 2.8Å; N591-L593 VanDerWaalsContact C-N 3.34Å; N591-L593 PolarHBondContact O-N 2.78Å; N591-L594 PolarHBondContact O-N 3.41Å; N591-Q595 WeakPolarHBondContact O-CB 3.22Å; N591-Q595 VanDerWaalsContact O-CG 3.29Å; N591-Q595 WeakPolarHBondContact O-CG 3.35Å; N591-Q595 PolarHBondContact O-N 3.36Å
592	S	94.8	Very high	91.7	Very high	70 Å²	70	100.1 Å²	100.1	49%	0.49	50%	0.503	S	S	.	.	H	α-helix	trans	-61	-42.1	174.6	-174.3	0	0	0	0	112.1	K588 F589 Q595 K596	K588-S592 WeakPolarHBondContact O-CB 3.42Å; K588-S592 PolarHBondContact O-N 3.47Å; F589-S592 WeakPolarHBondContact O-CB 3.09Å; F589-S592 PolarHBondContact O-N 3.49Å; S592-Q595 PolarHBondContact O-N 2.85Å; S592-K596 PolarHBondContact O-N 2.59Å
593	L	95.6	Very high	92.1	Very high	91 Å²	91	101.4 Å²	101.4	48%	0.476	51%	0.509	S	S	.	.	H	α-helix	trans	-63.3	-47.4	175.5	-175.6	63.8	0	0	0	111.7	F589 K590 N591 Q595 K596 E597	F589-L593 PolarHBondContact O-N 2.89Å; K590-L593 PolarHBondContact O-N 2.83Å; N591-L593 VanDerWaalsContact C-N 3.34Å; N591-L593 PolarHBondContact O-N 2.78Å; L593-Q595 PolarHBondContact O-N 3.24Å; L593-K596 WeakPolarHBondContact O-CB 3.31Å; L593-K596 PolarHBondContact O-N 2.84Å; L593-E597 PolarHBondContact O-N 2.94Å
594	L	92.5	Very high	92.4	Very high	104 Å²	104	101 Å²	101	55%	0.545	52%	0.517	S	S	.	.	H	α-helix	trans	-61	-43.1	176.8	-72.4	170.8	0	0	0	112	K590 N591 K596 E597 L598	K590-L594 WeakPolarHBondContact O-CG 3.31Å; K590-L594 PolarHBondContact O-N 3.38Å; N591-L594 PolarHBondContact O-N 3.41Å; L594-K596 VanDerWaalsContact C-N 3.31Å; L594-K596 PolarHBondContact O-N 2.89Å; L594-E597 PolarHBondContact O-N 3.25Å; L594-L598 VanDerWaalsContact O-CB 3.28Å; L594-L598 WeakPolarHBondContact O-CB 3.37Å; L594-L598 PolarHBondContact O-N 3Å
595	Q	93.3	Very high	92.5	Very high	135 Å²	135	102.7 Å²	102.7	63%	0.631	52%	0.521	S	S	*	.	H	α-helix	trans	-60.7	-38.6	174.5	-75.7	175.4	-4.2	0	0	112.2	N591 S592 L593 L598 K599	N591-Q595 WeakPolarHBondContact O-CB 3.22Å; N591-Q595 VanDerWaalsContact O-CG 3.29Å; N591-Q595 WeakPolarHBondContact O-CG 3.35Å; N591-Q595 PolarHBondContact O-N 3.36Å; S592-Q595 PolarHBondContact O-N 2.85Å; L593-Q595 PolarHBondContact O-N 3.24Å; Q595-L598 PolarHBondContact O-N 2.71Å; Q595-K599 WeakPolarHBondContact O-CB 3.49Å; Q595-K599 PolarHBondContact O-N 3.02Å
596	K	94.1	Very high	92.4	Very high	137 Å²	137	100.6 Å²	100.6	60%	0.596	52%	0.517	S	S	*	.	H	α-helix	trans	-66	-44.2	177.3	-169.4	175.8	-175.9	176.2	0	111.9	S592 L593 L594 K599 K600	S592-K596 PolarHBondContact O-N 2.59Å; L593-K596 WeakPolarHBondContact O-CB 3.31Å; L593-K596 PolarHBondContact O-N 2.84Å; L594-K596 VanDerWaalsContact C-N 3.31Å; L594-K596 PolarHBondContact O-N 2.89Å; K596-K599 PolarHBondContact O-N 3.04Å; K596-K600 WeakPolarHBondContact O-CG 3.32Å; K596-K600 PolarHBondContact O-N 3.24Å
597	E	94.4	Very high	92.1	Very high	86 Å²	86	99.6 Å²	99.6	40%	0.402	51%	0.508	S	S	.	.	H	α-helix	trans	-67.3	-40.3	175.3	-64.7	-48.4	126.8	0	0	112.1	L593 L594 K599 K600 A601	L593-E597 PolarHBondContact O-N 2.94Å; L594-E597 PolarHBondContact O-N 3.25Å; E597-K599 VanDerWaalsContact C-N 3.34Å; E597-K599 PolarHBondContact O-N 3.5Å; E597-K600 VanDerWaalsContact CD-NZ 3.3Å; E597-K600 WeakPolarHBondContact O-CB 3.46Å; E597-K600 PolarHBondContact O-N 2.95Å; E597-K600 WeakPolarHBondContact OE1-CE 3.27Å; E597-K600 IonicContact OE1-NZ 2.65Å; E597-K600 PolarHBondContact OE1-NZ 3.38Å; E597-K600 WeakPolarHBondContact OE2-CD 3.42Å; E597-K600 IonicContact OE2-NZ 3.13Å; E597-K600 PolarHBondContact OE2-NZ 3.02Å; E597-K600 VanDerWaalsContact OE2-NZ 3.13Å; E597-A601 WeakPolarHBondContact O-CB 3.47Å; E597-A601 PolarHBondContact O-N 2.91Å
598	L	93.2	Very high	91.6	Very high	101 Å²	101	98 Å²	98	53%	0.529	51%	0.511	S	S	.	.	H	α-helix	trans	-61.5	-42.8	175.7	-156.6	164.8	0	0	0	110.8	L594 Q595 A601 Q602	L594-L598 VanDerWaalsContact O-CB 3.28Å; L594-L598 WeakPolarHBondContact O-CB 3.37Å; L594-L598 PolarHBondContact O-N 3Å; Q595-L598 PolarHBondContact O-N 2.71Å; L598-A601 PolarHBondContact O-N 3Å; L598-Q602 HydrophobicContact CD2-CG 4.04Å; L598-Q602 WeakPolarHBondContact O-CG 3.45Å; L598-Q602 PolarHBondContact O-N 2.87Å
599	K	93.2	Very high	91.3	Very high	127 Å²	127	97 Å²	97	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-65.2	-39.5	175.4	-162.6	-179.1	-176.3	174.7	0	112.5	Q595 K596 E597 Q602 M603	Q595-K599 WeakPolarHBondContact O-CB 3.49Å; Q595-K599 PolarHBondContact O-N 3.02Å; K596-K599 PolarHBondContact O-N 3.04Å; E597-K599 VanDerWaalsContact C-N 3.34Å; E597-K599 PolarHBondContact O-N 3.5Å; K599-Q602 PolarHBondContact O-N 3.47Å; K599-M603 HydrophobicContact CD-CE 4.16Å; K599-M603 HydrophobicContact CG-CE 4.03Å; K599-M603 WeakPolarHBondContact O-CG 3.35Å; K599-M603 PolarHBondContact O-N 2.67Å
600	K	93	Very high	90.7	Very high	106 Å²	106	96.4 Å²	96.4	46%	0.461	51%	0.507	S	S	.	.	H	α-helix	trans	-61.6	-45.7	171.8	-73.3	176.9	-172.2	168.9	0	111.6	K596 E597 Q602 M603 A604	K596-K600 WeakPolarHBondContact O-CG 3.32Å; K596-K600 PolarHBondContact O-N 3.24Å; E597-K600 VanDerWaalsContact CD-NZ 3.3Å; E597-K600 WeakPolarHBondContact O-CB 3.46Å; E597-K600 PolarHBondContact O-N 2.95Å; E597-K600 WeakPolarHBondContact OE1-CE 3.27Å; E597-K600 IonicContact OE1-NZ 2.65Å; E597-K600 PolarHBondContact OE1-NZ 3.38Å; E597-K600 WeakPolarHBondContact OE2-CD 3.42Å; E597-K600 IonicContact OE2-NZ 3.13Å; E597-K600 PolarHBondContact OE2-NZ 3.02Å; E597-K600 VanDerWaalsContact OE2-NZ 3.13Å; K600-Q602 VanDerWaalsContact C-N 3.31Å; K600-Q602 PolarHBondContact O-N 2.89Å; K600-M603 PolarHBondContact O-N 3.39Å; K600-A604 WeakPolarHBondContact O-CB 3.46Å; K600-A604 PolarHBondContact O-N 3.42Å
601	A	91	Very high	90	Very high	61 Å²	61	100.3 Å²	100.3	50%	0.504	52%	0.519	S	S	.	.	H	α-helix	trans	-61.7	-40.1	179	0	0	0	0	0	111.6	E597 L598 A604 K605	E597-A601 WeakPolarHBondContact O-CB 3.47Å; E597-A601 PolarHBondContact O-N 2.91Å; L598-A601 PolarHBondContact O-N 3Å; A601-A604 PolarHBondContact O-N 3.47Å; A601-K605 WeakPolarHBondContact O-CB 3.28Å; A601-K605 PolarHBondContact O-N 3.48Å
602	Q	92.1	Very high	89.3	Confident	118 Å²	118	99 Å²	99	55%	0.551	52%	0.519	S	S	*	.	H	α-helix	trans	-62.4	-46.1	172.4	-75.2	174.1	-19.1	0	0	112.5	L598 K599 K600 K605 A606	L598-Q602 HydrophobicContact CD2-CG 4.04Å; L598-Q602 WeakPolarHBondContact O-CG 3.45Å; L598-Q602 PolarHBondContact O-N 2.87Å; K599-Q602 PolarHBondContact O-N 3.47Å; K600-Q602 VanDerWaalsContact C-N 3.31Å; K600-Q602 PolarHBondContact O-N 2.89Å; Q602-K605 PolarHBondContact O-N 3.22Å; Q602-A606 WeakPolarHBondContact O-CB 3.4Å; Q602-A606 PolarHBondContact O-N 3Å
603	M	89.6	Confident	88.3	Confident	118 Å²	118	101.1 Å²	101.1	58%	0.581	53%	0.525	S	S	*	.	H	α-helix	trans	-63	-41.9	175.9	-69.5	-174.2	-164.4	0	0	112.2	K599 K600 A606 A607	K599-M603 HydrophobicContact CD-CE 4.16Å; K599-M603 HydrophobicContact CG-CE 4.03Å; K599-M603 WeakPolarHBondContact O-CG 3.35Å; K599-M603 PolarHBondContact O-N 2.67Å; K600-M603 PolarHBondContact O-N 3.39Å; M603-A606 PolarHBondContact O-N 2.75Å; M603-A607 WeakPolarHBondContact O-CB 3.4Å; M603-A607 PolarHBondContact O-N 3.08Å
604	A	88.5	Confident	87.2	Confident	64 Å²	64	103 Å²	103	53%	0.529	53%	0.529	S	S	.	.	H	α-helix	trans	-64.2	-40.2	177.4	0	0	0	0	0	111.8	K600 A601 A608	K600-A604 WeakPolarHBondContact O-CB 3.46Å; K600-A604 PolarHBondContact O-N 3.42Å; A601-A604 PolarHBondContact O-N 3.47Å; A604-A608 WeakPolarHBondContact O-CB 3.19Å; A604-A608 PolarHBondContact O-N 2.68Å
605	K	91.2	Very high	86.2	Confident	131 Å²	131	102.2 Å²	102.2	57%	0.57	53%	0.529	S	S	*	.	H	α-helix	trans	-63.2	-49.9	173.3	179.8	176.6	169.7	178.6	0	111.5	A601 Q602 A607 A608 E609	A601-K605 WeakPolarHBondContact O-CB 3.28Å; A601-K605 PolarHBondContact O-N 3.48Å; Q602-K605 PolarHBondContact O-N 3.22Å; K605-A607 VanDerWaalsContact C-N 3.33Å; K605-A607 PolarHBondContact O-N 3.33Å; K605-A608 WeakPolarHBondContact O-CB 3.5Å; K605-A608 PolarHBondContact O-N 3.28Å; K605-A608 VanDerWaalsContact O-N 3.09Å; K605-E609 WeakPolarHBondContact CE-OE1 3.46Å; K605-E609 IonicContact NZ-OE1 3.45Å; K605-E609 WeakPolarHBondContact O-CG 3.42Å; K605-E609 PolarHBondContact O-N 3.45Å
606	A	87.7	Confident	84.8	Confident	52 Å²	52	100.5 Å²	100.5	43%	0.43	52%	0.524	S	S	.	.	H	α-helix	trans	-60.5	-41.1	178.4	0	0	0	0	0	112.2	Q602 M603 A608 E609 E610	Q602-A606 WeakPolarHBondContact O-CB 3.4Å; Q602-A606 PolarHBondContact O-N 3Å; M603-A606 PolarHBondContact O-N 2.75Å; A606-A608 VanDerWaalsContact C-N 3.33Å; A606-A608 PolarHBondContact O-N 3.46Å; A606-E609 PolarHBondContact O-N 3.4Å; A606-E610 WeakPolarHBondContact O-CB 3.09Å; A606-E610 PolarHBondContact O-N 3.5Å
607	A	86.1	Confident	83.4	Confident	38 Å²	38	103.1 Å²	103.1	31%	0.314	53%	0.53	S	S	.	.	H	α-helix	trans	-68.5	-29.7	175.2	0	0	0	0	0	113	M603 K605 R611	M603-A607 WeakPolarHBondContact O-CB 3.4Å; M603-A607 PolarHBondContact O-N 3.08Å; K605-A607 VanDerWaalsContact C-N 3.33Å; K605-A607 PolarHBondContact O-N 3.33Å; A607-R611 VanDerWaalsContact O-CB 3.32Å; A607-R611 WeakPolarHBondContact O-CB 3.5Å; A607-R611 WeakPolarHBondContact O-CD 3.46Å; A607-R611 WeakPolarHBondContact O-CG 3.38Å; A607-R611 PolarHBondContact O-N 3.08Å
608	A	82.6	Confident	81.7	Confident	56 Å²	56	104.1 Å²	104.1	46%	0.463	54%	0.537	S	S	.	.	H	α-helix	trans	-72.2	-41	172.3	0	0	0	0	0	111.7	A604 K605 A606 R611 A612	A604-A608 WeakPolarHBondContact O-CB 3.19Å; A604-A608 PolarHBondContact O-N 2.68Å; K605-A608 WeakPolarHBondContact O-CB 3.5Å; K605-A608 PolarHBondContact O-N 3.28Å; K605-A608 VanDerWaalsContact O-N 3.09Å; A606-A608 VanDerWaalsContact C-N 3.33Å; A606-A608 PolarHBondContact O-N 3.46Å; A608-R611 PolarHBondContact O-N 2.69Å; A608-A612 WeakPolarHBondContact O-CB 3.46Å; A608-A612 PolarHBondContact O-N 3.1Å
609	E	85.3	Confident	80.1	Confident	101 Å²	101	102 Å²	102	47%	0.472	53%	0.533	S	S	.	.	H	α-helix	trans	-64.1	-43.9	174	-71.8	171.4	171.8	0	0	111.5	K605 A606 A612 L613	K605-E609 WeakPolarHBondContact CE-OE1 3.46Å; K605-E609 IonicContact NZ-OE1 3.45Å; K605-E609 WeakPolarHBondContact O-CG 3.42Å; K605-E609 PolarHBondContact O-N 3.45Å; A606-E609 PolarHBondContact O-N 3.4Å; E609-A612 PolarHBondContact O-N 3.5Å; E609-L613 WeakPolarHBondContact O-CB 3.49Å; E609-L613 VanDerWaalsContact O-CG 3.31Å; E609-L613 WeakPolarHBondContact O-CG 3.47Å; E609-L613 PolarHBondContact O-N 3.19Å
610	E	81.3	Confident	78.4	Confident	140 Å²	140	99.8 Å²	99.8	65%	0.654	53%	0.531	S	S	*	.	H	α-helix	trans	-63.1	-42.6	174.4	-171.7	-177	-169.7	0	0	111.8	A606 A612 L613 F614	A606-E610 WeakPolarHBondContact O-CB 3.09Å; A606-E610 PolarHBondContact O-N 3.5Å; E610-A612 PolarHBondContact O-N 2.66Å; E610-L613 PolarHBondContact O-N 2.83Å; E610-F614 WeakPolarHBondContact O-CB 3.17Å; E610-F614 PolarHBondContact O-N 3.12Å
611	R	79.3	Confident	76.5	Confident	187 Å²	187	104 Å²	104	71%	0.706	54%	0.544	S	S	*	.	H	α-helix	trans	-61.6	-42.7	174	-79.1	171.5	-178.7	173.8	1.4	112	A607 A608 F614 T615	A607-R611 VanDerWaalsContact O-CB 3.32Å; A607-R611 WeakPolarHBondContact O-CB 3.5Å; A607-R611 WeakPolarHBondContact O-CD 3.46Å; A607-R611 WeakPolarHBondContact O-CG 3.38Å; A607-R611 PolarHBondContact O-N 3.08Å; A608-R611 PolarHBondContact O-N 2.69Å; R611-F614 PolarHBondContact O-N 2.93Å; R611-T615 PolarHBondContact O-N 3.28Å; R611-T615 PolarHBondContact O-OG1 2.83Å; R611-T615 VanDerWaalsContact O-OG1 3.07Å
612	A	76.6	Confident	74.6	Confident	55 Å²	55	105.6 Å²	105.6	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-60.8	-47.2	176.2	0	0	0	0	0	111.5	A608 E609 E610 F614 T615 D616	A608-A612 WeakPolarHBondContact O-CB 3.46Å; A608-A612 PolarHBondContact O-N 3.1Å; E609-A612 PolarHBondContact O-N 3.5Å; E610-A612 PolarHBondContact O-N 2.66Å; A612-F614 VanDerWaalsContact C-N 3.32Å; A612-F614 PolarHBondContact O-N 3.21Å; A612-T615 WeakPolarHBondContact CA-OG1 3.42Å; A612-T615 PolarHBondContact O-N 2.9Å; A612-T615 PolarHBondContact O-OG1 2.7Å; A612-D616 WeakPolarHBondContact O-CB 3.17Å; A612-D616 PolarHBondContact O-N 2.59Å
613	L	73.5	Confident	72.5	Confident	115 Å²	115	104.2 Å²	104.2	60%	0.602	55%	0.551	S	S	*	*	H	α-helix	trans	-63.4	-34.6	175.6	-70.8	167.2	0	0	0	112.8	E609 E610 R617	E609-L613 WeakPolarHBondContact O-CB 3.49Å; E609-L613 VanDerWaalsContact O-CG 3.31Å; E609-L613 WeakPolarHBondContact O-CG 3.47Å; E609-L613 PolarHBondContact O-N 3.19Å; E610-L613 PolarHBondContact O-N 2.83Å; L613-R617 WeakPolarHBondContact O-CB 3.22Å; L613-R617 WeakPolarHBondContact O-CG 3.39Å; L613-R617 PolarHBondContact O-N 3.06Å
614	F	73.8	Confident	70.6	Confident	130 Å²	130	104.5 Å²	104.5	57%	0.57	56%	0.559	S	S	*	*	H	α-helix	trans	-70	-42.1	174.7	-175.5	-93.7	0	0	0	111.9	E610 R611 A612 R617 M618	E610-F614 WeakPolarHBondContact O-CB 3.17Å; E610-F614 PolarHBondContact O-N 3.12Å; R611-F614 PolarHBondContact O-N 2.93Å; A612-F614 VanDerWaalsContact C-N 3.32Å; A612-F614 PolarHBondContact O-N 3.21Å; F614-R617 PolarHBondContact O-N 3.03Å; F614-M618 HydrophobicContact CD1-CG 4.46Å; F614-M618 HydrophobicContact CE1-CE 4.14Å; F614-M618 HydrophobicContact CE1-CG 4.08Å; F614-M618 HydrophobicContact CZ-CE 3.8Å; F614-M618 HydrophobicContact CZ-CG 4.47Å; F614-M618 PolarHBondContact O-N 3.18Å
615	T	70.3	Confident	68.7	Low	88 Å²	88	110.5 Å²	110.5	54%	0.54	58%	0.576	S	S	.	*	H	α-helix	trans	-65.2	-38.2	174.9	47.5	0	0	0	0	112.4	R611 A612 M618 A619	R611-T615 PolarHBondContact O-N 3.28Å; R611-T615 PolarHBondContact O-OG1 2.83Å; R611-T615 VanDerWaalsContact O-OG1 3.07Å; A612-T615 WeakPolarHBondContact CA-OG1 3.42Å; A612-T615 PolarHBondContact O-N 2.9Å; A612-T615 PolarHBondContact O-OG1 2.7Å; T615-M618 WeakPolarHBondContact O-CB 3.39Å; T615-M618 PolarHBondContact O-N 2.84Å; T615-A619 PolarHBondContact O-N 2.99Å
616	D	63.5	Low	66.7	Low	99 Å²	99	109 Å²	109	53%	0.529	58%	0.583	S	S	.	*	H	α-helix	trans	-66.8	-40	175.9	-171.9	49.1	0	0	0	111.8	A612 M618 A619 T620	A612-D616 WeakPolarHBondContact O-CB 3.17Å; A612-D616 PolarHBondContact O-N 2.59Å; D616-M618 VanDerWaalsContact C-N 3.33Å; D616-M618 PolarHBondContact O-N 2.81Å; D616-A619 PolarHBondContact O-N 2.87Å; D616-T620 WeakPolarHBondContact O-CG2 3.43Å; D616-T620 PolarHBondContact O-N 2.96Å; D616-T620 PolarHBondContact O-OG1 2.91Å
617	R	64.8	Low	64.6	Low	192 Å²	192	113.5 Å²	113.5	73%	0.725	60%	0.599	S	S	*	*	H	α-helix	trans	-64.1	-31.7	170.5	-81.2	-178.3	166.2	-175.5	-2.4	113.9	L613 F614 T620 R621	L613-R617 WeakPolarHBondContact O-CB 3.22Å; L613-R617 WeakPolarHBondContact O-CG 3.39Å; L613-R617 PolarHBondContact O-N 3.06Å; F614-R617 PolarHBondContact O-N 3.03Å; R617-T620 WeakPolarHBondContact CA-OG1 3.2Å; R617-T620 PolarHBondContact O-OG1 2.87Å; R617-R621 WeakPolarHBondContact O-CB 3.33Å; R617-R621 PolarHBondContact O-N 3.09Å
618	M	60.4	Low	62.8	Low	108 Å²	108	122.7 Å²	122.7	53%	0.532	63%	0.626	S	S	.	*	H	α-helix	trans	-71.4	-44.9	173.1	-84.5	-73.5	178	0	0	111.8	F614 T615 D616 R621 S622	F614-M618 HydrophobicContact CD1-CG 4.46Å; F614-M618 HydrophobicContact CE1-CE 4.14Å; F614-M618 HydrophobicContact CE1-CG 4.08Å; F614-M618 HydrophobicContact CZ-CE 3.8Å; F614-M618 HydrophobicContact CZ-CG 4.47Å; F614-M618 PolarHBondContact O-N 3.18Å; T615-M618 WeakPolarHBondContact O-CB 3.39Å; T615-M618 PolarHBondContact O-N 2.84Å; D616-M618 VanDerWaalsContact C-N 3.33Å; D616-M618 PolarHBondContact O-N 2.81Å; M618-R621 PolarHBondContact O-N 3.06Å; M618-S622 PolarHBondContact O-N 3.37Å
619	A	59.2	Low	61.3	Low	56 Å²	56	126.5 Å²	126.5	46%	0.463	64%	0.643	S	S	.	*	H	α-helix	trans	-61.4	-45.2	177.6	0	0	0	0	0	112.3	T615 D616 S622 T623	T615-A619 PolarHBondContact O-N 2.99Å; D616-A619 PolarHBondContact O-N 2.87Å; A619-S622 PolarHBondContact O-N 3.31Å; A619-T623 PolarHBondContact O-N 3.06Å; A619-T623 PolarHBondContact O-OG1 2.68Å
620	T	56.9	Low	59.3	Low	80 Å²	80	127.4 Å²	127.4	49%	0.491	66%	0.661	S	S	.	*	H	α-helix	trans	-66.4	-35.7	177.3	49.1	0	0	0	0	113	D616 R617	D616-T620 WeakPolarHBondContact O-CG2 3.43Å; D616-T620 PolarHBondContact O-N 2.96Å; D616-T620 PolarHBondContact O-OG1 2.91Å; R617-T620 WeakPolarHBondContact CA-OG1 3.2Å; R617-T620 PolarHBondContact O-OG1 2.87Å
621	R	53.5	Low	57.8	Low	196 Å²	196	131.9 Å²	131.9	74%	0.74	67%	0.672	S	S	*	*	H	α-helix	trans	-66.1	-43.6	171.9	-107.1	-180	164.9	179	-4.8	112.8	R617 M618 T623 T624	R617-R621 WeakPolarHBondContact O-CB 3.33Å; R617-R621 PolarHBondContact O-N 3.09Å; M618-R621 PolarHBondContact O-N 3.06Å; R621-T623 PolarHBondContact O-N 2.99Å; R621-T623 VanDerWaalsContact O-N 3.13Å; R621-T624 PolarHBondContact O-N 3.45Å; R621-T624 VanDerWaalsContact O-N 3.11Å; R621-T624 PolarHBondContact O-OG1 2.91Å
622	S	49.8	Very low	56.3	Low	93 Å²	93	131.2 Å²	131.2	65%	0.65	68%	0.681	S	S	*	*	H	α-helix	trans	-64.9	-17.6	-178.1	-155.3	0	0	0	0	113.4	M618 A619 T624	M618-S622 PolarHBondContact O-N 3.37Å; A619-S622 PolarHBondContact O-N 3.31Å; S622-T624 VanDerWaalsContact C-N 3.3Å; S622-T624 PolarHBondContact O-N 2.73Å
623	T	49.1	Very low	54.7	Low	90 Å²	90	136.2 Å²	136.2	55%	0.552	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-14	177.3	-56.5	0	0	0	0	113	A619 R621	A619-T623 PolarHBondContact O-N 3.06Å; A619-T623 PolarHBondContact O-OG1 2.68Å; R621-T623 PolarHBondContact O-N 2.99Å; R621-T623 VanDerWaalsContact O-N 3.13Å
624	T	48.7	Very low	53.3	Low	124 Å²	124	134 Å²	134	76%	0.761	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-9.4	-177.8	60.6	0	0	0	0	115	R621 S622	R621-T624 PolarHBondContact O-N 3.45Å; R621-T624 VanDerWaalsContact O-N 3.11Å; R621-T624 PolarHBondContact O-OG1 2.91Å; S622-T624 VanDerWaalsContact C-N 3.3Å; S622-T624 PolarHBondContact O-N 2.73Å
625	Q	48.6	Very low	52	Low	190 Å²	190	138 Å²	138	89%	0.888	72%	0.721	S	S	*	*	S	Bend	trans	-114	0.9	-175.8	-131.2	174.7	16	0	0	115.3
626	S	49.7	Very low	50.9	Low	100 Å²	100	142.9 Å²	142.9	70%	0.699	73%	0.734	S	S	*	*			trans	-131.9	63.9	179.8	-177	0	0	0	0	112.4
627	N	43.2	Very low	50	Low	145 Å²	145	146.5 Å²	146.5	78%	0.775	75%	0.75	S	S	*	*			trans	-124.6	70.7	168.3	-97.5	-45.4	0	0	0	111.5
628	R	48.6	Very low	49	Very low	232 Å²	232	144 Å²	144	88%	0.875	75%	0.751	S	S	*	*			trans	-119.4	120.5	154.2	-100.5	-172.8	168	-173.2	-3.6	109.8
629	T	50.5	Low	48.4	Very low	136 Å²	136	150.3 Å²	150.3	83%	0.834	77%	0.769	S	S	*	*			trans	56.5	98.4	155.7	59.2	0	0	0	0	118.9
630	S	45	Very low	48	Very low	119 Å²	119	153.4 Å²	153.4	83%	0.832	79%	0.787	S	S	*	*				-162.9	138.3	107.5	55.9	0	0	0	0	111.6
631	R	48.1	Very low	47.6	Very low	234 Å²	234	155.3 Å²	155.3	88%	0.883	80%	0.798	S	S	*	*			trans	-83.3	136.4	166.2	-73.3	178.1	175.9	178	-1.6	108.2
632	L	48.4	Very low	47.3	Very low	174 Å²	174	150.7 Å²	150.7	91%	0.911	80%	0.796	S	S	*	*			trans	-127.4	139.1	150.1	-91.9	167.3	0	0	0	109.7
633	I	43.3	Very low	47.1	Very low	159 Å²	159	153.6 Å²	153.6	82%	0.815	80%	0.804	S	S	*	*			trans	-94	131.3	-169.9	-68.8	168.2	0	0	0	108.2
634	G	43.3	Very low	47	Very low	68 Å²	68	155.3 Å²	155.3	70%	0.701	81%	0.814	S	S	*	*			trans	-83.2	-170.3	-170.5	0	0	0	0	0	114.7
635	K	47.2	Very low	47	Very low	216 Å²	216	155.9 Å²	155.9	94%	0.939	81%	0.811	S	S	*	*			trans	-140.5	145.7	160	-98.5	167.6	-175.5	174.3	0	110.4
636	K	47.3	Very low	47.3	Very low	190 Å²	190	160.8 Å²	160.8	83%	0.826	82%	0.824	S	S	*	*			trans	-72.2	151.3	-175.5	-58.8	168.2	174.9	175.3	0	111.3
637	M	44	Very low	47.1	Very low	174 Å²	174	163.9 Å²	163.9	86%	0.857	83%	0.83	S	S	*	*				-168.4	112.3	112.2	-107	149.6	53.5	0	0	115.1
638	N	45	Very low	47.3	Very low	139 Å²	139	164.8 Å²	164.8	74%	0.743	83%	0.833	S	S	*	*			trans	37.5	109.2	134.2	-55.3	-12.3	0	0	0	121.7
639	R	47.9	Very low	47.3	Very low	241 Å²	241	161.1 Å²	161.1	91%	0.909	83%	0.83	S	S	*	*				21.7	129.1	126.7	-73.8	178.8	164	176.1	-5.8	119.4
640	S	50.7	Low	47.1	Very low	122 Å²	122	162.6 Å²	162.6	85%	0.853	83%	0.83	S	S	*	*				-152.8	175.2	113.2	63.2	0	0	0	0	110.5
641	V	46.7	Very low	47.2	Very low	119 Å²	119	165.3 Å²	165.3	72%	0.721	83%	0.83	S	S	*	*			trans	-135	144.1	-157.1	-167.6	0	0	0	0	110.5
642	S	48.2	Very low	47.2	Very low	99 Å²	99	160.7 Å²	160.7	69%	0.692	83%	0.827	S	S	*	*			trans	46.2	130.1	156	62	0	0	0	0	120.8
643	L	44.7	Very low	47.1	Very low	155 Å²	155	159.8 Å²	159.8	81%	0.812	82%	0.821	S	S	*	*				-158.1	136.2	109.2	-140	72.1	0	0	0	112.9	I645	L643-I645 HydrophobicContact CD2-CD1 4.12Å
644	T	48.4	Very low	47.4	Very low	126 Å²	126	159.8 Å²	159.8	77%	0.773	82%	0.821	S	S	*	*			trans	-75.2	151.2	159.7	-46.6	0	0	0	0	109.4
645	I	48.8	Very low	47.7	Very low	135 Å²	135	167.5 Å²	167.5	69%	0.692	83%	0.831	S	S	*	*			trans	-165.1	129.3	142.1	-104.3	149.2	0	0	0	111.2	L643	L643-I645 HydrophobicContact CD2-CD1 4.12Å
646	Y	53.3	Low	47.7	Very low	294 Å²	294	163.1 Å²	163.1	100%	1.153	82%	0.821	S	S	*	*			trans	23.2	0	163.1	-62.2	-78.2	0	0	0	120.9

Retrieved 646 of 646 residues in 1639 ms (Link to these results)

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