A0A087XJE5_POEFO Loading...

Nuclear receptor subfamily 1, group D, member 2b

AlphaFold DB , UniProt , Accession A0A087XJE5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 584 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	33.3	Very low	27.6	Very low	238 Å²	238	137.5 Å²	137.5	100%	1.172	84%	0.835	S	S	*	*				0	87.5	0	-90.2	-163.9	176.3	0	0	105.2
2	D	27.4	Very low	27.6	Very low	159 Å²	159	132.8 Å²	132.8	85%	0.85	80%	0.8	S	S	*	*			trans	-100.9	139.7	-161.9	-57	-113.5	0	0	0	106.9
3	M	27.2	Very low	27.4	Very low	194 Å²	194	128.8 Å²	128.8	96%	0.956	79%	0.791	S	S	*	*			trans	-145	122.3	159.7	-140.6	165.9	-177.1	0	0	109.9
4	D	25.8	Very low	27.4	Very low	135 Å²	135	128.1 Å²	128.1	72%	0.722	77%	0.767	S	S	*	*			trans	-62.1	148.3	-170.6	178.8	21.6	0	0	0	113	S6	D4-S6 VanDerWaalsContact OD1-CB 3.28Å; D4-S6 WeakPolarHBondContact OD1-CB 3.36Å; D4-S6 PolarHBondContact OD1-N 2.99Å; D4-S6 PolarHBondContact OD1-OG 2.9Å; D4-S6 WeakPolarHBondContact OD2-CB 3.41Å; D4-S6 PolarHBondContact OD2-OG 3.48Å
5	S	29.5	Very low	27.7	Very low	121 Å²	121	126.1 Å²	126.1	85%	0.846	75%	0.75	S	S	*	*			trans	-127.4	43.9	177	-160.9	0	0	0	0	111.5	K7	S5-K7 PolarHBondContact O-N 3.49Å
6	S	26.9	Very low	27.4	Very low	93 Å²	93	124.9 Å²	124.9	65%	0.65	75%	0.75	S	S	*	*			trans	-88.4	91.8	179.8	-66.6	0	0	0	0	112.6	D4	D4-S6 VanDerWaalsContact OD1-CB 3.28Å; D4-S6 WeakPolarHBondContact OD1-CB 3.36Å; D4-S6 PolarHBondContact OD1-N 2.99Å; D4-S6 PolarHBondContact OD1-OG 2.9Å; D4-S6 WeakPolarHBondContact OD2-CB 3.41Å; D4-S6 PolarHBondContact OD2-OG 3.48Å
7	K	27.2	Very low	27.3	Very low	204 Å²	204	124 Å²	124	89%	0.887	75%	0.751	S	S	*	*			trans	-132.9	97	162.6	-96.8	-177.2	176.9	174.4	0	111.5	S5	S5-K7 PolarHBondContact O-N 3.49Å
8	A	28.1	Very low	27.4	Very low	103 Å²	103	123.7 Å²	123.7	85%	0.851	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-62.2	139.3	172	0	0	0	0	0	111.3	G10	A8-G10 PolarHBondContact O-N 3.26Å
9	G	25.5	Very low	27.4	Very low	77 Å²	77	123.4 Å²	123.4	79%	0.794	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-67.8	129.3	176.7	0	0	0	0	0	111.6	V11	G9-V11 PolarHBondContact O-N 3.04Å
10	G	25.2	Very low	27.6	Very low	75 Å²	75	122.9 Å²	122.9	77%	0.773	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-65.1	132.5	179.8	0	0	0	0	0	112.5	A8	A8-G10 PolarHBondContact O-N 3.26Å
11	V	27.2	Very low	27.7	Very low	113 Å²	113	121.9 Å²	121.9	69%	0.685	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-57.4	139.2	168.8	176.1	0	0	0	0	109.3	G9 A13	G9-V11 PolarHBondContact O-N 3.04Å; V11-A13 VanDerWaalsContact C-N 3.28Å; V11-A13 PolarHBondContact O-N 3.14Å
12	I	27.4	Very low	27.4	Very low	81 Å²	81	115.9 Å²	115.9	42%	0.415	75%	0.746	S	S	.	*			trans	-69.1	87.6	175.8	-56.7	178.5	0	0	0	109.1	Y14 V440	I12-Y14 PolarHBondContact O-N 3.04Å; I12-V440 HydrophobicContact CD1-CG2 4.39Å
13	A	25.9	Very low	27.2	Very low	82 Å²	82	114.1 Å²	114.1	68%	0.678	75%	0.746	S	S	*	*			trans	-66.9	113.2	173.1	0	0	0	0	0	109.8	V11 I15	V11-A13 VanDerWaalsContact C-N 3.28Å; V11-A13 PolarHBondContact O-N 3.14Å; A13-I15 PolarHBondContact O-N 3.31Å
14	Y	27.5	Very low	28	Very low	118 Å²	118	110.6 Å²	110.6	46%	0.463	74%	0.738	S	S	.	*	S	Bend	trans	-69	113.2	169.1	-88.8	-99.7	0	0	0	109.4	I12 V418	I12-Y14 PolarHBondContact O-N 3.04Å; Y14-V418 HydrophobicContact CE2-CG1 4.35Å
15	I	30.7	Very low	27.9	Very low	98 Å²	98	111.9 Å²	111.9	50%	0.503	74%	0.744	S	S	.	*			trans	69.7	85.5	167.5	-39.2	170	0	0	0	115.9	A13	A13-I15 PolarHBondContact O-N 3.31Å
16	S	23.5	Very low	27.8	Very low	108 Å²	108	110.8 Å²	110.8	76%	0.755	74%	0.737	S	S	*	*			trans	-138	121.4	144.4	-83.7	0	0	0	0	110.8
17	S	26.3	Very low	27.8	Very low	109 Å²	109	111.4 Å²	111.4	76%	0.762	74%	0.74	S	S	*	*			trans	-150.3	74.2	179.4	-63.2	0	0	0	0	109.2	S19	S17-S19 PolarHBondContact O-N 3.38Å; S17-S19 VanDerWaalsContact O-N 3.07Å
18	S	28.6	Very low	27.8	Very low	119 Å²	119	111.1 Å²	111.1	83%	0.832	74%	0.742	S	S	*	*			trans	-68.6	94.9	172.8	34.9	0	0	0	0	110.2	S20	S18-S20 PolarHBondContact O-N 3.28Å
19	S	28.2	Very low	27.8	Very low	117 Å²	117	111.2 Å²	111.2	82%	0.818	74%	0.736	S	S	*	*			trans	-86.2	86.7	172.6	28.9	0	0	0	0	110	S17	S17-S19 PolarHBondContact O-N 3.38Å; S17-S19 VanDerWaalsContact O-N 3.07Å
20	S	30	Very low	27.8	Very low	113 Å²	113	115.2 Å²	115.2	79%	0.79	74%	0.739	S	S	*	*			trans	-63.3	135.2	168.2	38.7	0	0	0	0	110.5	S18	S18-S20 PolarHBondContact O-N 3.28Å
21	A	29.7	Very low	27.9	Very low	103 Å²	103	116.6 Å²	116.6	85%	0.851	74%	0.737	S	S	*	*			trans	-86.8	125.7	-176.2	0	0	0	0	0	111.5
22	S	26.6	Very low	28.1	Very low	112 Å²	112	116.4 Å²	116.4	78%	0.783	74%	0.74	S	S	*	*			trans	-139.7	127.6	169.4	-66.6	0	0	0	0	110.2
23	S	23.7	Very low	28.2	Very low	122 Å²	122	119.6 Å²	119.6	85%	0.853	76%	0.759	S	S	*	*			trans	-172.1	154.2	171.3	-78	0	0	0	0	110.1
24	P	43.3	Very low	28.2	Very low	120 Å²	120	119.2 Å²	119.2	78%	0.779	76%	0.762	S	S	*	*			cis	-115.9	170	-28.6	39.1	-27.6	0	0	0	110.9
25	D	25.4	Very low	28.3	Very low	161 Å²	161	118 Å²	118	86%	0.861	77%	0.771	S	S	*	*			trans	-140.4	168.5	156.8	-135.1	-38.7	0	0	0	112.1
26	S	27.2	Very low	28.2	Very low	99 Å²	99	124.7 Å²	124.7	69%	0.692	79%	0.792	S	S	*	*			trans	-113.2	171.3	-143.9	59.1	0	0	0	0	115.5
27	C	27	Very low	28.5	Very low	106 Å²	106	128.9 Å²	128.9	72%	0.716	80%	0.799	S	S	*	*			trans	-53.1	139.2	-171.2	50.9	0	0	0	0	116.2
28	H	27.2	Very low	28.4	Very low	198 Å²	198	129.6 Å²	129.6	92%	0.917	80%	0.804	S	S	*	*			trans	-137.4	154	140.9	-91.2	-77.6	0	0	0	110.2
29	S	28.7	Very low	28.4	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	80%	0.801	S	S	*	*			trans	-115.2	144.2	-174.8	-55.8	0	0	0	0	110.6
30	D	25.2	Very low	28.5	Very low	160 Å²	160	128.7 Å²	128.7	86%	0.856	80%	0.798	S	S	*	*			trans	170.1	153.8	144.9	-91.6	-20.8	0	0	0	108.7
31	S	27.1	Very low	29.3	Very low	104 Å²	104	129.4 Å²	129.4	73%	0.727	80%	0.8	S	S	*	*			cis	-146	-175.2	6.3	-144.3	0	0	0	0	113.3
32	S	30.6	Very low	29.3	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	80%	0.801	S	S	*	*			trans	-65.2	176.6	177.4	-54.1	0	0	0	0	112.7
33	N	29.2	Very low	29.6	Very low	149 Å²	149	142 Å²	142	80%	0.797	81%	0.808	S	S	*	*			cis	-160.5	166.3	20.1	-164.5	-1.2	0	0	0	110.8
34	G	26.6	Very low	29.8	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	80%	0.802	S	S	*	*			trans	173.7	68.7	175.2	0	0	0	0	0	115.9
35	S	28.8	Very low	29.2	Very low	94 Å²	94	139.9 Å²	139.9	66%	0.657	81%	0.807	S	S	*	*			trans	-94.5	131	-176.4	-66.2	0	0	0	0	114.3
36	Y	29.3	Very low	29.5	Very low	238 Å²	238	137.7 Å²	137.7	93%	0.933	81%	0.805	S	S	*	*			trans	-140.5	145.4	152.3	-73.3	-70.2	0	0	0	110.4
37	Q	28.9	Very low	30.5	Very low	195 Å²	195	138.4 Å²	138.4	91%	0.911	81%	0.807	S	S	*	*			trans	-107.9	151.1	-171.4	-59.8	177	-3.5	0	0	112.3
38	S	25.8	Very low	30.8	Very low	124 Å²	124	138.4 Å²	138.4	87%	0.867	81%	0.808	S	S	*	*			trans	-158.9	168.6	131.4	-156.4	0	0	0	0	112.7
39	S	28.3	Very low	31.1	Very low	110 Å²	110	140.9 Å²	140.9	77%	0.769	81%	0.809	S	S	*	*			trans	-90	167.6	-156.5	58.2	0	0	0	0	116.9
40	S	30.3	Very low	31	Very low	108 Å²	108	139.6 Å²	139.6	76%	0.755	81%	0.813	S	S	*	*			trans	-101	176.7	174.6	-38	0	0	0	0	112.5
41	P	45.8	Very low	31.3	Very low	127 Å²	127	143.4 Å²	143.4	83%	0.825	82%	0.815	S	S	*	*				-149.5	131	110	34.6	-16.7	0	0	0	118.9
42	R	31	Very low	32.4	Very low	233 Å²	233	143.7 Å²	143.7	88%	0.879	82%	0.815	S	S	*	*			trans	6.7	135.9	143.5	-54.3	169.8	-178.4	-98.1	0.5	121.6
43	R	32.3	Very low	32.3	Very low	247 Å²	247	142 Å²	142	93%	0.932	82%	0.815	S	S	*	*				-177.4	139.6	108.8	-99.5	170.7	-172.2	-102	2.3	114.6
44	G	28.4	Very low	32.3	Very low	70 Å²	70	143.4 Å²	143.4	72%	0.722	82%	0.817	S	S	*	*			trans	37.7	152.5	137.4	0	0	0	0	0	124.1
45	S	29.4	Very low	32.5	Very low	127 Å²	127	147 Å²	147	89%	0.888	82%	0.818	S	S	*	*			cis	-161.3	166.2	0.5	-68.9	0	0	0	0	111.1
46	S	33.1	Very low	32.5	Very low	115 Å²	115	150.2 Å²	150.2	80%	0.804	82%	0.824	S	S	*	*			trans	-108	160.2	174.5	-52.5	0	0	0	0	112.6
47	P	47.8	Very low	32.5	Very low	115 Å²	115	146.2 Å²	146.2	75%	0.747	82%	0.819	S	S	*	*				-131.1	156.6	94.7	10.9	12.2	0	0	0	112.3
48	S	33.5	Very low	34.1	Very low	105 Å²	105	142.3 Å²	142.3	73%	0.734	81%	0.81	S	S	*	*				64.5	140.2	58.3	107.7	0	0	0	0	113.5
49	R	33.8	Very low	35.2	Very low	250 Å²	250	141.8 Å²	141.8	94%	0.943	80%	0.804	S	S	*	*			cis	-164.4	153.7	15.6	-142.1	175.9	-171.1	-178.1	3.3	109.3
50	G	26.4	Very low	35.1	Very low	79 Å²	79	144.6 Å²	144.6	81%	0.814	81%	0.809	S	S	*	*			trans	157.7	131.6	167.1	0	0	0	0	0	118
51	R	30	Very low	35.1	Very low	239 Å²	239	143.6 Å²	143.6	90%	0.902	81%	0.808	S	S	*	*			trans	-176.2	170.7	179	-145.7	-148.1	173.8	-161.5	-0.9	108.3
52	P	51	Low	34.4	Very low	111 Å²	111	144.8 Å²	144.8	72%	0.721	81%	0.812	S	S	*	*			cis	-118.9	-175.1	-31.7	38.4	-23.3	0	0	0	113.1
53	G	28.1	Very low	34.2	Very low	73 Å²	73	136.7 Å²	136.7	75%	0.753	80%	0.802	S	S	*	*			trans	166.7	107.8	158.6	0	0	0	0	0	120.5
54	Q	29.8	Very low	34.1	Very low	179 Å²	179	135.8 Å²	135.8	84%	0.836	80%	0.798	S	S	*	*			trans	41.3	120.5	143.6	-63.7	-175.1	-10.4	0	0	125.8
55	L	30	Very low	34.2	Very low	148 Å²	148	140 Å²	140	78%	0.775	80%	0.799	S	S	*	*				45	145.5	124.3	-93.3	80.6	0	0	0	126.6
56	M	30.5	Very low	34.2	Very low	162 Å²	162	140.9 Å²	140.9	80%	0.798	79%	0.794	S	S	*	*			trans	81.2	137.7	144.4	75.2	-133.2	163	0	0	123.7
57	D	28.5	Very low	33.9	Very low	154 Å²	154	142.5 Å²	142.5	82%	0.824	79%	0.793	S	S	*	*			trans	-95.6	-164.6	179.9	-58.2	-85.8	0	0	0	112.2
58	P	61.4	Low	33.9	Very low	112 Å²	112	142.8 Å²	142.8	73%	0.727	80%	0.795	S	S	*	*				-119.4	-168.5	-73.5	40	-24	0	0	0	111.3
59	P	48.7	Very low	33.6	Very low	114 Å²	114	141.5 Å²	141.5	74%	0.74	80%	0.798	S	S	*	*				-157.3	160.6	87.5	40.4	-19.7	0	0	0	119.1
60	L	27.6	Very low	33.5	Very low	168 Å²	168	134.6 Å²	134.6	88%	0.88	79%	0.788	S	S	*	*			trans	19.2	134	141.6	-53.6	170.9	0	0	0	123
61	A	29.3	Very low	33.8	Very low	88 Å²	88	140.2 Å²	140.2	73%	0.727	79%	0.793	S	S	*	*				142.2	148.1	106.8	0	0	0	0	0	117
62	V	31.1	Very low	33.8	Very low	151 Å²	151	132.8 Å²	132.8	92%	0.915	79%	0.791	S	S	*	*			trans	62.2	143.3	164.9	-159.1	0	0	0	0	117.7
63	G	27.8	Very low	32.8	Very low	64 Å²	64	131.7 Å²	131.7	66%	0.66	80%	0.8	S	S	*	*			cis	159.7	147	-16.3	0	0	0	0	0	115.3
64	R	30.1	Very low	32.8	Very low	227 Å²	227	132.1 Å²	132.1	86%	0.857	81%	0.805	S	S	*	*			trans	74.6	141.7	158.8	-96.3	-174.4	170	-156.6	-1	123.2
65	Q	29.7	Very low	32.9	Very low	159 Å²	159	135 Å²	135	74%	0.743	81%	0.808	S	S	*	*			trans	85.8	169.9	146.5	-72.5	172.1	-2.9	0	0	121
66	N	29.1	Very low	33	Very low	145 Å²	145	133.5 Å²	133.5	78%	0.775	81%	0.809	S	S	*	*			trans	-153.8	143.9	-134.1	-123.3	-9.9	0	0	0	113.4
67	L	27.4	Very low	33.2	Very low	150 Å²	150	131.7 Å²	131.7	79%	0.785	81%	0.813	S	S	*	*			trans	66.5	166.6	155.8	-61.7	165.1	0	0	0	118.3
68	P	48.1	Very low	33.4	Very low	120 Å²	120	130 Å²	130	78%	0.779	81%	0.813	S	S	*	*			cis	-138.5	163.4	-44.3	38	-22.3	0	0	0	116.2
69	G	27.3	Very low	32	Very low	78 Å²	78	130.3 Å²	130.3	80%	0.804	82%	0.818	S	S	*	*			trans	90.5	164.2	160.8	0	0	0	0	0	117.1
70	S	31.5	Very low	31.1	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	82%	0.817	S	S	*	*			cis	-161.7	137.6	-10.5	-164.4	0	0	0	0	113.3
71	Q	33	Very low	31.5	Very low	197 Å²	197	130.2 Å²	130.2	92%	0.921	82%	0.818	S	S	*	*			trans	64.6	155.2	159.6	-73.3	-172.3	82.2	0	0	122.8
72	G	30.4	Very low	31.9	Very low	84 Å²	84	130.8 Å²	130.8	87%	0.866	82%	0.816	S	S	*	*			trans	108.3	116.6	-178.6	0	0	0	0	0	113.3
73	G	29.2	Very low	32.3	Very low	87 Å²	87	126.4 Å²	126.4	90%	0.897	80%	0.801	S	S	*	*			cis	151.7	88	-9.4	0	0	0	0	0	112.6
74	G	27.9	Very low	33.4	Very low	83 Å²	83	129.6 Å²	129.6	86%	0.856	80%	0.802	S	S	*	*			trans	164.5	116.3	177.9	0	0	0	0	0	116.5
75	R	32.3	Very low	34.4	Very low	240 Å²	240	121.1 Å²	121.1	91%	0.906	78%	0.775	S	S	*	*			trans	-64.7	165.3	175.8	-58	151.1	85.3	177.6	8.2	112.2
76	S	31.7	Very low	35.3	Very low	115 Å²	115	120.9 Å²	120.9	80%	0.804	77%	0.772	S	S	*	*			cis	-179.7	135.3	-25.2	-87.1	0	0	0	0	108.5
77	S	35.2	Very low	36.5	Very low	125 Å²	125	117.6 Å²	117.6	87%	0.874	75%	0.754	S	S	*	*			trans	-143.9	135.8	157.1	60	0	0	0	0	112.4
78	S	33.3	Very low	37.5	Very low	118 Å²	118	117.2 Å²	117.2	83%	0.825	75%	0.752	S	S	*	*			trans	-77	159.1	-177	42.4	0	0	0	0	113.1
79	S	30.8	Very low	38	Very low	119 Å²	119	114.2 Å²	114.2	83%	0.832	74%	0.743	S	S	*	*			cis	-163.5	151.2	-8.6	170.2	0	0	0	0	108.4
80	G	31.4	Very low	39.8	Very low	69 Å²	69	116.4 Å²	116.4	71%	0.711	74%	0.735	S	S	*	*			trans	-177.2	41.3	-178.6	0	0	0	0	0	115.9	C82	G80-C82 PolarHBondContact O-N 2.96Å
81	K	35.6	Very low	42.2	Very low	210 Å²	210	115.8 Å²	115.8	91%	0.913	73%	0.727	S	S	*	*			trans	-60.8	102.2	-179.3	-76.6	-177.2	176.2	178.5	0	111.5	G83	K81-G83 PolarHBondContact O-N 3.17Å
82	C	36.4	Very low	44.8	Very low	101 Å²	101	108.6 Å²	108.6	68%	0.682	70%	0.695	S	S	*	*			trans	-68.5	110.8	170	-170.7	0	0	0	0	109.3	G80 I84	G80-C82 PolarHBondContact O-N 2.96Å; C82-I84 PolarHBondContact O-N 3.39Å
83	G	41.1	Very low	47.8	Very low	58 Å²	58	109.3 Å²	109.3	60%	0.598	68%	0.678	S	S	*	*			trans	-72.2	90.5	179.4	0	0	0	0	0	111.7	K81 T85	K81-G83 PolarHBondContact O-N 3.17Å; G83-T85 PolarHBondContact O-N 3.21Å
84	I	50.3	Low	51.1	Low	131 Å²	131	105.2 Å²	105.2	67%	0.672	64%	0.636	S	S	*	*			trans	-58.5	117.5	166.9	-75.6	166.8	0	0	0	108.4	C82 K86	C82-I84 PolarHBondContact O-N 3.39Å; I84-K86 HydrophobicContact CG2-CB 4.48Å; I84-K86 HydrophobicContact CG2-CG 3.94Å; I84-K86 PolarHBondContact O-N 3.23Å
85	T	51.8	Low	54.3	Low	50 Å²	50	107.5 Å²	107.5	31%	0.307	62%	0.622	S	S	.	*			trans	-77.4	71.7	175.3	50.2	0	0	0	0	110.4	G83 I87	G83-T85 PolarHBondContact O-N 3.21Å; T85-I87 PolarHBondContact O-N 3.19Å
86	K	47.5	Very low	57.4	Low	153 Å²	153	96.1 Å²	96.1	67%	0.665	58%	0.579	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.7	108.7	164	-93.5	177	175.4	-174	0	108.3	I84	I84-K86 HydrophobicContact CG2-CB 4.48Å; I84-K86 HydrophobicContact CG2-CG 3.94Å; I84-K86 PolarHBondContact O-N 3.23Å
87	I	54.4	Low	60.5	Low	77 Å²	77	90.9 Å²	90.9	40%	0.395	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.4	162.6	-58.5	177.2	0	0	0	105.6	T85 G89 L90 M182	T85-I87 PolarHBondContact O-N 3.19Å; I87-G89 PolarHBondContact O-N 3.07Å; I87-L90 PolarHBondContact O-N 3.37Å; I87-M182 HydrophobicContact CD1-CE 4.34Å
88	N	49.5	Very low	63.4	Low	142 Å²	142	87.1 Å²	87.1	76%	0.759	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	37.1	177.5	-57.1	4.3	0	0	0	114.5	L90	N88-L90 PolarHBondContact O-N 3.49Å
89	G	57.7	Low	66.4	Low	56 Å²	56	82.5 Å²	82.5	58%	0.577	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-13.7	179	0	0	0	0	0	116.2	I87	I87-G89 PolarHBondContact O-N 3.07Å
90	L	65.3	Low	69.4	Low	124 Å²	124	80.5 Å²	80.5	65%	0.649	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	139.5	-176.1	-62.6	174.7	0	0	0	112.3	I87 N88	I87-L90 PolarHBondContact O-N 3.37Å; N88-L90 PolarHBondContact O-N 3.49Å
91	V	82.1	Confident	72.4	Confident	92 Å²	92	77.5 Å²	77.5	56%	0.558	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	104	175.7	179.9	0	0	0	0	109.3	L93 V100	V91-L93 HydrophobicContact CG1-CD2 4.35Å; V91-V100 HydrophobicContact CG1-CG1 3.95Å; V91-V100 HydrophobicContact CG1-CG2 4.18Å
92	L	86.8	Confident	75.1	Confident	47 Å²	47	68.8 Å²	68.8	25%	0.246	41%	0.406	C	S	.	.			trans	-67.1	132.8	177.5	-62.2	175.8	0	0	0	111.2	A101	L92-A101 HydrophobicContact CB-CB 4.25Å; L92-A101 WeakPolarHBondContact O-CB 3.48Å; L92-A101 PolarHBondContact O-N 2.88Å
93	L	94.1	Very high	77.5	Confident	98 Å²	98	64.3 Å²	64.3	51%	0.513	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-104.1	149.7	-179.6	-58.2	-176.1	0	0	0	112.1	V91 K95	V91-L93 HydrophobicContact CG1-CD2 4.35Å; L93-K95 PolarHBondContact O-N 3.46Å
94	C	97.3	Very high	79.7	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.014	37%	0.37	C	S	.	.			trans	-70.7	111.7	178.8	174.7	0	0	0	0	111.1	V96 C97 G98 D99 H109 C111	C94-V96 PolarHBondContact O-N 3.25Å; C94-C97 PolarHBondContact O-N 3.48Å; C94-G98 PolarHBondContact O-N 2.98Å; C94-D99 WeakPolarHBondContact CB-O 3.2Å; C94-D99 PolarHBondContact N-O 3.33Å; C94-H109 WeakPolarHBondContact CA-O 3.48Å; C94-C111 HydrophobicContact CB-CB 3.99Å; C94-C111 PolarHBondContact SG-N 2.98Å; C94-C111 VanDerWaalsContact SG-N 3.41Å; C94-C111 VanDerWaalsContact SG-SG 3.67Å
95	K	95.7	Very high	81.7	Confident	131 Å²	131	61.7 Å²	61.7	57%	0.57	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-32.7	-179.9	-69.9	-167.3	175.5	-174.7	0	113.6	L93 H109 V158	L93-K95 PolarHBondContact O-N 3.46Å; K95-H109 PolarHBondContact N-O 3.47Å; K95-H109 VanDerWaalsContact N-O 3.1Å; K95-V158 HydrophobicContact CB-CB 4.01Å; K95-V158 HydrophobicContact CB-CG1 4.26Å; K95-V158 HydrophobicContact CB-CG2 4.12Å
96	V	97.8	Very high	83.6	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-39.9	176.8	-173.3	0	0	0	0	113.6	C94 C114 I139 K154 V158 M160	C94-V96 PolarHBondContact O-N 3.25Å; V96-C114 HydrophobicContact CB-CB 4.23Å; V96-C114 HydrophobicContact CG1-CB 4.39Å; V96-C114 HydrophobicContact CG2-CB 4.29Å; V96-I139 HydrophobicContact CG1-CG2 4.18Å; V96-I139 WeakPolarHBondContact O-CG2 3.44Å; V96-K154 VanDerWaalsContact O-CD 3.3Å; V96-K154 WeakPolarHBondContact O-CD 3.47Å; V96-K154 VanDerWaalsContact O-CE 3.23Å; V96-K154 WeakPolarHBondContact O-CE 3.25Å; V96-K154 PolarHBondContact O-NZ 3.41Å; V96-V158 HydrophobicContact CG2-CG2 3.65Å; V96-M160 HydrophobicContact CG2-CE 3.96Å; V96-M160 HydrophobicContact CG2-SD 4.29Å
97	C	96.9	Very high	85.6	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.034	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-149.3	4.6	-164.1	72.2	0	0	0	0	117.7	C94 D99 C111 C114 I139 M140 R141 R144	C94-C97 PolarHBondContact O-N 3.48Å; C97-D99 PolarHBondContact O-N 3.48Å; C97-D99 VanDerWaalsContact O-N 3.14Å; C97-C111 VanDerWaalsContact SG-SG 3.69Å; C97-C114 VanDerWaalsContact SG-SG 3.6Å; C97-I139 HydrophobicContact CB-CG2 4.05Å; C97-M140 CarbonylContact O-C 3.38Å; C97-M140 WeakPolarHBondContact O-CA 3.43Å; C97-R141 PolarHBondContact O-N 3.36Å; C97-R144 HydrophobicContact CB-CB 4.38Å; C97-R144 PolarHBondContact SG-NH1 2.89Å
98	G	94.9	Very high	87.4	Confident	46 Å²	46	52.1 Å²	52.1	47%	0.474	31%	0.306	S	S	.	.	S	Bend	trans	72.1	-2.2	177.7	0	0	0	0	0	116	C94	C94-G98 PolarHBondContact O-N 2.98Å
99	D	96.3	Very high	89.5	Confident	22 Å²	22	48.1 Å²	48.1	12%	0.118	28%	0.283	C	S	.	.	S	Bend	trans	-69.3	157.8	169.8	-161.1	8.7	0	0	0	110.9	C94 C97 A101 C111 R141 R144	C94-D99 WeakPolarHBondContact CB-O 3.2Å; C94-D99 PolarHBondContact N-O 3.33Å; C97-D99 PolarHBondContact O-N 3.48Å; C97-D99 VanDerWaalsContact O-N 3.14Å; D99-A101 PolarHBondContact O-N 3.13Å; D99-C111 HydrophobicContact CB-CB 4.04Å; D99-R141 HydrophobicContact CB-CB 4.15Å; D99-R141 HydrophobicContact CB-CG 3.89Å; D99-R141 WeakPolarHBondContact OD1-CD 3.33Å; D99-R141 IonicContact OD1-CZ 2.87Å; D99-R141 IonicContact OD1-NE 3.8Å; D99-R141 PolarHBondContact OD1-NE 3.06Å; D99-R141 IonicContact OD1-NH2 2.77Å; D99-R141 IonicContact OD2-NE 2.84Å; D99-R144 IonicContact OD2-CZ 3.76Å; D99-R144 IonicContact OD2-NH1 2.69Å; D99-R144 PolarHBondContact OD2-NH1 3.04Å; D99-R144 IonicContact OD2-NH2 3.79Å; D99-R144 PolarHBondContact OD2-NH2 2.78Å
100	V	94.1	Very high	91.3	Very high	76 Å²	76	45.5 Å²	45.5	46%	0.461	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-60.9	130.7	-176.7	180	0	0	0	0	110.7	V91 C111	V91-V100 HydrophobicContact CG1-CG1 3.95Å; V91-V100 HydrophobicContact CG1-CG2 4.18Å; V100-C111 WeakPolarHBondContact O-CA 3.49Å; V100-C111 WeakPolarHBondContact O-CB 3.3Å
101	A	94.9	Very high	92.8	Very high	6 Å²	6	39.7 Å²	39.7	5%	0.05	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-75.2	137.9	177.5	0	0	0	0	0	111.1	L92 D99 G103 H109 A110	L92-A101 HydrophobicContact CB-CB 4.25Å; L92-A101 WeakPolarHBondContact O-CB 3.48Å; L92-A101 PolarHBondContact O-N 2.88Å; D99-A101 PolarHBondContact O-N 3.13Å; A101-G103 VanDerWaalsContact C-N 3.3Å; A101-H109 HydrophobicContact CB-CB 4.15Å; A101-A110 WeakPolarHBondContact CA-O 3.35Å
102	S	92.6	Very high	93.5	Very high	27 Å²	27	39.9 Å²	39.9	19%	0.189	22%	0.221	C	C	.	.			trans	-94.3	12.6	173	56.6	0	0	0	0	112.4	H105 A110 E112	S102-H105 PolarHBondContact O-NE2 2.81Å; S102-H105 PolarHBondContact OG-NE2 2.91Å; S102-A110 PolarHBondContact N-O 3.36Å; S102-A110 PolarHBondContact OG-O 3.26Å; S102-E112 VanDerWaalsContact CB-OE1 3.3Å; S102-E112 WeakPolarHBondContact CB-OE1 3.27Å; S102-E112 PolarHBondContact OG-N 3.23Å; S102-E112 PolarHBondContact OG-OE1 3.03Å
103	G	86.4	Confident	94	Very high	8 Å²	8	39.2 Å²	39.2	8%	0.082	23%	0.225	C	C	.	.	S	Bend	trans	130.1	-164.5	-176.7	0	0	0	0	0	113	A101 H105 H109 A110	A101-G103 VanDerWaalsContact C-N 3.3Å; G103-H105 PolarHBondContact O-CD2 3Å; G103-H109 WeakPolarHBondContact O-CA 3.39Å; G103-A110 PolarHBondContact O-N 2.93Å; G103-A110 VanDerWaalsContact O-N 3.08Å
104	F	87.7	Confident	94.2	Very high	102 Å²	102	34.6 Å²	34.6	45%	0.447	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	119.9	177.7	-164.3	-101.2	0	0	0	109	G107 V108 H109	F104-G107 WeakPolarHBondContact CE2-O 3.48Å; F104-G107 WeakPolarHBondContact CZ-O 3.31Å; F104-V108 CarbonylContact C-O 3.59Å; F104-V108 WeakPolarHBondContact CA-O 3.33Å; F104-H109 AromaticContact CD2-CE1 3.84Å; F104-H109 AromaticContact CD2-ND1 3.91Å
105	H	92.1	Very high	94.2	Very high	32 Å²	32	36.8 Å²	36.8	15%	0.148	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	127.1	-175.5	-53.8	-82.5	0	0	0	109.5	S102 G103 G107 V108 A110 E112 K115	S102-H105 PolarHBondContact O-NE2 2.81Å; S102-H105 PolarHBondContact OG-NE2 2.91Å; G103-H105 PolarHBondContact O-CD2 3Å; H105-G107 PolarHBondContact O-N 2.93Å; H105-V108 PolarHBondContact N-O 3.28Å; H105-V108 PolarHBondContact O-N 3.06Å; H105-A110 HydrophobicContact CB-CB 4.35Å; H105-A110 PolarHBondContact CD2-O 2.9Å; H105-E112 IonicContact CE1-OE1 3.25Å; H105-E112 IonicContact NE2-OE1 2.73Å; H105-K115 HydrophobicContact CB-CB 4.21Å; H105-K115 HydrophobicContact CB-CD 4.47Å; H105-K115 HydrophobicContact CB-CG 3.98Å; H105-K115 VanDerWaalsContact CE1-CE 3.47Å; H105-K115 WeakPolarHBondContact CE1-CE 3.48Å; H105-K115 WeakPolarHBondContact ND1-CD 3.45Å; H105-K115 WeakPolarHBondContact ND1-CE 3.32Å
106	Y	92.6	Very high	94.2	Very high	39 Å²	39	31.3 Å²	31.3	15%	0.153	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	27.7	176.6	-46.2	-55.5	0	0	0	115.3	K115 F118 R119 M160 S161 S164 V165	Y106-K115 HydrophobicContact CE2-CG 3.9Å; Y106-F118 AromaticContact CD2-CD1 3.88Å; Y106-F118 HydrophobicContact CD2-CD1 3.88Å; Y106-F118 HydrophobicContact CG-CD1 4.23Å; Y106-R119 HydrophobicContact CE2-CB 4.25Å; Y106-R119 WeakPolarHBondContact OH-CD 3.39Å; Y106-R119 WeakPolarHBondContact OH-CG 3.1Å; Y106-M160 CarbonylContact O-C 3.47Å; Y106-M160 VanDerWaalsContact O-CA 3.28Å; Y106-M160 WeakPolarHBondContact O-CA 3.37Å; Y106-S161 PolarHBondContact O-N 3.13Å; Y106-S164 VanDerWaalsContact CD1-O 3.3Å; Y106-S164 WeakPolarHBondContact CD1-O 3.41Å; Y106-S164 WeakPolarHBondContact CE1-O 3.48Å; Y106-V165 HydrophobicContact CD1-CB 4.44Å; Y106-V165 HydrophobicContact CD1-CG2 3.69Å; Y106-V165 HydrophobicContact CD2-CG2 4.31Å; Y106-V165 HydrophobicContact CE1-CB 4.3Å; Y106-V165 HydrophobicContact CE1-CG2 3.85Å; Y106-V165 HydrophobicContact CE2-CG2 4.44Å; Y106-V165 HydrophobicContact CG-CG2 3.94Å
107	G	88.2	Confident	94.2	Very high	37 Å²	37	32 Å²	32	38%	0.381	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.6	-3.6	-179.8	0	0	0	0	0	115.6	F104 H105	F104-G107 WeakPolarHBondContact CE2-O 3.48Å; F104-G107 WeakPolarHBondContact CZ-O 3.31Å; H105-G107 PolarHBondContact O-N 2.93Å
108	V	92.2	Very high	94.2	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	156.3	-177.6	-46.6	0	0	0	0	113.6	F104 H105 A110 V158 G159 M160	F104-V108 CarbonylContact C-O 3.59Å; F104-V108 WeakPolarHBondContact CA-O 3.33Å; H105-V108 PolarHBondContact N-O 3.28Å; H105-V108 PolarHBondContact O-N 3.06Å; V108-A110 HydrophobicContact CG2-CB 4.17Å; V108-A110 PolarHBondContact O-N 3.18Å; V108-V158 HydrophobicContact CG1-CG2 4.28Å; V108-V158 WeakPolarHBondContact CG1-O 3.47Å; V108-V158 HydrophobicContact CG2-CG2 4.43Å; V108-G159 WeakPolarHBondContact CG1-O 3.33Å; V108-M160 HydrophobicContact CG1-CG 4.2Å; V108-M160 HydrophobicContact CG2-CE 3.43Å; V108-M160 VanDerWaalsContact CG2-CE 3.43Å; V108-M160 HydrophobicContact CG2-CG 3.6Å; V108-M160 HydrophobicContact CG2-SD 4.36Å
109	H	93.3	Very high	94.2	Very high	59 Å²	59	35.1 Å²	35.1	27%	0.273	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	120.2	164.2	-68.5	-58	0	0	0	110.6	C94 K95 A101 G103 F104	C94-H109 WeakPolarHBondContact CA-O 3.48Å; K95-H109 PolarHBondContact N-O 3.47Å; K95-H109 VanDerWaalsContact N-O 3.1Å; A101-H109 HydrophobicContact CB-CB 4.15Å; G103-H109 WeakPolarHBondContact O-CA 3.39Å; F104-H109 AromaticContact CD2-CE1 3.84Å; F104-H109 AromaticContact CD2-ND1 3.91Å
110	A	96.1	Very high	94.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.			trans	-141.6	149.3	-173.2	0	0	0	0	0	113	A101 S102 G103 H105 V108 M160	A101-A110 WeakPolarHBondContact CA-O 3.35Å; S102-A110 PolarHBondContact N-O 3.36Å; S102-A110 PolarHBondContact OG-O 3.26Å; G103-A110 PolarHBondContact O-N 2.93Å; G103-A110 VanDerWaalsContact O-N 3.08Å; H105-A110 HydrophobicContact CB-CB 4.35Å; H105-A110 PolarHBondContact CD2-O 2.9Å; V108-A110 HydrophobicContact CG2-CB 4.17Å; V108-A110 PolarHBondContact O-N 3.18Å; A110-M160 HydrophobicContact CB-CE 3.49Å; A110-M160 VanDerWaalsContact CB-CE 3.49Å
111	C	97.8	Very high	94.3	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.02	19%	0.187	C	C	.	.			trans	-79.5	154.3	166.5	66.3	0	0	0	0	110.4	C94 C97 D99 V100 G113 C114 K115 R144	C94-C111 HydrophobicContact CB-CB 3.99Å; C94-C111 PolarHBondContact SG-N 2.98Å; C94-C111 VanDerWaalsContact SG-N 3.41Å; C94-C111 VanDerWaalsContact SG-SG 3.67Å; C97-C111 VanDerWaalsContact SG-SG 3.69Å; D99-C111 HydrophobicContact CB-CB 4.04Å; V100-C111 WeakPolarHBondContact O-CA 3.49Å; V100-C111 WeakPolarHBondContact O-CB 3.3Å; C111-G113 PolarHBondContact O-N 3.26Å; C111-C114 PolarHBondContact O-N 3.08Å; C111-K115 PolarHBondContact O-N 3.19Å; C111-K115 VanDerWaalsContact O-N 3.07Å; C111-R144 PolarHBondContact SG-NH1 3.48Å
112	E	96.9	Very high	94.2	Very high	96 Å²	96	37.6 Å²	37.6	45%	0.449	19%	0.191	S	C	.	.	H	α-helix	trans	-49.5	-37.7	175.2	-69.1	-57.6	119.5	0	0	113	S102 H105 C114 K115 G116	S102-E112 VanDerWaalsContact CB-OE1 3.3Å; S102-E112 WeakPolarHBondContact CB-OE1 3.27Å; S102-E112 PolarHBondContact OG-N 3.23Å; S102-E112 PolarHBondContact OG-OE1 3.03Å; H105-E112 IonicContact CE1-OE1 3.25Å; H105-E112 IonicContact NE2-OE1 2.73Å; E112-C114 VanDerWaalsContact C-N 3.31Å; E112-C114 PolarHBondContact O-N 3.15Å; E112-K115 WeakPolarHBondContact OE1-CD 3.44Å; E112-K115 IonicContact OE1-NZ 3.65Å; E112-K115 PolarHBondContact OE1-NZ 3.38Å; E112-K115 WeakPolarHBondContact OE2-CD 3.27Å; E112-K115 IonicContact OE2-NZ 3.67Å; E112-K115 PolarHBondContact OE2-NZ 3.25Å; E112-G116 PolarHBondContact O-N 3.03Å
113	G	97.3	Very high	94	Very high	33 Å²	33	42.2 Å²	42.2	34%	0.34	21%	0.21	S	C	.	.	H	α-helix	trans	-64.3	-26.6	178.9	0	0	0	0	0	115.1	C111 F117 R151	C111-G113 PolarHBondContact O-N 3.26Å; G113-F117 WeakPolarHBondContact O-CB 3.49Å; G113-R151 PolarHBondContact O-NH2 3.17Å
114	C	98	Very high	94.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-96.5	-38.3	177.5	-73.7	0	0	0	0	111.8	V96 C97 C111 E112 F117 F118	V96-C114 HydrophobicContact CB-CB 4.23Å; V96-C114 HydrophobicContact CG1-CB 4.39Å; V96-C114 HydrophobicContact CG2-CB 4.29Å; C97-C114 VanDerWaalsContact SG-SG 3.6Å; C111-C114 PolarHBondContact O-N 3.08Å; E112-C114 VanDerWaalsContact C-N 3.31Å; E112-C114 PolarHBondContact O-N 3.15Å; C114-F117 PolarHBondContact O-N 3.09Å; C114-F118 WeakPolarHBondContact O-CB 3.45Å; C114-F118 PolarHBondContact O-N 3.05Å
115	K	96.4	Very high	94.1	Very high	48 Å²	48	49 Å²	49	21%	0.209	24%	0.244	C	C	.	.	H	α-helix	trans	-50.3	-56.4	166	171.2	-158.2	-174.3	-174.5	0	111.5	H105 Y106 C111 E112 F117 F118 R119	H105-K115 HydrophobicContact CB-CB 4.21Å; H105-K115 HydrophobicContact CB-CD 4.47Å; H105-K115 HydrophobicContact CB-CG 3.98Å; H105-K115 VanDerWaalsContact CE1-CE 3.47Å; H105-K115 WeakPolarHBondContact CE1-CE 3.48Å; H105-K115 WeakPolarHBondContact ND1-CD 3.45Å; H105-K115 WeakPolarHBondContact ND1-CE 3.32Å; Y106-K115 HydrophobicContact CE2-CG 3.9Å; C111-K115 PolarHBondContact O-N 3.19Å; C111-K115 VanDerWaalsContact O-N 3.07Å; E112-K115 WeakPolarHBondContact OE1-CD 3.44Å; E112-K115 IonicContact OE1-NZ 3.65Å; E112-K115 PolarHBondContact OE1-NZ 3.38Å; E112-K115 WeakPolarHBondContact OE2-CD 3.27Å; E112-K115 IonicContact OE2-NZ 3.67Å; E112-K115 PolarHBondContact OE2-NZ 3.25Å; K115-F117 VanDerWaalsContact C-N 3.35Å; K115-F117 PolarHBondContact O-N 2.96Å; K115-F118 PolarHBondContact O-N 2.7Å; K115-R119 WeakPolarHBondContact O-CB 3.35Å; K115-R119 PolarHBondContact O-N 2.99Å
116	G	96.3	Very high	94.1	Very high	17 Å²	17	50.1 Å²	50.1	18%	0.175	25%	0.251	C	S	.	.	H	α-helix	trans	-69.2	-28.3	-178.9	0	0	0	0	0	114.1	E112 R120	E112-G116 PolarHBondContact O-N 3.03Å; G116-R120 PolarHBondContact O-NH1 2.98Å
117	F	98	Very high	94.1	Very high	14 Å²	14	56.9 Å²	56.9	6%	0.061	28%	0.284	C	S	.	.	H	α-helix	trans	-66.3	-58.5	170.6	170.5	-95.8	0	0	0	110.5	G113 C114 K115 R119 R120 S121 Y128 Q148 R151 F152	G113-F117 WeakPolarHBondContact O-CB 3.49Å; C114-F117 PolarHBondContact O-N 3.09Å; K115-F117 VanDerWaalsContact C-N 3.35Å; K115-F117 PolarHBondContact O-N 2.96Å; F117-R119 VanDerWaalsContact C-N 3.31Å; F117-R119 PolarHBondContact O-N 3.36Å; F117-R120 PolarHBondContact O-N 2.87Å; F117-R120 VanDerWaalsContact O-N 3.07Å; F117-S121 PolarHBondContact O-N 3.19Å; F117-S121 PolarHBondContact O-OG 2.93Å; F117-Y128 HydrophobicContact CE2-CE1 4.34Å; F117-Y128 AromaticContact CE2-CZ 3.9Å; F117-Y128 HydrophobicContact CZ-CE1 4.49Å; F117-Y128 AromaticContact CZ-CE2 3.93Å; F117-Y128 HydrophobicContact CZ-CE2 3.93Å; F117-Y128 AromaticContact CZ-CZ 3.79Å; F117-Q148 HydrophobicContact CE2-CB 4.32Å; F117-Q148 HydrophobicContact CE2-CG 4.37Å; F117-Q148 HydrophobicContact CZ-CB 4.38Å; F117-R151 HydrophobicContact CD1-CG 4.11Å; F117-R151 HydrophobicContact CE1-CB 4.13Å; F117-R151 HydrophobicContact CE1-CG 3.87Å; F117-R151 HydrophobicContact CZ-CB 4.19Å; F117-R151 HydrophobicContact CZ-CG 4.28Å; F117-F152 HydrophobicContact CE1-CB 3.89Å; F117-F152 HydrophobicContact CE1-CD2 4.28Å; F117-F152 HydrophobicContact CZ-CB 4.07Å
118	F	97.1	Very high	94.4	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.8	-41.6	-176.1	-174	-104.8	0	0	0	112.1	Y106 C114 K115 R120 S121 I122 F152 C155 L156 M160 S161 R162 V165	Y106-F118 AromaticContact CD2-CD1 3.88Å; Y106-F118 HydrophobicContact CD2-CD1 3.88Å; Y106-F118 HydrophobicContact CG-CD1 4.23Å; C114-F118 WeakPolarHBondContact O-CB 3.45Å; C114-F118 PolarHBondContact O-N 3.05Å; K115-F118 PolarHBondContact O-N 2.7Å; F118-R120 VanDerWaalsContact C-N 3.32Å; F118-R120 PolarHBondContact O-N 2.95Å; F118-S121 WeakPolarHBondContact O-CB 3.17Å; F118-S121 PolarHBondContact O-N 3.49Å; F118-S121 VanDerWaalsContact O-N 3.16Å; F118-I122 HydrophobicContact CD1-CG1 4.34Å; F118-I122 HydrophobicContact CE1-CG1 3.96Å; F118-I122 HydrophobicContact CE2-CD1 4.24Å; F118-I122 HydrophobicContact CE2-CG1 4.24Å; F118-I122 HydrophobicContact CZ-CD1 4.07Å; F118-I122 HydrophobicContact CZ-CG1 3.9Å; F118-I122 WeakPolarHBondContact O-CG1 3.06Å; F118-I122 PolarHBondContact O-N 3.31Å; F118-F152 AromaticContact CD2-CD2 3.88Å; F118-F152 HydrophobicContact CD2-CD2 3.88Å; F118-F152 AromaticContact CD2-CE2 3.65Å; F118-F152 HydrophobicContact CD2-CE2 3.65Å; F118-F152 HydrophobicContact CE2-CD2 4.14Å; F118-F152 AromaticContact CE2-CE2 3.56Å; F118-F152 HydrophobicContact CE2-CE2 3.56Å; F118-F152 HydrophobicContact CE2-CZ 4.37Å; F118-C155 HydrophobicContact CD2-CB 3.48Å; F118-C155 VanDerWaalsContact CD2-CB 3.48Å; F118-C155 HydrophobicContact CE2-CB 3.95Å; F118-C155 HydrophobicContact CG-CB 4.31Å; F118-L156 HydrophobicContact CE2-CD2 3.74Å; F118-L156 HydrophobicContact CE2-CG 4.24Å; F118-L156 HydrophobicContact CZ-CD2 3.96Å; F118-M160 HydrophobicContact CB-SD 3.79Å; F118-M160 HydrophobicContact CD1-CB 4.01Å; F118-M160 HydrophobicContact CD1-SD 3.98Å; F118-M160 HydrophobicContact CD2-CB 4.18Å; F118-M160 HydrophobicContact CD2-SD 4.05Å; F118-M160 HydrophobicContact CE1-CB 3.67Å; F118-M160 HydrophobicContact CE2-CB 3.85Å; F118-M160 HydrophobicContact CG-CB 4.26Å; F118-M160 HydrophobicContact CG-SD 3.67Å; F118-M160 HydrophobicContact CZ-CB 3.58Å; F118-M160 VanDerWaalsContact CZ-O 3.23Å; F118-M160 WeakPolarHBondContact CZ-O 3.32Å; F118-S161 WeakPolarHBondContact CE1-O 3.5Å; F118-R162 HydrophobicContact CZ-CG 4.44Å; F118-V165 HydrophobicContact CD1-CG2 3.7Å; F118-V165 HydrophobicContact CE1-CG2 3.5Å
119	R	94.9	Very high	94.5	Very high	116 Å²	116	66.3 Å²	66.3	44%	0.438	31%	0.314	S	S	.	.	H	α-helix	trans	-53.6	-47.3	174.8	-164.7	-174.4	79.6	-166.3	0.5	112.2	Y106 K115 F117 Q123 V165	Y106-R119 HydrophobicContact CE2-CB 4.25Å; Y106-R119 WeakPolarHBondContact OH-CD 3.39Å; Y106-R119 WeakPolarHBondContact OH-CG 3.1Å; K115-R119 WeakPolarHBondContact O-CB 3.35Å; K115-R119 PolarHBondContact O-N 2.99Å; F117-R119 VanDerWaalsContact C-N 3.31Å; F117-R119 PolarHBondContact O-N 3.36Å; R119-Q123 HydrophobicContact CG-CG 4.31Å; R119-Q123 VanDerWaalsContact O-CB 3.3Å; R119-Q123 WeakPolarHBondContact O-CB 3.25Å; R119-Q123 VanDerWaalsContact O-CG 3.28Å; R119-Q123 WeakPolarHBondContact O-CG 3.3Å; R119-Q123 PolarHBondContact O-N 2.9Å; R119-V165 HydrophobicContact CB-CG1 4.47Å; R119-V165 HydrophobicContact CG-CG1 3.85Å
120	R	95.6	Very high	94.3	Very high	124 Å²	124	72 Å²	72	47%	0.468	34%	0.337	S	S	.	.	H	α-helix	trans	-68.5	-41.6	177.3	-70.9	-174.1	-62.3	-95.6	0.4	112.2	G116 F117 F118 I122 Q123 Q124 I126	G116-R120 PolarHBondContact O-NH1 2.98Å; F117-R120 PolarHBondContact O-N 2.87Å; F117-R120 VanDerWaalsContact O-N 3.07Å; F118-R120 VanDerWaalsContact C-N 3.32Å; F118-R120 PolarHBondContact O-N 2.95Å; R120-I122 PolarHBondContact O-N 2.88Å; R120-Q123 PolarHBondContact O-N 2.8Å; R120-Q124 PolarHBondContact O-N 2.66Å; R120-I126 HydrophobicContact CB-CD1 4.34Å; R120-I126 WeakPolarHBondContact O-CD1 3.38Å
121	S	95.7	Very high	94.2	Very high	3 Å²	3	72.9 Å²	72.9	2%	0.021	34%	0.344	C	S	.	.	H	α-helix	trans	-53.6	-42	177	-44.2	0	0	0	0	112	F117 F118 N125 I126 Y128 F152	F117-S121 PolarHBondContact O-N 3.19Å; F117-S121 PolarHBondContact O-OG 2.93Å; F118-S121 WeakPolarHBondContact O-CB 3.17Å; F118-S121 PolarHBondContact O-N 3.49Å; F118-S121 VanDerWaalsContact O-N 3.16Å; S121-N125 PolarHBondContact O-N 3.49Å; S121-I126 PolarHBondContact O-N 3.31Å; S121-Y128 WeakPolarHBondContact CB-OH 3.26Å; S121-Y128 PolarHBondContact OG-OH 2.95Å; S121-F152 VanDerWaalsContact CB-CD2 3.41Å
122	I	92.4	Very high	93.9	Very high	29 Å²	29	81 Å²	81	15%	0.149	39%	0.386	C	S	.	.	H	α-helix	trans	-79.3	-53.1	177.8	-57.2	-57.7	0	0	0	111.9	F118 R120 Q124 N125 F152 R162 V165	F118-I122 HydrophobicContact CD1-CG1 4.34Å; F118-I122 HydrophobicContact CE1-CG1 3.96Å; F118-I122 HydrophobicContact CE2-CD1 4.24Å; F118-I122 HydrophobicContact CE2-CG1 4.24Å; F118-I122 HydrophobicContact CZ-CD1 4.07Å; F118-I122 HydrophobicContact CZ-CG1 3.9Å; F118-I122 WeakPolarHBondContact O-CG1 3.06Å; F118-I122 PolarHBondContact O-N 3.31Å; R120-I122 PolarHBondContact O-N 2.88Å; I122-Q124 VanDerWaalsContact C-N 3.26Å; I122-Q124 PolarHBondContact O-N 3.16Å; I122-N125 PolarHBondContact O-N 3.14Å; I122-N125 VanDerWaalsContact O-N 3.08Å; I122-F152 HydrophobicContact CD1-CE2 3.79Å; I122-F152 HydrophobicContact CD1-CZ 3.66Å; I122-F152 HydrophobicContact CG1-CE2 4.42Å; I122-R162 HydrophobicContact CD1-CB 3.97Å; I122-R162 HydrophobicContact CD1-CG 3.77Å; I122-V165 HydrophobicContact CB-CB 4.25Å; I122-V165 HydrophobicContact CB-CG1 4.09Å; I122-V165 HydrophobicContact CB-CG2 4.33Å; I122-V165 HydrophobicContact CG1-CG2 4.13Å; I122-V165 HydrophobicContact CG2-CB 4.06Å; I122-V165 HydrophobicContact CG2-CG1 4.17Å
123	Q	89	Confident	93	Very high	124 Å²	124	82.9 Å²	82.9	58%	0.579	39%	0.393	S	S	*	.	H	α-helix	trans	-63.1	-28.7	-173.4	-73.4	-176.3	-41.1	0	0	114.1	R119 R120 V165	R119-Q123 HydrophobicContact CG-CG 4.31Å; R119-Q123 VanDerWaalsContact O-CB 3.3Å; R119-Q123 WeakPolarHBondContact O-CB 3.25Å; R119-Q123 VanDerWaalsContact O-CG 3.28Å; R119-Q123 WeakPolarHBondContact O-CG 3.3Å; R119-Q123 PolarHBondContact O-N 2.9Å; R120-Q123 PolarHBondContact O-N 2.8Å; Q123-V165 HydrophobicContact CG-CG1 3.97Å
124	Q	88.8	Confident	92.3	Very high	136 Å²	136	86.3 Å²	86.3	64%	0.636	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	13.2	178.3	-56.3	179.9	-77.9	0	0	112.3	R120 I122 I126	R120-Q124 PolarHBondContact O-N 2.66Å; I122-Q124 VanDerWaalsContact C-N 3.26Å; I122-Q124 PolarHBondContact O-N 3.16Å; Q124-I126 HydrophobicContact CB-CD1 4.07Å; Q124-I126 HydrophobicContact CB-CG1 3.66Å; Q124-I126 PolarHBondContact O-N 2.84Å; Q124-I126 VanDerWaalsContact O-N 3.12Å
125	N	87.4	Confident	91.7	Very high	116 Å²	116	90 Å²	90	62%	0.62	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.4	47	-177.8	-162	23.2	0	0	0	114.1	S121 I122 Q127	S121-N125 PolarHBondContact O-N 3.49Å; I122-N125 PolarHBondContact O-N 3.14Å; I122-N125 VanDerWaalsContact O-N 3.08Å; N125-Q127 PolarHBondContact O-N 3.49Å; N125-Q127 VanDerWaalsContact O-N 3.13Å
126	I	92.3	Very high	91.4	Very high	56 Å²	56	91.7 Å²	91.7	29%	0.287	45%	0.447	S	S	.	.			trans	-73.4	111	-163.2	-51.1	179.7	0	0	0	110.9	R120 S121 Q124 Y128	R120-I126 HydrophobicContact CB-CD1 4.34Å; R120-I126 WeakPolarHBondContact O-CD1 3.38Å; S121-I126 PolarHBondContact O-N 3.31Å; Q124-I126 HydrophobicContact CB-CD1 4.07Å; Q124-I126 HydrophobicContact CB-CG1 3.66Å; Q124-I126 PolarHBondContact O-N 2.84Å; Q124-I126 VanDerWaalsContact O-N 3.12Å; I126-Y128 HydrophobicContact CB-CE1 4.24Å; I126-Y128 HydrophobicContact CB-CE2 4.37Å; I126-Y128 HydrophobicContact CG2-CD1 3.96Å; I126-Y128 HydrophobicContact CG2-CE1 3.53Å; I126-Y128 HydrophobicContact CG2-CE2 4.42Å; I126-Y128 PolarHBondContact O-N 3.09Å
127	Q	92.1	Very high	91.4	Very high	182 Å²	182	92.2 Å²	92.2	85%	0.85	45%	0.447	S	S	*	.			trans	-75.4	113.2	167.9	-60.2	-170.7	12.7	0	0	110	N125	N125-Q127 PolarHBondContact O-N 3.49Å; N125-Q127 VanDerWaalsContact O-N 3.13Å
128	Y	94.9	Very high	91.2	Very high	40 Å²	40	95.9 Å²	95.9	16%	0.157	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-86.6	143.1	177.4	-64.6	-64.3	0	0	0	111.9	F117 S121 I126 K130 Q148 F152	F117-Y128 HydrophobicContact CE2-CE1 4.34Å; F117-Y128 AromaticContact CE2-CZ 3.9Å; F117-Y128 HydrophobicContact CZ-CE1 4.49Å; F117-Y128 AromaticContact CZ-CE2 3.93Å; F117-Y128 HydrophobicContact CZ-CE2 3.93Å; F117-Y128 AromaticContact CZ-CZ 3.79Å; S121-Y128 WeakPolarHBondContact CB-OH 3.26Å; S121-Y128 PolarHBondContact OG-OH 2.95Å; I126-Y128 HydrophobicContact CB-CE1 4.24Å; I126-Y128 HydrophobicContact CB-CE2 4.37Å; I126-Y128 HydrophobicContact CG2-CD1 3.96Å; I126-Y128 HydrophobicContact CG2-CE1 3.53Å; I126-Y128 HydrophobicContact CG2-CE2 4.42Å; I126-Y128 PolarHBondContact O-N 3.09Å; Y128-K130 PolarHBondContact O-N 3.11Å; Y128-Q148 HydrophobicContact CD1-CB 3.33Å; Y128-Q148 HydrophobicContact CD1-CG 4.16Å; Y128-Q148 VanDerWaalsContact CD1-OE1 3.24Å; Y128-Q148 HydrophobicContact CD2-CB 4.38Å; Y128-Q148 HydrophobicContact CE1-CB 3.66Å; Y128-Q148 HydrophobicContact CE1-CG 4.2Å; Y128-Q148 HydrophobicContact CG-CB 3.74Å; Y128-F152 HydrophobicContact CD2-CB 4.03Å; Y128-F152 HydrophobicContact CD2-CD1 4.46Å; Y128-F152 HydrophobicContact CD2-CG 4.33Å; Y128-F152 HydrophobicContact CE2-CB 3.91Å; Y128-F152 HydrophobicContact CE2-CD1 4.46Å; Y128-F152 HydrophobicContact CE2-CD2 4.45Å; Y128-F152 HydrophobicContact CE2-CG 4.03Å
129	K	93.6	Very high	91.2	Very high	197 Å²	197	96.3 Å²	96.3	86%	0.857	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-54.9	138.1	171.6	-62.4	-170	178.8	-170.7	0	110.6
130	K	90.5	Very high	91.3	Very high	177 Å²	177	95 Å²	95	77%	0.77	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-55.2	145.4	178.8	-66.7	-173.3	178.6	-177.2	0	111.5	Y128 L132	Y128-K130 PolarHBondContact O-N 3.11Å; K130-L132 PolarHBondContact O-N 3.47Å
131	C	94.1	Very high	91.3	Very high	20 Å²	20	97 Å²	97	14%	0.135	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-70.5	127.6	-177.8	-176.1	0	0	0	0	112	K133 E135 C150	C131-K133 PolarHBondContact O-N 3.18Å; C131-K133 PolarHBondContact SG-N 3.07Å; C131-K133 PolarHBondContact SG-O 3.01Å; C131-E135 HydrophobicContact CB-CG 4.34Å; C131-C150 PolarHBondContact SG-SG 2.77Å
132	L	91.4	Very high	91.3	Very high	173 Å²	173	105 Å²	105	91%	0.906	52%	0.521	S	S	*	.	S	Bend	trans	-78	6.4	176.7	-52.1	179.6	0	0	0	113.9	K130	K130-L132 PolarHBondContact O-N 3.47Å
133	K	77.8	Confident	91.3	Very high	135 Å²	135	105.3 Å²	105.3	59%	0.587	52%	0.523	S	S	*	.	S	Bend	trans	-145.5	75.6	-177.1	-64.1	-164.8	175	-141.3	0	110.5	C131 E135 S136	C131-K133 PolarHBondContact O-N 3.18Å; C131-K133 PolarHBondContact SG-N 3.07Å; C131-K133 PolarHBondContact SG-O 3.01Å; K133-E135 PolarHBondContact O-N 2.92Å; K133-S136 PolarHBondContact O-N 2.99Å
134	S	82.6	Confident	91.6	Very high	105 Å²	105	101.3 Å²	101.3	73%	0.734	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.9	36.8	167.4	56.8	0	0	0	0	116.5	S136	S134-S136 WeakPolarHBondContact O-CB 3.49Å; S134-S136 PolarHBondContact O-N 3.1Å; S134-S136 PolarHBondContact O-OG 2.93Å; S134-S136 PolarHBondContact OG-OG 3.4Å; S134-S136 VanDerWaalsContact OG-OG 3.12Å
135	E	84.9	Confident	91.9	Very high	79 Å²	79	100.8 Å²	100.8	37%	0.369	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	12.3	-180	-58.1	-145.6	150.4	0	0	117.9	C131 K133 Q149 C150 K153	C131-E135 HydrophobicContact CB-CG 4.34Å; K133-E135 PolarHBondContact O-N 2.92Å; E135-Q149 PolarHBondContact OE1-NE2 3.23Å; E135-C150 PolarHBondContact O-SG 2.87Å; E135-K153 IonicContact OE2-NZ 3.55Å; E135-K153 PolarHBondContact OE2-NZ 3.3Å
136	S	91	Very high	92.3	Very high	83 Å²	83	105 Å²	105	58%	0.58	51%	0.512	S	S	*	.			trans	-121.8	19.5	-165.7	49.3	0	0	0	0	113.3	K133 S134	K133-S136 PolarHBondContact O-N 2.99Å; S134-S136 WeakPolarHBondContact O-CB 3.49Å; S134-S136 PolarHBondContact O-N 3.1Å; S134-S136 PolarHBondContact O-OG 2.93Å; S134-S136 PolarHBondContact OG-OG 3.4Å; S134-S136 VanDerWaalsContact OG-OG 3.12Å
137	C	95.4	Very high	92.5	Very high	28 Å²	28	103.1 Å²	103.1	19%	0.189	50%	0.503	C	S	.	.			trans	-54.6	123.4	-177.6	-79.3	0	0	0	0	112.1	I139 C147 C150	C137-I139 WeakPolarHBondContact O-CD1 3.32Å; C137-I139 WeakPolarHBondContact O-CG1 3.19Å; C137-I139 PolarHBondContact O-N 3.4Å; C137-C147 HydrophobicContact CB-CB 4.03Å; C137-C150 HydrophobicContact CB-CB 3.85Å
138	P	94.4	Very high	92.8	Very high	91 Å²	91	99.4 Å²	99.4	59%	0.591	49%	0.486	S	S	*	.			trans	-67.3	124.4	-177.6	25.6	-34	0	0	0	111.1	N143	P138-N143 VanDerWaalsContact O-CG 3.29Å; P138-N143 PolarHBondContact O-ND2 3.01Å; P138-N143 PolarHBondContact O-OD1 2.88Å; P138-N143 VanDerWaalsContact O-OD1 3.09Å
139	I	97.4	Very high	92.9	Very high	9 Å²	9	99.3 Å²	99.3	5%	0.046	49%	0.487	C	S	.	.			trans	-101.2	109.8	-175.8	-52.6	-59	0	0	0	110.3	V96 C97 C137 R144 C150 R151 K154	V96-I139 HydrophobicContact CG1-CG2 4.18Å; V96-I139 WeakPolarHBondContact O-CG2 3.44Å; C97-I139 HydrophobicContact CB-CG2 4.05Å; C137-I139 WeakPolarHBondContact O-CD1 3.32Å; C137-I139 WeakPolarHBondContact O-CG1 3.19Å; C137-I139 PolarHBondContact O-N 3.4Å; I139-R144 HydrophobicContact CG2-CB 3.78Å; I139-C150 HydrophobicContact CD1-CB 4.08Å; I139-R151 HydrophobicContact CD1-CB 4.09Å; I139-R151 HydrophobicContact CG2-CG 4.16Å; I139-K154 HydrophobicContact CB-CD 3.79Å; I139-K154 HydrophobicContact CG1-CB 4.35Å; I139-K154 HydrophobicContact CG1-CD 4.02Å; I139-K154 HydrophobicContact CG2-CD 4.45Å; I139-K154 PolarHBondContact O-NZ 2.76Å
140	M	95.8	Very high	93	Very high	89 Å²	89	90.2 Å²	90.2	44%	0.438	45%	0.448	S	S	.	.			trans	-133.1	163.1	-179.5	-56.2	-173.4	-71.2	0	0	110.7	C97 M142 N143 R144	C97-M140 CarbonylContact O-C 3.38Å; C97-M140 WeakPolarHBondContact O-CA 3.43Å; M140-M142 HydrophobicContact CB-CG 4.46Å; M140-M142 HydrophobicContact CE-SD 4.49Å; M140-M142 PolarHBondContact O-N 3.08Å; M140-M142 VanDerWaalsContact O-N 3.08Å; M140-N143 WeakPolarHBondContact CA-OD1 3.41Å; M140-N143 WeakPolarHBondContact CB-OD1 3.42Å; M140-N143 PolarHBondContact N-OD1 3.47Å; M140-N143 PolarHBondContact O-N 3.37Å; M140-N143 PolarHBondContact O-OD1 3.12Å; M140-N143 VanDerWaalsContact O-OD1 3.11Å; M140-R144 VanDerWaalsContact O-CB 3.26Å; M140-R144 WeakPolarHBondContact O-CB 3.07Å; M140-R144 PolarHBondContact O-N 3.05Å
141	R	95.9	Very high	93.4	Very high	165 Å²	165	82.3 Å²	82.3	62%	0.623	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.8	-45.8	-178.7	-174.7	179.1	-167.8	-142.5	-2.9	113.9	C97 D99 R144	C97-R141 PolarHBondContact O-N 3.36Å; D99-R141 HydrophobicContact CB-CB 4.15Å; D99-R141 HydrophobicContact CB-CG 3.89Å; D99-R141 WeakPolarHBondContact OD1-CD 3.33Å; D99-R141 IonicContact OD1-CZ 2.87Å; D99-R141 IonicContact OD1-NE 3.8Å; D99-R141 PolarHBondContact OD1-NE 3.06Å; D99-R141 IonicContact OD1-NH2 2.77Å; D99-R141 IonicContact OD2-NE 2.84Å; R141-R144 PolarHBondContact O-NE 3.02Å
142	M	95.1	Very high	93.6	Very high	170 Å²	170	83 Å²	83	84%	0.837	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-33.1	-177.5	59.7	177.9	75.2	0	0	114.9	M140	M140-M142 HydrophobicContact CB-CG 4.46Å; M140-M142 HydrophobicContact CE-SD 4.49Å; M140-M142 PolarHBondContact O-N 3.08Å; M140-M142 VanDerWaalsContact O-N 3.08Å
143	N	92.9	Very high	93.8	Very high	36 Å²	36	79 Å²	79	19%	0.193	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-2.4	-167.5	73.6	-3.9	0	0	0	114.2	P138 M140 N145 R146	P138-N143 VanDerWaalsContact O-CG 3.29Å; P138-N143 PolarHBondContact O-ND2 3.01Å; P138-N143 PolarHBondContact O-OD1 2.88Å; P138-N143 VanDerWaalsContact O-OD1 3.09Å; M140-N143 WeakPolarHBondContact CA-OD1 3.41Å; M140-N143 WeakPolarHBondContact CB-OD1 3.42Å; M140-N143 PolarHBondContact N-OD1 3.47Å; M140-N143 PolarHBondContact O-N 3.37Å; M140-N143 PolarHBondContact O-OD1 3.12Å; M140-N143 VanDerWaalsContact O-OD1 3.11Å; N143-N145 PolarHBondContact O-N 2.96Å; N143-R146 WeakPolarHBondContact O-CB 3.1Å; N143-R146 PolarHBondContact O-N 3.14Å
144	R	95.6	Very high	94.7	Very high	40 Å²	40	75.4 Å²	75.4	15%	0.151	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-14.1	-179.3	59.6	-175.1	173.3	-170.7	-6.5	116.1	C97 D99 C111 I139 M140 R141 R151	C97-R144 HydrophobicContact CB-CB 4.38Å; C97-R144 PolarHBondContact SG-NH1 2.89Å; D99-R144 IonicContact OD2-CZ 3.76Å; D99-R144 IonicContact OD2-NH1 2.69Å; D99-R144 PolarHBondContact OD2-NH1 3.04Å; D99-R144 IonicContact OD2-NH2 3.79Å; D99-R144 PolarHBondContact OD2-NH2 2.78Å; C111-R144 PolarHBondContact SG-NH1 3.48Å; I139-R144 HydrophobicContact CG2-CB 3.78Å; M140-R144 VanDerWaalsContact O-CB 3.26Å; M140-R144 WeakPolarHBondContact O-CB 3.07Å; M140-R144 PolarHBondContact O-N 3.05Å; R141-R144 PolarHBondContact O-NE 3.02Å; R144-R151 VanDerWaalsContact O-CD 3.29Å; R144-R151 WeakPolarHBondContact O-CD 3.4Å; R144-R151 PolarHBondContact O-NH1 2.57Å
145	N	95.6	Very high	95.4	Very high	125 Å²	125	70.4 Å²	70.4	67%	0.668	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-13.8	175.1	-65.4	-6.4	0	0	0	113	N143 C147 R151	N143-N145 PolarHBondContact O-N 2.96Å; N145-C147 PolarHBondContact O-N 3.29Å; N145-R151 PolarHBondContact OD1-NH1 3.11Å
146	R	95.5	Very high	96	Very high	205 Å²	205	69.8 Å²	69.8	77%	0.774	34%	0.338	S	S	*	.	S	Bend	trans	-71.2	-29.7	-170	-167.8	177.6	-170.6	168.7	7	114.6	N143	N143-R146 WeakPolarHBondContact O-CB 3.1Å; N143-R146 PolarHBondContact O-N 3.14Å
147	C	97	Very high	96.2	Very high	16 Å²	16	72.8 Å²	72.8	11%	0.108	34%	0.344	C	S	.	.			trans	-140.8	110.9	172.3	-176.8	0	0	0	0	110.2	C137 N145 C150 R151	C137-C147 HydrophobicContact CB-CB 4.03Å; N145-C147 PolarHBondContact O-N 3.29Å; C147-C150 HydrophobicContact CB-CB 4.08Å; C147-C150 PolarHBondContact SG-N 3.17Å; C147-C150 PolarHBondContact SG-SG 2.84Å; C147-R151 WeakPolarHBondContact O-CB 3.46Å; C147-R151 PolarHBondContact O-N 3.45Å; C147-R151 VanDerWaalsContact O-N 3.11Å
148	Q	96.7	Very high	96.2	Very high	104 Å²	104	73.1 Å²	73.1	49%	0.486	35%	0.345	S	S	.	.	H	α-helix	trans	-71.3	-38.9	-178.1	-64.4	171.4	-30.5	0	0	112.1	F117 Y128 R151 F152	F117-Q148 HydrophobicContact CE2-CB 4.32Å; F117-Q148 HydrophobicContact CE2-CG 4.37Å; F117-Q148 HydrophobicContact CZ-CB 4.38Å; Y128-Q148 HydrophobicContact CD1-CB 3.33Å; Y128-Q148 HydrophobicContact CD1-CG 4.16Å; Y128-Q148 VanDerWaalsContact CD1-OE1 3.24Å; Y128-Q148 HydrophobicContact CD2-CB 4.38Å; Y128-Q148 HydrophobicContact CE1-CB 3.66Å; Y128-Q148 HydrophobicContact CE1-CG 4.2Å; Y128-Q148 HydrophobicContact CG-CB 3.74Å; Q148-R151 PolarHBondContact O-N 2.79Å; Q148-F152 WeakPolarHBondContact O-CB 3.38Å; Q148-F152 PolarHBondContact O-N 2.71Å
149	Q	96.8	Very high	96.1	Very high	38 Å²	38	70.7 Å²	70.7	18%	0.178	34%	0.337	C	S	.	.	H	α-helix	trans	-59.6	-51.7	176.2	-166.6	-151.9	16	0	0	111.2	E135 R151 F152 K153	E135-Q149 PolarHBondContact OE1-NE2 3.23Å; Q149-R151 VanDerWaalsContact C-N 3.33Å; Q149-R151 PolarHBondContact O-N 3.35Å; Q149-F152 PolarHBondContact O-N 3.4Å; Q149-K153 WeakPolarHBondContact O-CB 3.33Å; Q149-K153 PolarHBondContact O-N 3.24Å
150	C	97.4	Very high	96	Very high	7 Å²	7	70.5 Å²	70.5	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-64	-35.9	178.2	-65.3	0	0	0	0	112.4	C131 E135 C137 I139 C147 K154	C131-C150 PolarHBondContact SG-SG 2.77Å; E135-C150 PolarHBondContact O-SG 2.87Å; C137-C150 HydrophobicContact CB-CB 3.85Å; I139-C150 HydrophobicContact CD1-CB 4.08Å; C147-C150 HydrophobicContact CB-CB 4.08Å; C147-C150 PolarHBondContact SG-N 3.17Å; C147-C150 PolarHBondContact SG-SG 2.84Å; C150-K154 WeakPolarHBondContact O-CB 3.32Å; C150-K154 PolarHBondContact O-N 3.45Å
151	R	98	Very high	95.8	Very high	11 Å²	11	68 Å²	68	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-63.2	-44.7	173.6	-169.7	-165.1	-168.9	144.9	-12	111.7	G113 F117 I139 R144 N145 C147 Q148 Q149 K154 C155	G113-R151 PolarHBondContact O-NH2 3.17Å; F117-R151 HydrophobicContact CD1-CG 4.11Å; F117-R151 HydrophobicContact CE1-CB 4.13Å; F117-R151 HydrophobicContact CE1-CG 3.87Å; F117-R151 HydrophobicContact CZ-CB 4.19Å; F117-R151 HydrophobicContact CZ-CG 4.28Å; I139-R151 HydrophobicContact CD1-CB 4.09Å; I139-R151 HydrophobicContact CG2-CG 4.16Å; R144-R151 VanDerWaalsContact O-CD 3.29Å; R144-R151 WeakPolarHBondContact O-CD 3.4Å; R144-R151 PolarHBondContact O-NH1 2.57Å; N145-R151 PolarHBondContact OD1-NH1 3.11Å; C147-R151 WeakPolarHBondContact O-CB 3.46Å; C147-R151 PolarHBondContact O-N 3.45Å; C147-R151 VanDerWaalsContact O-N 3.11Å; Q148-R151 PolarHBondContact O-N 2.79Å; Q149-R151 VanDerWaalsContact C-N 3.33Å; Q149-R151 PolarHBondContact O-N 3.35Å; R151-K154 PolarHBondContact O-N 2.89Å; R151-C155 PolarHBondContact O-N 2.91Å; R151-C155 PolarHBondContact O-SG 3.27Å
152	F	97.5	Very high	95.3	Very high	33 Å²	33	65.9 Å²	65.9	15%	0.145	32%	0.319	C	S	.	.	H	α-helix	trans	-69.2	-44	179.2	-175.5	-113.5	0	0	0	112	F117 F118 S121 I122 Y128 Q148 Q149 K154 C155 L156	F117-F152 HydrophobicContact CE1-CB 3.89Å; F117-F152 HydrophobicContact CE1-CD2 4.28Å; F117-F152 HydrophobicContact CZ-CB 4.07Å; F118-F152 AromaticContact CD2-CD2 3.88Å; F118-F152 HydrophobicContact CD2-CD2 3.88Å; F118-F152 AromaticContact CD2-CE2 3.65Å; F118-F152 HydrophobicContact CD2-CE2 3.65Å; F118-F152 HydrophobicContact CE2-CD2 4.14Å; F118-F152 AromaticContact CE2-CE2 3.56Å; F118-F152 HydrophobicContact CE2-CE2 3.56Å; F118-F152 HydrophobicContact CE2-CZ 4.37Å; S121-F152 VanDerWaalsContact CB-CD2 3.41Å; I122-F152 HydrophobicContact CD1-CE2 3.79Å; I122-F152 HydrophobicContact CD1-CZ 3.66Å; I122-F152 HydrophobicContact CG1-CE2 4.42Å; Y128-F152 HydrophobicContact CD2-CB 4.03Å; Y128-F152 HydrophobicContact CD2-CD1 4.46Å; Y128-F152 HydrophobicContact CD2-CG 4.33Å; Y128-F152 HydrophobicContact CE2-CB 3.91Å; Y128-F152 HydrophobicContact CE2-CD1 4.46Å; Y128-F152 HydrophobicContact CE2-CD2 4.45Å; Y128-F152 HydrophobicContact CE2-CG 4.03Å; Q148-F152 WeakPolarHBondContact O-CB 3.38Å; Q148-F152 PolarHBondContact O-N 2.71Å; Q149-F152 PolarHBondContact O-N 3.4Å; F152-K154 VanDerWaalsContact C-N 3.28Å; F152-K154 PolarHBondContact O-N 2.69Å; F152-C155 WeakPolarHBondContact O-CB 3.44Å; F152-C155 PolarHBondContact O-N 3.43Å; F152-C155 VanDerWaalsContact O-N 3.08Å; F152-L156 HydrophobicContact CD1-CD1 4.26Å; F152-L156 HydrophobicContact CE1-CD1 3.82Å; F152-L156 HydrophobicContact CZ-CD1 4.08Å; F152-L156 HydrophobicContact CZ-CD2 4.46Å; F152-L156 HydrophobicContact CZ-CG 4.39Å; F152-L156 PolarHBondContact O-N 3.1Å; F152-L156 VanDerWaalsContact O-N 3.1Å
153	K	96.5	Very high	94.5	Very high	89 Å²	89	62 Å²	62	39%	0.387	30%	0.302	S	S	.	.	H	α-helix	trans	-53.4	-45.1	170.3	-167.8	174.7	-173.3	177.8	0	110.8	E135 Q149 L156 M157	E135-K153 IonicContact OE2-NZ 3.55Å; E135-K153 PolarHBondContact OE2-NZ 3.3Å; Q149-K153 WeakPolarHBondContact O-CB 3.33Å; Q149-K153 PolarHBondContact O-N 3.24Å; K153-L156 PolarHBondContact O-N 3.43Å; K153-M157 VanDerWaalsContact O-CB 3.27Å; K153-M157 WeakPolarHBondContact O-CB 3.4Å; K153-M157 PolarHBondContact O-N 3.04Å
154	K	97.6	Very high	93.6	Very high	61 Å²	61	62.6 Å²	62.6	27%	0.265	31%	0.309	S	S	.	.	H	α-helix	trans	-69	-35.2	175.6	-164	179.3	178.6	-168.9	0	113.6	V96 I139 C150 R151 F152 M157 V158	V96-K154 VanDerWaalsContact O-CD 3.3Å; V96-K154 WeakPolarHBondContact O-CD 3.47Å; V96-K154 VanDerWaalsContact O-CE 3.23Å; V96-K154 WeakPolarHBondContact O-CE 3.25Å; V96-K154 PolarHBondContact O-NZ 3.41Å; I139-K154 HydrophobicContact CB-CD 3.79Å; I139-K154 HydrophobicContact CG1-CB 4.35Å; I139-K154 HydrophobicContact CG1-CD 4.02Å; I139-K154 HydrophobicContact CG2-CD 4.45Å; I139-K154 PolarHBondContact O-NZ 2.76Å; C150-K154 WeakPolarHBondContact O-CB 3.32Å; C150-K154 PolarHBondContact O-N 3.45Å; R151-K154 PolarHBondContact O-N 2.89Å; F152-K154 VanDerWaalsContact C-N 3.28Å; F152-K154 PolarHBondContact O-N 2.69Å; K154-M157 PolarHBondContact O-N 3.28Å; K154-V158 HydrophobicContact CG-CG1 4.19Å; K154-V158 WeakPolarHBondContact O-CG1 3.49Å; K154-V158 WeakPolarHBondContact O-CG2 3.3Å; K154-V158 PolarHBondContact O-N 2.83Å
155	C	97.5	Very high	92.2	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-57.7	-49.9	173.5	-72.3	0	0	0	0	111.4	F118 R151 F152 V158 M160	F118-C155 HydrophobicContact CD2-CB 3.48Å; F118-C155 VanDerWaalsContact CD2-CB 3.48Å; F118-C155 HydrophobicContact CE2-CB 3.95Å; F118-C155 HydrophobicContact CG-CB 4.31Å; R151-C155 PolarHBondContact O-N 2.91Å; R151-C155 PolarHBondContact O-SG 3.27Å; F152-C155 WeakPolarHBondContact O-CB 3.44Å; F152-C155 PolarHBondContact O-N 3.43Å; F152-C155 VanDerWaalsContact O-N 3.08Å; C155-V158 WeakPolarHBondContact O-CG2 3.06Å; C155-M160 HydrophobicContact CB-CB 4.36Å; C155-M160 HydrophobicContact CB-CG 4.33Å; C155-M160 HydrophobicContact CB-SD 3.67Å; C155-M160 VanDerWaalsContact O-CB 3.23Å; C155-M160 WeakPolarHBondContact O-CB 3.36Å; C155-M160 WeakPolarHBondContact O-CG 3.15Å; C155-M160 PolarHBondContact O-N 3.08Å
156	L	96.3	Very high	90.7	Very high	66 Å²	66	65.5 Å²	65.5	35%	0.346	31%	0.311	S	S	.	.	H	α-helix	trans	-60.9	-50.8	176.3	-63.5	170.3	0	0	0	110.8	F118 F152 K153 V158 G159 R162	F118-L156 HydrophobicContact CE2-CD2 3.74Å; F118-L156 HydrophobicContact CE2-CG 4.24Å; F118-L156 HydrophobicContact CZ-CD2 3.96Å; F152-L156 HydrophobicContact CD1-CD1 4.26Å; F152-L156 HydrophobicContact CE1-CD1 3.82Å; F152-L156 HydrophobicContact CZ-CD1 4.08Å; F152-L156 HydrophobicContact CZ-CD2 4.46Å; F152-L156 HydrophobicContact CZ-CG 4.39Å; F152-L156 PolarHBondContact O-N 3.1Å; F152-L156 VanDerWaalsContact O-N 3.1Å; K153-L156 PolarHBondContact O-N 3.43Å; L156-V158 VanDerWaalsContact C-N 3.29Å; L156-V158 PolarHBondContact O-N 3.2Å; L156-G159 PolarHBondContact O-N 3.18Å; L156-R162 HydrophobicContact CD2-CG 3.84Å
157	M	95.6	Very high	88.6	Confident	145 Å²	145	64.2 Å²	64.2	71%	0.714	31%	0.311	S	S	*	.	H	α-helix	trans	-56.2	-33.3	-179.3	178.9	-171.9	-78	0	0	114.6	K153 K154 G159	K153-M157 VanDerWaalsContact O-CB 3.27Å; K153-M157 WeakPolarHBondContact O-CB 3.4Å; K153-M157 PolarHBondContact O-N 3.04Å; K154-M157 PolarHBondContact O-N 3.28Å; M157-G159 VanDerWaalsContact C-N 3.29Å
158	V	95.1	Very high	86.6	Confident	35 Å²	35	65.9 Å²	65.9	21%	0.212	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-0.5	177.2	-58	0	0	0	0	114	K95 V96 V108 K154 C155 L156	K95-V158 HydrophobicContact CB-CB 4.01Å; K95-V158 HydrophobicContact CB-CG1 4.26Å; K95-V158 HydrophobicContact CB-CG2 4.12Å; V96-V158 HydrophobicContact CG2-CG2 3.65Å; V108-V158 HydrophobicContact CG1-CG2 4.28Å; V108-V158 WeakPolarHBondContact CG1-O 3.47Å; V108-V158 HydrophobicContact CG2-CG2 4.43Å; K154-V158 HydrophobicContact CG-CG1 4.19Å; K154-V158 WeakPolarHBondContact O-CG1 3.49Å; K154-V158 WeakPolarHBondContact O-CG2 3.3Å; K154-V158 PolarHBondContact O-N 2.83Å; C155-V158 WeakPolarHBondContact O-CG2 3.06Å; L156-V158 VanDerWaalsContact C-N 3.29Å; L156-V158 PolarHBondContact O-N 3.2Å
159	G	93.4	Very high	84.5	Confident	41 Å²	41	72.5 Å²	72.5	42%	0.423	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.2	21.3	177.1	0	0	0	0	0	116.2	V108 L156 M157 S161	V108-G159 WeakPolarHBondContact CG1-O 3.33Å; L156-G159 PolarHBondContact O-N 3.18Å; M157-G159 VanDerWaalsContact C-N 3.29Å; G159-S161 PolarHBondContact O-N 3.05Å
160	M	95	Very high	82.6	Confident	5 Å²	5	76 Å²	76	3%	0.025	37%	0.371	C	S	.	.			trans	-75.8	108.1	172.9	-68.8	-171.1	160.3	0	0	111.5	V96 Y106 V108 A110 F118 C155	V96-M160 HydrophobicContact CG2-CE 3.96Å; V96-M160 HydrophobicContact CG2-SD 4.29Å; Y106-M160 CarbonylContact O-C 3.47Å; Y106-M160 VanDerWaalsContact O-CA 3.28Å; Y106-M160 WeakPolarHBondContact O-CA 3.37Å; V108-M160 HydrophobicContact CG1-CG 4.2Å; V108-M160 HydrophobicContact CG2-CE 3.43Å; V108-M160 VanDerWaalsContact CG2-CE 3.43Å; V108-M160 HydrophobicContact CG2-CG 3.6Å; V108-M160 HydrophobicContact CG2-SD 4.36Å; A110-M160 HydrophobicContact CB-CE 3.49Å; A110-M160 VanDerWaalsContact CB-CE 3.49Å; F118-M160 HydrophobicContact CB-SD 3.79Å; F118-M160 HydrophobicContact CD1-CB 4.01Å; F118-M160 HydrophobicContact CD1-SD 3.98Å; F118-M160 HydrophobicContact CD2-CB 4.18Å; F118-M160 HydrophobicContact CD2-SD 4.05Å; F118-M160 HydrophobicContact CE1-CB 3.67Å; F118-M160 HydrophobicContact CE2-CB 3.85Å; F118-M160 HydrophobicContact CG-CB 4.26Å; F118-M160 HydrophobicContact CG-SD 3.67Å; F118-M160 HydrophobicContact CZ-CB 3.58Å; F118-M160 VanDerWaalsContact CZ-O 3.23Å; F118-M160 WeakPolarHBondContact CZ-O 3.32Å; C155-M160 HydrophobicContact CB-CB 4.36Å; C155-M160 HydrophobicContact CB-CG 4.33Å; C155-M160 HydrophobicContact CB-SD 3.67Å; C155-M160 VanDerWaalsContact O-CB 3.23Å; C155-M160 WeakPolarHBondContact O-CB 3.36Å; C155-M160 WeakPolarHBondContact O-CG 3.15Å; C155-M160 PolarHBondContact O-N 3.08Å
161	S	90.1	Very high	80.8	Confident	35 Å²	35	79.7 Å²	79.7	25%	0.245	39%	0.394	C	S	.	.			trans	-71.9	134.7	176.5	151.5	0	0	0	0	111.6	Y106 F118 G159 D163 S164	Y106-S161 PolarHBondContact O-N 3.13Å; F118-S161 WeakPolarHBondContact CE1-O 3.5Å; G159-S161 PolarHBondContact O-N 3.05Å; S161-D163 VanDerWaalsContact C-N 3.31Å; S161-D163 PolarHBondContact OG-N 3.46Å; S161-D163 PolarHBondContact OG-OD2 3.21Å; S161-S164 WeakPolarHBondContact CB-OG 3.44Å; S161-S164 PolarHBondContact OG-N 2.67Å; S161-S164 PolarHBondContact OG-OG 3.23Å; S161-S164 VanDerWaalsContact OG-OG 3.05Å
162	R	86.6	Confident	78.7	Confident	121 Å²	121	88.3 Å²	88.3	46%	0.457	43%	0.432	S	S	.	.	S	Bend	trans	-70.9	-33.2	178	-52.2	178.7	82.2	170.9	1.3	110.8	F118 I122 L156 V165	F118-R162 HydrophobicContact CZ-CG 4.44Å; I122-R162 HydrophobicContact CD1-CB 3.97Å; I122-R162 HydrophobicContact CD1-CG 3.77Å; L156-R162 HydrophobicContact CD2-CG 3.84Å; R162-V165 VanDerWaalsContact O-CB 3.25Å; R162-V165 WeakPolarHBondContact O-CB 3.48Å; R162-V165 PolarHBondContact O-N 2.92Å; R162-V165 VanDerWaalsContact O-N 3.12Å
163	D	78.4	Confident	77.1	Confident	89 Å²	89	97.5 Å²	97.5	48%	0.476	47%	0.466	S	S	.	.	H	α-helix	trans	-74.5	-39.8	-173.9	-26.6	-72	0	0	0	109.7	S161 V165 R166 F167	S161-D163 VanDerWaalsContact C-N 3.31Å; S161-D163 PolarHBondContact OG-N 3.46Å; S161-D163 PolarHBondContact OG-OD2 3.21Å; D163-V165 PolarHBondContact O-N 3.27Å; D163-R166 WeakPolarHBondContact O-CB 3.04Å; D163-R166 PolarHBondContact O-N 3.31Å; D163-F167 VanDerWaalsContact O-CD2 3.27Å; D163-F167 WeakPolarHBondContact O-CD2 3.2Å; D163-F167 PolarHBondContact O-N 3.18Å
164	S	73.3	Confident	75.7	Confident	48 Å²	48	96.8 Å²	96.8	34%	0.336	46%	0.464	S	S	.	.	H	α-helix	trans	-56.9	-17	168.2	-62.9	0	0	0	0	113.7	Y106 S161	Y106-S164 VanDerWaalsContact CD1-O 3.3Å; Y106-S164 WeakPolarHBondContact CD1-O 3.41Å; Y106-S164 WeakPolarHBondContact CE1-O 3.48Å; S161-S164 WeakPolarHBondContact CB-OG 3.44Å; S161-S164 PolarHBondContact OG-N 2.67Å; S161-S164 PolarHBondContact OG-OG 3.23Å; S161-S164 VanDerWaalsContact OG-OG 3.05Å
165	V	66.4	Low	73.7	Confident	8 Å²	8	100.4 Å²	100.4	5%	0.048	48%	0.48	C	S	.	.	H	α-helix	trans	-84.9	-31.3	172.4	-175.4	0	0	0	0	112.1	Y106 F118 R119 I122 Q123 R162 D163	Y106-V165 HydrophobicContact CD1-CB 4.44Å; Y106-V165 HydrophobicContact CD1-CG2 3.69Å; Y106-V165 HydrophobicContact CD2-CG2 4.31Å; Y106-V165 HydrophobicContact CE1-CB 4.3Å; Y106-V165 HydrophobicContact CE1-CG2 3.85Å; Y106-V165 HydrophobicContact CE2-CG2 4.44Å; Y106-V165 HydrophobicContact CG-CG2 3.94Å; F118-V165 HydrophobicContact CD1-CG2 3.7Å; F118-V165 HydrophobicContact CE1-CG2 3.5Å; R119-V165 HydrophobicContact CB-CG1 4.47Å; R119-V165 HydrophobicContact CG-CG1 3.85Å; I122-V165 HydrophobicContact CB-CB 4.25Å; I122-V165 HydrophobicContact CB-CG1 4.09Å; I122-V165 HydrophobicContact CB-CG2 4.33Å; I122-V165 HydrophobicContact CG1-CG2 4.13Å; I122-V165 HydrophobicContact CG2-CB 4.06Å; I122-V165 HydrophobicContact CG2-CG1 4.17Å; Q123-V165 HydrophobicContact CG-CG1 3.97Å; R162-V165 VanDerWaalsContact O-CB 3.25Å; R162-V165 WeakPolarHBondContact O-CB 3.48Å; R162-V165 PolarHBondContact O-N 2.92Å; R162-V165 VanDerWaalsContact O-N 3.12Å; D163-V165 PolarHBondContact O-N 3.27Å
166	R	63.6	Low	72.2	Confident	218 Å²	218	106.2 Å²	106.2	82%	0.823	51%	0.507	S	S	*	.	H	α-helix	trans	-69.3	-46	176.1	-84	178.6	157.1	171.1	-10.4	111.7	D163 G168	D163-R166 WeakPolarHBondContact O-CB 3.04Å; D163-R166 PolarHBondContact O-N 3.31Å; R166-G168 PolarHBondContact O-N 2.86Å; R166-G168 VanDerWaalsContact O-N 3.13Å
167	F	52.5	Low	71.3	Confident	178 Å²	178	110.1 Å²	110.1	78%	0.781	52%	0.517	S	S	*	.	S	Bend	trans	-74.3	1.5	-172.8	-69	-69.5	0	0	0	116.6	D163 R169	D163-F167 VanDerWaalsContact O-CD2 3.27Å; D163-F167 WeakPolarHBondContact O-CD2 3.2Å; D163-F167 PolarHBondContact O-N 3.18Å; F167-R169 PolarHBondContact O-N 3.46Å
168	G	55	Low	69.5	Low	51 Å²	51	108 Å²	108	53%	0.526	51%	0.507	S	S	.	.			trans	70.2	-130.4	170.1	0	0	0	0	0	114.9	R166	R166-G168 PolarHBondContact O-N 2.86Å; R166-G168 VanDerWaalsContact O-N 3.13Å
169	R	53	Low	68.2	Low	244 Å²	244	110.2 Å²	110.2	92%	0.921	52%	0.517	S	S	*	.	S	Bend	trans	-88.6	113.5	-175.4	-67.8	-177.8	-176.2	132.4	-2.8	110.5	F167	F167-R169 PolarHBondContact O-N 3.46Å
170	I	56.8	Low	67.1	Low	112 Å²	112	113.3 Å²	113.3	57%	0.574	52%	0.523	S	S	*	.			trans	-46.3	124.3	170.1	-64.3	173.3	0	0	0	110.2	E174	I170-E174 HydrophobicContact CG2-CB 3.73Å; I170-E174 HydrophobicContact CG2-CG 3.97Å
171	P	59.6	Low	66	Low	83 Å²	83	118.4 Å²	118.4	54%	0.539	55%	0.547	S	S	.	.			trans	-58.1	147.3	179.5	-27.1	35.7	0	0	0	113	R173 E174 K175	P171-R173 PolarHBondContact O-N 2.91Å; P171-E174 HydrophobicContact CB-CB 4.44Å; P171-E174 WeakPolarHBondContact O-CB 3.25Å; P171-E174 PolarHBondContact O-N 3.44Å; P171-E174 VanDerWaalsContact O-N 3.09Å; P171-K175 PolarHBondContact O-N 3.13Å; P171-K175 VanDerWaalsContact O-N 3.15Å
172	K	54	Low	64.5	Low	193 Å²	193	121.2 Å²	121.2	84%	0.839	56%	0.557	S	S	*	*	H	α-helix	trans	-55.4	-36.7	179	-73.2	-177.5	178.1	177.6	0	112.6	K175 Q176	K172-K175 PolarHBondContact O-N 3.44Å; K172-Q176 PolarHBondContact O-N 3.5Å
173	R	63.5	Low	63.5	Low	226 Å²	226	121.2 Å²	121.2	85%	0.853	56%	0.562	S	S	*	*	H	α-helix	trans	-62.8	-42.5	178.6	-162.8	174.7	-170.8	165.1	2.1	112	P171 Q176 R177	P171-R173 PolarHBondContact O-N 2.91Å; R173-Q176 WeakPolarHBondContact O-CB 3.35Å; R173-Q176 PolarHBondContact O-N 3.43Å; R173-R177 PolarHBondContact O-N 3.39Å
174	E	66.6	Low	63.2	Low	74 Å²	74	120.2 Å²	120.2	35%	0.346	56%	0.563	S	S	.	*	H	α-helix	trans	-63.5	-46.1	176.1	-158.2	65.1	-112.1	0	0	111.5	I170 P171 Q176 R177 M178	I170-E174 HydrophobicContact CG2-CB 3.73Å; I170-E174 HydrophobicContact CG2-CG 3.97Å; P171-E174 HydrophobicContact CB-CB 4.44Å; P171-E174 WeakPolarHBondContact O-CB 3.25Å; P171-E174 PolarHBondContact O-N 3.44Å; P171-E174 VanDerWaalsContact O-N 3.09Å; E174-Q176 VanDerWaalsContact C-N 3.29Å; E174-Q176 PolarHBondContact O-N 2.91Å; E174-R177 WeakPolarHBondContact O-CB 3.24Å; E174-R177 PolarHBondContact O-N 2.85Å; E174-R177 IonicContact OE1-CZ 3.15Å; E174-R177 VanDerWaalsContact OE1-CZ 3.26Å; E174-R177 IonicContact OE1-NE 3.44Å; E174-R177 PolarHBondContact OE1-NE 3.33Å; E174-R177 IonicContact OE1-NH2 3.64Å; E174-R177 PolarHBondContact OE1-NH2 3.23Å; E174-M178 PolarHBondContact O-N 3.25Å
175	K	55.9	Low	62.9	Low	136 Å²	136	120.8 Å²	120.8	59%	0.591	57%	0.57	S	S	*	*	H	α-helix	trans	-62	-36.9	175.4	-173.5	-174.8	174.7	-169.6	0	112.1	P171 K172 L179	P171-K175 PolarHBondContact O-N 3.13Å; P171-K175 VanDerWaalsContact O-N 3.15Å; K172-K175 PolarHBondContact O-N 3.44Å; K175-L179 HydrophobicContact CG-CD1 4.37Å; K175-L179 WeakPolarHBondContact O-CG 2.99Å; K175-L179 PolarHBondContact O-N 3.49Å
176	Q	64.9	Low	62.4	Low	123 Å²	123	124.9 Å²	124.9	58%	0.575	59%	0.59	S	S	*	*	H	α-helix	trans	-66.9	-43.2	176.9	-160.1	74.5	11.3	0	0	111.1	K172 R173 E174 L179 L180	K172-Q176 PolarHBondContact O-N 3.5Å; R173-Q176 WeakPolarHBondContact O-CB 3.35Å; R173-Q176 PolarHBondContact O-N 3.43Å; E174-Q176 VanDerWaalsContact C-N 3.29Å; E174-Q176 PolarHBondContact O-N 2.91Å; Q176-L179 PolarHBondContact O-N 3.08Å; Q176-L180 HydrophobicContact CG-CD1 4.38Å; Q176-L180 PolarHBondContact O-N 3.03Å
177	R	77.2	Confident	62.7	Low	148 Å²	148	119 Å²	119	56%	0.558	58%	0.575	S	S	*	*	H	α-helix	trans	-56.5	-53.3	174.8	-178.1	168.4	77	125.1	-8.5	111.4	R173 E174 L179 L180 E181	R173-R177 PolarHBondContact O-N 3.39Å; E174-R177 WeakPolarHBondContact O-CB 3.24Å; E174-R177 PolarHBondContact O-N 2.85Å; E174-R177 IonicContact OE1-CZ 3.15Å; E174-R177 VanDerWaalsContact OE1-CZ 3.26Å; E174-R177 IonicContact OE1-NE 3.44Å; E174-R177 PolarHBondContact OE1-NE 3.33Å; E174-R177 IonicContact OE1-NH2 3.64Å; E174-R177 PolarHBondContact OE1-NH2 3.23Å; R177-L179 VanDerWaalsContact C-N 3.27Å; R177-L179 PolarHBondContact O-N 2.91Å; R177-L180 PolarHBondContact O-N 2.71Å; R177-L180 VanDerWaalsContact O-N 3.14Å; R177-E181 WeakPolarHBondContact O-CB 3.14Å; R177-E181 PolarHBondContact O-N 3.29Å
178	M	58.3	Low	63.7	Low	101 Å²	101	114.8 Å²	114.8	50%	0.498	57%	0.567	S	S	.	*	H	α-helix	trans	-61.3	-31	-179.9	-173.3	178.9	-73.2	0	0	113.5	E174 M182	E174-M178 PolarHBondContact O-N 3.25Å; M178-M182 WeakPolarHBondContact O-CB 3.39Å; M178-M182 PolarHBondContact O-N 2.96Å; M178-M182 VanDerWaalsContact O-N 3.08Å
179	L	67.2	Low	63.7	Low	80 Å²	80	119.3 Å²	119.3	42%	0.419	58%	0.576	S	S	.	*	H	α-helix	trans	-73.5	-41.7	174.2	-77.9	168.8	0	0	0	112.5	K175 Q176 R177 E181 M182 Q183	K175-L179 HydrophobicContact CG-CD1 4.37Å; K175-L179 WeakPolarHBondContact O-CG 2.99Å; K175-L179 PolarHBondContact O-N 3.49Å; Q176-L179 PolarHBondContact O-N 3.08Å; R177-L179 VanDerWaalsContact C-N 3.27Å; R177-L179 PolarHBondContact O-N 2.91Å; L179-E181 VanDerWaalsContact C-N 3.33Å; L179-M182 HydrophobicContact CD2-CE 4.33Å; L179-Q183 WeakPolarHBondContact O-CB 3.47Å; L179-Q183 PolarHBondContact O-N 2.91Å
180	L	71	Confident	64	Low	107 Å²	107	115.6 Å²	115.6	56%	0.56	57%	0.571	S	S	*	*	H	α-helix	trans	-62.7	-40.5	174.1	-80.9	158.3	0	0	0	111.7	Q176 R177 Q183 S184	Q176-L180 HydrophobicContact CG-CD1 4.38Å; Q176-L180 PolarHBondContact O-N 3.03Å; R177-L180 PolarHBondContact O-N 2.71Å; R177-L180 VanDerWaalsContact O-N 3.14Å; L180-Q183 PolarHBondContact O-N 3.2Å; L180-S184 PolarHBondContact O-N 3.05Å; L180-S184 PolarHBondContact O-OG 3.01Å
181	E	71.1	Confident	63.9	Low	111 Å²	111	114.8 Å²	114.8	52%	0.519	58%	0.576	S	S	.	*	H	α-helix	trans	-69	-39.4	179.4	-169.7	166.7	-140	0	0	112.4	R177 L179 Q183 S184 A185	R177-E181 WeakPolarHBondContact O-CB 3.14Å; R177-E181 PolarHBondContact O-N 3.29Å; L179-E181 VanDerWaalsContact C-N 3.33Å; E181-Q183 VanDerWaalsContact C-N 3.31Å; E181-Q183 PolarHBondContact O-N 3.43Å; E181-S184 PolarHBondContact O-OG 2.94Å; E181-S184 VanDerWaalsContact O-OG 3.04Å; E181-A185 WeakPolarHBondContact O-CB 3.3Å; E181-A185 PolarHBondContact O-N 3.06Å; E181-A185 VanDerWaalsContact O-N 3.13Å
182	M	59.3	Low	63.3	Low	95 Å²	95	114.7 Å²	114.7	47%	0.468	59%	0.59	S	S	.	*	H	α-helix	trans	-67.7	-31.8	171.2	-168.3	179.2	73	0	0	112.2	I87 M178 L179 M186	I87-M182 HydrophobicContact CD1-CE 4.34Å; M178-M182 WeakPolarHBondContact O-CB 3.39Å; M178-M182 PolarHBondContact O-N 2.96Å; M178-M182 VanDerWaalsContact O-N 3.08Å; L179-M182 HydrophobicContact CD2-CE 4.33Å; M182-M186 PolarHBondContact O-N 3.48Å
183	Q	65.6	Low	62.7	Low	120 Å²	120	108.7 Å²	108.7	56%	0.561	58%	0.583	S	S	*	*	H	α-helix	trans	-79.5	-35.4	178.5	-168.8	163.6	24.5	0	0	112.7	L179 L180 E181 M186 N187	L179-Q183 WeakPolarHBondContact O-CB 3.47Å; L179-Q183 PolarHBondContact O-N 2.91Å; L180-Q183 PolarHBondContact O-N 3.2Å; E181-Q183 VanDerWaalsContact C-N 3.31Å; E181-Q183 PolarHBondContact O-N 3.43Å; Q183-M186 PolarHBondContact O-N 3.22Å; Q183-N187 PolarHBondContact O-N 3.36Å
184	S	72.3	Confident	62	Low	69 Å²	69	105.9 Å²	105.9	48%	0.483	58%	0.579	S	S	.	*	H	α-helix	trans	-66.7	-38.8	172.6	63.8	0	0	0	0	111.4	L180 E181 M186 N187 S188	L180-S184 PolarHBondContact O-N 3.05Å; L180-S184 PolarHBondContact O-OG 3.01Å; E181-S184 PolarHBondContact O-OG 2.94Å; E181-S184 VanDerWaalsContact O-OG 3.04Å; S184-M186 PolarHBondContact O-N 2.98Å; S184-N187 PolarHBondContact O-N 2.98Å; S184-S188 WeakPolarHBondContact O-CB 3.26Å; S184-S188 PolarHBondContact O-N 3.36Å
185	A	66.9	Low	60.4	Low	59 Å²	59	110 Å²	110	49%	0.488	60%	0.602	S	S	.	*	H	α-helix	trans	-58.2	-45.4	171.4	0	0	0	0	0	112.2	E181 N187 S188 M189	E181-A185 WeakPolarHBondContact O-CB 3.3Å; E181-A185 PolarHBondContact O-N 3.06Å; E181-A185 VanDerWaalsContact O-N 3.13Å; A185-N187 PolarHBondContact O-N 3.44Å; A185-S188 PolarHBondContact O-N 3.48Å; A185-M189 PolarHBondContact O-N 3.03Å
186	M	57.3	Low	59.6	Low	94 Å²	94	112.8 Å²	112.8	46%	0.463	62%	0.618	S	S	.	*	H	α-helix	trans	-67.1	-31	176.4	-80.7	-167.9	157.8	0	0	114	M182 Q183 S184 M189	M182-M186 PolarHBondContact O-N 3.48Å; Q183-M186 PolarHBondContact O-N 3.22Å; S184-M186 PolarHBondContact O-N 2.98Å; M186-M189 HydrophobicContact CB-CE 4.2Å; M186-M189 HydrophobicContact CG-CE 3.96Å; M186-M189 WeakPolarHBondContact O-CG 3.28Å
187	N	68.9	Low	58	Low	96 Å²	96	111.5 Å²	111.5	51%	0.513	62%	0.622	S	S	.	*	H	α-helix	trans	-78.5	-35.1	176.3	-71.6	-2.7	0	0	0	112.4	Q183 S184 A185 M189 M190 S191	Q183-N187 PolarHBondContact O-N 3.36Å; S184-N187 PolarHBondContact O-N 2.98Å; A185-N187 PolarHBondContact O-N 3.44Å; N187-M189 PolarHBondContact O-N 2.88Å; N187-M190 WeakPolarHBondContact O-CB 3.41Å; N187-M190 PolarHBondContact O-N 2.68Å; N187-M190 VanDerWaalsContact O-N 3.07Å; N187-S191 PolarHBondContact O-N 2.75Å; N187-S191 PolarHBondContact O-OG 3.14Å
188	S	72.5	Confident	55.7	Low	88 Å²	88	111.6 Å²	111.6	62%	0.615	63%	0.629	S	S	*	*	H	α-helix	trans	-62.1	-43.9	179.8	-166.7	0	0	0	0	111.4	S184 A185 M190 S191	S184-S188 WeakPolarHBondContact O-CB 3.26Å; S184-S188 PolarHBondContact O-N 3.36Å; A185-S188 PolarHBondContact O-N 3.48Å; S188-M190 PolarHBondContact O-N 2.69Å; S188-S191 PolarHBondContact O-N 2.75Å
189	M	56.4	Low	54.5	Low	147 Å²	147	114 Å²	114	72%	0.724	64%	0.643	S	S	*	*	H	α-helix	trans	-68.7	-9.6	174.7	68.7	-178.9	-157.1	0	0	114.8	A185 M186 N187	A185-M189 PolarHBondContact O-N 3.03Å; M186-M189 HydrophobicContact CB-CE 4.2Å; M186-M189 HydrophobicContact CG-CE 3.96Å; M186-M189 WeakPolarHBondContact O-CG 3.28Å; N187-M189 PolarHBondContact O-N 2.88Å
190	M	58	Low	52.7	Low	165 Å²	165	115.1 Å²	115.1	81%	0.813	66%	0.658	S	S	*	*	H	α-helix	trans	-95.7	-23.4	175.2	-161.4	75.7	-171.7	0	0	112.4	N187 S188	N187-M190 WeakPolarHBondContact O-CB 3.41Å; N187-M190 PolarHBondContact O-N 2.68Å; N187-M190 VanDerWaalsContact O-N 3.07Å; S188-M190 PolarHBondContact O-N 2.69Å
191	S	55	Low	50.9	Low	95 Å²	95	118.5 Å²	118.5	66%	0.664	67%	0.671	S	S	*	*	H	α-helix	trans	-97.5	-15.2	-169.5	-53.1	0	0	0	0	114.4	N187 S188 G193	N187-S191 PolarHBondContact O-N 2.75Å; N187-S191 PolarHBondContact O-OG 3.14Å; S188-S191 PolarHBondContact O-N 2.75Å; S191-G193 PolarHBondContact O-N 2.71Å
192	G	46.7	Very low	49.7	Very low	82 Å²	82	118.7 Å²	118.7	85%	0.845	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	27.3	-178.2	0	0	0	0	0	115.9
193	G	42.6	Very low	48.4	Very low	66 Å²	66	123.3 Å²	123.3	68%	0.68	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	2.6	-165.6	0	0	0	0	0	116.8	S191	S191-G193 PolarHBondContact O-N 2.71Å
194	H	48	Very low	46.7	Very low	167 Å²	167	122.4 Å²	122.4	77%	0.773	72%	0.715	S	S	*	*			trans	-157.2	111.3	178.5	-140.7	61.9	0	0	0	114.1
195	L	33.6	Very low	44.6	Very low	160 Å²	160	124 Å²	124	84%	0.838	73%	0.732	S	S	*	*				166.5	129.6	118	-90	164.9	0	0	0	111.7
196	Q	38.3	Very low	42.7	Very low	195 Å²	195	124.5 Å²	124.5	91%	0.911	74%	0.743	S	S	*	*			trans	-151.8	110.7	167.2	175.7	-174.8	19.5	0	0	107.6
197	S	31.7	Very low	41.3	Very low	97 Å²	97	129.1 Å²	129.1	68%	0.678	76%	0.763	S	S	*	*			trans	-179	173.4	148.1	-148.9	0	0	0	0	111.3
198	E	30.2	Very low	39.5	Very low	149 Å²	149	129 Å²	129	70%	0.696	78%	0.775	S	S	*	*			trans	66.6	141.8	168.3	-46.8	-47.3	101.2	0	0	119.5
199	L	31.9	Very low	37.7	Very low	152 Å²	152	129.2 Å²	129.2	80%	0.796	78%	0.782	S	S	*	*			cis	-157.1	152.8	-37.9	-170.3	56.3	0	0	0	108.1
200	S	30.3	Very low	37.3	Very low	104 Å²	104	127.4 Å²	127.4	73%	0.727	78%	0.782	S	S	*	*			trans	-96.4	136.2	-178.9	-51.5	0	0	0	0	113.3
201	Q	33.2	Very low	36.1	Very low	177 Å²	177	127.3 Å²	127.3	83%	0.827	78%	0.784	S	S	*	*				-178.5	146.9	128.8	-103.3	172.5	17.5	0	0	113.2
202	P	45.2	Very low	34.9	Very low	115 Å²	115	129.9 Å²	129.9	75%	0.747	80%	0.796	S	S	*	*			trans	-112.9	149.3	173.2	38.8	-29.6	0	0	0	113.7
203	H	31.7	Very low	34.1	Very low	193 Å²	193	130.3 Å²	130.3	89%	0.894	79%	0.791	S	S	*	*			trans	-144.3	148.4	158.5	-89	-80.6	0	0	0	110
204	A	29.3	Very low	33.6	Very low	101 Å²	101	132.2 Å²	132.2	84%	0.835	80%	0.8	S	S	*	*			trans	-140.9	150.6	-174.3	0	0	0	0	0	111.5
205	A	28.2	Very low	32.8	Very low	101 Å²	101	129.2 Å²	129.2	84%	0.835	80%	0.804	S	S	*	*			trans	-163.5	119.6	163.5	0	0	0	0	0	112.1
206	G	28.6	Very low	32.8	Very low	70 Å²	70	128.8 Å²	128.8	72%	0.722	80%	0.798	S	S	*	*			trans	62.1	169.6	155.2	0	0	0	0	0	120.4
207	E	27.8	Very low	32.4	Very low	192 Å²	192	127.3 Å²	127.3	90%	0.897	79%	0.789	S	S	*	*			cis	-161.7	165.3	-37.3	-134.8	172.7	122.3	0	0	110.9
208	A	29.5	Very low	32.3	Very low	92 Å²	92	127.9 Å²	127.9	76%	0.76	80%	0.799	S	S	*	*			trans	37.5	121.9	158.6	0	0	0	0	0	122.3
209	A	35.2	Very low	32.1	Very low	93 Å²	93	124.3 Å²	124.3	77%	0.769	80%	0.802	S	S	*	*			trans	-89.1	179.2	144.1	0	0	0	0	0	109.1
210	P	47.8	Very low	32.9	Very low	110 Å²	110	123.5 Å²	123.5	71%	0.714	81%	0.806	S	S	*	*			cis	-144	174.1	10.1	43.6	-24.1	0	0	0	118.5
211	L	33	Very low	33	Very low	163 Å²	163	122.8 Å²	122.8	85%	0.853	81%	0.806	S	S	*	*			trans	38	127.5	144.3	-64	167.9	0	0	0	122.8
212	T	29.6	Very low	33.4	Very low	149 Å²	149	120.4 Å²	120.4	91%	0.914	81%	0.807	S	S	*	*				-168.1	138.4	126.5	10.2	0	0	0	0	117
213	A	31.3	Very low	32.8	Very low	91 Å²	91	120.2 Å²	120.2	75%	0.752	81%	0.808	S	S	*	*			trans	24.1	112.9	150.9	0	0	0	0	0	126.2
214	A	32.1	Very low	33.3	Very low	105 Å²	105	117.2 Å²	117.2	87%	0.868	81%	0.806	S	S	*	*				58.4	127.7	109.9	0	0	0	0	0	125.9
215	A	31	Very low	33.3	Very low	104 Å²	104	118.5 Å²	118.5	86%	0.86	81%	0.808	S	S	*	*			trans	173.7	160.3	140.7	0	0	0	0	0	110.7
216	E	32	Very low	33.3	Very low	152 Å²	152	116.8 Å²	116.8	71%	0.71	80%	0.8	S	S	*	*			cis	-160.5	161.2	-46.8	-142.5	-141.1	148.9	0	0	110
217	K	31.2	Very low	33.5	Very low	164 Å²	164	118.9 Å²	118.9	71%	0.713	80%	0.804	S	S	*	*			trans	48.6	122.5	163.8	-71.8	177.2	177.5	69.7	0	122.6
218	A	28.4	Very low	33.7	Very low	109 Å²	109	115.8 Å²	115.8	90%	0.901	80%	0.803	S	S	*	*				173.7	160.6	109.3	0	0	0	0	0	113.4
219	G	27.6	Very low	33.8	Very low	73 Å²	73	120.9 Å²	120.9	75%	0.753	81%	0.811	S	S	*	*			trans	-147.8	-165	170.3	0	0	0	0	0	110.3
220	P	47.9	Very low	33.7	Very low	136 Å²	136	121 Å²	121	88%	0.883	81%	0.807	S	S	*	*			cis	-126.7	-157.1	4.6	42.7	-25.6	0	0	0	113.7
221	A	32.5	Very low	32.7	Very low	88 Å²	88	122.2 Å²	122.2	73%	0.727	81%	0.807	S	S	*	*			trans	-78.9	171.6	-176.6	0	0	0	0	0	115.2
222	P	40.9	Very low	32.7	Very low	128 Å²	128	119.3 Å²	119.3	83%	0.831	80%	0.8	S	S	*	*				-143.8	172.7	101	41.1	-28.6	0	0	0	115.9
223	S	32.4	Very low	32.9	Very low	110 Å²	110	117.2 Å²	117.2	77%	0.769	79%	0.792	S	S	*	*			trans	-79.3	173.1	172.7	-40.4	0	0	0	0	113.3
224	P	42.3	Very low	33	Very low	131 Å²	131	117.7 Å²	117.7	85%	0.851	79%	0.79	S	S	*	*				-130.2	172.3	125.6	38.4	-31.9	0	0	0	113
225	S	30.1	Very low	32.9	Very low	127 Å²	127	120.1 Å²	120.1	89%	0.888	79%	0.788	S	S	*	*			trans	-139.7	163.5	-174.8	56.4	0	0	0	0	112.5
226	G	28.4	Very low	33.8	Very low	65 Å²	65	120.6 Å²	120.6	67%	0.67	78%	0.783	S	S	*	*			trans	159.5	153.9	160.8	0	0	0	0	0	112.8
227	S	32.2	Very low	33.8	Very low	114 Å²	114	121.3 Å²	121.3	80%	0.797	79%	0.791	S	S	*	*			cis	170	121.5	-25.2	39.9	0	0	0	0	107.1
228	S	32	Very low	33.8	Very low	127 Å²	127	117 Å²	117	89%	0.888	79%	0.793	S	S	*	*			trans	-159.4	131	161.2	-76.1	0	0	0	0	109.4
229	Q	31	Very low	34.2	Very low	199 Å²	199	116.4 Å²	116.4	93%	0.93	79%	0.789	S	S	*	*			trans	-93.2	176.6	170.9	-61.5	157.6	-56.4	0	0	107.5
230	S	33.8	Very low	34.7	Very low	96 Å²	96	120.2 Å²	120.2	67%	0.671	79%	0.79	S	S	*	*			cis	-146.2	-169.4	11.8	64.7	0	0	0	0	109.1
231	D	26.8	Very low	34.8	Very low	136 Å²	136	119.1 Å²	119.1	73%	0.727	78%	0.783	S	S	*	*			cis	-155.5	172.8	14.2	-128.6	-45.8	0	0	0	113.1
232	S	33.2	Very low	35.1	Very low	101 Å²	101	123.7 Å²	123.7	71%	0.706	79%	0.792	S	S	*	*			trans	-33.6	161.5	169.3	-56.1	0	0	0	0	118.6
233	S	33.6	Very low	34.8	Very low	105 Å²	105	125 Å²	125	73%	0.734	79%	0.791	S	S	*	*			cis	-176.8	-176.1	-18.2	60.7	0	0	0	0	107.1
234	S	32.5	Very low	35.1	Very low	102 Å²	102	127 Å²	127	71%	0.713	80%	0.799	S	S	*	*			cis	-152.1	166.1	9.7	-52.3	0	0	0	0	111.3
235	D	31	Very low	34.6	Very low	155 Å²	155	124.2 Å²	124.2	83%	0.829	79%	0.794	S	S	*	*			trans	-76.4	179.3	164.8	-60.3	-72.9	0	0	0	112.6
236	P	50.7	Low	35.1	Very low	114 Å²	114	123.7 Å²	123.7	74%	0.74	79%	0.791	S	S	*	*			cis	-144.3	171	11.2	46.4	-28.3	0	0	0	119.5
237	D	31.7	Very low	35.3	Very low	168 Å²	168	126.3 Å²	126.3	90%	0.898	80%	0.799	S	S	*	*			trans	56.7	151.6	146.9	-124.2	-37.5	0	0	0	122.8
238	G	30.9	Very low	35.3	Very low	73 Å²	73	125.9 Å²	125.9	75%	0.753	80%	0.796	S	S	*	*			trans	143.9	80.4	171.6	0	0	0	0	0	116
239	A	37.3	Very low	35.7	Very low	97 Å²	97	125.5 Å²	125.5	80%	0.802	79%	0.791	S	S	*	*			trans	-87.3	132.7	171.5	0	0	0	0	0	112.7
240	I	37.6	Very low	35.7	Very low	153 Å²	153	121.5 Å²	121.5	79%	0.785	78%	0.784	S	S	*	*			trans	-166.7	140.4	152.5	-99.2	-68.6	0	0	0	107.1
241	P	49.4	Very low	36.1	Very low	113 Å²	113	122.2 Å²	122.2	73%	0.734	79%	0.787	S	S	*	*			trans	-88.7	148.1	-179.2	34.7	-34	0	0	0	113.2
242	M	38.3	Very low	36.5	Very low	184 Å²	184	121.1 Å²	121.1	91%	0.906	79%	0.79	S	S	*	*			trans	-145.5	134	159.4	-80.3	-165.4	171.9	0	0	111.3
243	D	35.9	Very low	37	Very low	154 Å²	154	122 Å²	122	82%	0.824	79%	0.79	S	S	*	*			trans	-73.2	137.3	167	-65.6	-78.4	0	0	0	111.4
244	T	39.3	Very low	37.5	Very low	152 Å²	152	121.2 Å²	121.2	93%	0.933	79%	0.785	S	S	*	*				162.2	139.2	128.1	36.1	0	0	0	0	110.2
245	G	31.8	Very low	38.6	Very low	73 Å²	73	121 Å²	121	75%	0.753	78%	0.776	S	S	*	*			trans	141.4	97.5	171	0	0	0	0	0	114.6	S247	G245-S247 PolarHBondContact O-N 2.86Å
246	S	40	Very low	40.2	Very low	116 Å²	116	118.6 Å²	118.6	81%	0.811	77%	0.771	S	S	*	*			trans	-22.4	121.2	171.3	-51	0	0	0	0	117.4
247	S	31.8	Very low	41.7	Very low	120 Å²	120	114.9 Å²	114.9	84%	0.839	75%	0.754	S	S	*	*			trans	-136	77.5	154.1	-75.4	0	0	0	0	108.8	G245	G245-S247 PolarHBondContact O-N 2.86Å
248	S	32.7	Very low	44.3	Very low	106 Å²	106	109 Å²	109	74%	0.741	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-62.1	132.4	-179.9	-52.4	0	0	0	0	110.7	S250	S248-S250 PolarHBondContact O-N 3.26Å
249	P	41.4	Very low	47.2	Very low	119 Å²	119	108.5 Å²	108.5	77%	0.773	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-62.3	137.8	169	27.6	-33.5	0	0	0	109.4
250	S	30.7	Very low	49.9	Very low	114 Å²	114	110.4 Å²	110.4	80%	0.797	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-61.1	129.9	177.8	-52.9	0	0	0	0	110.2	S248 S252	S248-S250 PolarHBondContact O-N 3.26Å; S250-S252 PolarHBondContact O-N 3.28Å
251	P	40.9	Very low	52.6	Low	112 Å²	112	104.2 Å²	104.2	73%	0.727	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-69.1	122.2	-178.8	27.2	-33.6	0	0	0	110.8	V253	P251-V253 VanDerWaalsContact C-N 3.3Å; P251-V253 HydrophobicContact CB-CG2 4.27Å; P251-V253 HydrophobicContact CG-CG2 4.41Å; P251-V253 PolarHBondContact O-N 3.31Å
252	S	36.5	Very low	54.9	Low	113 Å²	113	99 Å²	99	79%	0.79	63%	0.628	S	S	*	*			trans	-73.1	82.9	168.4	43.4	0	0	0	0	110	S250 S254	S250-S252 PolarHBondContact O-N 3.28Å; S252-S254 PolarHBondContact O-N 2.94Å
253	V	42.8	Very low	57.6	Low	118 Å²	118	91 Å²	91	72%	0.715	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	128.6	-175.7	173.4	0	0	0	0	111.5	P251	P251-V253 VanDerWaalsContact C-N 3.3Å; P251-V253 HydrophobicContact CB-CG2 4.27Å; P251-V253 HydrophobicContact CG-CG2 4.41Å; P251-V253 PolarHBondContact O-N 3.31Å
254	S	45.3	Very low	60.5	Low	89 Å²	89	84.9 Å²	84.9	62%	0.622	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	89	-4.1	163.8	-64.2	0	0	0	0	121.5	S252 S256 G257	S252-S254 PolarHBondContact O-N 2.94Å; S254-S256 VanDerWaalsContact C-N 3.32Å; S254-S256 PolarHBondContact O-N 3.07Å; S254-G257 PolarHBondContact O-N 2.8Å
255	D	53.7	Low	63.2	Low	99 Å²	99	77.6 Å²	77.6	53%	0.529	52%	0.518	S	S	.	.	H	α-helix	trans	-59.1	-39.9	-179.4	-156.6	30.9	0	0	0	113.3	G257 E258	D255-G257 VanDerWaalsContact C-N 3.25Å; D255-G257 PolarHBondContact O-N 3.07Å; D255-G257 VanDerWaalsContact O-N 3.11Å; D255-E258 PolarHBondContact O-N 2.84Å; D255-E258 VanDerWaalsContact O-N 3.14Å
256	S	65	Low	66.2	Low	103 Å²	103	74.5 Å²	74.5	72%	0.72	49%	0.485	S	S	*	.	H	α-helix	trans	-60.9	-25.6	-174.2	63.2	0	0	0	0	115.5	S254	S254-S256 VanDerWaalsContact C-N 3.32Å; S254-S256 PolarHBondContact O-N 3.07Å
257	G	82.3	Confident	68.8	Low	37 Å²	37	75.1 Å²	75.1	38%	0.381	47%	0.469	S	S	.	.	H	α-helix	trans	-82.3	-22.5	-179.3	0	0	0	0	0	113.6	S254 D255 V261	S254-G257 PolarHBondContact O-N 2.8Å; D255-G257 VanDerWaalsContact C-N 3.25Å; D255-G257 PolarHBondContact O-N 3.07Å; D255-G257 VanDerWaalsContact O-N 3.11Å; G257-V261 WeakPolarHBondContact O-CG2 3.46Å
258	E	87.3	Confident	71.8	Confident	43 Å²	43	69.6 Å²	69.6	20%	0.201	43%	0.431	C	S	.	.	H	α-helix	trans	-81.8	-42.6	179.9	-60.2	-167.9	171.1	0	0	110.8	D255 E260 V261 I262 R539 S543	D255-E258 PolarHBondContact O-N 2.84Å; D255-E258 VanDerWaalsContact O-N 3.14Å; E258-E260 VanDerWaalsContact C-N 3.33Å; E258-E260 PolarHBondContact O-N 3.26Å; E258-V261 PolarHBondContact O-N 2.92Å; E258-I262 VanDerWaalsContact O-CG1 3.3Å; E258-I262 WeakPolarHBondContact O-CG1 3.3Å; E258-I262 PolarHBondContact O-N 2.99Å; E258-R539 WeakPolarHBondContact OE1-CD 3.39Å; E258-R539 WeakPolarHBondContact OE1-CG 3.44Å; E258-S543 WeakPolarHBondContact OE2-CB 3.42Å; E258-S543 PolarHBondContact OE2-OG 2.98Å
259	D	90.8	Very high	74.7	Confident	63 Å²	63	65 Å²	65	34%	0.337	40%	0.398	S	S	.	.	H	α-helix	trans	-65.6	-30.9	174.6	-94.4	-32.8	0	0	0	113.4	I262 G263 R547	D259-I262 PolarHBondContact O-N 3.32Å; D259-G263 PolarHBondContact O-N 3.44Å; D259-R547 IonicContact OD1-CZ 2.88Å; D259-R547 VanDerWaalsContact OD1-CZ 3.27Å; D259-R547 IonicContact OD1-NH1 3.27Å; D259-R547 PolarHBondContact OD1-NH1 3.21Å; D259-R547 IonicContact OD1-NH2 3.02Å; D259-R547 PolarHBondContact OD1-NH2 3.12Å; D259-R547 IonicContact OD2-CZ 3.19Å; D259-R547 IonicContact OD2-NH1 3.94Å; D259-R547 PolarHBondContact OD2-NH1 3.17Å
260	E	93.8	Very high	77	Confident	138 Å²	138	63 Å²	63	65%	0.645	38%	0.378	S	S	*	.	H	α-helix	trans	-64	-40.9	172.3	-173.1	178.4	-179.1	0	0	111.6	E258 S264	E258-E260 VanDerWaalsContact C-N 3.33Å; E258-E260 PolarHBondContact O-N 3.26Å; E260-S264 WeakPolarHBondContact O-CB 3.44Å; E260-S264 PolarHBondContact O-N 3.27Å; E260-S264 PolarHBondContact O-OG 2.89Å
261	V	95.9	Very high	79.7	Confident	22 Å²	22	62.5 Å²	62.5	13%	0.133	36%	0.363	C	S	.	.	H	α-helix	trans	-68.4	-46.1	175.8	172.3	0	0	0	0	110.9	G257 E258 S264 V265 T536 L537 A540	G257-V261 WeakPolarHBondContact O-CG2 3.46Å; E258-V261 PolarHBondContact O-N 2.92Å; V261-S264 PolarHBondContact O-N 2.89Å; V261-V265 HydrophobicContact CG1-CG2 4.42Å; V261-V265 WeakPolarHBondContact O-CG2 3.34Å; V261-V265 PolarHBondContact O-N 3.32Å; V261-T536 HydrophobicContact CG2-CG2 4.5Å; V261-L537 HydrophobicContact CG1-CD2 3.98Å; V261-A540 HydrophobicContact CB-CB 4.42Å; V261-A540 HydrophobicContact CG1-CB 4.06Å
262	I	96.1	Very high	81.9	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.015	33%	0.331	C	S	.	.	H	α-helix	trans	-55.3	-57.5	176	-67.5	160.4	0	0	0	109.7	E258 D259 S264 V265 T266 L510 A540 L544	E258-I262 VanDerWaalsContact O-CG1 3.3Å; E258-I262 WeakPolarHBondContact O-CG1 3.3Å; E258-I262 PolarHBondContact O-N 2.99Å; D259-I262 PolarHBondContact O-N 3.32Å; I262-S264 VanDerWaalsContact C-N 3.28Å; I262-S264 PolarHBondContact O-N 2.93Å; I262-V265 PolarHBondContact O-N 3.12Å; I262-T266 WeakPolarHBondContact O-CB 3.35Å; I262-T266 PolarHBondContact O-N 3.25Å; I262-T266 PolarHBondContact O-OG1 3.25Å; I262-L510 HydrophobicContact CG1-CD2 3.78Å; I262-A540 HydrophobicContact CG1-CB 4.09Å; I262-L544 HydrophobicContact CD1-CB 3.97Å; I262-L544 HydrophobicContact CD1-CD1 4.44Å; I262-L544 HydrophobicContact CG1-CB 4.44Å; I262-L544 HydrophobicContact CG2-CD1 4.21Å; I262-L544 HydrophobicContact CG2-CD2 4.03Å
263	G	95.4	Very high	84	Confident	18 Å²	18	52.2 Å²	52.2	19%	0.186	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-34.5	-177.9	0	0	0	0	0	113.4	D259 R267	D259-G263 PolarHBondContact O-N 3.44Å; G263-R267 WeakPolarHBondContact O-CB 3.46Å; G263-R267 VanDerWaalsContact O-CG 3.3Å; G263-R267 WeakPolarHBondContact O-CG 3.41Å; G263-R267 VanDerWaalsContact O-CZ 3.27Å; G263-R267 PolarHBondContact O-N 3.34Å; G263-R267 PolarHBondContact O-NH1 3.44Å
264	S	96.2	Very high	85.2	Confident	24 Å²	24	48.7 Å²	48.7	17%	0.168	27%	0.269	C	S	.	.	H	α-helix	trans	-71.4	-41.7	177.9	-60.5	0	0	0	0	112.6	E260 V261 I262 R267 A268	E260-S264 WeakPolarHBondContact O-CB 3.44Å; E260-S264 PolarHBondContact O-N 3.27Å; E260-S264 PolarHBondContact O-OG 2.89Å; V261-S264 PolarHBondContact O-N 2.89Å; I262-S264 VanDerWaalsContact C-N 3.28Å; I262-S264 PolarHBondContact O-N 2.93Å; S264-R267 PolarHBondContact OG-NH2 3.02Å; S264-A268 VanDerWaalsContact O-CB 3.27Å; S264-A268 WeakPolarHBondContact O-CB 3.44Å; S264-A268 PolarHBondContact O-N 3.09Å
265	V	96.8	Very high	85.5	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-71.2	-37.5	176.9	176.2	0	0	0	0	111.5	V261 I262 A268 H269 F424 I428 S509 L510 A513 L537	V261-V265 HydrophobicContact CG1-CG2 4.42Å; V261-V265 WeakPolarHBondContact O-CG2 3.34Å; V261-V265 PolarHBondContact O-N 3.32Å; I262-V265 PolarHBondContact O-N 3.12Å; V265-A268 WeakPolarHBondContact O-CB 3.32Å; V265-A268 PolarHBondContact O-N 3.01Å; V265-H269 PolarHBondContact O-N 2.88Å; V265-F424 HydrophobicContact CG1-CE2 4.24Å; V265-F424 HydrophobicContact CG1-CZ 4.08Å; V265-I428 HydrophobicContact CG2-CG2 4.49Å; V265-S509 WeakPolarHBondContact CG1-O 3.45Å; V265-L510 HydrophobicContact CB-CD1 4.13Å; V265-L510 HydrophobicContact CG1-CB 4.42Å; V265-L510 HydrophobicContact CG1-CD1 4.05Å; V265-L510 HydrophobicContact CG2-CD1 4.1Å; V265-A513 HydrophobicContact CG1-CB 3.86Å; V265-L537 HydrophobicContact CG2-CD2 4.17Å
266	T	95.4	Very high	85.4	Confident	8 Å²	8	49.3 Å²	49.3	5%	0.049	26%	0.257	C	S	.	.	H	α-helix	trans	-60.2	-51.6	172.9	-60.9	0	0	0	0	111.2	I262 A268 H269 Q270 E506	I262-T266 WeakPolarHBondContact O-CB 3.35Å; I262-T266 PolarHBondContact O-N 3.25Å; I262-T266 PolarHBondContact O-OG1 3.25Å; T266-A268 VanDerWaalsContact C-N 3.32Å; T266-A268 PolarHBondContact O-N 2.74Å; T266-H269 WeakPolarHBondContact O-CB 3.39Å; T266-H269 PolarHBondContact O-N 3.05Å; T266-H269 VanDerWaalsContact O-N 3.13Å; T266-Q270 PolarHBondContact O-N 3.47Å; T266-E506 HydrophobicContact CG2-CG 3.97Å
267	R	94.5	Very high	84.7	Confident	129 Å²	129	48.8 Å²	48.8	49%	0.487	24%	0.243	S	C	.	.	H	α-helix	trans	-58.8	-43.4	175.6	-73.4	-175.5	-58.1	-91.7	2.8	111.9	G263 S264 H269 Q270 E271	G263-R267 WeakPolarHBondContact O-CB 3.46Å; G263-R267 VanDerWaalsContact O-CG 3.3Å; G263-R267 WeakPolarHBondContact O-CG 3.41Å; G263-R267 VanDerWaalsContact O-CZ 3.27Å; G263-R267 PolarHBondContact O-N 3.34Å; G263-R267 PolarHBondContact O-NH1 3.44Å; S264-R267 PolarHBondContact OG-NH2 3.02Å; R267-H269 VanDerWaalsContact C-N 3.27Å; R267-H269 PolarHBondContact O-N 3.39Å; R267-Q270 PolarHBondContact O-N 2.72Å; R267-E271 WeakPolarHBondContact O-CB 3.45Å; R267-E271 VanDerWaalsContact O-CG 3.3Å; R267-E271 WeakPolarHBondContact O-CG 3.36Å; R267-E271 PolarHBondContact O-N 2.97Å
268	A	94.8	Very high	82.7	Confident	3 Å²	3	51.9 Å²	51.9	3%	0.025	25%	0.247	C	C	.	.	H	α-helix	trans	-57.9	-39.1	176.5	0	0	0	0	0	112.6	S264 V265 T266 T272 F424 K427	S264-A268 VanDerWaalsContact O-CB 3.27Å; S264-A268 WeakPolarHBondContact O-CB 3.44Å; S264-A268 PolarHBondContact O-N 3.09Å; V265-A268 WeakPolarHBondContact O-CB 3.32Å; V265-A268 PolarHBondContact O-N 3.01Å; T266-A268 VanDerWaalsContact C-N 3.32Å; T266-A268 PolarHBondContact O-N 2.74Å; A268-T272 WeakPolarHBondContact O-CB 3.44Å; A268-T272 PolarHBondContact O-N 2.79Å; A268-T272 PolarHBondContact O-OG1 3.24Å; A268-F424 HydrophobicContact CB-CD2 3.98Å; A268-F424 HydrophobicContact CB-CE2 4.06Å; A268-K427 HydrophobicContact CB-CB 3.47Å; A268-K427 VanDerWaalsContact CB-CB 3.47Å; A268-K427 HydrophobicContact CB-CD 4.02Å; A268-K427 HydrophobicContact CB-CG 4.42Å
269	H	92.3	Very high	80.4	Confident	10 Å²	10	52.9 Å²	52.9	5%	0.046	25%	0.252	C	S	.	.	H	α-helix	trans	-68.7	-50.6	175.2	-179.2	101.2	0	0	0	111.5	V265 T266 R267 E271 T272 F273 F424 E505 S509 M512	V265-H269 PolarHBondContact O-N 2.88Å; T266-H269 WeakPolarHBondContact O-CB 3.39Å; T266-H269 PolarHBondContact O-N 3.05Å; T266-H269 VanDerWaalsContact O-N 3.13Å; R267-H269 VanDerWaalsContact C-N 3.27Å; R267-H269 PolarHBondContact O-N 3.39Å; H269-E271 PolarHBondContact O-N 3.41Å; H269-T272 PolarHBondContact O-N 2.98Å; H269-F273 HydrophobicContact CB-CD2 4.36Å; H269-F273 AromaticContact CE1-CD2 3.81Å; H269-F273 AromaticContact CG-CD2 3.84Å; H269-F273 AromaticContact ND1-CD2 3.48Å; H269-F273 WeakPolarHBondContact ND1-CD2 3.42Å; H269-F273 AromaticContact ND1-CE2 3.97Å; H269-F273 WeakPolarHBondContact O-CB 3.13Å; H269-F273 PolarHBondContact O-N 3.13Å; H269-F424 HydrophobicContact CB-CD2 4.45Å; H269-F424 HydrophobicContact CB-CE2 3.94Å; H269-E505 IonicContact CD2-OE1 2.71Å; H269-S509 VanDerWaalsContact CB-CB 3.47Å; H269-M512 PolarHBondContact CE1-SD 2.87Å
270	Q	89.6	Confident	77.9	Confident	76 Å²	76	52.8 Å²	52.8	36%	0.355	27%	0.266	S	S	.	.	I	π-helix	trans	-58.3	-51.9	-178.2	-76.3	170.8	-14.6	0	0	112.3	T266 R267 T272 M274 Y275 E505	T266-Q270 PolarHBondContact O-N 3.47Å; R267-Q270 PolarHBondContact O-N 2.72Å; Q270-T272 PolarHBondContact O-N 3.29Å; Q270-M274 PolarHBondContact O-N 3.19Å; Q270-M274 VanDerWaalsContact O-N 3.09Å; Q270-Y275 PolarHBondContact O-N 2.88Å; Q270-E505 WeakPolarHBondContact CG-OE1 3.35Å; Q270-E505 PolarHBondContact NE2-OE2 3.07Å
271	E	88	Confident	75.1	Confident	105 Å²	105	50.7 Å²	50.7	49%	0.491	27%	0.267	S	S	.	.	I	π-helix	trans	-59.7	-30.5	178.3	-71.7	173.5	-167.1	0	0	113.6	R267 H269 K427	R267-E271 WeakPolarHBondContact O-CB 3.45Å; R267-E271 VanDerWaalsContact O-CG 3.3Å; R267-E271 WeakPolarHBondContact O-CG 3.36Å; R267-E271 PolarHBondContact O-N 2.97Å; H269-E271 PolarHBondContact O-N 3.41Å; E271-K427 WeakPolarHBondContact OE2-CE 3.3Å; E271-K427 IonicContact OE2-NZ 3.51Å; E271-K427 PolarHBondContact OE2-NZ 3.09Å
272	T	86.9	Confident	72	Confident	8 Å²	8	59 Å²	59	5%	0.049	30%	0.295	C	S	.	.	I	π-helix	trans	-102.9	-26.8	-167.5	-46.6	0	0	0	0	113	A268 H269 Q270 N276 E420 E423 F424 K427	A268-T272 WeakPolarHBondContact O-CB 3.44Å; A268-T272 PolarHBondContact O-N 2.79Å; A268-T272 PolarHBondContact O-OG1 3.24Å; H269-T272 PolarHBondContact O-N 2.98Å; Q270-T272 PolarHBondContact O-N 3.29Å; T272-N276 PolarHBondContact O-ND2 3.45Å; T272-E420 HydrophobicContact CG2-CB 4.15Å; T272-E420 WeakPolarHBondContact CG2-O 3.46Å; T272-E423 HydrophobicContact CG2-CB 4.06Å; T272-F424 HydrophobicContact CG2-CB 4.15Å; T272-K427 PolarHBondContact OG1-NZ 3.35Å
273	F	80.6	Confident	69	Low	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.328	C	S	.	.	I	π-helix	trans	-121.8	-31.2	-175.4	-57.7	-57.2	0	0	0	114.6	H269 E420 V421 F424 R454 M512	H269-F273 HydrophobicContact CB-CD2 4.36Å; H269-F273 AromaticContact CE1-CD2 3.81Å; H269-F273 AromaticContact CG-CD2 3.84Å; H269-F273 AromaticContact ND1-CD2 3.48Å; H269-F273 WeakPolarHBondContact ND1-CD2 3.42Å; H269-F273 AromaticContact ND1-CE2 3.97Å; H269-F273 WeakPolarHBondContact O-CB 3.13Å; H269-F273 PolarHBondContact O-N 3.13Å; F273-E420 HydrophobicContact CD1-CB 3.94Å; F273-E420 HydrophobicContact CE1-CB 3.67Å; F273-V421 HydrophobicContact CE1-CG2 4.25Å; F273-V421 HydrophobicContact CZ-CG2 4.23Å; F273-F424 HydrophobicContact CE2-CB 3.7Å; F273-F424 AromaticContact CE2-CD1 3.94Å; F273-F424 HydrophobicContact CE2-CD1 3.94Å; F273-F424 AromaticContact CE2-CD2 3.75Å; F273-F424 HydrophobicContact CE2-CD2 3.75Å; F273-F424 HydrophobicContact CE2-CE2 4.35Å; F273-F424 AromaticContact CE2-CG 3.51Å; F273-F424 HydrophobicContact CE2-CG 3.51Å; F273-F424 HydrophobicContact CZ-CB 3.58Å; F273-F424 HydrophobicContact CZ-CD1 4.13Å; F273-F424 HydrophobicContact CZ-CD2 4.48Å; F273-F424 AromaticContact CZ-CG 3.83Å; F273-F424 HydrophobicContact CZ-CG 3.83Å; F273-R454 VanDerWaalsContact CD1-CZ 3.47Å; F273-R454 PolarHBondContact O-NH2 3.36Å; F273-M512 HydrophobicContact CD2-CE 4.03Å; F273-M512 HydrophobicContact CE2-CE 3.48Å; F273-M512 VanDerWaalsContact CE2-CE 3.48Å; F273-M512 HydrophobicContact CZ-CE 3.87Å
274	M	68.9	Low	66.2	Low	44 Å²	44	68.1 Å²	68.1	22%	0.217	36%	0.359	C	S	.	.	I	π-helix	trans	-95.9	-42.6	-176.5	-66.3	-68.4	97.5	0	0	112.9	Q270 N276 Q277 E278	Q270-M274 PolarHBondContact O-N 3.19Å; Q270-M274 VanDerWaalsContact O-N 3.09Å; M274-N276 PolarHBondContact O-N 3.31Å; M274-N276 VanDerWaalsContact O-N 3.15Å; M274-Q277 WeakPolarHBondContact O-CA 3.44Å; M274-Q277 WeakPolarHBondContact O-CB 3.23Å; M274-Q277 PolarHBondContact O-N 3.31Å; M274-E278 PolarHBondContact O-N 2.86Å
275	Y	52	Low	63.2	Low	133 Å²	133	76.4 Å²	76.4	52%	0.522	40%	0.395	S	S	.	.	H	α-helix	trans	-59.8	-28.9	177.9	-174.8	-110.6	0	0	0	113.1	Q270 Q279	Q270-Y275 PolarHBondContact O-N 2.88Å; Y275-Q279 PolarHBondContact O-NE2 2.86Å
276	N	49.8	Very low	60.3	Low	68 Å²	68	79.3 Å²	79.3	36%	0.364	42%	0.424	S	S	.	.	H	α-helix	trans	-75.1	-26.2	171.5	-71.5	-16.9	0	0	0	113.3	T272 M274 E420	T272-N276 PolarHBondContact O-ND2 3.45Å; M274-N276 PolarHBondContact O-N 3.31Å; M274-N276 VanDerWaalsContact O-N 3.15Å; N276-E420 PolarHBondContact ND2-OE1 3.21Å
277	Q	51.3	Low	57.6	Low	93 Å²	93	84.3 Å²	84.3	44%	0.435	46%	0.457	S	S	.	.	H	α-helix	trans	-84.4	-46.3	-177.9	-173.4	173.4	88.1	0	0	111.6	M274 Q279 G280	M274-Q277 WeakPolarHBondContact O-CA 3.44Å; M274-Q277 WeakPolarHBondContact O-CB 3.23Å; M274-Q277 PolarHBondContact O-N 3.31Å; Q277-Q279 VanDerWaalsContact C-N 3.26Å; Q277-Q279 PolarHBondContact O-N 3.35Å; Q277-G280 PolarHBondContact O-N 3.34Å
278	E	40	Very low	54.5	Low	101 Å²	101	84.5 Å²	84.5	47%	0.472	48%	0.475	S	S	.	.	H	α-helix	trans	-59.6	-35.5	-178.7	-70	-168.1	97.2	0	0	113.3	M274 G280 S281 R282	M274-E278 PolarHBondContact O-N 2.86Å; E278-G280 PolarHBondContact O-N 3.05Å; E278-S281 WeakPolarHBondContact CA-OG 3.25Å; E278-S281 PolarHBondContact O-N 3.1Å; E278-S281 VanDerWaalsContact O-N 3.09Å; E278-S281 PolarHBondContact O-OG 2.91Å; E278-R282 PolarHBondContact O-N 3.28Å
279	Q	39	Very low	51.4	Low	65 Å²	65	95.6 Å²	95.6	30%	0.304	52%	0.516	S	S	.	.	H	α-helix	trans	-74.4	-10	177.9	-72.5	176	80.2	0	0	113.9	Y275 Q277 R314	Y275-Q279 PolarHBondContact O-NE2 2.86Å; Q277-Q279 VanDerWaalsContact C-N 3.26Å; Q277-Q279 PolarHBondContact O-N 3.35Å; Q279-R314 VanDerWaalsContact OE1-CZ 3.27Å
280	G	39.1	Very low	48.6	Very low	60 Å²	60	101 Å²	101	62%	0.619	55%	0.553	S	S	*	*	H	α-helix	trans	-83.9	-21.2	166.2	0	0	0	0	0	113.2	Q277 E278	Q277-G280 PolarHBondContact O-N 3.34Å; E278-G280 PolarHBondContact O-N 3.05Å
281	S	33.8	Very low	46.2	Very low	95 Å²	95	105.6 Å²	105.6	66%	0.664	58%	0.579	S	S	*	*	H	α-helix	trans	-100	-15.3	-175.9	45	0	0	0	0	115.2	E278	E278-S281 WeakPolarHBondContact CA-OG 3.25Å; E278-S281 PolarHBondContact O-N 3.1Å; E278-S281 VanDerWaalsContact O-N 3.09Å; E278-S281 PolarHBondContact O-OG 2.91Å
282	R	30.7	Very low	43.4	Very low	196 Å²	196	108.6 Å²	108.6	74%	0.74	60%	0.598	S	S	*	*			trans	-90.2	105	171	-65.1	-168.7	-171.4	-156.9	4.8	110.4	E278	E278-R282 PolarHBondContact O-N 3.28Å
283	A	33	Very low	40.8	Very low	85 Å²	85	118 Å²	118	70%	0.702	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-60.6	145	165.5	0	0	0	0	0	110.1	E285	A283-E285 PolarHBondContact O-N 3.22Å
284	P	38.5	Very low	38.3	Very low	128 Å²	128	123.4 Å²	123.4	83%	0.831	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-71	117.2	179.2	28.4	-33.4	0	0	0	110.5	G286	P284-G286 PolarHBondContact O-N 2.85Å
285	E	32.6	Very low	36.6	Very low	198 Å²	198	128 Å²	128	93%	0.925	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-62.1	116.7	163.6	-72.2	-173.7	103.8	0	0	108.7	A283	A283-E285 PolarHBondContact O-N 3.22Å
286	G	35.6	Very low	35.5	Very low	60 Å²	60	128.4 Å²	128.4	62%	0.619	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-67.3	152.7	175.9	0	0	0	0	0	111.4	P284	P284-G286 PolarHBondContact O-N 2.85Å
287	P	37.9	Very low	34.5	Very low	114 Å²	114	134.6 Å²	134.6	74%	0.74	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-60.5	144.8	177.2	27	-35	0	0	0	110.7	R289	P287-R289 PolarHBondContact O-N 3.22Å; P287-R289 VanDerWaalsContact O-N 3.09Å
288	P	30.7	Very low	33.6	Very low	132 Å²	132	134.9 Å²	134.9	86%	0.857	74%	0.742	S	S	*	*			trans	-62.5	114.9	-173.8	25	-34.3	0	0	0	110.9
289	R	29.8	Very low	32.9	Very low	236 Å²	236	134.6 Å²	134.6	89%	0.891	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-83.5	144.5	173.2	-79.8	-170.8	168.7	-165.6	-2.5	111	P287	P287-R289 PolarHBondContact O-N 3.22Å; P287-R289 VanDerWaalsContact O-N 3.09Å
290	P	31.9	Very low	32.4	Very low	125 Å²	125	137.3 Å²	137.3	81%	0.812	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-67.3	155.3	179.2	-18.1	31.8	0	0	0	113	N292	P290-N292 PolarHBondContact O-N 3.26Å
291	L	39	Very low	31.8	Very low	172 Å²	172	140.5 Å²	140.5	90%	0.901	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-58.4	126	169.6	-76.4	154	0	0	0	111.7
292	N	30.8	Very low	31.4	Very low	167 Å²	167	144.7 Å²	144.7	89%	0.893	80%	0.797	S	S	*	*			trans	-156.6	168.9	139.8	-121.9	-38.1	0	0	0	112.6	P290	P290-N292 PolarHBondContact O-N 3.26Å
293	R	31.4	Very low	31.4	Very low	205 Å²	205	143.1 Å²	143.1	77%	0.774	80%	0.802	S	S	*	*			trans	-101	158.7	-158.6	-88.6	175.4	54.4	172	-3.2	116.5
294	D	28.7	Very low	31.2	Very low	114 Å²	114	143.1 Å²	143.1	61%	0.61	80%	0.797	S	S	*	*			trans	89.4	135.4	141.4	-78.8	-40	0	0	0	123.2
295	L	31.8	Very low	31	Very low	141 Å²	141	143.7 Å²	143.7	74%	0.738	79%	0.789	S	S	*	*			trans	78.2	101	150.9	-67.6	164.5	0	0	0	122.8
296	N	30	Very low	30.9	Very low	141 Å²	141	140.8 Å²	140.8	75%	0.754	78%	0.775	S	S	*	*				47.4	106.1	125.5	-65	-8.9	0	0	0	121.9
297	Q	28.2	Very low	30.7	Very low	199 Å²	199	141.1 Å²	141.1	93%	0.93	78%	0.778	S	S	*	*				-156.2	154.5	125.2	-149.5	79.8	80.6	0	0	109.8
298	A	33.2	Very low	30.6	Very low	98 Å²	98	143 Å²	143	81%	0.81	77%	0.771	S	S	*	*			trans	-125.8	127.9	178.4	0	0	0	0	0	111.6
299	A	25	Very low	30.8	Very low	96 Å²	96	140.3 Å²	140.3	79%	0.793	75%	0.749	S	S	*	*			trans	-157.5	164.3	175.1	0	0	0	0	0	108.7
300	P	28.8	Very low	31.1	Very low	122 Å²	122	133.2 Å²	133.2	79%	0.792	73%	0.732	S	S	*	*			trans	-82.4	156	-153.6	32.3	-36.7	0	0	0	115.5	Q302	P300-Q302 PolarHBondContact O-N 3Å; P300-Q302 VanDerWaalsContact O-N 3.17Å
301	V	26.1	Very low	31.3	Very low	126 Å²	126	131.5 Å²	131.5	76%	0.764	71%	0.709	S	S	*	*			trans	-69	106	175.2	179.3	0	0	0	0	110.6	L303	V301-L303 HydrophobicContact CG1-CD1 4.02Å
302	Q	26.2	Very low	31.2	Very low	183 Å²	183	126.2 Å²	126.2	86%	0.855	68%	0.682	S	S	*	*			trans	-80.5	111.2	150.7	-72	-173.5	-13.1	0	0	107.6	P300 S304	P300-Q302 PolarHBondContact O-N 3Å; P300-Q302 VanDerWaalsContact O-N 3.17Å; Q302-S304 PolarHBondContact O-N 2.94Å
303	L	29.5	Very low	31.5	Very low	164 Å²	164	124.5 Å²	124.5	86%	0.859	67%	0.668	S	S	*	*			trans	-73.9	109	174.9	-151.9	76.5	0	0	0	107.6	V301	V301-L303 HydrophobicContact CG1-CD1 4.02Å
304	S	29.8	Very low	31.7	Very low	85 Å²	85	120.7 Å²	120.7	59%	0.594	65%	0.654	S	S	*	*			trans	-74.6	153.9	-161.9	60.4	0	0	0	0	113.7	Q302 Q306	Q302-S304 PolarHBondContact O-N 2.94Å; S304-Q306 PolarHBondContact O-N 2.88Å
305	E	33.7	Very low	32.1	Very low	140 Å²	140	118 Å²	118	65%	0.654	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-1.6	-179.3	-62.2	175.9	93.1	0	0	113.5	G307 R308	E305-G307 VanDerWaalsContact C-N 3.26Å; E305-G307 PolarHBondContact O-N 3.11Å; E305-G307 VanDerWaalsContact O-N 3.1Å; E305-R308 WeakPolarHBondContact O-CB 3.37Å; E305-R308 PolarHBondContact O-N 3.22Å; E305-R308 IonicContact OE1-NH1 2.73Å
306	Q	30.3	Very low	32.2	Very low	136 Å²	136	117.1 Å²	117.1	64%	0.636	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-32	-172.2	-147.5	79.2	79.3	0	0	114.8	S304 R308	S304-Q306 PolarHBondContact O-N 2.88Å; Q306-R308 PolarHBondContact O-N 2.95Å
307	G	31.8	Very low	32.2	Very low	67 Å²	67	114.5 Å²	114.5	69%	0.691	63%	0.628	S	S	*	*	H	α-helix	trans	-70.4	-18.2	177	0	0	0	0	0	113.8	E305	E305-G307 VanDerWaalsContact C-N 3.26Å; E305-G307 PolarHBondContact O-N 3.11Å; E305-G307 VanDerWaalsContact O-N 3.1Å
308	R	35.5	Very low	32.6	Very low	153 Å²	153	110.6 Å²	110.6	58%	0.577	62%	0.618	S	S	*	*	H	α-helix	trans	-76.8	-24.9	-176.2	-151.6	175.9	-170.4	-174.6	0.6	112.4	E305 Q306 N312	E305-R308 WeakPolarHBondContact O-CB 3.37Å; E305-R308 PolarHBondContact O-N 3.22Å; E305-R308 IonicContact OE1-NH1 2.73Å; Q306-R308 PolarHBondContact O-N 2.95Å; R308-N312 PolarHBondContact O-ND2 3.23Å
309	D	36	Very low	32.6	Very low	77 Å²	77	111.8 Å²	111.8	41%	0.412	61%	0.611	S	S	.	*	H	α-helix	trans	-88.3	-31.9	-174.1	-60	-41.2	0	0	0	113.4	W311 N312 H313	D309-W311 PolarHBondContact O-N 2.94Å; D309-N312 PolarHBondContact O-N 3.46Å; D309-N312 VanDerWaalsContact O-N 3.09Å; D309-H313 PolarHBondContact O-N 3.45Å
310	V	36.5	Very low	32.8	Very low	86 Å²	86	115.8 Å²	115.8	52%	0.521	62%	0.615	S	S	.	*	H	α-helix	trans	-61.7	-42.8	-168.9	-178.6	0	0	0	0	112.8
311	W	34.1	Very low	32.8	Very low	89 Å²	89	115 Å²	115	34%	0.337	62%	0.619	S	S	.	*	H	α-helix	trans	-71.8	-31.6	177.1	-170.2	85.7	0	0	0	112.6	D309 N315 L469	D309-W311 PolarHBondContact O-N 2.94Å; W311-N315 PolarHBondContact O-ND2 3.43Å; W311-L469 HydrophobicContact CH2-CD1 4.1Å; W311-L469 HydrophobicContact CZ2-CD1 3.49Å; W311-L469 VanDerWaalsContact CZ2-CD1 3.49Å
312	N	38.5	Very low	33.1	Very low	61 Å²	61	111.4 Å²	111.4	33%	0.326	61%	0.607	S	S	.	*	H	α-helix	trans	-83	-44.7	-175.1	-73.6	-57.8	0	0	0	112.8	R308 D309 R314 N315 N316	R308-N312 PolarHBondContact O-ND2 3.23Å; D309-N312 PolarHBondContact O-N 3.46Å; D309-N312 VanDerWaalsContact O-N 3.09Å; N312-R314 VanDerWaalsContact C-N 3.33Å; N312-R314 PolarHBondContact O-N 2.89Å; N312-N315 PolarHBondContact O-N 3.15Å; N312-N316 PolarHBondContact O-N 3.08Å
313	H	35.7	Very low	33.2	Very low	131 Å²	131	112.2 Å²	112.2	61%	0.606	61%	0.61	S	S	*	*	H	α-helix	trans	-59.4	-44.1	-179.7	-107.3	-57.2	0	0	0	111.6	D309 N315 N316 S317	D309-H313 PolarHBondContact O-N 3.45Å; H313-N315 VanDerWaalsContact C-N 3.35Å; H313-N315 PolarHBondContact O-N 3.38Å; H313-N316 PolarHBondContact O-N 3.36Å; H313-S317 PolarHBondContact O-N 2.85Å; H313-S317 VanDerWaalsContact O-N 3.08Å; H313-S317 PolarHBondContact O-OG 3.12Å
314	R	37.3	Very low	32.9	Very low	125 Å²	125	110.1 Å²	110.1	47%	0.472	61%	0.61	S	S	.	*	H	α-helix	trans	-63.4	-38	-177.7	-161.3	174.1	-169.6	140.3	1.1	113	Q279 N312	Q279-R314 VanDerWaalsContact OE1-CZ 3.27Å; N312-R314 VanDerWaalsContact C-N 3.33Å; N312-R314 PolarHBondContact O-N 2.89Å
315	N	35.3	Very low	32.7	Very low	57 Å²	57	114.2 Å²	114.2	31%	0.305	62%	0.624	S	S	.	*	H	α-helix	trans	-72.5	-30.4	177.8	-82.7	-39.6	0	0	0	113.3	W311 N312 H313 P416	W311-N315 PolarHBondContact O-ND2 3.43Å; N312-N315 PolarHBondContact O-N 3.15Å; H313-N315 VanDerWaalsContact C-N 3.35Å; H313-N315 PolarHBondContact O-N 3.38Å; N315-P416 HydrophobicContact CB-CG 4.16Å
316	N	34.4	Very low	32.3	Very low	123 Å²	123	115.4 Å²	115.4	66%	0.658	63%	0.634	S	S	*	*	H	α-helix	trans	-80.4	-22	175.6	-85.6	-22	0	0	0	114	N312 H313 V318 N319	N312-N316 PolarHBondContact O-N 3.08Å; H313-N316 PolarHBondContact O-N 3.36Å; N316-V318 PolarHBondContact O-N 3.12Å; N316-N319 PolarHBondContact O-N 3.23Å
317	S	29.5	Very low	32	Very low	86 Å²	86	114.9 Å²	114.9	60%	0.601	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-0.4	-174.5	-70.1	0	0	0	0	116.3	H313	H313-S317 PolarHBondContact O-N 2.85Å; H313-S317 VanDerWaalsContact O-N 3.08Å; H313-S317 PolarHBondContact O-OG 3.12Å
318	V	36.5	Very low	31.6	Very low	117 Å²	117	119.1 Å²	119.1	71%	0.709	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	22.5	175.4	-156	0	0	0	0	112.1	N316	N316-V318 PolarHBondContact O-N 3.12Å
319	N	33.5	Very low	31.1	Very low	123 Å²	123	120.2 Å²	120.2	66%	0.658	67%	0.667	S	S	*	*	S	Bend	trans	-132	5.1	-175.6	-126.5	28.9	0	0	0	115.4	N316	N316-N319 PolarHBondContact O-N 3.23Å
320	M	28.8	Very low	30.4	Very low	180 Å²	180	120.4 Å²	120.4	89%	0.887	69%	0.687	S	S	*	*			trans	-135.8	57.8	176.2	-80.6	-66.1	174.7	0	0	111.9
321	A	29.1	Very low	29.8	Very low	107 Å²	107	125.3 Å²	125.3	88%	0.884	70%	0.704	S	S	*	*			trans	-126.5	40.8	171.2	0	0	0	0	0	111.1
322	G	32	Very low	29.8	Very low	49 Å²	49	125.7 Å²	125.7	51%	0.505	72%	0.718	S	S	.	*	S	Bend	trans	-155.1	121.7	178.4	0	0	0	0	0	110.9
323	H	30.1	Very low	29.1	Very low	200 Å²	200	131.5 Å²	131.5	93%	0.926	74%	0.743	S	S	*	*			trans	61.8	76.6	174.1	-49	-76.9	0	0	0	117.5
324	S	23	Very low	28.4	Very low	121 Å²	121	129.1 Å²	129.1	85%	0.846	74%	0.741	S	S	*	*			trans	-147.4	96.7	136.5	-170.5	0	0	0	0	110.7
325	L	25.4	Very low	27.8	Very low	171 Å²	171	131.6 Å²	131.6	90%	0.895	76%	0.758	S	S	*	*			trans	-148.6	77.5	168.8	-112.5	-179.9	0	0	0	109.3
326	L	24.5	Very low	27.2	Very low	165 Å²	165	135.6 Å²	135.6	86%	0.864	78%	0.779	S	S	*	*			trans	-174	99.3	153.4	-107.3	168.7	0	0	0	110.8
327	S	24.1	Very low	26.7	Very low	125 Å²	125	135.6 Å²	135.6	87%	0.874	78%	0.778	S	S	*	*			trans	-171.2	106.2	150.2	-86.2	0	0	0	0	109.3
328	I	23.9	Very low	26.4	Very low	155 Å²	155	137 Å²	137	80%	0.795	78%	0.779	S	S	*	*			trans	-121.1	138.7	170.7	-83.2	176.8	0	0	0	106.7
329	L	24	Very low	25.9	Very low	177 Å²	177	139.2 Å²	139.2	93%	0.927	78%	0.782	S	S	*	*			trans	74.4	142	179.9	-60.9	156.6	0	0	0	117.7
330	G	23.1	Very low	25.4	Very low	80 Å²	80	138.6 Å²	138.6	83%	0.825	79%	0.786	S	S	*	*			trans	115.2	78.9	139.9	0	0	0	0	0	119.5
331	Q	22.1	Very low	25.7	Very low	189 Å²	189	135.6 Å²	135.6	88%	0.883	78%	0.78	S	S	*	*			trans	-85.2	172.1	146.4	-100.6	-170.4	-2.1	0	0	109.8
332	P	35.8	Very low	25.5	Very low	98 Å²	98	138 Å²	138	64%	0.636	78%	0.777	S	S	*	*			cis	-132.7	175.3	-23.4	38	-22.7	0	0	0	113.2
333	H	23.2	Very low	25.1	Very low	182 Å²	182	147.4 Å²	147.4	84%	0.843	80%	0.797	S	S	*	*				-173.2	-165.6	127.2	-114.1	-75.5	0	0	0	114.2
334	S	21.6	Very low	24.9	Very low	81 Å²	81	142.2 Å²	142.2	57%	0.566	79%	0.788	S	S	*	*			trans	-128.3	-179.1	-150	51.7	0	0	0	0	114.6
335	Q	23.7	Very low	24.9	Very low	177 Å²	177	142.4 Å²	142.4	83%	0.827	79%	0.79	S	S	*	*			trans	79.6	156.8	170.3	-65.2	178.9	-33.8	0	0	116.9
336	L	22.5	Very low	24.9	Very low	142 Å²	142	146.2 Å²	146.2	74%	0.743	79%	0.792	S	S	*	*			cis	-166.6	164.2	-35.4	-159.3	72.8	0	0	0	108.4
337	D	23.5	Very low	24.9	Very low	122 Å²	122	144.4 Å²	144.4	65%	0.652	79%	0.793	S	S	*	*			trans	68.7	127.9	150.8	-88.2	2.7	0	0	0	123.5
338	N	24.7	Very low	25	Very low	115 Å²	115	143.6 Å²	143.6	62%	0.615	79%	0.794	S	S	*	*				54.8	153.1	125.7	-64.2	-43.1	0	0	0	121.8
339	Q	24.8	Very low	25.1	Very low	164 Å²	164	140 Å²	140	77%	0.766	80%	0.795	S	S	*	*			cis	-153.5	163.8	6.6	-147.6	121.3	65.9	0	0	111.8
340	C	23.8	Very low	25.2	Very low	111 Å²	111	137.6 Å²	137.6	75%	0.75	79%	0.788	S	S	*	*			trans	-93.8	166.3	161.1	-57.5	0	0	0	0	110.9
341	P	34.1	Very low	25.3	Very low	116 Å²	116	139.5 Å²	139.5	75%	0.753	79%	0.789	S	S	*	*				-155.4	137.3	97.3	36.8	-17.1	0	0	0	118.7
342	I	25.6	Very low	25.3	Very low	159 Å²	159	138.4 Å²	138.4	82%	0.815	78%	0.783	S	S	*	*				33.9	121	125.8	-56.3	174	0	0	0	119.9
343	R	24.1	Very low	24.7	Very low	246 Å²	246	138.9 Å²	138.9	93%	0.928	79%	0.789	S	S	*	*				-159.3	152	115.5	-133.6	173.1	-173.2	157.4	4.5	114
344	A	25.4	Very low	25	Very low	91 Å²	91	135.8 Å²	135.8	75%	0.752	79%	0.785	S	S	*	*			trans	-126.1	159.9	175.3	0	0	0	0	0	111.2
345	S	23.3	Very low	25.1	Very low	125 Å²	125	136.4 Å²	136.4	87%	0.874	80%	0.795	S	S	*	*			trans	-153.2	149.6	166.6	-81.7	0	0	0	0	111
346	R	24.9	Very low	25.1	Very low	251 Å²	251	139 Å²	139	95%	0.947	80%	0.799	S	S	*	*			trans	-102.8	151	-178.5	-65.5	174.4	171.7	177.5	-3.9	111.1
347	S	25	Very low	25.3	Very low	126 Å²	126	139.3 Å²	139.3	88%	0.881	80%	0.8	S	S	*	*			trans	-150.3	162.7	142.5	59.8	0	0	0	0	109.2
348	A	26.1	Very low	25.3	Very low	108 Å²	108	143.1 Å²	143.1	89%	0.893	81%	0.813	S	S	*	*			trans	-136	152.2	-176.5	0	0	0	0	0	110.6
349	G	25.7	Very low	25.3	Very low	79 Å²	79	141 Å²	141	81%	0.814	82%	0.819	S	S	*	*			trans	-150.1	119.9	177.3	0	0	0	0	0	111.2
350	T	25.9	Very low	25.3	Very low	127 Å²	127	138.1 Å²	138.1	78%	0.779	82%	0.823	S	S	*	*			trans	-95.5	144.7	-173.3	-15.7	0	0	0	0	111.7
351	S	25.1	Very low	25.4	Very low	120 Å²	120	140 Å²	140	84%	0.839	83%	0.831	S	S	*	*			trans	-152.6	153	157.1	55.2	0	0	0	0	110.2
352	H	23.6	Very low	25	Very low	166 Å²	166	145.8 Å²	145.8	77%	0.769	84%	0.837	S	S	*	*			trans	-137.9	163.6	-167.7	-89.7	-91.7	0	0	0	112.3
353	S	22.3	Very low	24.9	Very low	109 Å²	109	142.8 Å²	142.8	76%	0.762	84%	0.836	S	S	*	*			trans	94.1	153.4	157.6	-42	0	0	0	0	117.1
354	P	29.1	Very low	24.9	Very low	117 Å²	117	138.8 Å²	138.8	76%	0.76	83%	0.832	S	S	*	*			cis	-132.7	165.5	-46.7	37	-23.3	0	0	0	112.7
355	A	23.3	Very low	25	Very low	93 Å²	93	139.2 Å²	139.2	77%	0.769	83%	0.827	S	S	*	*			trans	-97.9	149.2	176.9	0	0	0	0	0	112.9
356	Y	24.8	Very low	25.3	Very low	231 Å²	231	140 Å²	140	91%	0.906	83%	0.827	S	S	*	*			trans	-105.7	142.9	165	-88.2	-93.4	0	0	0	110
357	I	25.5	Very low	25.6	Very low	149 Å²	149	135.9 Å²	135.9	76%	0.764	82%	0.818	S	S	*	*			trans	-131.7	126.9	179.9	-65.2	179.9	0	0	0	111
358	H	24.9	Very low	26.4	Very low	202 Å²	202	134.6 Å²	134.6	94%	0.935	81%	0.807	S	S	*	*			trans	-149.6	138.8	148.5	-94.8	-96.2	0	0	0	105.7
359	G	23.2	Very low	26.3	Very low	72 Å²	72	135.4 Å²	135.4	74%	0.742	81%	0.805	S	S	*	*			cis	170.1	105.4	-7.3	0	0	0	0	0	108.3
360	A	24.7	Very low	26.8	Very low	102 Å²	102	137.7 Å²	137.7	84%	0.843	81%	0.805	S	S	*	*			trans	-120	145.9	-172.5	0	0	0	0	0	111.9
361	V	27.2	Very low	26.7	Very low	151 Å²	151	135.7 Å²	135.7	92%	0.915	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-75.4	139.2	-172.3	-179	0	0	0	0	111.2
362	R	24.5	Very low	26.8	Very low	238 Å²	238	133.7 Å²	133.7	90%	0.898	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-70.9	135.5	174.9	-82.6	177.5	165	167.5	-6.4	111.9
363	A	24.8	Very low	26.9	Very low	95 Å²	95	131.6 Å²	131.6	79%	0.785	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-98.3	157.7	140.9	0	0	0	0	0	108.9
364	L	24.3	Very low	27.1	Very low	162 Å²	162	137.5 Å²	137.5	85%	0.848	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-95.3	141.4	-174	-162.7	68.3	0	0	0	110.9
365	P	27.6	Very low	27.3	Very low	100 Å²	100	137.5 Å²	137.5	65%	0.649	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-85.2	165.6	-174.3	34.6	-36.6	0	0	0	113.7
366	T	28.6	Very low	27.4	Very low	141 Å²	141	136.3 Å²	136.3	87%	0.865	81%	0.814	S	S	*	*			trans	-111.7	136.2	161.7	-48.3	0	0	0	0	108.5
367	E	31.6	Very low	27.5	Very low	165 Å²	165	128.2 Å²	128.2	77%	0.771	80%	0.801	S	S	*	*			trans	-89.8	172.1	-169.1	-87.8	-77.3	97.7	0	0	113.8
368	P	42.7	Very low	27.6	Very low	99 Å²	99	126 Å²	126	64%	0.643	81%	0.805	S	S	*	*			trans	-120.7	-173.8	-141.4	45.5	-38.4	0	0	0	115.2
369	C	23.4	Very low	28.2	Very low	126 Å²	126	127.5 Å²	127.5	85%	0.851	80%	0.802	S	S	*	*			trans	-161.2	165.6	151.5	-113.4	0	0	0	0	110.4
370	P	35.3	Very low	28.6	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	81%	0.814	S	S	*	*				-135.2	166.6	-114.4	40.2	-23.3	0	0	0	117.7
371	G	25	Very low	29.1	Very low	85 Å²	85	134 Å²	134	88%	0.876	80%	0.798	S	S	*	*			trans	122.2	132.1	152.9	0	0	0	0	0	116.3
372	G	26.2	Very low	29.7	Very low	79 Å²	79	131.3 Å²	131.3	81%	0.814	80%	0.801	S	S	*	*			trans	115.3	85.8	170.6	0	0	0	0	0	114.7
373	V	26.8	Very low	30.7	Very low	122 Å²	122	123.2 Å²	123.2	74%	0.739	78%	0.781	S	S	*	*			trans	-95	112.3	179.1	178.9	0	0	0	0	111.3
374	Y	26.5	Very low	32.1	Very low	233 Å²	233	124.6 Å²	124.6	91%	0.914	77%	0.766	S	S	*	*			trans	-132.7	107.2	153.2	-77.3	-75.5	0	0	0	109.1	G376	Y374-G376 PolarHBondContact O-N 3.19Å
375	S	31.9	Very low	33.6	Very low	116 Å²	116	122 Å²	122	81%	0.811	75%	0.751	S	S	*	*			trans	-80.4	78.7	-175.7	-65.2	0	0	0	0	111.8
376	G	26.2	Very low	35.2	Very low	68 Å²	68	122.1 Å²	122.1	70%	0.701	74%	0.739	S	S	*	*			trans	-66.8	134	159.7	0	0	0	0	0	110.2	Y374 A378	Y374-G376 PolarHBondContact O-N 3.19Å; G376-A378 PolarHBondContact O-N 2.86Å; G376-A378 VanDerWaalsContact O-N 3.11Å
377	G	27.5	Very low	37.1	Very low	62 Å²	62	116.7 Å²	116.7	64%	0.639	71%	0.705	S	S	*	*			trans	-64.1	111.8	-178.6	0	0	0	0	0	111.8	W379	G377-W379 PolarHBondContact O-N 3.39Å
378	A	27.7	Very low	39	Very low	102 Å²	102	110.1 Å²	110.1	84%	0.843	68%	0.675	S	S	*	*			trans	-67.7	98.2	179.7	0	0	0	0	0	111.3	G376 R380	G376-A378 PolarHBondContact O-N 2.86Å; G376-A378 VanDerWaalsContact O-N 3.11Å; A378-R380 PolarHBondContact O-N 2.83Å
379	W	37.1	Very low	40.5	Very low	233 Å²	233	106.2 Å²	106.2	88%	0.883	65%	0.65	S	S	*	*			trans	-59.3	121	177.4	-66	87.8	0	0	0	110.6	G377 G381	G377-W379 PolarHBondContact O-N 3.39Å; W379-G381 PolarHBondContact O-N 3.35Å
380	R	31.7	Very low	42.6	Very low	261 Å²	261	100.2 Å²	100.2	99%	0.985	61%	0.61	S	S	*	*	S	Bend	trans	-79.1	61.7	-172.4	-163.4	-173.6	-66.9	-108	1.9	112.2	A378	A378-R380 PolarHBondContact O-N 2.83Å
381	G	35.5	Very low	44.2	Very low	50 Å²	50	94.3 Å²	94.3	52%	0.515	57%	0.572	S	S	.	*			trans	-164	85.5	-179.6	0	0	0	0	0	111.5	W379 S383	W379-G381 PolarHBondContact O-N 3.35Å; G381-S383 PolarHBondContact O-N 3.24Å
382	G	39.5	Very low	46.4	Very low	94 Å²	94	91 Å²	91	97%	0.969	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	40.7	-163	0	0	0	0	0	117.7
383	S	44.8	Very low	48.4	Very low	69 Å²	69	89.9 Å²	89.9	48%	0.483	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.1	9.3	177	-157.9	0	0	0	0	115.1	G381 M385	G381-S383 PolarHBondContact O-N 3.24Å; S383-M385 VanDerWaalsContact C-N 3.27Å; S383-M385 PolarHBondContact O-N 3.15Å
384	R	53.5	Low	50.3	Low	123 Å²	123	86 Å²	86	46%	0.464	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	7.2	-177.1	-139.9	175.9	-171.1	168.1	4.1	114.8	H583	R384-H583 PolarHBondContact NH1-O 3.37Å; R384-H583 PolarHBondContact NH2-O 2.64Å
385	M	57.2	Low	52.3	Low	108 Å²	108	75 Å²	75	53%	0.532	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-5.9	179.2	-65	-63.9	165.8	0	0	113.8	S383 V397 P399	S383-M385 VanDerWaalsContact C-N 3.27Å; S383-M385 PolarHBondContact O-N 3.15Å; M385-V397 WeakPolarHBondContact O-CB 3.28Å; M385-V397 PolarHBondContact O-N 3.33Å; M385-P399 HydrophobicContact SD-CB 4.39Å; M385-P399 HydrophobicContact SD-CG 4.15Å
386	Y	60.9	Low	54.2	Low	102 Å²	102	76.2 Å²	76.2	40%	0.4	44%	0.439	S	S	.	.	B	Isolated β-bridge	trans	-132.2	134	179.4	-56.4	-75.6	0	0	0	111.7	P395 Q396 M482	Y386-P395 CarbonylContact C-O 3.44Å; Y386-P395 WeakPolarHBondContact CA-O 3.28Å; Y386-Q396 HydrophobicContact CD1-CG 4.42Å; Y386-Q396 HydrophobicContact CE1-CG 4.16Å; Y386-M482 WeakPolarHBondContact CB-O 3.27Å; Y386-M482 HydrophobicContact CD1-CB 4.39Å; Y386-M482 HydrophobicContact CD1-CG 4.17Å; Y386-M482 HydrophobicContact CD1-SD 3.82Å; Y386-M482 HydrophobicContact CD2-CB 4.06Å; Y386-M482 HydrophobicContact CD2-CG 4.25Å; Y386-M482 HydrophobicContact CE1-CG 4.28Å; Y386-M482 HydrophobicContact CE1-SD 3.95Å; Y386-M482 HydrophobicContact CE2-CG 4.36Å; Y386-M482 HydrophobicContact CG-CB 3.95Å; Y386-M482 HydrophobicContact CG-CG 4.17Å; Y386-M482 HydrophobicContact CG-SD 4.35Å
387	L	68.8	Low	56.4	Low	28 Å²	28	74.2 Å²	74.2	15%	0.147	41%	0.413	C	S	.	.			trans	-113.6	94.8	169.7	-87.6	174.1	0	0	0	108.4	C389 N392 P395 V397 V406 F410 F580	L387-C389 PolarHBondContact O-N 3.36Å; L387-N392 PolarHBondContact O-ND2 2.9Å; L387-P395 PolarHBondContact N-O 3.42Å; L387-P395 WeakPolarHBondContact O-CA 3.27Å; L387-V397 HydrophobicContact CB-CG2 4.03Å; L387-V397 HydrophobicContact CD1-CG2 4.05Å; L387-V397 HydrophobicContact CG-CG2 3.83Å; L387-V406 HydrophobicContact CD1-CG1 3.51Å; L387-F410 HydrophobicContact CB-CD2 4.42Å; L387-F410 HydrophobicContact CD1-CB 3.8Å; L387-F410 HydrophobicContact CD1-CD2 4.09Å; L387-F410 HydrophobicContact CD1-CG 3.93Å; L387-F410 HydrophobicContact CD2-CD1 4.4Å; L387-F410 HydrophobicContact CD2-CD2 4.4Å; L387-F410 HydrophobicContact CD2-CG 4.34Å; L387-F580 HydrophobicContact CD2-CE1 4.4Å
388	V	69.9	Low	58.5	Low	26 Å²	26	74.6 Å²	74.6	16%	0.158	40%	0.401	C	S	.	.			trans	-91.7	92.1	-169.5	-161.9	0	0	0	0	111.3	F468 L479 M482 L488	V388-F468 HydrophobicContact CG1-CZ 3.99Å; V388-L479 HydrophobicContact CG1-CB 4.08Å; V388-L479 HydrophobicContact CG1-CD2 3.27Å; V388-L479 HydrophobicContact CG1-CG 4.25Å; V388-M482 HydrophobicContact CG2-CB 4.05Å; V388-L488 HydrophobicContact CB-CD2 4.47Å; V388-L488 HydrophobicContact CG1-CD2 3.67Å
389	C	74.9	Confident	60.4	Low	17 Å²	17	74.1 Å²	74.1	12%	0.115	39%	0.389	C	S	.	.			trans	-137.5	136.8	169.7	-174.3	0	0	0	0	110.3	L387 M391 N392 F410 F414 F468	L387-C389 PolarHBondContact O-N 3.36Å; C389-M391 PolarHBondContact O-N 3.41Å; C389-N392 WeakPolarHBondContact O-CB 3.44Å; C389-N392 PolarHBondContact O-N 3.41Å; C389-F410 HydrophobicContact CB-CE2 3.79Å; C389-F410 HydrophobicContact CB-CZ 4.26Å; C389-F414 HydrophobicContact CB-CZ 4.32Å; C389-F414 VanDerWaalsContact SG-CZ 3.53Å; C389-F468 WeakPolarHBondContact O-CD2 3.47Å; C389-F468 WeakPolarHBondContact O-CE2 3.27Å
390	P	67.4	Low	62	Low	0 Å²	0	71.4 Å²	71.4	0%	0	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-20.8	176.6	-26.1	36.3	0	0	0	114.9	N392 L458 F459 V466 F468 L469 L488	P390-N392 VanDerWaalsContact C-N 3.3Å; P390-L458 HydrophobicContact CB-CD1 4.18Å; P390-F459 HydrophobicContact CG-CZ 4.35Å; P390-V466 HydrophobicContact CB-CG1 3.98Å; P390-V466 HydrophobicContact CG-CG1 3.79Å; P390-F468 HydrophobicContact CB-CD1 4.49Å; P390-F468 WeakPolarHBondContact O-CA 3.48Å; P390-L469 PolarHBondContact O-N 2.83Å; P390-L488 HydrophobicContact CG-CD1 4.03Å
391	M	70.2	Confident	64	Low	3 Å²	3	62.7 Å²	62.7	2%	0.015	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-14.4	175.7	-73.4	-59.8	-63.8	0	0	114.6	C389 F414 A417 F455 L469	C389-M391 PolarHBondContact O-N 3.41Å; M391-F414 HydrophobicContact CB-CD1 4.22Å; M391-F414 HydrophobicContact CB-CE1 3.89Å; M391-F414 HydrophobicContact CB-CZ 4.39Å; M391-F414 HydrophobicContact CG-CD1 4.05Å; M391-F414 HydrophobicContact CG-CE1 3.88Å; M391-A417 HydrophobicContact CE-CB 3.59Å; M391-F455 HydrophobicContact CE-CZ 4.23Å; M391-F455 HydrophobicContact CG-CD2 4.47Å; M391-F455 HydrophobicContact CG-CE1 4.24Å; M391-F455 HydrophobicContact CG-CE2 3.62Å; M391-F455 HydrophobicContact CG-CZ 3.5Å; M391-F455 HydrophobicContact SD-CD1 4.2Å; M391-F455 HydrophobicContact SD-CE1 3.31Å; M391-F455 WeakPolarHBondContact SD-CE1 3.29Å; M391-F455 HydrophobicContact SD-CE2 3.84Å; M391-F455 HydrophobicContact SD-CZ 3.11Å; M391-F455 WeakPolarHBondContact SD-CZ 3.47Å; M391-L469 HydrophobicContact CE-CD1 3.44Å; M391-L469 VanDerWaalsContact CE-CD1 3.44Å; M391-L469 HydrophobicContact SD-CD1 3.52Å; M391-L469 VanDerWaalsContact SD-CD1 3.52Å; M391-L469 HydrophobicContact SD-CG 4.11Å
392	N	70.3	Confident	65.9	Low	15 Å²	15	62.9 Å²	62.9	8%	0.08	35%	0.349	C	S	.	.	S	Bend	trans	-82.2	146.2	-179.3	-64.1	-6.6	0	0	0	110.7	L387 C389 P390 S394 F410 F468	L387-N392 PolarHBondContact O-ND2 2.9Å; C389-N392 WeakPolarHBondContact O-CB 3.44Å; C389-N392 PolarHBondContact O-N 3.41Å; P390-N392 VanDerWaalsContact C-N 3.3Å; N392-S394 WeakPolarHBondContact CB-O 3.38Å; N392-S394 PolarHBondContact O-N 2.96Å; N392-F410 WeakPolarHBondContact ND2-CD2 3.33Å; N392-F410 WeakPolarHBondContact ND2-CE2 3.37Å; N392-F410 WeakPolarHBondContact OD1-CD2 3.43Å; N392-F410 WeakPolarHBondContact OD1-CE2 3.43Å; N392-F468 VanDerWaalsContact O-CD2 3.32Å; N392-F468 WeakPolarHBondContact O-CD2 3.18Å
393	T	68.4	Low	67.2	Low	56 Å²	56	60.2 Å²	60.2	34%	0.344	32%	0.321	S	S	.	.	S	Bend	trans	-65.7	-26.9	173	-39.7	0	0	0	0	112.2
394	S	66.5	Low	68.4	Low	40 Å²	40	62.7 Å²	62.7	28%	0.28	33%	0.325	S	S	.	.			trans	-151.2	147.8	174.1	178.5	0	0	0	0	109.2	N392 Q396	N392-S394 WeakPolarHBondContact CB-O 3.38Å; N392-S394 PolarHBondContact O-N 2.96Å; S394-Q396 PolarHBondContact O-N 3.34Å; S394-Q396 PolarHBondContact OG-N 2.82Å; S394-Q396 VanDerWaalsContact OG-N 3.15Å
395	P	69.2	Low	69.3	Low	1 Å²	1	60.8 Å²	60.8	1%	0.006	32%	0.324	C	S	.	.	S	Bend	trans	-73.8	-10.8	169	31.4	-34.8	0	0	0	113.1	Y386 L387 F468 Y474 M482	Y386-P395 CarbonylContact C-O 3.44Å; Y386-P395 WeakPolarHBondContact CA-O 3.28Å; L387-P395 PolarHBondContact N-O 3.42Å; L387-P395 WeakPolarHBondContact O-CA 3.27Å; P395-F468 HydrophobicContact CB-CE2 3.9Å; P395-F468 HydrophobicContact CB-CZ 4.42Å; P395-F468 HydrophobicContact CG-CE2 4.29Å; P395-Y474 VanDerWaalsContact CD-CZ 3.44Å; P395-Y474 WeakPolarHBondContact CD-OH 3.46Å; P395-Y474 HydrophobicContact CG-CD1 4.5Å; P395-Y474 HydrophobicContact CG-CE1 3.82Å; P395-Y474 HydrophobicContact CG-CE2 4.16Å; P395-M482 HydrophobicContact CB-CE 4.19Å; P395-M482 HydrophobicContact CB-SD 4.36Å; P395-M482 HydrophobicContact CG-CE 3.98Å; P395-M482 HydrophobicContact CG-SD 4.09Å
396	Q	70.3	Confident	69.9	Low	143 Å²	143	56.6 Å²	56.6	67%	0.668	31%	0.305	S	S	*	.	B	Isolated β-bridge	trans	-78.4	137.8	-176	-65.4	174.6	-18	0	0	112.5	Y386 S394	Y386-Q396 HydrophobicContact CD1-CG 4.42Å; Y386-Q396 HydrophobicContact CE1-CG 4.16Å; S394-Q396 PolarHBondContact O-N 3.34Å; S394-Q396 PolarHBondContact OG-N 2.82Å; S394-Q396 VanDerWaalsContact OG-N 3.15Å
397	V	73.6	Confident	70.4	Confident	25 Å²	25	55.3 Å²	55.3	15%	0.152	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-101.4	138	172.8	179	0	0	0	0	109.9	M385 L387 P399 V406	M385-V397 WeakPolarHBondContact O-CB 3.28Å; M385-V397 PolarHBondContact O-N 3.33Å; L387-V397 HydrophobicContact CB-CG2 4.03Å; L387-V397 HydrophobicContact CD1-CG2 4.05Å; L387-V397 HydrophobicContact CG-CG2 3.83Å; V397-P399 WeakPolarHBondContact O-CD 3.48Å; V397-V406 HydrophobicContact CG1-CB 4.3Å; V397-V406 HydrophobicContact CG1-CG1 3.62Å; V397-V406 HydrophobicContact CG1-CG2 3.63Å; V397-V406 HydrophobicContact CG2-CG1 4.22Å
398	D	71.9	Confident	70.6	Confident	70 Å²	70	59.6 Å²	59.6	37%	0.374	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-70.5	118.1	172.5	-178.3	-11	0	0	0	110.6	H400 K401	D398-H400 PolarHBondContact O-N 2.82Å; D398-H400 VanDerWaalsContact O-N 3.13Å; D398-H400 WeakPolarHBondContact OD1-CB 3.45Å; D398-H400 IonicContact OD1-CD2 2.71Å; D398-H400 PolarHBondContact OD1-CD2 2.96Å; D398-H400 IonicContact OD1-CG 3.19Å; D398-H400 PolarHBondContact OD1-N 3.15Å; D398-K401 HydrophobicContact CB-CB 4.42Å; D398-K401 HydrophobicContact CB-CD 3.93Å; D398-K401 HydrophobicContact CB-CG 3.97Å; D398-K401 PolarHBondContact O-N 3.28Å
399	P	66.6	Low	70.8	Confident	92 Å²	92	63.7 Å²	63.7	60%	0.597	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-12.6	-179.9	-21.1	34.1	0	0	0	115.1	M385 V397	M385-P399 HydrophobicContact SD-CB 4.39Å; M385-P399 HydrophobicContact SD-CG 4.15Å; V397-P399 WeakPolarHBondContact O-CD 3.48Å
400	H	71.9	Confident	70.8	Confident	177 Å²	177	64.4 Å²	64.4	82%	0.819	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-16	-178.2	-61.4	-75.6	0	0	0	113.9	D398	D398-H400 PolarHBondContact O-N 2.82Å; D398-H400 VanDerWaalsContact O-N 3.13Å; D398-H400 WeakPolarHBondContact OD1-CB 3.45Å; D398-H400 IonicContact OD1-CD2 2.71Å; D398-H400 PolarHBondContact OD1-CD2 2.96Å; D398-H400 IonicContact OD1-CG 3.19Å; D398-H400 PolarHBondContact OD1-N 3.15Å
401	K	73.1	Confident	71.2	Confident	78 Å²	78	66.9 Å²	66.9	34%	0.339	35%	0.354	S	S	.	.	S	Bend	trans	-78.5	150.7	174.8	-70.2	-179.2	-178	173.9	0	110.9	D398 D405 V406 E409	D398-K401 HydrophobicContact CB-CB 4.42Å; D398-K401 HydrophobicContact CB-CD 3.93Å; D398-K401 HydrophobicContact CB-CG 3.97Å; D398-K401 PolarHBondContact O-N 3.28Å; K401-D405 HydrophobicContact CB-CB 4.32Å; K401-V406 HydrophobicContact CB-CG2 3.58Å; K401-V406 HydrophobicContact CD-CG2 4.36Å; K401-E409 IonicContact NZ-OE1 3.83Å; K401-E409 PolarHBondContact NZ-OE1 2.84Å; K401-E409 IonicContact NZ-OE2 2.66Å; K401-E409 PolarHBondContact NZ-OE2 3.21Å
402	S	75.1	Confident	71.4	Confident	54 Å²	54	72.7 Å²	72.7	38%	0.378	38%	0.381	S	S	.	.			trans	-72.9	158.7	173	82.2	0	0	0	0	111	Q404 D405 V406	S402-Q404 PolarHBondContact O-N 3.48Å; S402-Q404 VanDerWaalsContact O-N 3.08Å; S402-Q404 PolarHBondContact OG-N 2.77Å; S402-D405 WeakPolarHBondContact CA-OD2 3.29Å; S402-D405 WeakPolarHBondContact CB-OD2 3.12Å; S402-D405 PolarHBondContact N-OD2 2.84Å; S402-D405 PolarHBondContact O-N 3.13Å; S402-D405 PolarHBondContact OG-N 2.95Å; S402-D405 PolarHBondContact OG-OD2 3.39Å; S402-V406 WeakPolarHBondContact O-CB 3.28Å; S402-V406 VanDerWaalsContact O-CG2 3.31Å; S402-V406 WeakPolarHBondContact O-CG2 3.49Å; S402-V406 PolarHBondContact O-N 2.95Å
403	G	67.3	Low	71.7	Confident	38 Å²	38	73 Å²	73	39%	0.392	39%	0.385	S	S	.	.	H	α-helix	trans	-61.9	-15.3	175.2	0	0	0	0	0	114.3	W407	G403-W407 WeakPolarHBondContact O-CB 3.49Å; G403-W407 PolarHBondContact O-N 3.12Å
404	Q	69.7	Low	72.3	Confident	120 Å²	120	72.4 Å²	72.4	56%	0.561	38%	0.377	S	S	*	.	H	α-helix	trans	-86.4	-46.2	174.4	-68.2	-179.9	-8.4	0	0	110.7	S402 V406 W407 E408 S584	S402-Q404 PolarHBondContact O-N 3.48Å; S402-Q404 VanDerWaalsContact O-N 3.08Å; S402-Q404 PolarHBondContact OG-N 2.77Å; Q404-V406 VanDerWaalsContact C-N 3.31Å; Q404-V406 PolarHBondContact O-N 3.35Å; Q404-W407 WeakPolarHBondContact O-CB 3.48Å; Q404-W407 PolarHBondContact O-N 2.9Å; Q404-E408 PolarHBondContact O-N 3.27Å; Q404-S584 PolarHBondContact NE2-O 3.04Å
405	D	72.3	Confident	73	Confident	83 Å²	83	72.7 Å²	72.7	44%	0.444	38%	0.377	S	S	.	.	H	α-helix	trans	-58.6	-44.6	175.1	-45.5	-57.6	0	0	0	111.4	K401 S402 W407 E408 E409	K401-D405 HydrophobicContact CB-CB 4.32Å; S402-D405 WeakPolarHBondContact CA-OD2 3.29Å; S402-D405 WeakPolarHBondContact CB-OD2 3.12Å; S402-D405 PolarHBondContact N-OD2 2.84Å; S402-D405 PolarHBondContact O-N 3.13Å; S402-D405 PolarHBondContact OG-N 2.95Å; S402-D405 PolarHBondContact OG-OD2 3.39Å; D405-W407 VanDerWaalsContact C-N 3.29Å; D405-W407 PolarHBondContact O-N 3.26Å; D405-E408 PolarHBondContact O-N 3Å; D405-E409 WeakPolarHBondContact O-CB 3.48Å; D405-E409 PolarHBondContact O-N 2.69Å
406	V	70.3	Confident	73.7	Confident	21 Å²	21	73.7 Å²	73.7	13%	0.127	38%	0.384	C	S	.	.	H	α-helix	trans	-61.3	-37.2	176.3	168.4	0	0	0	0	111.7	L387 V397 K401 S402 Q404 F410	L387-V406 HydrophobicContact CD1-CG1 3.51Å; V397-V406 HydrophobicContact CG1-CB 4.3Å; V397-V406 HydrophobicContact CG1-CG1 3.62Å; V397-V406 HydrophobicContact CG1-CG2 3.63Å; V397-V406 HydrophobicContact CG2-CG1 4.22Å; K401-V406 HydrophobicContact CB-CG2 3.58Å; K401-V406 HydrophobicContact CD-CG2 4.36Å; S402-V406 WeakPolarHBondContact O-CB 3.28Å; S402-V406 VanDerWaalsContact O-CG2 3.31Å; S402-V406 WeakPolarHBondContact O-CG2 3.49Å; S402-V406 PolarHBondContact O-N 2.95Å; Q404-V406 VanDerWaalsContact C-N 3.31Å; Q404-V406 PolarHBondContact O-N 3.35Å; V406-F410 VanDerWaalsContact O-CB 3.24Å; V406-F410 WeakPolarHBondContact O-CB 3.36Å; V406-F410 PolarHBondContact O-N 3.06Å; V406-F410 VanDerWaalsContact O-N 3.12Å
407	W	70.1	Confident	74.4	Confident	74 Å²	74	67 Å²	67	28%	0.28	35%	0.353	S	S	.	.	H	α-helix	trans	-73	-40	176.5	168	-96.8	0	0	0	112.1	G403 Q404 D405 F410 S411 L577 F580	G403-W407 WeakPolarHBondContact O-CB 3.49Å; G403-W407 PolarHBondContact O-N 3.12Å; Q404-W407 WeakPolarHBondContact O-CB 3.48Å; Q404-W407 PolarHBondContact O-N 2.9Å; D405-W407 VanDerWaalsContact C-N 3.29Å; D405-W407 PolarHBondContact O-N 3.26Å; W407-F410 AromaticContact CE3-CD1 3.95Å; W407-F410 HydrophobicContact CE3-CD1 3.95Å; W407-F410 AromaticContact CZ3-CD1 3.76Å; W407-F410 HydrophobicContact CZ3-CD1 3.76Å; W407-F410 AromaticContact CZ3-CE1 3.99Å; W407-F410 HydrophobicContact CZ3-CE1 3.99Å; W407-F410 PolarHBondContact O-N 2.83Å; W407-S411 VanDerWaalsContact O-CB 3.27Å; W407-S411 WeakPolarHBondContact O-CB 3.48Å; W407-S411 PolarHBondContact O-N 3.11Å; W407-L577 HydrophobicContact CH2-CD2 3.79Å; W407-F580 HydrophobicContact CE3-CB 4.35Å; W407-F580 HydrophobicContact CE3-CD1 4.35Å; W407-F580 HydrophobicContact CZ3-CB 4Å; W407-F580 HydrophobicContact CZ3-CD1 4.44Å; W407-F580 HydrophobicContact CZ3-CG 4.23Å
408	E	73	Confident	75.1	Confident	119 Å²	119	67.5 Å²	67.5	56%	0.556	36%	0.356	S	S	*	.	H	α-helix	trans	-66.9	-45.5	177.3	-71.1	-168.9	171.1	0	0	111.2	Q404 D405 F410 S411 H412	Q404-E408 PolarHBondContact O-N 3.27Å; D405-E408 PolarHBondContact O-N 3Å; E408-F410 VanDerWaalsContact C-N 3.32Å; E408-F410 PolarHBondContact O-N 3.08Å; E408-S411 PolarHBondContact O-N 2.88Å; E408-H412 WeakPolarHBondContact O-CB 3.37Å; E408-H412 PolarHBondContact O-CD2 3.25Å; E408-H412 PolarHBondContact O-N 2.78Å
409	E	73.7	Confident	75.9	Confident	111 Å²	111	69.2 Å²	69.2	52%	0.519	36%	0.357	S	S	.	.	H	α-helix	trans	-56.8	-44.6	173.5	-174.8	172	-148.1	0	0	111.6	K401 D405 H412 S413	K401-E409 IonicContact NZ-OE1 3.83Å; K401-E409 PolarHBondContact NZ-OE1 2.84Å; K401-E409 IonicContact NZ-OE2 2.66Å; K401-E409 PolarHBondContact NZ-OE2 3.21Å; D405-E409 WeakPolarHBondContact O-CB 3.48Å; D405-E409 PolarHBondContact O-N 2.69Å; E409-H412 PolarHBondContact O-N 3.33Å; E409-S413 PolarHBondContact O-N 3.04Å; E409-S413 VanDerWaalsContact O-N 3.16Å
410	F	74.9	Confident	77	Confident	32 Å²	32	66.2 Å²	66.2	14%	0.14	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-47.9	174.4	179.6	-116.5	0	0	0	112.8	L387 C389 N392 V406 W407 E408 H412 S413 F414	L387-F410 HydrophobicContact CB-CD2 4.42Å; L387-F410 HydrophobicContact CD1-CB 3.8Å; L387-F410 HydrophobicContact CD1-CD2 4.09Å; L387-F410 HydrophobicContact CD1-CG 3.93Å; L387-F410 HydrophobicContact CD2-CD1 4.4Å; L387-F410 HydrophobicContact CD2-CD2 4.4Å; L387-F410 HydrophobicContact CD2-CG 4.34Å; C389-F410 HydrophobicContact CB-CE2 3.79Å; C389-F410 HydrophobicContact CB-CZ 4.26Å; N392-F410 WeakPolarHBondContact ND2-CD2 3.33Å; N392-F410 WeakPolarHBondContact ND2-CE2 3.37Å; N392-F410 WeakPolarHBondContact OD1-CD2 3.43Å; N392-F410 WeakPolarHBondContact OD1-CE2 3.43Å; V406-F410 VanDerWaalsContact O-CB 3.24Å; V406-F410 WeakPolarHBondContact O-CB 3.36Å; V406-F410 PolarHBondContact O-N 3.06Å; V406-F410 VanDerWaalsContact O-N 3.12Å; W407-F410 AromaticContact CE3-CD1 3.95Å; W407-F410 HydrophobicContact CE3-CD1 3.95Å; W407-F410 AromaticContact CZ3-CD1 3.76Å; W407-F410 HydrophobicContact CZ3-CD1 3.76Å; W407-F410 AromaticContact CZ3-CE1 3.99Å; W407-F410 HydrophobicContact CZ3-CE1 3.99Å; W407-F410 PolarHBondContact O-N 2.83Å; E408-F410 VanDerWaalsContact C-N 3.32Å; E408-F410 PolarHBondContact O-N 3.08Å; F410-H412 VanDerWaalsContact C-N 3.31Å; F410-H412 PolarHBondContact O-N 3.2Å; F410-S413 WeakPolarHBondContact O-CB 3.41Å; F410-S413 PolarHBondContact O-N 2.74Å; F410-S413 PolarHBondContact O-OG 2.86Å; F410-F414 HydrophobicContact CD1-CE2 4.3Å; F410-F414 HydrophobicContact CD2-CE2 4.08Å; F410-F414 AromaticContact CE1-CE2 3.92Å; F410-F414 HydrophobicContact CE1-CE2 3.92Å; F410-F414 HydrophobicContact CE1-CZ 4.44Å; F410-F414 AromaticContact CE2-CE2 3.67Å; F410-F414 HydrophobicContact CE2-CE2 3.67Å; F410-F414 AromaticContact CE2-CZ 3.88Å; F410-F414 HydrophobicContact CE2-CZ 3.88Å; F410-F414 HydrophobicContact CG-CE2 4.39Å; F410-F414 AromaticContact CZ-CE2 3.59Å; F410-F414 HydrophobicContact CZ-CE2 3.59Å; F410-F414 AromaticContact CZ-CZ 3.75Å; F410-F414 HydrophobicContact CZ-CZ 3.75Å; F410-F414 VanDerWaalsContact O-CD2 3.23Å; F410-F414 WeakPolarHBondContact O-CD2 3.07Å; F410-F414 WeakPolarHBondContact O-CE2 3.46Å
411	S	75.8	Confident	78.1	Confident	53 Å²	53	57.8 Å²	57.8	37%	0.371	30%	0.296	S	S	.	.	H	α-helix	trans	-63.7	-36.9	178.4	-173.8	0	0	0	0	111.8	W407 E408 S413 F414	W407-S411 VanDerWaalsContact O-CB 3.27Å; W407-S411 WeakPolarHBondContact O-CB 3.48Å; W407-S411 PolarHBondContact O-N 3.11Å; E408-S411 PolarHBondContact O-N 2.88Å; S411-S413 VanDerWaalsContact C-N 3.35Å; S411-F414 PolarHBondContact O-N 2.86Å
412	H	75.3	Confident	79.2	Confident	124 Å²	124	55.5 Å²	55.5	57%	0.574	29%	0.289	S	S	*	.	H	α-helix	trans	-67.9	-31	176.9	-87.7	-69.8	0	0	0	112.8	E408 E409 F410 F414 T415 P416	E408-H412 WeakPolarHBondContact O-CB 3.37Å; E408-H412 PolarHBondContact O-CD2 3.25Å; E408-H412 PolarHBondContact O-N 2.78Å; E409-H412 PolarHBondContact O-N 3.33Å; F410-H412 VanDerWaalsContact C-N 3.31Å; F410-H412 PolarHBondContact O-N 3.2Å; H412-F414 PolarHBondContact O-N 2.85Å; H412-F414 VanDerWaalsContact O-N 3.17Å; H412-T415 VanDerWaalsContact O-CB 3.28Å; H412-T415 WeakPolarHBondContact O-CB 3.19Å; H412-T415 PolarHBondContact O-N 2.97Å; H412-T415 PolarHBondContact O-OG1 2.89Å; H412-P416 WeakPolarHBondContact O-CD 3.46Å
413	S	77.7	Confident	80.2	Confident	23 Å²	23	56.9 Å²	56.9	16%	0.161	29%	0.289	C	S	.	.	H	α-helix	trans	-57	-31.1	177.2	78.3	0	0	0	0	114	E409 F410 S411	E409-S413 PolarHBondContact O-N 3.04Å; E409-S413 VanDerWaalsContact O-N 3.16Å; F410-S413 WeakPolarHBondContact O-CB 3.41Å; F410-S413 PolarHBondContact O-N 2.74Å; F410-S413 PolarHBondContact O-OG 2.86Å; S411-S413 VanDerWaalsContact C-N 3.35Å
414	F	79.1	Confident	81.6	Confident	43 Å²	43	55 Å²	55	19%	0.189	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-18.2	176.5	-60.1	-86.5	0	0	0	113.5	C389 M391 F410 S411 H412 A417 V418	C389-F414 HydrophobicContact CB-CZ 4.32Å; C389-F414 VanDerWaalsContact SG-CZ 3.53Å; M391-F414 HydrophobicContact CB-CD1 4.22Å; M391-F414 HydrophobicContact CB-CE1 3.89Å; M391-F414 HydrophobicContact CB-CZ 4.39Å; M391-F414 HydrophobicContact CG-CD1 4.05Å; M391-F414 HydrophobicContact CG-CE1 3.88Å; F410-F414 HydrophobicContact CD1-CE2 4.3Å; F410-F414 HydrophobicContact CD2-CE2 4.08Å; F410-F414 AromaticContact CE1-CE2 3.92Å; F410-F414 HydrophobicContact CE1-CE2 3.92Å; F410-F414 HydrophobicContact CE1-CZ 4.44Å; F410-F414 AromaticContact CE2-CE2 3.67Å; F410-F414 HydrophobicContact CE2-CE2 3.67Å; F410-F414 AromaticContact CE2-CZ 3.88Å; F410-F414 HydrophobicContact CE2-CZ 3.88Å; F410-F414 HydrophobicContact CG-CE2 4.39Å; F410-F414 AromaticContact CZ-CE2 3.59Å; F410-F414 HydrophobicContact CZ-CE2 3.59Å; F410-F414 AromaticContact CZ-CZ 3.75Å; F410-F414 HydrophobicContact CZ-CZ 3.75Å; F410-F414 VanDerWaalsContact O-CD2 3.23Å; F410-F414 WeakPolarHBondContact O-CD2 3.07Å; F410-F414 WeakPolarHBondContact O-CE2 3.46Å; S411-F414 PolarHBondContact O-N 2.86Å; H412-F414 PolarHBondContact O-N 2.85Å; H412-F414 VanDerWaalsContact O-N 3.17Å; F414-A417 PolarHBondContact O-N 3.28Å; F414-A417 VanDerWaalsContact O-N 3.1Å; F414-V418 HydrophobicContact CB-CG2 4.47Å; F414-V418 WeakPolarHBondContact O-CG2 3.5Å; F414-V418 PolarHBondContact O-N 3.16Å
415	T	83.1	Confident	82.9	Confident	45 Å²	45	49.3 Å²	49.3	28%	0.276	24%	0.244	S	C	.	.	H	α-helix	trans	-58.1	-42.4	-172.9	-64.9	0	0	0	0	113.3	H412 R419	H412-T415 VanDerWaalsContact O-CB 3.28Å; H412-T415 WeakPolarHBondContact O-CB 3.19Å; H412-T415 PolarHBondContact O-N 2.97Å; H412-T415 PolarHBondContact O-OG1 2.89Å; T415-R419 VanDerWaalsContact O-CG 3.32Å; T415-R419 WeakPolarHBondContact O-CG 3.34Å; T415-R419 PolarHBondContact O-N 3.44Å; T415-R419 VanDerWaalsContact O-N 3.11Å
416	P	82.8	Confident	84.1	Confident	23 Å²	23	49.5 Å²	49.5	15%	0.149	24%	0.241	C	C	.	.	H	α-helix	trans	-59.8	-47.9	172.3	-24.6	35.6	0	0	0	113	N315 H412 V418 R419 E420	N315-P416 HydrophobicContact CB-CG 4.16Å; H412-P416 WeakPolarHBondContact O-CD 3.46Å; P416-V418 PolarHBondContact O-N 3.07Å; P416-R419 WeakPolarHBondContact O-CA 3.38Å; P416-R419 WeakPolarHBondContact O-CB 3.29Å; P416-R419 PolarHBondContact O-N 3.27Å; P416-R419 VanDerWaalsContact O-N 3.07Å; P416-E420 PolarHBondContact O-N 3.33Å
417	A	84.2	Confident	85.4	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.008	25%	0.25	C	S	.	.	H	α-helix	trans	-67	-34.5	-177.9	0	0	0	0	0	112.9	M391 F414 R419 E420 V421 L451	M391-A417 HydrophobicContact CE-CB 3.59Å; F414-A417 PolarHBondContact O-N 3.28Å; F414-A417 VanDerWaalsContact O-N 3.1Å; A417-R419 VanDerWaalsContact C-N 3.35Å; A417-E420 PolarHBondContact O-N 3Å; A417-V421 WeakPolarHBondContact O-CG2 3.14Å; A417-V421 PolarHBondContact O-N 3.04Å; A417-L451 HydrophobicContact CB-CD1 4.38Å; A417-L451 HydrophobicContact CB-CD2 3.81Å
418	V	88.4	Confident	86.7	Confident	36 Å²	36	48.8 Å²	48.8	22%	0.218	24%	0.238	C	C	.	.	H	α-helix	trans	-63.7	-40.4	171	173.6	0	0	0	0	110.8	Y14 F414 P416 V421 V422 T447 L451	Y14-V418 HydrophobicContact CE2-CG1 4.35Å; F414-V418 HydrophobicContact CB-CG2 4.47Å; F414-V418 WeakPolarHBondContact O-CG2 3.5Å; F414-V418 PolarHBondContact O-N 3.16Å; P416-V418 PolarHBondContact O-N 3.07Å; V418-V421 PolarHBondContact O-N 3.08Å; V418-V422 WeakPolarHBondContact O-CG2 3.45Å; V418-V422 PolarHBondContact O-N 3.03Å; V418-V422 VanDerWaalsContact O-N 3.11Å; V418-T447 HydrophobicContact CB-CG2 4.41Å; V418-T447 HydrophobicContact CG1-CG2 4.29Å; V418-T447 HydrophobicContact CG2-CG2 4Å; V418-L451 HydrophobicContact CG2-CD1 4.49Å
419	R	89.3	Confident	87.9	Confident	106 Å²	106	45.5 Å²	45.5	40%	0.4	23%	0.227	S	C	.	.	H	α-helix	trans	-65.6	-43.1	174.5	-69.3	169.7	-178.6	-171.1	-0.7	111.9	T415 P416 A417 V421 V422 E423	T415-R419 VanDerWaalsContact O-CG 3.32Å; T415-R419 WeakPolarHBondContact O-CG 3.34Å; T415-R419 PolarHBondContact O-N 3.44Å; T415-R419 VanDerWaalsContact O-N 3.11Å; P416-R419 WeakPolarHBondContact O-CA 3.38Å; P416-R419 WeakPolarHBondContact O-CB 3.29Å; P416-R419 PolarHBondContact O-N 3.27Å; P416-R419 VanDerWaalsContact O-N 3.07Å; A417-R419 VanDerWaalsContact C-N 3.35Å; R419-V421 VanDerWaalsContact C-N 3.32Å; R419-V421 PolarHBondContact O-N 3.42Å; R419-V422 WeakPolarHBondContact O-CB 3.14Å; R419-V422 PolarHBondContact O-N 3.1Å; R419-V422 VanDerWaalsContact O-N 3.08Å; R419-E423 PolarHBondContact O-N 3.05Å
420	E	91.1	Very high	89	Confident	29 Å²	29	41.6 Å²	41.6	14%	0.136	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-42	175	-70	175.3	129	0	0	111.4	T272 F273 N276 P416 A417 V422 E423 F424 R454	T272-E420 HydrophobicContact CG2-CB 4.15Å; T272-E420 WeakPolarHBondContact CG2-O 3.46Å; F273-E420 HydrophobicContact CD1-CB 3.94Å; F273-E420 HydrophobicContact CE1-CB 3.67Å; N276-E420 PolarHBondContact ND2-OE1 3.21Å; P416-E420 PolarHBondContact O-N 3.33Å; A417-E420 PolarHBondContact O-N 3Å; E420-V422 VanDerWaalsContact C-N 3.34Å; E420-V422 PolarHBondContact O-N 3.49Å; E420-E423 PolarHBondContact O-N 3.22Å; E420-F424 WeakPolarHBondContact O-CB 3.37Å; E420-F424 PolarHBondContact O-N 3.03Å; E420-R454 IonicContact OE1-NH2 2.75Å; E420-R454 PolarHBondContact OE1-NH2 3.38Å; E420-R454 IonicContact OE2-CZ 2.75Å; E420-R454 VanDerWaalsContact OE2-CZ 3.3Å; E420-R454 IonicContact OE2-NH1 2.71Å; E420-R454 PolarHBondContact OE2-NH1 2.93Å; E420-R454 IonicContact OE2-NH2 3.16Å; E420-R454 PolarHBondContact OE2-NH2 3.16Å; E420-R454 VanDerWaalsContact OE2-NH2 3.14Å
421	V	94.6	Very high	90.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.9	-36.2	174.2	173.6	0	0	0	0	112.5	F273 A417 V418 R419 A425 L443 T447 V450 L451	F273-V421 HydrophobicContact CE1-CG2 4.25Å; F273-V421 HydrophobicContact CZ-CG2 4.23Å; A417-V421 WeakPolarHBondContact O-CG2 3.14Å; A417-V421 PolarHBondContact O-N 3.04Å; V418-V421 PolarHBondContact O-N 3.08Å; R419-V421 VanDerWaalsContact C-N 3.32Å; R419-V421 PolarHBondContact O-N 3.42Å; V421-A425 WeakPolarHBondContact O-CB 3.31Å; V421-A425 PolarHBondContact O-N 3.08Å; V421-L443 HydrophobicContact CG1-CD2 4.35Å; V421-T447 HydrophobicContact CB-CG2 4.27Å; V421-T447 HydrophobicContact CG1-CG2 4.2Å; V421-T447 HydrophobicContact CG2-CG2 4.48Å; V421-V450 HydrophobicContact CG1-CB 4.23Å; V421-V450 HydrophobicContact CG1-CG1 4.1Å; V421-V450 HydrophobicContact CG2-CB 4.32Å; V421-V450 HydrophobicContact CG2-CG1 3.83Å; V421-L451 HydrophobicContact CG2-CD2 3.58Å; V421-L451 HydrophobicContact CG2-CG 4.06Å
422	V	95.5	Very high	91.1	Very high	30 Å²	30	45.8 Å²	45.8	18%	0.182	22%	0.223	C	C	.	.	H	α-helix	trans	-67.3	-40.2	175	172.1	0	0	0	0	112	V418 R419 E420 A425 K426 L443	V418-V422 WeakPolarHBondContact O-CG2 3.45Å; V418-V422 PolarHBondContact O-N 3.03Å; V418-V422 VanDerWaalsContact O-N 3.11Å; R419-V422 WeakPolarHBondContact O-CB 3.14Å; R419-V422 PolarHBondContact O-N 3.1Å; R419-V422 VanDerWaalsContact O-N 3.08Å; E420-V422 VanDerWaalsContact C-N 3.34Å; E420-V422 PolarHBondContact O-N 3.49Å; V422-A425 WeakPolarHBondContact O-CB 3.48Å; V422-A425 PolarHBondContact O-N 3.06Å; V422-K426 WeakPolarHBondContact O-CG 3.2Å; V422-K426 PolarHBondContact O-N 3.38Å; V422-L443 HydrophobicContact CG2-CD1 4.14Å; V422-L443 HydrophobicContact CG2-CD2 3.94Å
423	E	95.9	Very high	92.1	Very high	83 Å²	83	46.7 Å²	46.7	39%	0.388	23%	0.228	S	C	.	.	H	α-helix	trans	-71.6	-36.4	175.9	-62.4	-44.4	130.1	0	0	112.6	T272 R419 E420 K426 K427	T272-E423 HydrophobicContact CG2-CB 4.06Å; R419-E423 PolarHBondContact O-N 3.05Å; E420-E423 PolarHBondContact O-N 3.22Å; E423-K426 PolarHBondContact O-N 3.48Å; E423-K426 IonicContact OE1-NZ 3.55Å; E423-K426 PolarHBondContact OE1-NZ 3.08Å; E423-K426 VanDerWaalsContact OE2-CD 3.24Å; E423-K426 WeakPolarHBondContact OE2-CD 3.46Å; E423-K426 IonicContact OE2-NZ 3.43Å; E423-K426 PolarHBondContact OE2-NZ 3.42Å; E423-K427 WeakPolarHBondContact O-CG 3.23Å; E423-K427 PolarHBondContact O-N 3.08Å
424	F	97.1	Very high	93.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.7	-46.9	171.4	173.8	-113.4	0	0	0	110.8	V265 A268 H269 T272 F273 E420 K426 K427 I428 M512 A513	V265-F424 HydrophobicContact CG1-CE2 4.24Å; V265-F424 HydrophobicContact CG1-CZ 4.08Å; A268-F424 HydrophobicContact CB-CD2 3.98Å; A268-F424 HydrophobicContact CB-CE2 4.06Å; H269-F424 HydrophobicContact CB-CD2 4.45Å; H269-F424 HydrophobicContact CB-CE2 3.94Å; T272-F424 HydrophobicContact CG2-CB 4.15Å; F273-F424 HydrophobicContact CE2-CB 3.7Å; F273-F424 AromaticContact CE2-CD1 3.94Å; F273-F424 HydrophobicContact CE2-CD1 3.94Å; F273-F424 AromaticContact CE2-CD2 3.75Å; F273-F424 HydrophobicContact CE2-CD2 3.75Å; F273-F424 HydrophobicContact CE2-CE2 4.35Å; F273-F424 AromaticContact CE2-CG 3.51Å; F273-F424 HydrophobicContact CE2-CG 3.51Å; F273-F424 HydrophobicContact CZ-CB 3.58Å; F273-F424 HydrophobicContact CZ-CD1 4.13Å; F273-F424 HydrophobicContact CZ-CD2 4.48Å; F273-F424 AromaticContact CZ-CG 3.83Å; F273-F424 HydrophobicContact CZ-CG 3.83Å; E420-F424 WeakPolarHBondContact O-CB 3.37Å; E420-F424 PolarHBondContact O-N 3.03Å; F424-K426 VanDerWaalsContact C-N 3.35Å; F424-K426 PolarHBondContact O-N 2.92Å; F424-K427 PolarHBondContact O-N 3.08Å; F424-I428 HydrophobicContact CD1-CD1 4.34Å; F424-I428 HydrophobicContact CE1-CD1 3.97Å; F424-I428 HydrophobicContact CE1-CG1 4.43Å; F424-I428 HydrophobicContact CZ-CD1 4.36Å; F424-I428 HydrophobicContact CZ-CG1 4.4Å; F424-I428 PolarHBondContact O-N 2.73Å; F424-M512 HydrophobicContact CE1-CB 4.12Å; F424-M512 HydrophobicContact CZ-CB 4.33Å; F424-A513 HydrophobicContact CZ-CB 4.31Å
425	A	97.9	Very high	93.9	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-54.7	-47.1	178.4	0	0	0	0	0	112.8	V421 V422 K427 I428 F431 L443 L516	V421-A425 WeakPolarHBondContact O-CB 3.31Å; V421-A425 PolarHBondContact O-N 3.08Å; V422-A425 WeakPolarHBondContact O-CB 3.48Å; V422-A425 PolarHBondContact O-N 3.06Å; A425-K427 PolarHBondContact O-N 3.45Å; A425-I428 PolarHBondContact O-N 2.71Å; A425-I428 VanDerWaalsContact O-N 3.16Å; A425-F431 HydrophobicContact CB-CD1 4.15Å; A425-F431 HydrophobicContact CB-CE1 3.76Å; A425-F431 HydrophobicContact CB-CE2 4.39Å; A425-F431 HydrophobicContact CB-CZ 3.89Å; A425-F431 WeakPolarHBondContact O-CB 3.49Å; A425-F431 VanDerWaalsContact O-CD1 3.23Å; A425-F431 WeakPolarHBondContact O-CD1 3.38Å; A425-F431 VanDerWaalsContact O-CG 3.3Å; A425-F431 WeakPolarHBondContact O-CG 3.45Å; A425-L443 HydrophobicContact CB-CD2 3.88Å; A425-L516 HydrophobicContact CB-CD2 3.55Å
426	K	97	Very high	94.6	Very high	87 Å²	87	50.5 Å²	50.5	38%	0.378	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-21.3	178.3	-70.5	163.5	176.7	175.1	0	114.1	V422 E423 F424 R432	V422-K426 WeakPolarHBondContact O-CG 3.2Å; V422-K426 PolarHBondContact O-N 3.38Å; E423-K426 PolarHBondContact O-N 3.48Å; E423-K426 IonicContact OE1-NZ 3.55Å; E423-K426 PolarHBondContact OE1-NZ 3.08Å; E423-K426 VanDerWaalsContact OE2-CD 3.24Å; E423-K426 WeakPolarHBondContact OE2-CD 3.46Å; E423-K426 IonicContact OE2-NZ 3.43Å; E423-K426 PolarHBondContact OE2-NZ 3.42Å; F424-K426 VanDerWaalsContact C-N 3.35Å; F424-K426 PolarHBondContact O-N 2.92Å; K426-R432 VanDerWaalsContact O-CD 3.22Å; K426-R432 WeakPolarHBondContact O-CD 3.45Å; K426-R432 WeakPolarHBondContact O-CG 3.46Å
427	K	96.9	Very high	95.2	Very high	77 Å²	77	53.5 Å²	53.5	34%	0.335	26%	0.258	S	S	.	.	H	α-helix	trans	-94.4	-9.7	179.7	-65.5	176.4	-173.7	-177.4	0	113.3	A268 E271 T272 E423 F424 A425 P429	A268-K427 HydrophobicContact CB-CB 3.47Å; A268-K427 VanDerWaalsContact CB-CB 3.47Å; A268-K427 HydrophobicContact CB-CD 4.02Å; A268-K427 HydrophobicContact CB-CG 4.42Å; E271-K427 WeakPolarHBondContact OE2-CE 3.3Å; E271-K427 IonicContact OE2-NZ 3.51Å; E271-K427 PolarHBondContact OE2-NZ 3.09Å; T272-K427 PolarHBondContact OG1-NZ 3.35Å; E423-K427 WeakPolarHBondContact O-CG 3.23Å; E423-K427 PolarHBondContact O-N 3.08Å; F424-K427 PolarHBondContact O-N 3.08Å; A425-K427 PolarHBondContact O-N 3.45Å; K427-P429 WeakPolarHBondContact O-CD 3.46Å
428	I	97.9	Very high	95.8	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	26%	0.258	C	S	.	.	S	Bend	trans	-68.1	122.4	172.3	-61.9	171	0	0	0	108.4	V265 F424 A425 G430 F431 A513 L516 V517 L537	V265-I428 HydrophobicContact CG2-CG2 4.49Å; F424-I428 HydrophobicContact CD1-CD1 4.34Å; F424-I428 HydrophobicContact CE1-CD1 3.97Å; F424-I428 HydrophobicContact CE1-CG1 4.43Å; F424-I428 HydrophobicContact CZ-CD1 4.36Å; F424-I428 HydrophobicContact CZ-CG1 4.4Å; F424-I428 PolarHBondContact O-N 2.73Å; A425-I428 PolarHBondContact O-N 2.71Å; A425-I428 VanDerWaalsContact O-N 3.16Å; I428-G430 PolarHBondContact O-N 3.19Å; I428-F431 HydrophobicContact CB-CB 4.06Å; I428-F431 HydrophobicContact CG2-CB 4.43Å; I428-F431 WeakPolarHBondContact O-CB 3.02Å; I428-F431 PolarHBondContact O-N 3.2Å; I428-F431 VanDerWaalsContact O-N 3.15Å; I428-A513 HydrophobicContact CD1-CB 3.81Å; I428-A513 HydrophobicContact CG1-CB 4.27Å; I428-L516 HydrophobicContact CD1-CD2 4.06Å; I428-V517 HydrophobicContact CD1-CG2 4.43Å; I428-L537 HydrophobicContact CG2-CD1 4.08Å; I428-L537 HydrophobicContact CG2-CD2 3.99Å
429	P	97.1	Very high	96.2	Very high	50 Å²	50	52.7 Å²	52.7	33%	0.325	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	130.6	177.6	-24.8	34.4	0	0	0	111.4	K427 L533	K427-P429 WeakPolarHBondContact O-CD 3.46Å; P429-L533 WeakPolarHBondContact O-CD1 3.17Å
430	G	96.5	Very high	96.5	Very high	30 Å²	30	49.5 Å²	49.5	31%	0.309	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	-7.3	-179.6	0	0	0	0	0	115.8	I428 E433	I428-G430 PolarHBondContact O-N 3.19Å; G430-E433 WeakPolarHBondContact CA-OE2 3.2Å; G430-E433 PolarHBondContact N-OE2 3.15Å
431	F	97.9	Very high	96.7	Very high	1 Å²	1	48.9 Å²	48.9	0%	0.004	24%	0.242	C	C	.	.	S	Bend	trans	-75.2	-34.4	178.7	-176	-91.3	0	0	0	113.3	A425 I428 E433 L434 Q439 L442 L443 V517 L533	A425-F431 HydrophobicContact CB-CD1 4.15Å; A425-F431 HydrophobicContact CB-CE1 3.76Å; A425-F431 HydrophobicContact CB-CE2 4.39Å; A425-F431 HydrophobicContact CB-CZ 3.89Å; A425-F431 WeakPolarHBondContact O-CB 3.49Å; A425-F431 VanDerWaalsContact O-CD1 3.23Å; A425-F431 WeakPolarHBondContact O-CD1 3.38Å; A425-F431 VanDerWaalsContact O-CG 3.3Å; A425-F431 WeakPolarHBondContact O-CG 3.45Å; I428-F431 HydrophobicContact CB-CB 4.06Å; I428-F431 HydrophobicContact CG2-CB 4.43Å; I428-F431 WeakPolarHBondContact O-CB 3.02Å; I428-F431 PolarHBondContact O-N 3.2Å; I428-F431 VanDerWaalsContact O-N 3.15Å; F431-E433 PolarHBondContact N-OE2 3.33Å; F431-E433 PolarHBondContact O-N 3.14Å; F431-L434 HydrophobicContact CD2-CD1 4.21Å; F431-L434 WeakPolarHBondContact O-CB 3.43Å; F431-L434 PolarHBondContact O-N 3.37Å; F431-Q439 HydrophobicContact CD1-CG 4.15Å; F431-Q439 HydrophobicContact CE1-CB 3.88Å; F431-Q439 HydrophobicContact CE1-CG 3.7Å; F431-Q439 HydrophobicContact CZ-CB 3.91Å; F431-Q439 HydrophobicContact CZ-CG 3.99Å; F431-Q439 WeakPolarHBondContact O-CG 3.26Å; F431-Q439 PolarHBondContact O-NE2 2.8Å; F431-L442 HydrophobicContact CD2-CD1 4.46Å; F431-L442 HydrophobicContact CE2-CB 4.27Å; F431-L442 HydrophobicContact CE2-CD1 3.85Å; F431-L443 HydrophobicContact CZ-CD1 4.42Å; F431-L443 HydrophobicContact CZ-CG 4.3Å; F431-V517 HydrophobicContact CD2-CG2 4Å; F431-L533 HydrophobicContact CB-CD2 4.4Å
432	R	97.2	Very high	96.8	Very high	171 Å²	171	48.9 Å²	48.9	65%	0.645	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-20	-177	-65	-176.1	66.1	170.6	-0.7	112.5	K426 Q439	K426-R432 VanDerWaalsContact O-CD 3.22Å; K426-R432 WeakPolarHBondContact O-CD 3.45Å; K426-R432 WeakPolarHBondContact O-CG 3.46Å; R432-Q439 PolarHBondContact O-NE2 2.73Å
433	E	97.4	Very high	96.8	Very high	143 Å²	143	48.2 Å²	48.2	67%	0.668	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-16.1	-179.3	-63.4	63.9	-146.6	0	0	112.1	G430 F431	G430-E433 WeakPolarHBondContact CA-OE2 3.2Å; G430-E433 PolarHBondContact N-OE2 3.15Å; F431-E433 PolarHBondContact N-OE2 3.33Å; F431-E433 PolarHBondContact O-N 3.14Å
434	L	97.3	Very high	96.6	Very high	15 Å²	15	50 Å²	50	8%	0.079	24%	0.244	C	C	.	.	S	Bend	trans	-68.3	161.6	169.3	-61.6	178.4	0	0	0	111.4	F431 D438 Q439 L442 V530 L533	F431-L434 HydrophobicContact CD2-CD1 4.21Å; F431-L434 WeakPolarHBondContact O-CB 3.43Å; F431-L434 PolarHBondContact O-N 3.37Å; L434-D438 HydrophobicContact CB-CB 4.4Å; L434-Q439 HydrophobicContact CB-CG 4.03Å; L434-Q439 PolarHBondContact O-NE2 3.3Å; L434-L442 HydrophobicContact CD1-CD1 3.64Å; L434-V530 HydrophobicContact CD1-CG2 4.22Å; L434-V530 HydrophobicContact CD2-CG2 4.09Å; L434-L533 HydrophobicContact CD1-CD2 3.95Å; L434-L533 HydrophobicContact CG-CD2 4.34Å
435	S	96.9	Very high	96.2	Very high	42 Å²	42	51.2 Å²	51.2	29%	0.294	25%	0.254	S	S	.	.			trans	-62.7	151.4	175.3	83.5	0	0	0	0	111.5	H437 D438 Q439	S435-H437 PolarHBondContact O-N 3.23Å; S435-H437 PolarHBondContact OG-N 3.25Å; S435-D438 WeakPolarHBondContact CB-OD2 3.3Å; S435-D438 PolarHBondContact O-N 3.45Å; S435-D438 VanDerWaalsContact O-N 3.11Å; S435-D438 WeakPolarHBondContact OG-CB 3.23Å; S435-D438 PolarHBondContact OG-N 2.97Å; S435-D438 PolarHBondContact OG-OD2 2.92Å; S435-Q439 WeakPolarHBondContact O-CG 3.29Å; S435-Q439 PolarHBondContact O-N 2.83Å
436	Q	96.8	Very high	96	Very high	135 Å²	135	51.2 Å²	51.2	63%	0.631	25%	0.254	S	S	*	.	H	α-helix	trans	-62.4	-25.7	175.1	-73	-64.8	-63.5	0	0	112.4	Q439 V440	Q436-Q439 VanDerWaalsContact NE2-CD 3.28Å; Q436-Q439 VanDerWaalsContact NE2-OE1 3.08Å; Q436-V440 WeakPolarHBondContact O-CB 3.39Å; Q436-V440 VanDerWaalsContact O-CG2 3.27Å; Q436-V440 WeakPolarHBondContact O-CG2 3.23Å; Q436-V440 PolarHBondContact O-N 3.25Å
437	H	96.1	Very high	95.8	Very high	86 Å²	86	47.3 Å²	47.3	40%	0.398	24%	0.237	S	C	.	.	H	α-helix	trans	-65.5	-53.8	170.2	-164.8	136.1	0	0	0	110.1	S435 Q439 V440 S441 G523 E525	S435-H437 PolarHBondContact O-N 3.23Å; S435-H437 PolarHBondContact OG-N 3.25Å; H437-Q439 PolarHBondContact O-N 3.31Å; H437-V440 PolarHBondContact O-N 2.75Å; H437-V440 VanDerWaalsContact O-N 3.14Å; H437-S441 PolarHBondContact CD2-OG 2.97Å; H437-S441 PolarHBondContact O-N 2.92Å; H437-S441 PolarHBondContact O-OG 3.17Å; H437-G523 PolarHBondContact CD2-O 2.61Å; H437-G523 PolarHBondContact NE2-O 3.43Å; H437-E525 HydrophobicContact CB-CG 4.23Å; H437-E525 IonicContact CE1-OE1 2.87Å; H437-E525 PolarHBondContact CE1-OE1 3.21Å; H437-E525 IonicContact CG-OE1 3.5Å; H437-E525 IonicContact ND1-OE1 3.62Å; H437-E525 PolarHBondContact ND1-OE1 2.92Å; H437-E525 IonicContact ND1-OE2 3.5Å
438	D	97	Very high	95.6	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.011	23%	0.228	C	C	.	.	H	α-helix	trans	-62.5	-43.4	-176.4	-62.2	-44.8	0	0	0	111.5	L434 S435 V440 S441 L442 I524 E525 V530	L434-D438 HydrophobicContact CB-CB 4.4Å; S435-D438 WeakPolarHBondContact CB-OD2 3.3Å; S435-D438 PolarHBondContact O-N 3.45Å; S435-D438 VanDerWaalsContact O-N 3.11Å; S435-D438 WeakPolarHBondContact OG-CB 3.23Å; S435-D438 PolarHBondContact OG-N 2.97Å; S435-D438 PolarHBondContact OG-OD2 2.92Å; D438-V440 VanDerWaalsContact C-N 3.31Å; D438-V440 PolarHBondContact O-N 2.73Å; D438-S441 PolarHBondContact O-N 3.14Å; D438-L442 WeakPolarHBondContact O-CB 3.49Å; D438-L442 VanDerWaalsContact O-CG 3.22Å; D438-L442 WeakPolarHBondContact O-CG 3.42Å; D438-L442 PolarHBondContact O-N 3.41Å; D438-I524 HydrophobicContact CB-CD1 4.48Å; D438-I524 VanDerWaalsContact OD1-CA 3.32Å; D438-I524 WeakPolarHBondContact OD1-CA 3.35Å; D438-I524 WeakPolarHBondContact OD1-CG2 3.45Å; D438-E525 PolarHBondContact OD1-N 2.91Å; D438-V530 HydrophobicContact CB-CG2 4.35Å
439	Q	97.4	Very high	95.4	Very high	18 Å²	18	45.1 Å²	45.1	8%	0.084	23%	0.228	C	C	.	.	H	α-helix	trans	-55.1	-46.3	173.9	-69.1	179.3	40.1	0	0	111.4	F431 R432 L434 S435 Q436 H437 L443	F431-Q439 HydrophobicContact CD1-CG 4.15Å; F431-Q439 HydrophobicContact CE1-CB 3.88Å; F431-Q439 HydrophobicContact CE1-CG 3.7Å; F431-Q439 HydrophobicContact CZ-CB 3.91Å; F431-Q439 HydrophobicContact CZ-CG 3.99Å; F431-Q439 WeakPolarHBondContact O-CG 3.26Å; F431-Q439 PolarHBondContact O-NE2 2.8Å; R432-Q439 PolarHBondContact O-NE2 2.73Å; L434-Q439 HydrophobicContact CB-CG 4.03Å; L434-Q439 PolarHBondContact O-NE2 3.3Å; S435-Q439 WeakPolarHBondContact O-CG 3.29Å; S435-Q439 PolarHBondContact O-N 2.83Å; Q436-Q439 VanDerWaalsContact NE2-CD 3.28Å; Q436-Q439 VanDerWaalsContact NE2-OE1 3.08Å; H437-Q439 PolarHBondContact O-N 3.31Å; Q439-L443 WeakPolarHBondContact O-CB 3.46Å; Q439-L443 WeakPolarHBondContact O-CD1 3.47Å; Q439-L443 VanDerWaalsContact O-CG 3.32Å; Q439-L443 WeakPolarHBondContact O-CG 3.5Å; Q439-L443 PolarHBondContact O-N 3.33Å; Q439-L443 VanDerWaalsContact O-N 3.08Å
440	V	95.2	Very high	95.3	Very high	39 Å²	39	42.7 Å²	42.7	24%	0.236	21%	0.212	C	C	.	.	H	α-helix	trans	-70.9	-37.3	179.4	168.7	0	0	0	0	112.3	I12 Q436 H437 D438 K444	I12-V440 HydrophobicContact CD1-CG2 4.39Å; Q436-V440 WeakPolarHBondContact O-CB 3.39Å; Q436-V440 VanDerWaalsContact O-CG2 3.27Å; Q436-V440 WeakPolarHBondContact O-CG2 3.23Å; Q436-V440 PolarHBondContact O-N 3.25Å; H437-V440 PolarHBondContact O-N 2.75Å; H437-V440 VanDerWaalsContact O-N 3.14Å; D438-V440 VanDerWaalsContact C-N 3.31Å; D438-V440 PolarHBondContact O-N 2.73Å; V440-K444 HydrophobicContact CG1-CD 3.82Å; V440-K444 HydrophobicContact CG1-CG 4.37Å; V440-K444 VanDerWaalsContact O-CB 3.31Å; V440-K444 WeakPolarHBondContact O-CB 3.3Å; V440-K444 VanDerWaalsContact O-CG 3.23Å; V440-K444 WeakPolarHBondContact O-CG 3.41Å; V440-K444 PolarHBondContact O-N 2.89Å
441	S	95.6	Very high	95	Very high	16 Å²	16	41.7 Å²	41.7	11%	0.112	20%	0.2	C	C	.	.	H	α-helix	trans	-69.4	-40.6	176.7	-77.5	0	0	0	0	112.4	H437 D438 K444 A445 G523	H437-S441 PolarHBondContact CD2-OG 2.97Å; H437-S441 PolarHBondContact O-N 2.92Å; H437-S441 PolarHBondContact O-OG 3.17Å; D438-S441 PolarHBondContact O-N 3.14Å; S441-K444 PolarHBondContact O-N 3.06Å; S441-A445 WeakPolarHBondContact O-CB 3.36Å; S441-A445 PolarHBondContact O-N 3.46Å; S441-A445 VanDerWaalsContact O-N 3.09Å; S441-G523 VanDerWaalsContact CB-O 3.23Å; S441-G523 WeakPolarHBondContact CB-O 3.47Å; S441-G523 PolarHBondContact OG-O 2.99Å
442	L	96.4	Very high	94.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.9	-48.1	172.9	-72.6	173.2	0	0	0	111.4	F431 L434 D438 A445 G446 V517 S518 R521 I524 V530	F431-L442 HydrophobicContact CD2-CD1 4.46Å; F431-L442 HydrophobicContact CE2-CB 4.27Å; F431-L442 HydrophobicContact CE2-CD1 3.85Å; L434-L442 HydrophobicContact CD1-CD1 3.64Å; D438-L442 WeakPolarHBondContact O-CB 3.49Å; D438-L442 VanDerWaalsContact O-CG 3.22Å; D438-L442 WeakPolarHBondContact O-CG 3.42Å; D438-L442 PolarHBondContact O-N 3.41Å; L442-A445 PolarHBondContact O-N 3.2Å; L442-G446 WeakPolarHBondContact O-CA 3.11Å; L442-G446 PolarHBondContact O-N 3.39Å; L442-V517 HydrophobicContact CD1-CG1 4.48Å; L442-S518 WeakPolarHBondContact CD2-O 3.32Å; L442-R521 HydrophobicContact CD2-CG 4.31Å; L442-I524 HydrophobicContact CD2-CD1 3.93Å; L442-I524 HydrophobicContact CG-CD1 3.89Å; L442-V530 HydrophobicContact CD1-CG1 4.1Å; L442-V530 HydrophobicContact CD1-CG2 4.39Å; L442-V530 HydrophobicContact CD2-CG1 3.99Å
443	L	95.8	Very high	94.5	Very high	15 Å²	15	33.6 Å²	33.6	8%	0.079	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-50.5	175.9	-75.3	163.7	0	0	0	111.9	V421 V422 A425 F431 Q439 A445 G446 T447 L516	V421-L443 HydrophobicContact CG1-CD2 4.35Å; V422-L443 HydrophobicContact CG2-CD1 4.14Å; V422-L443 HydrophobicContact CG2-CD2 3.94Å; A425-L443 HydrophobicContact CB-CD2 3.88Å; F431-L443 HydrophobicContact CZ-CD1 4.42Å; F431-L443 HydrophobicContact CZ-CG 4.3Å; Q439-L443 WeakPolarHBondContact O-CB 3.46Å; Q439-L443 WeakPolarHBondContact O-CD1 3.47Å; Q439-L443 VanDerWaalsContact O-CG 3.32Å; Q439-L443 WeakPolarHBondContact O-CG 3.5Å; Q439-L443 PolarHBondContact O-N 3.33Å; Q439-L443 VanDerWaalsContact O-N 3.08Å; L443-A445 PolarHBondContact O-N 2.95Å; L443-G446 PolarHBondContact O-N 2.92Å; L443-T447 WeakPolarHBondContact O-CB 3.43Å; L443-T447 PolarHBondContact O-N 3.35Å; L443-T447 PolarHBondContact O-OG1 3.1Å; L443-L516 HydrophobicContact CD2-CD1 4.25Å
444	K	90.4	Very high	94	Very high	122 Å²	122	28.3 Å²	28.3	53%	0.53	14%	0.143	S	C	.	.	H	α-helix	trans	-57.3	-33.9	-179.9	-80.1	171.3	179.4	169.1	0	113.8	V440 S441	V440-K444 HydrophobicContact CG1-CD 3.82Å; V440-K444 HydrophobicContact CG1-CG 4.37Å; V440-K444 VanDerWaalsContact O-CB 3.31Å; V440-K444 WeakPolarHBondContact O-CB 3.3Å; V440-K444 VanDerWaalsContact O-CG 3.23Å; V440-K444 WeakPolarHBondContact O-CG 3.41Å; V440-K444 PolarHBondContact O-N 2.89Å; S441-K444 PolarHBondContact O-N 3.06Å
445	A	90.1	Very high	93.4	Very high	25 Å²	25	28.1 Å²	28.1	21%	0.207	14%	0.142	C	C	.	.	H	α-helix	trans	-94.9	-25.6	-179.4	0	0	0	0	0	113.7	S441 L442 L443 R521 N570	S441-A445 WeakPolarHBondContact O-CB 3.36Å; S441-A445 PolarHBondContact O-N 3.46Å; S441-A445 VanDerWaalsContact O-N 3.09Å; L442-A445 PolarHBondContact O-N 3.2Å; L443-A445 PolarHBondContact O-N 2.95Å; A445-R521 HydrophobicContact CB-CB 4.31Å; A445-R521 HydrophobicContact CB-CG 4.1Å; A445-R521 PolarHBondContact O-NH1 3.34Å; A445-R521 VanDerWaalsContact O-NH1 3.14Å; A445-N570 PolarHBondContact O-ND2 3.11Å
446	G	93	Very high	92.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-98.4	-26.1	-173.2	0	0	0	0	0	115.6	L442 L443 F448 E449 V450	L442-G446 WeakPolarHBondContact O-CA 3.11Å; L442-G446 PolarHBondContact O-N 3.39Å; L443-G446 PolarHBondContact O-N 2.92Å; G446-F448 PolarHBondContact O-N 3.49Å; G446-E449 PolarHBondContact O-N 3.01Å; G446-V450 WeakPolarHBondContact O-CG2 3.45Å; G446-V450 PolarHBondContact O-N 3.02Å
447	T	93.3	Very high	92.1	Very high	5 Å²	5	22.9 Å²	22.9	3%	0.031	12%	0.12	C	C	.	.	H	α-helix	trans	-55.9	-45.6	-169.7	-70.8	0	0	0	0	113.7	V418 V421 L443 E449 V450 L451	V418-T447 HydrophobicContact CB-CG2 4.41Å; V418-T447 HydrophobicContact CG1-CG2 4.29Å; V418-T447 HydrophobicContact CG2-CG2 4Å; V421-T447 HydrophobicContact CB-CG2 4.27Å; V421-T447 HydrophobicContact CG1-CG2 4.2Å; V421-T447 HydrophobicContact CG2-CG2 4.48Å; L443-T447 WeakPolarHBondContact O-CB 3.43Å; L443-T447 PolarHBondContact O-N 3.35Å; L443-T447 PolarHBondContact O-OG1 3.1Å; T447-E449 VanDerWaalsContact C-N 3.32Å; T447-E449 PolarHBondContact O-N 3.05Å; T447-V450 PolarHBondContact O-N 3.22Å; T447-L451 HydrophobicContact CG2-CD1 4.1Å; T447-L451 HydrophobicContact CG2-CG 4.35Å; T447-L451 VanDerWaalsContact O-CG 3.31Å; T447-L451 WeakPolarHBondContact O-CG 3.49Å; T447-L451 PolarHBondContact O-N 3.03Å
448	F	92	Very high	91.3	Very high	31 Å²	31	19.7 Å²	19.7	14%	0.136	11%	0.106	C	C	.	.	H	α-helix	trans	-60.7	-40.5	177.6	176.8	-100.3	0	0	0	112.5	G446 L451 V452 L487 M491 L569 N570 H573	G446-F448 PolarHBondContact O-N 3.49Å; F448-L451 PolarHBondContact O-N 3.37Å; F448-V452 HydrophobicContact CD1-CG2 4.09Å; F448-V452 HydrophobicContact CE1-CG2 3.51Å; F448-V452 HydrophobicContact CE2-CG2 4.01Å; F448-V452 HydrophobicContact CZ-CG2 3.45Å; F448-V452 VanDerWaalsContact CZ-CG2 3.45Å; F448-V452 WeakPolarHBondContact O-CG2 3.41Å; F448-V452 PolarHBondContact O-N 3.42Å; F448-L487 HydrophobicContact CZ-CD1 4.23Å; F448-M491 HydrophobicContact CZ-SD 4.13Å; F448-L569 HydrophobicContact CE1-CB 4.07Å; F448-N570 HydrophobicContact CD1-CB 4Å; F448-H573 HydrophobicContact CD1-CB 3.97Å; F448-H573 HydrophobicContact CD2-CB 4.13Å; F448-H573 AromaticContact CD2-CD2 3.26Å; F448-H573 WeakPolarHBondContact CD2-CD2 3.47Å; F448-H573 AromaticContact CD2-CE1 3.83Å; F448-H573 AromaticContact CD2-CG 3.5Å; F448-H573 AromaticContact CD2-ND1 3.85Å; F448-H573 AromaticContact CD2-NE2 3.49Å; F448-H573 WeakPolarHBondContact CD2-NE2 3.21Å; F448-H573 HydrophobicContact CE1-CB 3.67Å; F448-H573 HydrophobicContact CE2-CB 3.84Å; F448-H573 AromaticContact CE2-CD2 3.77Å; F448-H573 AromaticContact CE2-CE1 3.97Å; F448-H573 AromaticContact CE2-CG 3.48Å; F448-H573 VanDerWaalsContact CE2-CG 3.48Å; F448-H573 AromaticContact CE2-ND1 3.62Å; F448-H573 HydrophobicContact CG-CB 4.19Å; F448-H573 AromaticContact CG-CD2 3.42Å; F448-H573 VanDerWaalsContact CG-CD2 3.42Å; F448-H573 WeakPolarHBondContact CG-CD2 3.33Å; F448-H573 AromaticContact CG-CG 3.86Å; F448-H573 HydrophobicContact CZ-CB 3.61Å; F448-H573 AromaticContact CZ-CG 3.82Å
449	E	94.4	Very high	90.7	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-68	-40	-179.3	-63.5	172.4	-151.5	0	0	111.6	G446 T447 L451 V452 V453 V515 R521 L566 R567 N570	G446-E449 PolarHBondContact O-N 3.01Å; T447-E449 VanDerWaalsContact C-N 3.32Å; T447-E449 PolarHBondContact O-N 3.05Å; E449-L451 VanDerWaalsContact C-N 3.33Å; E449-L451 PolarHBondContact O-N 2.88Å; E449-V452 PolarHBondContact O-N 3.42Å; E449-V453 WeakPolarHBondContact O-CG2 3.42Å; E449-V453 PolarHBondContact O-N 3.39Å; E449-V453 VanDerWaalsContact O-N 3.1Å; E449-V515 HydrophobicContact CB-CG1 3.56Å; E449-R521 VanDerWaalsContact CD-NH1 3.31Å; E449-R521 IonicContact OE1-CZ 2.64Å; E449-R521 IonicContact OE1-NH1 2.72Å; E449-R521 PolarHBondContact OE1-NH1 3.3Å; E449-R521 IonicContact OE1-NH2 3.36Å; E449-R521 IonicContact OE2-CZ 2.67Å; E449-R521 IonicContact OE2-NH1 3.05Å; E449-R521 PolarHBondContact OE2-NH1 3.33Å; E449-R521 IonicContact OE2-NH2 3.94Å; E449-R521 PolarHBondContact OE2-NH2 2.84Å; E449-L566 HydrophobicContact CB-CB 4.17Å; E449-L566 HydrophobicContact CB-CD2 4.15Å; E449-L566 HydrophobicContact CG-CB 3.94Å; E449-R567 WeakPolarHBondContact OE1-CD 3.43Å; E449-R567 IonicContact OE1-NE 3.85Å; E449-R567 WeakPolarHBondContact OE2-CD 3.27Å; E449-R567 IonicContact OE2-NE 3.57Å; E449-R567 PolarHBondContact OE2-NE 3.22Å; E449-R567 VanDerWaalsContact OE2-NE 3.15Å; E449-N570 HydrophobicContact CG-CB 3.89Å; E449-N570 WeakPolarHBondContact OE1-CB 3.13Å; E449-N570 PolarHBondContact OE1-ND2 3.34Å
450	V	94.4	Very high	90.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.7	-40	172.7	178.6	0	0	0	0	111.3	V421 G446 T447 V453 R454 M512 V515 L516	V421-V450 HydrophobicContact CG1-CB 4.23Å; V421-V450 HydrophobicContact CG1-CG1 4.1Å; V421-V450 HydrophobicContact CG2-CB 4.32Å; V421-V450 HydrophobicContact CG2-CG1 3.83Å; G446-V450 WeakPolarHBondContact O-CG2 3.45Å; G446-V450 PolarHBondContact O-N 3.02Å; T447-V450 PolarHBondContact O-N 3.22Å; V450-V453 PolarHBondContact O-N 2.93Å; V450-R454 PolarHBondContact O-N 2.91Å; V450-M512 HydrophobicContact CG1-CB 4.43Å; V450-M512 HydrophobicContact CG1-CE 3.57Å; V450-V515 HydrophobicContact CG2-CG1 4.1Å; V450-L516 HydrophobicContact CG2-CB 3.75Å; V450-L516 HydrophobicContact CG2-CD1 4.22Å; V450-L516 HydrophobicContact CG2-CG 4.44Å
451	L	90.8	Very high	89.5	Confident	8 Å²	8	21.8 Å²	21.8	4%	0.042	12%	0.115	C	C	.	.	H	α-helix	trans	-66.1	-43.7	176.5	-71.4	-177.2	0	0	0	112	A417 V418 V421 T447 F448 E449 V453 R454 F455	A417-L451 HydrophobicContact CB-CD1 4.38Å; A417-L451 HydrophobicContact CB-CD2 3.81Å; V418-L451 HydrophobicContact CG2-CD1 4.49Å; V421-L451 HydrophobicContact CG2-CD2 3.58Å; V421-L451 HydrophobicContact CG2-CG 4.06Å; T447-L451 HydrophobicContact CG2-CD1 4.1Å; T447-L451 HydrophobicContact CG2-CG 4.35Å; T447-L451 VanDerWaalsContact O-CG 3.31Å; T447-L451 WeakPolarHBondContact O-CG 3.49Å; T447-L451 PolarHBondContact O-N 3.03Å; F448-L451 PolarHBondContact O-N 3.37Å; E449-L451 VanDerWaalsContact C-N 3.33Å; E449-L451 PolarHBondContact O-N 2.88Å; L451-V453 VanDerWaalsContact C-N 3.29Å; L451-V453 PolarHBondContact O-N 2.96Å; L451-R454 PolarHBondContact O-N 3.26Å; L451-F455 HydrophobicContact CB-CD2 4.4Å; L451-F455 HydrophobicContact CB-CE2 3.68Å; L451-F455 HydrophobicContact CB-CZ 3.75Å; L451-F455 HydrophobicContact CD1-CZ 4.35Å; L451-F455 HydrophobicContact CD2-CE1 4.24Å; L451-F455 HydrophobicContact CD2-CZ 3.79Å; L451-F455 HydrophobicContact CG-CZ 4.16Å; L451-F455 WeakPolarHBondContact O-CB 3.49Å; L451-F455 WeakPolarHBondContact O-CD1 3.42Å; L451-F455 WeakPolarHBondContact O-CD2 3.18Å; L451-F455 WeakPolarHBondContact O-CG 3.48Å; L451-F455 PolarHBondContact O-N 3.33Å
452	V	90.9	Very high	89	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.006	15%	0.153	C	C	.	.	H	α-helix	trans	-55.9	-44.9	173.3	171.5	0	0	0	0	111.1	F448 E449 F455 A456 M491 F494 L566 L569	F448-V452 HydrophobicContact CD1-CG2 4.09Å; F448-V452 HydrophobicContact CE1-CG2 3.51Å; F448-V452 HydrophobicContact CE2-CG2 4.01Å; F448-V452 HydrophobicContact CZ-CG2 3.45Å; F448-V452 VanDerWaalsContact CZ-CG2 3.45Å; F448-V452 WeakPolarHBondContact O-CG2 3.41Å; F448-V452 PolarHBondContact O-N 3.42Å; E449-V452 PolarHBondContact O-N 3.42Å; V452-F455 PolarHBondContact O-N 3.37Å; V452-A456 PolarHBondContact O-N 2.94Å; V452-M491 HydrophobicContact CG2-CE 4.25Å; V452-M491 HydrophobicContact CG2-CG 4.31Å; V452-F494 HydrophobicContact CG1-CD1 3.59Å; V452-F494 HydrophobicContact CG1-CE1 3.83Å; V452-F494 HydrophobicContact CG1-CG 4.46Å; V452-L566 HydrophobicContact CB-CD2 4.1Å; V452-L566 HydrophobicContact CG1-CD2 3.94Å; V452-L569 HydrophobicContact CG1-CD1 3.92Å
453	V	92.9	Very high	88.6	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.006	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-47	177.8	174.8	0	0	0	0	111.5	E449 V450 L451 F455 A456 F494 L498 M508 F511 M512 V515 L566	E449-V453 WeakPolarHBondContact O-CG2 3.42Å; E449-V453 PolarHBondContact O-N 3.39Å; E449-V453 VanDerWaalsContact O-N 3.1Å; V450-V453 PolarHBondContact O-N 2.93Å; L451-V453 VanDerWaalsContact C-N 3.29Å; L451-V453 PolarHBondContact O-N 2.96Å; V453-F455 VanDerWaalsContact C-N 3.28Å; V453-F455 PolarHBondContact O-N 3.41Å; V453-A456 WeakPolarHBondContact O-CB 3.41Å; V453-A456 PolarHBondContact O-N 3.33Å; V453-A456 VanDerWaalsContact O-N 3.15Å; V453-F494 HydrophobicContact CG2-CE1 4.2Å; V453-F494 HydrophobicContact CG2-CZ 4.27Å; V453-L498 HydrophobicContact CG1-CD2 4.17Å; V453-L498 HydrophobicContact CG2-CD2 4.44Å; V453-M508 HydrophobicContact CG1-CG 4.34Å; V453-M508 HydrophobicContact CG1-SD 3.56Å; V453-M508 VanDerWaalsContact CG1-SD 3.56Å; V453-F511 HydrophobicContact CG1-CD1 3.96Å; V453-F511 HydrophobicContact CG1-CE1 4.23Å; V453-F511 HydrophobicContact CG2-CD1 4.33Å; V453-F511 HydrophobicContact CG2-CE1 3.81Å; V453-M512 HydrophobicContact CB-CG 4.03Å; V453-M512 HydrophobicContact CG1-CG 3.4Å; V453-M512 VanDerWaalsContact CG1-CG 3.4Å; V453-M512 HydrophobicContact CG1-SD 4.19Å; V453-V515 HydrophobicContact CG2-CG2 4.47Å; V453-L566 HydrophobicContact CG2-CD1 3.9Å; V453-L566 HydrophobicContact CG2-CD2 4.03Å
454	R	87.6	Confident	88.3	Confident	32 Å²	32	40.7 Å²	40.7	12%	0.121	19%	0.193	C	C	.	.	H	α-helix	trans	-56.7	-43.7	176	-174.1	-168.9	176.8	-167.9	14.1	111.6	F273 E420 V450 L451 A456 S457 M512	F273-R454 VanDerWaalsContact CD1-CZ 3.47Å; F273-R454 PolarHBondContact O-NH2 3.36Å; E420-R454 IonicContact OE1-NH2 2.75Å; E420-R454 PolarHBondContact OE1-NH2 3.38Å; E420-R454 IonicContact OE2-CZ 2.75Å; E420-R454 VanDerWaalsContact OE2-CZ 3.3Å; E420-R454 IonicContact OE2-NH1 2.71Å; E420-R454 PolarHBondContact OE2-NH1 2.93Å; E420-R454 IonicContact OE2-NH2 3.16Å; E420-R454 PolarHBondContact OE2-NH2 3.16Å; E420-R454 VanDerWaalsContact OE2-NH2 3.14Å; V450-R454 PolarHBondContact O-N 2.91Å; L451-R454 PolarHBondContact O-N 3.26Å; R454-A456 PolarHBondContact O-N 2.62Å; R454-S457 PolarHBondContact O-N 3.45Å; R454-S457 PolarHBondContact O-OG 2.87Å; R454-M512 HydrophobicContact CB-CE 3.95Å; R454-M512 HydrophobicContact CG-CE 4.49Å
455	F	84	Confident	88.2	Confident	12 Å²	12	35.2 Å²	35.2	5%	0.053	17%	0.17	C	C	.	.	H	α-helix	trans	-71.8	-8.7	-176.8	-55.7	-24.8	0	0	0	113.6	M391 L451 V452 V453 S457 L458 F459	M391-F455 HydrophobicContact CE-CZ 4.23Å; M391-F455 HydrophobicContact CG-CD2 4.47Å; M391-F455 HydrophobicContact CG-CE1 4.24Å; M391-F455 HydrophobicContact CG-CE2 3.62Å; M391-F455 HydrophobicContact CG-CZ 3.5Å; M391-F455 HydrophobicContact SD-CD1 4.2Å; M391-F455 HydrophobicContact SD-CE1 3.31Å; M391-F455 WeakPolarHBondContact SD-CE1 3.29Å; M391-F455 HydrophobicContact SD-CE2 3.84Å; M391-F455 HydrophobicContact SD-CZ 3.11Å; M391-F455 WeakPolarHBondContact SD-CZ 3.47Å; L451-F455 HydrophobicContact CB-CD2 4.4Å; L451-F455 HydrophobicContact CB-CE2 3.68Å; L451-F455 HydrophobicContact CB-CZ 3.75Å; L451-F455 HydrophobicContact CD1-CZ 4.35Å; L451-F455 HydrophobicContact CD2-CE1 4.24Å; L451-F455 HydrophobicContact CD2-CZ 3.79Å; L451-F455 HydrophobicContact CG-CZ 4.16Å; L451-F455 WeakPolarHBondContact O-CB 3.49Å; L451-F455 WeakPolarHBondContact O-CD1 3.42Å; L451-F455 WeakPolarHBondContact O-CD2 3.18Å; L451-F455 WeakPolarHBondContact O-CG 3.48Å; L451-F455 PolarHBondContact O-N 3.33Å; V452-F455 PolarHBondContact O-N 3.37Å; V453-F455 VanDerWaalsContact C-N 3.28Å; V453-F455 PolarHBondContact O-N 3.41Å; F455-S457 PolarHBondContact O-N 2.96Å; F455-S457 VanDerWaalsContact O-N 3.12Å; F455-L458 HydrophobicContact CB-CD1 4.18Å; F455-L458 HydrophobicContact CD1-CD1 4.11Å; F455-L458 HydrophobicContact CG-CD1 4.3Å; F455-L458 VanDerWaalsContact O-CB 3.31Å; F455-L458 WeakPolarHBondContact O-CB 3.38Å; F455-L458 PolarHBondContact O-N 3.09Å; F455-F459 HydrophobicContact CB-CE2 4.33Å; F455-F459 WeakPolarHBondContact O-CD2 3.47Å; F455-F459 WeakPolarHBondContact O-CE2 2.99Å
456	A	86.3	Confident	88	Confident	2 Å²	2	34.1 Å²	34.1	2%	0.017	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-50.8	-34.7	171.2	0	0	0	0	0	112.5	V452 V453 R454 L458 F459 C495 L498 M499	V452-A456 PolarHBondContact O-N 2.94Å; V453-A456 WeakPolarHBondContact O-CB 3.41Å; V453-A456 PolarHBondContact O-N 3.33Å; V453-A456 VanDerWaalsContact O-N 3.15Å; R454-A456 PolarHBondContact O-N 2.62Å; A456-L458 PolarHBondContact O-N 2.84Å; A456-F459 PolarHBondContact O-N 2.93Å; A456-F459 VanDerWaalsContact O-N 3.15Å; A456-C495 HydrophobicContact CB-CB 4.23Å; A456-L498 HydrophobicContact CB-CD2 4.17Å; A456-M499 HydrophobicContact CB-CG 4.32Å; A456-M499 HydrophobicContact CB-SD 4.06Å
457	S	79.8	Confident	87.5	Confident	64 Å²	64	35.5 Å²	35.5	45%	0.448	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-59.6	-25.6	173.1	58.5	0	0	0	0	115.1	R454 F455 F459	R454-S457 PolarHBondContact O-N 3.45Å; R454-S457 PolarHBondContact O-OG 2.87Å; F455-S457 PolarHBondContact O-N 2.96Å; F455-S457 VanDerWaalsContact O-N 3.12Å; S457-F459 VanDerWaalsContact C-N 3.34Å
458	L	80.3	Confident	87	Confident	19 Å²	19	35.3 Å²	35.3	10%	0.099	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-83	-9.8	178.5	-56.9	179.2	0	0	0	113.1	P390 F455 A456 V466 T467 L469	P390-L458 HydrophobicContact CB-CD1 4.18Å; F455-L458 HydrophobicContact CB-CD1 4.18Å; F455-L458 HydrophobicContact CD1-CD1 4.11Å; F455-L458 HydrophobicContact CG-CD1 4.3Å; F455-L458 VanDerWaalsContact O-CB 3.31Å; F455-L458 WeakPolarHBondContact O-CB 3.38Å; F455-L458 PolarHBondContact O-N 3.09Å; A456-L458 PolarHBondContact O-N 2.84Å; L458-V466 HydrophobicContact CB-CG1 4.3Å; L458-V466 WeakPolarHBondContact O-CA 3.03Å; L458-T467 PolarHBondContact O-N 3.5Å; L458-L469 HydrophobicContact CD1-CD2 4.32Å
459	F	83.5	Confident	85.9	Confident	8 Å²	8	36.2 Å²	36.2	4%	0.035	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	104.2	-176.2	-69.6	-85.8	0	0	0	111.7	P390 F455 A456 S457 V461 V466 F492 C495	P390-F459 HydrophobicContact CG-CZ 4.35Å; F455-F459 HydrophobicContact CB-CE2 4.33Å; F455-F459 WeakPolarHBondContact O-CD2 3.47Å; F455-F459 WeakPolarHBondContact O-CE2 2.99Å; A456-F459 PolarHBondContact O-N 2.93Å; A456-F459 VanDerWaalsContact O-N 3.15Å; S457-F459 VanDerWaalsContact C-N 3.34Å; F459-V461 VanDerWaalsContact C-N 3.33Å; F459-V461 PolarHBondContact O-N 2.93Å; F459-V466 HydrophobicContact CD1-CB 4.27Å; F459-V466 HydrophobicContact CD1-CG1 3.85Å; F459-V466 HydrophobicContact CD1-CG2 3.56Å; F459-V466 HydrophobicContact CE1-CB 4.29Å; F459-V466 HydrophobicContact CE1-CG1 3.74Å; F459-V466 HydrophobicContact CE1-CG2 3.5Å; F459-V466 VanDerWaalsContact CE1-CG2 3.5Å; F459-V466 HydrophobicContact CE2-CG1 4.46Å; F459-V466 HydrophobicContact CG-CG1 4.29Å; F459-V466 HydrophobicContact CZ-CG1 4.06Å; F459-F492 HydrophobicContact CD1-CB 4.37Å; F459-F492 AromaticContact CD1-CD2 3.42Å; F459-F492 HydrophobicContact CD1-CD2 3.42Å; F459-F492 VanDerWaalsContact CD1-CD2 3.42Å; F459-F492 AromaticContact CD1-CE2 3.98Å; F459-F492 HydrophobicContact CD1-CE2 3.98Å; F459-F492 HydrophobicContact CD1-CG 4.26Å; F459-F492 HydrophobicContact CE1-CB 4.08Å; F459-F492 AromaticContact CE1-CD2 3.85Å; F459-F492 HydrophobicContact CE1-CD2 3.85Å; F459-F492 HydrophobicContact CE1-CG 4.43Å; F459-F492 HydrophobicContact CG-CD2 4.49Å; F459-C495 HydrophobicContact CB-CB 4.09Å; F459-C495 HydrophobicContact CD1-CB 4.5Å; F459-C495 HydrophobicContact CD2-CB 3.57Å; F459-C495 WeakPolarHBondContact CD2-SG 3.2Å; F459-C495 HydrophobicContact CE2-CB 4.11Å; F459-C495 WeakPolarHBondContact CE2-SG 3.4Å; F459-C495 HydrophobicContact CG-CB 3.8Å
460	H	85.4	Confident	84.6	Confident	65 Å²	65	37.6 Å²	37.6	30%	0.301	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	79.3	175.3	-61.3	-83.6	0	0	0	110.2	K462 E463 R464 S465 T467 K473	H460-K462 VanDerWaalsContact C-N 3.34Å; H460-K462 PolarHBondContact O-N 3.27Å; H460-E463 HydrophobicContact CB-CB 4.24Å; H460-E463 CarbonylContact O-C 3.53Å; H460-E463 PolarHBondContact O-N 3.19Å; H460-R464 PolarHBondContact O-N 3.2Å; H460-S465 PolarHBondContact N-O 3.09Å; H460-S465 PolarHBondContact O-N 3.22Å; H460-T467 PolarHBondContact CD2-OG1 2.85Å; H460-T467 PolarHBondContact NE2-OG1 3.06Å; H460-K473 VanDerWaalsContact CD2-CE 3.49Å; H460-K473 WeakPolarHBondContact CD2-CE 3.39Å
461	V	83.1	Confident	83.6	Confident	30 Å²	30	40.1 Å²	40.1	18%	0.182	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-46.1	-52.3	-175.4	178.6	0	0	0	0	112.7	F459 E463 R464 E496 M499	F459-V461 VanDerWaalsContact C-N 3.33Å; F459-V461 PolarHBondContact O-N 2.93Å; V461-E463 PolarHBondContact O-N 3.24Å; V461-R464 PolarHBondContact O-N 2.81Å; V461-E496 HydrophobicContact CG1-CB 4.4Å; V461-E496 HydrophobicContact CG1-CG 3.82Å; V461-E496 HydrophobicContact CG2-CB 4.34Å; V461-M499 HydrophobicContact CG2-CB 4.25Å
462	K	85.6	Confident	83	Confident	213 Å²	213	45.2 Å²	45.2	93%	0.926	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-59.3	-31.7	-179.1	-66.9	-176.9	179.6	178.3	0	114	H460	H460-K462 VanDerWaalsContact C-N 3.34Å; H460-K462 PolarHBondContact O-N 3.27Å
463	E	87	Confident	82.7	Confident	115 Å²	115	49.2 Å²	49.2	54%	0.537	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-101.9	8.7	-178.9	-65.5	171	-90.8	0	0	112.1	H460 V461 S465 K473	H460-E463 HydrophobicContact CB-CB 4.24Å; H460-E463 CarbonylContact O-C 3.53Å; H460-E463 PolarHBondContact O-N 3.19Å; V461-E463 PolarHBondContact O-N 3.24Å; E463-S465 VanDerWaalsContact CB-OG 3.23Å; E463-S465 WeakPolarHBondContact CB-OG 3.28Å; E463-S465 WeakPolarHBondContact O-CB 3.49Å; E463-S465 PolarHBondContact O-N 2.98Å; E463-S465 PolarHBondContact O-OG 2.98Å; E463-K473 IonicContact OE1-NZ 2.64Å; E463-K473 PolarHBondContact OE1-NZ 3.15Å; E463-K473 IonicContact OE2-NZ 3.18Å; E463-K473 PolarHBondContact OE2-NZ 2.82Å
464	R	88.9	Confident	82.3	Confident	101 Å²	101	51.4 Å²	51.4	38%	0.381	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	39.7	48.9	-177	-65.5	-176.6	54.5	71	3.4	113.1	H460 V461 S475 V476	H460-R464 PolarHBondContact O-N 3.2Å; V461-R464 PolarHBondContact O-N 2.81Å; R464-S475 WeakPolarHBondContact O-CA 3.41Å; R464-V476 WeakPolarHBondContact O-CG2 3.43Å; R464-V476 PolarHBondContact O-N 2.9Å
465	S	88.9	Confident	82.4	Confident	6 Å²	6	52.4 Å²	52.4	4%	0.042	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	161.1	-171.7	41.6	0	0	0	0	112.7	H460 E463 K473 Y474	H460-S465 PolarHBondContact N-O 3.09Å; H460-S465 PolarHBondContact O-N 3.22Å; E463-S465 VanDerWaalsContact CB-OG 3.23Å; E463-S465 WeakPolarHBondContact CB-OG 3.28Å; E463-S465 WeakPolarHBondContact O-CB 3.49Å; E463-S465 PolarHBondContact O-N 2.98Å; E463-S465 PolarHBondContact O-OG 2.98Å; S465-K473 WeakPolarHBondContact OG-CE 3.11Å; S465-Y474 CarbonylContact C-O 3.43Å; S465-Y474 WeakPolarHBondContact CA-O 3.4Å; S465-Y474 WeakPolarHBondContact CB-O 3.3Å
466	V	85.6	Confident	82.4	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.012	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	130.5	-178.1	-157.4	0	0	0	0	108.9	P390 L458 F459 K473 Y474 L479 F492	P390-V466 HydrophobicContact CB-CG1 3.98Å; P390-V466 HydrophobicContact CG-CG1 3.79Å; L458-V466 HydrophobicContact CB-CG1 4.3Å; L458-V466 WeakPolarHBondContact O-CA 3.03Å; F459-V466 HydrophobicContact CD1-CB 4.27Å; F459-V466 HydrophobicContact CD1-CG1 3.85Å; F459-V466 HydrophobicContact CD1-CG2 3.56Å; F459-V466 HydrophobicContact CE1-CB 4.29Å; F459-V466 HydrophobicContact CE1-CG1 3.74Å; F459-V466 HydrophobicContact CE1-CG2 3.5Å; F459-V466 VanDerWaalsContact CE1-CG2 3.5Å; F459-V466 HydrophobicContact CE2-CG1 4.46Å; F459-V466 HydrophobicContact CG-CG1 4.29Å; F459-V466 HydrophobicContact CZ-CG1 4.06Å; V466-K473 WeakPolarHBondContact O-CA 3.45Å; V466-Y474 PolarHBondContact N-O 3.38Å; V466-Y474 PolarHBondContact O-N 3.49Å; V466-L479 HydrophobicContact CB-CD1 4.16Å; V466-L479 HydrophobicContact CG2-CD1 3.65Å; V466-F492 HydrophobicContact CG2-CD2 4.45Å
467	T	83.6	Confident	82.4	Confident	30 Å²	30	55.9 Å²	55.9	18%	0.184	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	118.4	173	-62.9	0	0	0	0	108.7	L458 H460	L458-T467 PolarHBondContact O-N 3.5Å; H460-T467 PolarHBondContact CD2-OG1 2.85Å; H460-T467 PolarHBondContact NE2-OG1 3.06Å
468	F	81.2	Confident	82.6	Confident	1 Å²	1	54.5 Å²	54.5	0%	0.004	29%	0.287	C	S	.	.			trans	-77.7	158.3	177	-82.8	38.5	0	0	0	110	V388 C389 P390 N392 P395 G470 G471 Q472 Y474 L479	V388-F468 HydrophobicContact CG1-CZ 3.99Å; C389-F468 WeakPolarHBondContact O-CD2 3.47Å; C389-F468 WeakPolarHBondContact O-CE2 3.27Å; P390-F468 HydrophobicContact CB-CD1 4.49Å; P390-F468 WeakPolarHBondContact O-CA 3.48Å; N392-F468 VanDerWaalsContact O-CD2 3.32Å; N392-F468 WeakPolarHBondContact O-CD2 3.18Å; P395-F468 HydrophobicContact CB-CE2 3.9Å; P395-F468 HydrophobicContact CB-CZ 4.42Å; P395-F468 HydrophobicContact CG-CE2 4.29Å; F468-G470 PolarHBondContact O-N 3.09Å; F468-G471 WeakPolarHBondContact O-CA 3.49Å; F468-G471 PolarHBondContact O-N 2.84Å; F468-Q472 WeakPolarHBondContact CB-O 3.43Å; F468-Q472 PolarHBondContact N-O 3.11Å; F468-Y474 HydrophobicContact CB-CE2 4.27Å; F468-Y474 AromaticContact CD1-CD2 3.6Å; F468-Y474 HydrophobicContact CD1-CD2 3.6Å; F468-Y474 HydrophobicContact CD1-CE2 4.08Å; F468-Y474 HydrophobicContact CD2-CD2 4.32Å; F468-Y474 HydrophobicContact CD2-CE2 4.03Å; F468-Y474 AromaticContact CE1-CD2 3.83Å; F468-Y474 HydrophobicContact CE1-CD2 3.83Å; F468-Y474 HydrophobicContact CE1-CE2 4.48Å; F468-Y474 HydrophobicContact CE2-CE2 4.43Å; F468-Y474 AromaticContact CG-CD2 3.89Å; F468-Y474 HydrophobicContact CG-CD2 3.89Å; F468-Y474 AromaticContact CG-CE2 3.86Å; F468-Y474 HydrophobicContact CG-CE2 3.86Å; F468-Y474 HydrophobicContact CZ-CD2 4.29Å; F468-L479 HydrophobicContact CE1-CD1 4.38Å; F468-L479 HydrophobicContact CE1-CD2 3.62Å; F468-L479 HydrophobicContact CZ-CD2 3.54Å
469	L	69.6	Low	82.8	Confident	50 Å²	50	53.7 Å²	53.7	26%	0.262	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.7	179.4	-69.8	-167.4	0	0	0	114.5	W311 P390 M391 L458 G471	W311-L469 HydrophobicContact CH2-CD1 4.1Å; W311-L469 HydrophobicContact CZ2-CD1 3.49Å; W311-L469 VanDerWaalsContact CZ2-CD1 3.49Å; P390-L469 PolarHBondContact O-N 2.83Å; M391-L469 HydrophobicContact CE-CD1 3.44Å; M391-L469 VanDerWaalsContact CE-CD1 3.44Å; M391-L469 HydrophobicContact SD-CD1 3.52Å; M391-L469 VanDerWaalsContact SD-CD1 3.52Å; M391-L469 HydrophobicContact SD-CG 4.11Å; L458-L469 HydrophobicContact CD1-CD2 4.32Å; L469-G471 PolarHBondContact O-N 3.31Å
470	G	67.4	Low	82.7	Confident	29 Å²	29	58.6 Å²	58.6	30%	0.299	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	13	167.6	0	0	0	0	0	115.1	F468 Q472	F468-G470 PolarHBondContact O-N 3.09Å; G470-Q472 PolarHBondContact O-N 2.9Å; G470-Q472 VanDerWaalsContact O-N 3.08Å
471	G	73	Confident	82.4	Confident	53 Å²	53	61.4 Å²	61.4	55%	0.546	32%	0.323	S	S	.	.	S	Bend	trans	75.6	-16.5	-176.6	0	0	0	0	0	115	F468 L469	F468-G471 WeakPolarHBondContact O-CA 3.49Å; F468-G471 PolarHBondContact O-N 2.84Å; L469-G471 PolarHBondContact O-N 3.31Å
472	Q	77.8	Confident	82	Confident	115 Å²	115	61.3 Å²	61.3	54%	0.537	32%	0.321	S	S	.	.			trans	-72.2	129.7	-176.3	-64.2	-61.7	93	0	0	112.2	F468 G470 Y474	F468-Q472 WeakPolarHBondContact CB-O 3.43Å; F468-Q472 PolarHBondContact N-O 3.11Å; G470-Q472 PolarHBondContact O-N 2.9Å; G470-Q472 VanDerWaalsContact O-N 3.08Å; Q472-Y474 HydrophobicContact CB-CD2 4.49Å; Q472-Y474 HydrophobicContact CB-CE2 3.55Å
473	K	85.6	Confident	81	Confident	86 Å²	86	53.1 Å²	53.1	37%	0.374	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	128.6	-178.2	-168.3	173.6	-172.4	174.8	0	111.2	H460 E463 S465 V466	H460-K473 VanDerWaalsContact CD2-CE 3.49Å; H460-K473 WeakPolarHBondContact CD2-CE 3.39Å; E463-K473 IonicContact OE1-NZ 2.64Å; E463-K473 PolarHBondContact OE1-NZ 3.15Å; E463-K473 IonicContact OE2-NZ 3.18Å; E463-K473 PolarHBondContact OE2-NZ 2.82Å; S465-K473 WeakPolarHBondContact OG-CE 3.11Å; V466-K473 WeakPolarHBondContact O-CA 3.45Å
474	Y	84.3	Confident	80.2	Confident	46 Å²	46	48.4 Å²	48.4	18%	0.18	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.2	-178.4	-61.1	-87.8	0	0	0	110.8	P395 S465 V466 F468 Q472 L479 M482	P395-Y474 VanDerWaalsContact CD-CZ 3.44Å; P395-Y474 WeakPolarHBondContact CD-OH 3.46Å; P395-Y474 HydrophobicContact CG-CD1 4.5Å; P395-Y474 HydrophobicContact CG-CE1 3.82Å; P395-Y474 HydrophobicContact CG-CE2 4.16Å; S465-Y474 CarbonylContact C-O 3.43Å; S465-Y474 WeakPolarHBondContact CA-O 3.4Å; S465-Y474 WeakPolarHBondContact CB-O 3.3Å; V466-Y474 PolarHBondContact N-O 3.38Å; V466-Y474 PolarHBondContact O-N 3.49Å; F468-Y474 HydrophobicContact CB-CE2 4.27Å; F468-Y474 AromaticContact CD1-CD2 3.6Å; F468-Y474 HydrophobicContact CD1-CD2 3.6Å; F468-Y474 HydrophobicContact CD1-CE2 4.08Å; F468-Y474 HydrophobicContact CD2-CD2 4.32Å; F468-Y474 HydrophobicContact CD2-CE2 4.03Å; F468-Y474 AromaticContact CE1-CD2 3.83Å; F468-Y474 HydrophobicContact CE1-CD2 3.83Å; F468-Y474 HydrophobicContact CE1-CE2 4.48Å; F468-Y474 HydrophobicContact CE2-CE2 4.43Å; F468-Y474 AromaticContact CG-CD2 3.89Å; F468-Y474 HydrophobicContact CG-CD2 3.89Å; F468-Y474 AromaticContact CG-CE2 3.86Å; F468-Y474 HydrophobicContact CG-CE2 3.86Å; F468-Y474 HydrophobicContact CZ-CD2 4.29Å; Q472-Y474 HydrophobicContact CB-CD2 4.49Å; Q472-Y474 HydrophobicContact CB-CE2 3.55Å; Y474-L479 HydrophobicContact CG-CD2 4.1Å; Y474-M482 HydrophobicContact CD1-CE 4.02Å; Y474-M482 HydrophobicContact CE1-CE 4.44Å
475	S	89.1	Confident	79.5	Confident	53 Å²	53	45.4 Å²	45.4	37%	0.371	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	148	170.6	65.5	0	0	0	0	111.1	R464 D477 A478 L479	R464-S475 WeakPolarHBondContact O-CA 3.41Å; S475-D477 PolarHBondContact O-N 2.9Å; S475-A478 PolarHBondContact O-N 3.2Å; S475-A478 VanDerWaalsContact O-N 3.12Å; S475-A478 VanDerWaalsContact OG-CB 3.29Å; S475-A478 WeakPolarHBondContact OG-CB 3.41Å; S475-A478 PolarHBondContact OG-N 3.35Å; S475-L479 VanDerWaalsContact O-CG 3.28Å; S475-L479 WeakPolarHBondContact O-CG 3.41Å; S475-L479 PolarHBondContact O-N 3.12Å
476	V	85.3	Confident	79.3	Confident	9 Å²	9	50.5 Å²	50.5	6%	0.055	30%	0.304	C	S	.	.	H	α-helix	trans	-53.5	-37.5	175.6	169.7	0	0	0	0	111.3	R464 L479 R480 F492	R464-V476 WeakPolarHBondContact O-CG2 3.43Å; R464-V476 PolarHBondContact O-N 2.9Å; V476-L479 PolarHBondContact O-N 3.4Å; V476-R480 WeakPolarHBondContact O-CB 3.33Å; V476-R480 PolarHBondContact O-N 3.32Å; V476-F492 HydrophobicContact CG2-CD1 4.33Å; V476-F492 HydrophobicContact CG2-CD2 3.15Å; V476-F492 HydrophobicContact CG2-CE1 4.44Å; V476-F492 HydrophobicContact CG2-CE2 3.31Å; V476-F492 HydrophobicContact CG2-CG 3.75Å; V476-F492 HydrophobicContact CG2-CZ 3.99Å
477	D	85.8	Confident	79.3	Confident	79 Å²	79	51.5 Å²	51.5	42%	0.422	31%	0.309	S	S	.	.	H	α-helix	trans	-76.4	-32.1	-176.7	-53.9	-54.4	0	0	0	111.6	S475 R480 T481	S475-D477 PolarHBondContact O-N 2.9Å; D477-R480 WeakPolarHBondContact O-CB 3.43Å; D477-R480 PolarHBondContact O-N 2.9Å; D477-T481 PolarHBondContact O-N 2.89Å; D477-T481 PolarHBondContact O-OG1 2.99Å
478	A	84.6	Confident	79.4	Confident	34 Å²	34	50.9 Å²	50.9	28%	0.281	30%	0.304	S	S	.	.	H	α-helix	trans	-67.6	-42	168.2	0	0	0	0	0	112	S475 R480 T481 M482	S475-A478 PolarHBondContact O-N 3.2Å; S475-A478 VanDerWaalsContact O-N 3.12Å; S475-A478 VanDerWaalsContact OG-CB 3.29Å; S475-A478 WeakPolarHBondContact OG-CB 3.41Å; S475-A478 PolarHBondContact OG-N 3.35Å; A478-R480 VanDerWaalsContact C-N 3.29Å; A478-R480 PolarHBondContact O-N 3.13Å; A478-T481 WeakPolarHBondContact CA-OG1 3.43Å; A478-T481 PolarHBondContact O-N 2.87Å; A478-T481 PolarHBondContact O-OG1 2.93Å; A478-M482 WeakPolarHBondContact O-CG 3.38Å; A478-M482 PolarHBondContact O-N 2.98Å
479	L	83.3	Confident	79.7	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-39.7	174.1	-64.9	163.7	0	0	0	110.8	V388 V466 F468 Y474 S475 V476 M482 S484 L488	V388-L479 HydrophobicContact CG1-CB 4.08Å; V388-L479 HydrophobicContact CG1-CD2 3.27Å; V388-L479 HydrophobicContact CG1-CG 4.25Å; V466-L479 HydrophobicContact CB-CD1 4.16Å; V466-L479 HydrophobicContact CG2-CD1 3.65Å; F468-L479 HydrophobicContact CE1-CD1 4.38Å; F468-L479 HydrophobicContact CE1-CD2 3.62Å; F468-L479 HydrophobicContact CZ-CD2 3.54Å; Y474-L479 HydrophobicContact CG-CD2 4.1Å; S475-L479 VanDerWaalsContact O-CG 3.28Å; S475-L479 WeakPolarHBondContact O-CG 3.41Å; S475-L479 PolarHBondContact O-N 3.12Å; V476-L479 PolarHBondContact O-N 3.4Å; L479-M482 HydrophobicContact CD2-CE 3.84Å; L479-M482 HydrophobicContact CG-CE 4.48Å; L479-M482 PolarHBondContact O-N 2.97Å; L479-S484 WeakPolarHBondContact O-CB 3.45Å; L479-S484 PolarHBondContact O-N 2.8Å; L479-S484 PolarHBondContact O-OG 3.3Å; L479-L488 HydrophobicContact CB-CD2 4.27Å; L479-L488 HydrophobicContact CD1-CD2 4.38Å
480	R	82	Confident	80.8	Confident	111 Å²	111	51.2 Å²	51.2	42%	0.419	31%	0.311	S	S	.	.	H	α-helix	trans	-62.7	-44.5	173.9	-168.9	-177.6	-56.3	-68.1	-8.1	111.9	V476 D477 A478 M482 G483 S484 S489	V476-R480 WeakPolarHBondContact O-CB 3.33Å; V476-R480 PolarHBondContact O-N 3.32Å; D477-R480 WeakPolarHBondContact O-CB 3.43Å; D477-R480 PolarHBondContact O-N 2.9Å; A478-R480 VanDerWaalsContact C-N 3.29Å; A478-R480 PolarHBondContact O-N 3.13Å; R480-M482 VanDerWaalsContact C-N 3.33Å; R480-M482 PolarHBondContact O-N 3.48Å; R480-G483 PolarHBondContact O-N 3.27Å; R480-S484 WeakPolarHBondContact CA-OG 3.44Å; R480-S484 PolarHBondContact N-OG 3.43Å; R480-S489 PolarHBondContact NH1-OG 3.16Å; R480-S489 PolarHBondContact NH2-OG 3.38Å
481	T	78.2	Confident	81.9	Confident	123 Å²	123	50.4 Å²	50.4	76%	0.755	30%	0.3	S	S	*	.	H	α-helix	trans	-69.2	-26.6	176.4	53.3	0	0	0	0	114	D477 A478 G483	D477-T481 PolarHBondContact O-N 2.89Å; D477-T481 PolarHBondContact O-OG1 2.99Å; A478-T481 WeakPolarHBondContact CA-OG1 3.43Å; A478-T481 PolarHBondContact O-N 2.87Å; A478-T481 PolarHBondContact O-OG1 2.93Å; T481-G483 PolarHBondContact O-N 3.47Å
482	M	74.3	Confident	82.7	Confident	29 Å²	29	48 Å²	48	14%	0.143	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	9.2	169.2	-69.3	-173.8	-62.6	0	0	113.3	Y386 V388 P395 Y474 A478 L479 R480	Y386-M482 WeakPolarHBondContact CB-O 3.27Å; Y386-M482 HydrophobicContact CD1-CB 4.39Å; Y386-M482 HydrophobicContact CD1-CG 4.17Å; Y386-M482 HydrophobicContact CD1-SD 3.82Å; Y386-M482 HydrophobicContact CD2-CB 4.06Å; Y386-M482 HydrophobicContact CD2-CG 4.25Å; Y386-M482 HydrophobicContact CE1-CG 4.28Å; Y386-M482 HydrophobicContact CE1-SD 3.95Å; Y386-M482 HydrophobicContact CE2-CG 4.36Å; Y386-M482 HydrophobicContact CG-CB 3.95Å; Y386-M482 HydrophobicContact CG-CG 4.17Å; Y386-M482 HydrophobicContact CG-SD 4.35Å; V388-M482 HydrophobicContact CG2-CB 4.05Å; P395-M482 HydrophobicContact CB-CE 4.19Å; P395-M482 HydrophobicContact CB-SD 4.36Å; P395-M482 HydrophobicContact CG-CE 3.98Å; P395-M482 HydrophobicContact CG-SD 4.09Å; Y474-M482 HydrophobicContact CD1-CE 4.02Å; Y474-M482 HydrophobicContact CE1-CE 4.44Å; A478-M482 WeakPolarHBondContact O-CG 3.38Å; A478-M482 PolarHBondContact O-N 2.98Å; L479-M482 HydrophobicContact CD2-CE 3.84Å; L479-M482 HydrophobicContact CG-CE 4.48Å; L479-M482 PolarHBondContact O-N 2.97Å; R480-M482 VanDerWaalsContact C-N 3.33Å; R480-M482 PolarHBondContact O-N 3.48Å
483	G	65.9	Low	83.3	Confident	41 Å²	41	46 Å²	46	42%	0.423	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	22.3	175.6	0	0	0	0	0	114.9	R480 T481 G485	R480-G483 PolarHBondContact O-N 3.27Å; T481-G483 PolarHBondContact O-N 3.47Å; G483-G485 PolarHBondContact O-N 2.88Å; G483-G485 VanDerWaalsContact O-N 3.15Å
484	S	69.1	Low	83.7	Confident	16 Å²	16	42.1 Å²	42.1	11%	0.112	25%	0.25	C	S	.	.			trans	-62.4	118.4	172	69.9	0	0	0	0	111.2	L479 R480	L479-S484 WeakPolarHBondContact O-CB 3.45Å; L479-S484 PolarHBondContact O-N 2.8Å; L479-S484 PolarHBondContact O-OG 3.3Å; R480-S484 WeakPolarHBondContact CA-OG 3.44Å; R480-S484 PolarHBondContact N-OG 3.43Å
485	G	75.6	Confident	84	Confident	37 Å²	37	39.9 Å²	39.9	38%	0.381	24%	0.242	S	C	.	.			trans	-70.1	174.4	-176.6	0	0	0	0	0	113.6	G483 L487 L488	G483-G485 PolarHBondContact O-N 2.88Å; G483-G485 VanDerWaalsContact O-N 3.15Å; G485-L487 PolarHBondContact O-N 2.83Å; G485-L488 PolarHBondContact O-N 3.41Å
486	D	84.6	Confident	84.1	Confident	114 Å²	114	40 Å²	40	61%	0.61	24%	0.236	S	C	*	.	H	α-helix	trans	-55.2	-26.4	-174.6	-55	-57.2	0	0	0	113.8	S489 S490 M572	D486-S489 PolarHBondContact O-N 3.08Å; D486-S490 VanDerWaalsContact O-CB 3.29Å; D486-S490 WeakPolarHBondContact O-CB 3.33Å; D486-S490 PolarHBondContact O-N 3.01Å; D486-S490 PolarHBondContact O-OG 3.26Å; D486-M572 HydrophobicContact CB-CE 3.81Å
487	L	86	Confident	84.5	Confident	23 Å²	23	44.2 Å²	44.2	12%	0.12	25%	0.254	C	S	.	.	H	α-helix	trans	-57.2	-47.9	173.1	178.4	62.8	0	0	0	112.2	F448 G485 S490 M491 L569 M572 H573 Q576	F448-L487 HydrophobicContact CZ-CD1 4.23Å; G485-L487 PolarHBondContact O-N 2.83Å; L487-S490 PolarHBondContact O-N 3.15Å; L487-M491 HydrophobicContact CD1-CG 4.37Å; L487-M491 HydrophobicContact CD1-SD 4.25Å; L487-M491 HydrophobicContact CG-SD 4.04Å; L487-M491 WeakPolarHBondContact O-CB 3.42Å; L487-M491 VanDerWaalsContact O-CG 3.29Å; L487-M491 WeakPolarHBondContact O-CG 3.26Å; L487-M491 PolarHBondContact O-N 3.26Å; L487-L569 HydrophobicContact CD1-CD2 4.49Å; L487-M572 HydrophobicContact CD1-CB 3.87Å; L487-H573 HydrophobicContact CD1-CB 4.29Å; L487-H573 HydrophobicContact CD2-CB 4.12Å; L487-Q576 HydrophobicContact CB-CG 4.42Å; L487-Q576 HydrophobicContact CD2-CG 4.14Å
488	L	85.1	Confident	84.9	Confident	16 Å²	16	40.5 Å²	40.5	8%	0.084	23%	0.234	C	C	.	.	H	α-helix	trans	-72	-34.8	-177.7	-172	64.1	0	0	0	111.7	V388 P390 L479 G485 M491 F492	V388-L488 HydrophobicContact CB-CD2 4.47Å; V388-L488 HydrophobicContact CG1-CD2 3.67Å; P390-L488 HydrophobicContact CG-CD1 4.03Å; L479-L488 HydrophobicContact CB-CD2 4.27Å; L479-L488 HydrophobicContact CD1-CD2 4.38Å; G485-L488 PolarHBondContact O-N 3.41Å; L488-M491 PolarHBondContact O-N 3.25Å; L488-F492 PolarHBondContact O-N 3.34Å
489	S	87.7	Confident	85.1	Confident	18 Å²	18	42.8 Å²	42.8	13%	0.126	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-46.2	170.9	-66.6	0	0	0	0	110.8	R480 D486 M491 F492 D493	R480-S489 PolarHBondContact NH1-OG 3.16Å; R480-S489 PolarHBondContact NH2-OG 3.38Å; D486-S489 PolarHBondContact O-N 3.08Å; S489-M491 VanDerWaalsContact C-N 3.34Å; S489-M491 PolarHBondContact O-N 2.98Å; S489-F492 WeakPolarHBondContact O-CB 3.42Å; S489-F492 PolarHBondContact O-N 3.41Å; S489-D493 WeakPolarHBondContact O-CB 3.41Å; S489-D493 PolarHBondContact O-N 3.26Å
490	S	91.6	Very high	85.5	Confident	40 Å²	40	48 Å²	48	28%	0.28	27%	0.268	S	S	.	.	H	α-helix	trans	-68.1	-33.4	-179.7	-54.6	0	0	0	0	112.4	D486 L487 F494	D486-S490 VanDerWaalsContact O-CB 3.29Å; D486-S490 WeakPolarHBondContact O-CB 3.33Å; D486-S490 PolarHBondContact O-N 3.01Å; D486-S490 PolarHBondContact O-OG 3.26Å; L487-S490 PolarHBondContact O-N 3.15Å; S490-F494 WeakPolarHBondContact O-CB 3.32Å; S490-F494 PolarHBondContact O-N 3.4Å
491	M	90.6	Very high	86	Confident	12 Å²	12	43.7 Å²	43.7	6%	0.059	25%	0.253	C	S	.	.	H	α-helix	trans	-65.3	-44.8	170.3	-74.7	170.7	59.8	0	0	111.7	F448 V452 L487 L488 S489 F494 C495 L569	F448-M491 HydrophobicContact CZ-SD 4.13Å; V452-M491 HydrophobicContact CG2-CE 4.25Å; V452-M491 HydrophobicContact CG2-CG 4.31Å; L487-M491 HydrophobicContact CD1-CG 4.37Å; L487-M491 HydrophobicContact CD1-SD 4.25Å; L487-M491 HydrophobicContact CG-SD 4.04Å; L487-M491 WeakPolarHBondContact O-CB 3.42Å; L487-M491 VanDerWaalsContact O-CG 3.29Å; L487-M491 WeakPolarHBondContact O-CG 3.26Å; L487-M491 PolarHBondContact O-N 3.26Å; L488-M491 PolarHBondContact O-N 3.25Å; S489-M491 VanDerWaalsContact C-N 3.34Å; S489-M491 PolarHBondContact O-N 2.98Å; M491-F494 PolarHBondContact O-N 3.41Å; M491-C495 WeakPolarHBondContact O-CB 3.31Å; M491-C495 PolarHBondContact O-N 2.95Å; M491-C495 PolarHBondContact O-SG 2.98Å; M491-L569 HydrophobicContact CG-CD1 4.38Å; M491-L569 HydrophobicContact CG-CD2 4.28Å
492	F	89.6	Confident	86.6	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.018	24%	0.244	C	C	.	.	H	α-helix	trans	-58.1	-52.3	174.8	-177	-82.1	0	0	0	111	F459 V466 V476 L488 S489 F494 C495 E496	F459-F492 HydrophobicContact CD1-CB 4.37Å; F459-F492 AromaticContact CD1-CD2 3.42Å; F459-F492 HydrophobicContact CD1-CD2 3.42Å; F459-F492 VanDerWaalsContact CD1-CD2 3.42Å; F459-F492 AromaticContact CD1-CE2 3.98Å; F459-F492 HydrophobicContact CD1-CE2 3.98Å; F459-F492 HydrophobicContact CD1-CG 4.26Å; F459-F492 HydrophobicContact CE1-CB 4.08Å; F459-F492 AromaticContact CE1-CD2 3.85Å; F459-F492 HydrophobicContact CE1-CD2 3.85Å; F459-F492 HydrophobicContact CE1-CG 4.43Å; F459-F492 HydrophobicContact CG-CD2 4.49Å; V466-F492 HydrophobicContact CG2-CD2 4.45Å; V476-F492 HydrophobicContact CG2-CD1 4.33Å; V476-F492 HydrophobicContact CG2-CD2 3.15Å; V476-F492 HydrophobicContact CG2-CE1 4.44Å; V476-F492 HydrophobicContact CG2-CE2 3.31Å; V476-F492 HydrophobicContact CG2-CG 3.75Å; V476-F492 HydrophobicContact CG2-CZ 3.99Å; L488-F492 PolarHBondContact O-N 3.34Å; S489-F492 WeakPolarHBondContact O-CB 3.42Å; S489-F492 PolarHBondContact O-N 3.41Å; F492-F494 PolarHBondContact O-N 2.98Å; F492-C495 PolarHBondContact O-N 3.37Å; F492-C495 VanDerWaalsContact O-N 3.11Å; F492-E496 HydrophobicContact CE1-CB 4.22Å; F492-E496 PolarHBondContact O-N 3.15Å
493	D	90.8	Very high	87.5	Confident	71 Å²	71	40.3 Å²	40.3	38%	0.38	24%	0.244	S	C	.	.	H	α-helix	trans	-56	-33.5	177.8	-92.5	40.7	0	0	0	113.2	S489 K497	S489-D493 WeakPolarHBondContact O-CB 3.41Å; S489-D493 PolarHBondContact O-N 3.26Å; D493-K497 WeakPolarHBondContact O-CD 3.33Å; D493-K497 WeakPolarHBondContact O-CE 3.48Å; D493-K497 WeakPolarHBondContact O-CG 3.44Å; D493-K497 PolarHBondContact O-N 3.04Å; D493-K497 PolarHBondContact O-NZ 3.17Å; D493-K497 IonicContact OD2-NZ 3.3Å; D493-K497 PolarHBondContact OD2-NZ 3.42Å
494	F	94	Very high	88.8	Confident	5 Å²	5	40.3 Å²	40.3	2%	0.022	24%	0.237	C	C	.	.	H	α-helix	trans	-73.1	-49.6	174.1	172.6	-91.6	0	0	0	111.5	V452 V453 S490 M491 F492 E496 K497 L498 K562 D565 L566 L569	V452-F494 HydrophobicContact CG1-CD1 3.59Å; V452-F494 HydrophobicContact CG1-CE1 3.83Å; V452-F494 HydrophobicContact CG1-CG 4.46Å; V453-F494 HydrophobicContact CG2-CE1 4.2Å; V453-F494 HydrophobicContact CG2-CZ 4.27Å; S490-F494 WeakPolarHBondContact O-CB 3.32Å; S490-F494 PolarHBondContact O-N 3.4Å; M491-F494 PolarHBondContact O-N 3.41Å; F492-F494 PolarHBondContact O-N 2.98Å; F494-E496 VanDerWaalsContact C-N 3.34Å; F494-E496 PolarHBondContact O-N 3.48Å; F494-K497 CarbonylContact O-C 3.53Å; F494-K497 PolarHBondContact O-N 3.02Å; F494-K497 VanDerWaalsContact O-N 3.13Å; F494-L498 HydrophobicContact CE1-CB 4.4Å; F494-L498 HydrophobicContact CE1-CD2 3.78Å; F494-L498 HydrophobicContact CZ-CD2 4.14Å; F494-L498 WeakPolarHBondContact O-CB 3.22Å; F494-L498 PolarHBondContact O-N 3.43Å; F494-K562 HydrophobicContact CD2-CD 4.45Å; F494-K562 HydrophobicContact CE2-CB 3.89Å; F494-K562 HydrophobicContact CE2-CD 3.96Å; F494-K562 HydrophobicContact CE2-CG 4.34Å; F494-K562 HydrophobicContact CZ-CB 4.26Å; F494-D565 HydrophobicContact CD2-CB 3.7Å; F494-D565 HydrophobicContact CE2-CB 3.97Å; F494-L566 HydrophobicContact CD1-CD2 4.45Å; F494-L566 HydrophobicContact CE1-CD2 3.77Å; F494-L566 HydrophobicContact CE1-CG 4.36Å; F494-L566 HydrophobicContact CE2-CD1 4.38Å; F494-L566 HydrophobicContact CE2-CD2 3.91Å; F494-L566 HydrophobicContact CE2-CG 3.67Å; F494-L566 HydrophobicContact CZ-CD1 3.95Å; F494-L566 HydrophobicContact CZ-CD2 3.47Å; F494-L566 VanDerWaalsContact CZ-CD2 3.47Å; F494-L566 HydrophobicContact CZ-CG 3.54Å; F494-L569 HydrophobicContact CB-CD1 3.78Å; F494-L569 HydrophobicContact CD1-CD1 4.33Å; F494-L569 HydrophobicContact CD2-CD1 4.25Å; F494-L569 HydrophobicContact CG-CD1 3.86Å
495	C	91.8	Very high	89.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.8	-40.7	-179.1	-67.9	0	0	0	0	111.8	A456 F459 M491 F492 K497 L498 M499	A456-C495 HydrophobicContact CB-CB 4.23Å; F459-C495 HydrophobicContact CB-CB 4.09Å; F459-C495 HydrophobicContact CD1-CB 4.5Å; F459-C495 HydrophobicContact CD2-CB 3.57Å; F459-C495 WeakPolarHBondContact CD2-SG 3.2Å; F459-C495 HydrophobicContact CE2-CB 4.11Å; F459-C495 WeakPolarHBondContact CE2-SG 3.4Å; F459-C495 HydrophobicContact CG-CB 3.8Å; M491-C495 WeakPolarHBondContact O-CB 3.31Å; M491-C495 PolarHBondContact O-N 2.95Å; M491-C495 PolarHBondContact O-SG 2.98Å; F492-C495 PolarHBondContact O-N 3.37Å; F492-C495 VanDerWaalsContact O-N 3.11Å; C495-K497 PolarHBondContact O-N 3.35Å; C495-L498 PolarHBondContact O-N 3.24Å; C495-M499 WeakPolarHBondContact O-CB 3.49Å; C495-M499 VanDerWaalsContact O-CG 3.28Å; C495-M499 WeakPolarHBondContact O-CG 3.31Å; C495-M499 PolarHBondContact O-N 3.35Å
496	E	90.7	Very high	90.7	Very high	54 Å²	54	44.7 Å²	44.7	25%	0.252	25%	0.246	S	C	.	.	H	α-helix	trans	-57.9	-48	171.5	175.2	166.1	-132.6	0	0	111.6	V461 F492 F494 L498 N500	V461-E496 HydrophobicContact CG1-CB 4.4Å; V461-E496 HydrophobicContact CG1-CG 3.82Å; V461-E496 HydrophobicContact CG2-CB 4.34Å; F492-E496 HydrophobicContact CE1-CB 4.22Å; F492-E496 PolarHBondContact O-N 3.15Å; F494-E496 VanDerWaalsContact C-N 3.34Å; F494-E496 PolarHBondContact O-N 3.48Å; E496-L498 VanDerWaalsContact C-N 3.27Å; E496-L498 PolarHBondContact O-N 3.43Å; E496-N500 VanDerWaalsContact O-CB 3.25Å; E496-N500 WeakPolarHBondContact O-CB 3.39Å; E496-N500 PolarHBondContact O-N 3Å; E496-N500 PolarHBondContact O-ND2 3.18Å; E496-N500 VanDerWaalsContact O-ND2 3.12Å
497	K	92.8	Very high	91.3	Very high	99 Å²	99	39.3 Å²	39.3	43%	0.43	22%	0.217	S	C	.	.	H	α-helix	trans	-67.3	-23.9	178.3	-68.4	162.7	-158.3	148.7	0	113.5	D493 F494 C495	D493-K497 WeakPolarHBondContact O-CD 3.33Å; D493-K497 WeakPolarHBondContact O-CE 3.48Å; D493-K497 WeakPolarHBondContact O-CG 3.44Å; D493-K497 PolarHBondContact O-N 3.04Å; D493-K497 PolarHBondContact O-NZ 3.17Å; D493-K497 IonicContact OD2-NZ 3.3Å; D493-K497 PolarHBondContact OD2-NZ 3.42Å; F494-K497 CarbonylContact O-C 3.53Å; F494-K497 PolarHBondContact O-N 3.02Å; F494-K497 VanDerWaalsContact O-N 3.13Å; C495-K497 PolarHBondContact O-N 3.35Å
498	L	94	Very high	91.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-84.3	-48	177.1	179	61.6	0	0	0	111.6	V453 A456 F494 C495 E496 N500 L501 L503 M508 F511 L559 K562	V453-L498 HydrophobicContact CG1-CD2 4.17Å; V453-L498 HydrophobicContact CG2-CD2 4.44Å; A456-L498 HydrophobicContact CB-CD2 4.17Å; F494-L498 HydrophobicContact CE1-CB 4.4Å; F494-L498 HydrophobicContact CE1-CD2 3.78Å; F494-L498 HydrophobicContact CZ-CD2 4.14Å; F494-L498 WeakPolarHBondContact O-CB 3.22Å; F494-L498 PolarHBondContact O-N 3.43Å; C495-L498 PolarHBondContact O-N 3.24Å; E496-L498 VanDerWaalsContact C-N 3.27Å; E496-L498 PolarHBondContact O-N 3.43Å; L498-N500 VanDerWaalsContact C-N 3.26Å; L498-N500 PolarHBondContact O-N 3.14Å; L498-L501 HydrophobicContact CD1-CD1 4.35Å; L498-L501 VanDerWaalsContact O-CB 3.3Å; L498-L501 WeakPolarHBondContact O-CB 3.23Å; L498-L501 PolarHBondContact O-N 3.36Å; L498-L503 HydrophobicContact CD1-CD1 3.96Å; L498-M508 HydrophobicContact CD1-CE 4.49Å; L498-M508 HydrophobicContact CD2-CE 4.21Å; L498-M508 HydrophobicContact CD2-SD 4.04Å; L498-M508 HydrophobicContact CG-CE 4.14Å; L498-M508 HydrophobicContact CG-SD 4.48Å; L498-F511 HydrophobicContact CD1-CD1 4.46Å; L498-F511 HydrophobicContact CD1-CE1 4.17Å; L498-L559 HydrophobicContact CD1-CD1 3.81Å; L498-K562 HydrophobicContact CD1-CG 4.38Å
499	M	90.3	Very high	92.2	Very high	82 Å²	82	38.8 Å²	38.8	40%	0.404	21%	0.214	S	C	.	.	H	α-helix	trans	-63.1	-33.3	177.6	-67.2	-60.3	-70	0	0	111.9	A456 V461 C495 L501 G502	A456-M499 HydrophobicContact CB-CG 4.32Å; A456-M499 HydrophobicContact CB-SD 4.06Å; V461-M499 HydrophobicContact CG2-CB 4.25Å; C495-M499 WeakPolarHBondContact O-CB 3.49Å; C495-M499 VanDerWaalsContact O-CG 3.28Å; C495-M499 WeakPolarHBondContact O-CG 3.31Å; C495-M499 PolarHBondContact O-N 3.35Å; M499-L501 PolarHBondContact O-N 2.98Å; M499-L501 VanDerWaalsContact O-N 3.08Å; M499-G502 PolarHBondContact O-N 3.05Å
500	N	91.3	Very high	92.7	Very high	114 Å²	114	37.9 Å²	37.9	61%	0.61	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	3	172.9	-70.7	-20.8	0	0	0	114.4	E496 L498	E496-N500 VanDerWaalsContact O-CB 3.25Å; E496-N500 WeakPolarHBondContact O-CB 3.39Å; E496-N500 PolarHBondContact O-N 3Å; E496-N500 PolarHBondContact O-ND2 3.18Å; E496-N500 VanDerWaalsContact O-ND2 3.12Å; L498-N500 VanDerWaalsContact C-N 3.26Å; L498-N500 PolarHBondContact O-N 3.14Å
501	L	92.3	Very high	93	Very high	19 Å²	19	36 Å²	36	10%	0.099	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-8.2	167	-58.9	-177.6	0	0	0	113.5	L498 M499 L503 K558 L559	L498-L501 HydrophobicContact CD1-CD1 4.35Å; L498-L501 VanDerWaalsContact O-CB 3.3Å; L498-L501 WeakPolarHBondContact O-CB 3.23Å; L498-L501 PolarHBondContact O-N 3.36Å; M499-L501 PolarHBondContact O-N 2.98Å; M499-L501 VanDerWaalsContact O-N 3.08Å; L501-L503 VanDerWaalsContact C-N 3.32Å; L501-L503 HydrophobicContact CB-CD2 4.04Å; L501-L503 HydrophobicContact CB-CG 4Å; L501-L503 PolarHBondContact O-N 2.64Å; L501-K558 HydrophobicContact CD1-CB 4.33Å; L501-K558 HydrophobicContact CD2-CB 3.72Å; L501-K558 HydrophobicContact CD2-CD 3.57Å; L501-K558 HydrophobicContact CD2-CG 4.26Å; L501-L559 HydrophobicContact CD1-CB 4.22Å; L501-L559 HydrophobicContact CD1-CD1 4.09Å
502	G	91.2	Very high	93.2	Very high	55 Å²	55	35.4 Å²	35.4	57%	0.567	19%	0.192	S	C	*	.			trans	65.8	28.6	174.4	0	0	0	0	0	115.2	M499	M499-G502 PolarHBondContact O-N 3.05Å
503	L	92.6	Very high	93.6	Very high	27 Å²	27	35.2 Å²	35.2	14%	0.141	19%	0.191	C	C	.	.			trans	-67.2	146.5	-174.7	-55	-179	0	0	0	112.9	L498 L501 E507 M508 I545 I555 L559	L498-L503 HydrophobicContact CD1-CD1 3.96Å; L501-L503 VanDerWaalsContact C-N 3.32Å; L501-L503 HydrophobicContact CB-CD2 4.04Å; L501-L503 HydrophobicContact CB-CG 4Å; L501-L503 PolarHBondContact O-N 2.64Å; L503-E507 VanDerWaalsContact CA-OE2 3.26Å; L503-E507 WeakPolarHBondContact CA-OE2 3.5Å; L503-E507 HydrophobicContact CB-CB 4.09Å; L503-M508 HydrophobicContact CB-CE 4.32Å; L503-M508 HydrophobicContact CD1-CE 4.1Å; L503-I545 HydrophobicContact CD2-CD1 3.77Å; L503-I555 HydrophobicContact CD2-CG2 3.8Å; L503-L559 HydrophobicContact CD1-CD1 3.82Å; L503-L559 HydrophobicContact CD1-CD2 3.97Å; L503-L559 HydrophobicContact CD2-CD2 4.29Å
504	S	93.1	Very high	93.9	Very high	41 Å²	41	31.9 Å²	31.9	29%	0.287	17%	0.173	S	C	.	.			trans	-73.9	168.4	169	79.6	0	0	0	0	112.5	E506 E507 M508	S504-E506 VanDerWaalsContact C-N 3.32Å; S504-E506 PolarHBondContact O-N 2.9Å; S504-E506 PolarHBondContact OG-N 3.08Å; S504-E507 PolarHBondContact N-OE2 3.25Å; S504-E507 PolarHBondContact O-N 3Å; S504-E507 WeakPolarHBondContact OG-CG 3.38Å; S504-E507 PolarHBondContact OG-N 3.24Å; S504-M508 WeakPolarHBondContact O-CB 3.11Å; S504-M508 PolarHBondContact O-N 3.18Å
505	E	90.6	Very high	94	Very high	76 Å²	76	31.6 Å²	31.6	36%	0.355	17%	0.172	S	C	.	.	H	α-helix	trans	-59.4	-44.1	173.1	-165.9	-159.4	173.5	0	0	111.3	H269 Q270 E507 M508 S509	H269-E505 IonicContact CD2-OE1 2.71Å; Q270-E505 WeakPolarHBondContact CG-OE1 3.35Å; Q270-E505 PolarHBondContact NE2-OE2 3.07Å; E505-E507 VanDerWaalsContact C-N 3.35Å; E505-E507 PolarHBondContact O-N 2.86Å; E505-M508 PolarHBondContact O-N 3.09Å; E505-S509 WeakPolarHBondContact O-CB 3.3Å; E505-S509 PolarHBondContact O-N 3.49Å
506	E	95.2	Very high	94.3	Very high	69 Å²	69	31.6 Å²	31.6	32%	0.322	17%	0.172	S	C	.	.	H	α-helix	trans	-58.3	-46.8	177.6	-51.5	-171.8	121.6	0	0	111.2	T266 S504 M508 S509 L510 L544	T266-E506 HydrophobicContact CG2-CG 3.97Å; S504-E506 VanDerWaalsContact C-N 3.32Å; S504-E506 PolarHBondContact O-N 2.9Å; S504-E506 PolarHBondContact OG-N 3.08Å; E506-M508 PolarHBondContact O-N 3.42Å; E506-S509 PolarHBondContact O-N 2.86Å; E506-S509 PolarHBondContact O-OG 3.35Å; E506-L510 WeakPolarHBondContact O-CB 3.37Å; E506-L510 PolarHBondContact O-N 2.69Å; E506-L544 HydrophobicContact CB-CD2 3.79Å
507	E	96.2	Very high	94.5	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.2	-40.1	178.3	-71.2	167.6	174.7	0	0	112.1	L503 S504 E505 F511 L544 I545 N548 H549	L503-E507 VanDerWaalsContact CA-OE2 3.26Å; L503-E507 WeakPolarHBondContact CA-OE2 3.5Å; L503-E507 HydrophobicContact CB-CB 4.09Å; S504-E507 PolarHBondContact N-OE2 3.25Å; S504-E507 PolarHBondContact O-N 3Å; S504-E507 WeakPolarHBondContact OG-CG 3.38Å; S504-E507 PolarHBondContact OG-N 3.24Å; E505-E507 VanDerWaalsContact C-N 3.35Å; E505-E507 PolarHBondContact O-N 2.86Å; E507-F511 VanDerWaalsContact O-CB 3.26Å; E507-F511 WeakPolarHBondContact O-CB 3.49Å; E507-F511 PolarHBondContact O-N 3.37Å; E507-L544 HydrophobicContact CB-CD2 4.43Å; E507-L544 HydrophobicContact CG-CD2 3.69Å; E507-L544 HydrophobicContact CG-CG 3.8Å; E507-I545 HydrophobicContact CB-CD1 4.03Å; E507-I545 VanDerWaalsContact CD-CD1 3.45Å; E507-I545 HydrophobicContact CG-CD1 3.65Å; E507-I545 HydrophobicContact CG-CG1 4.22Å; E507-N548 WeakPolarHBondContact OE1-CB 3.4Å; E507-N548 PolarHBondContact OE1-ND2 2.87Å; E507-H549 VanDerWaalsContact CD-NE2 3.32Å; E507-H549 IonicContact OE1-CD2 2.95Å; E507-H549 PolarHBondContact OE1-CD2 3.28Å; E507-H549 IonicContact OE1-NE2 3.77Å; E507-H549 PolarHBondContact OE1-NE2 3.22Å; E507-H549 IonicContact OE2-CD2 2.96Å; E507-H549 IonicContact OE2-CE1 2.7Å; E507-H549 IonicContact OE2-NE2 3.89Å; E507-H549 PolarHBondContact OE2-NE2 3.49Å
508	M	94.8	Very high	94.5	Very high	28 Å²	28	24.4 Å²	24.4	14%	0.138	14%	0.14	C	C	.	.	H	α-helix	trans	-65.7	-43.3	175	-166	65.4	71.7	0	0	111.4	V453 L498 L503 S504 E505 E506 L510 F511 M512	V453-M508 HydrophobicContact CG1-CG 4.34Å; V453-M508 HydrophobicContact CG1-SD 3.56Å; V453-M508 VanDerWaalsContact CG1-SD 3.56Å; L498-M508 HydrophobicContact CD1-CE 4.49Å; L498-M508 HydrophobicContact CD2-CE 4.21Å; L498-M508 HydrophobicContact CD2-SD 4.04Å; L498-M508 HydrophobicContact CG-CE 4.14Å; L498-M508 HydrophobicContact CG-SD 4.48Å; L503-M508 HydrophobicContact CB-CE 4.32Å; L503-M508 HydrophobicContact CD1-CE 4.1Å; S504-M508 WeakPolarHBondContact O-CB 3.11Å; S504-M508 PolarHBondContact O-N 3.18Å; E505-M508 PolarHBondContact O-N 3.09Å; E506-M508 PolarHBondContact O-N 3.42Å; M508-L510 VanDerWaalsContact C-N 3.31Å; M508-L510 PolarHBondContact O-N 3.41Å; M508-F511 PolarHBondContact O-N 2.82Å; M508-M512 WeakPolarHBondContact O-CG 3.22Å; M508-M512 PolarHBondContact O-N 2.83Å
509	S	95.7	Very high	94	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.8	-42.4	178.1	81.2	0	0	0	0	112	V265 H269 E505 E506 M512 A513	V265-S509 WeakPolarHBondContact CG1-O 3.45Å; H269-S509 VanDerWaalsContact CB-CB 3.47Å; E505-S509 WeakPolarHBondContact O-CB 3.3Å; E505-S509 PolarHBondContact O-N 3.49Å; E506-S509 PolarHBondContact O-N 2.86Å; E506-S509 PolarHBondContact O-OG 3.35Å; S509-M512 WeakPolarHBondContact O-CB 3.43Å; S509-M512 PolarHBondContact O-N 3.37Å; S509-A513 PolarHBondContact O-N 3.41Å; S509-A513 VanDerWaalsContact O-N 3.12Å
510	L	97.3	Very high	93.7	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-80.9	-30.5	-176.3	-169.5	53.8	0	0	0	111.6	I262 V265 E506 M508 A513 V514 L537 A540 L541 L544	I262-L510 HydrophobicContact CG1-CD2 3.78Å; V265-L510 HydrophobicContact CB-CD1 4.13Å; V265-L510 HydrophobicContact CG1-CB 4.42Å; V265-L510 HydrophobicContact CG1-CD1 4.05Å; V265-L510 HydrophobicContact CG2-CD1 4.1Å; E506-L510 WeakPolarHBondContact O-CB 3.37Å; E506-L510 PolarHBondContact O-N 2.69Å; M508-L510 VanDerWaalsContact C-N 3.31Å; M508-L510 PolarHBondContact O-N 3.41Å; L510-A513 HydrophobicContact CD1-CB 4.49Å; L510-A513 PolarHBondContact O-N 3.42Å; L510-V514 WeakPolarHBondContact O-CG2 3.42Å; L510-V514 PolarHBondContact O-N 3.43Å; L510-V514 VanDerWaalsContact O-N 3.08Å; L510-L537 HydrophobicContact CD1-CD2 3.91Å; L510-A540 HydrophobicContact CD2-CB 3.89Å; L510-L541 HydrophobicContact CB-CD1 4.19Å; L510-L541 HydrophobicContact CD2-CB 4.16Å; L510-L541 HydrophobicContact CG-CB 4.05Å; L510-L541 HydrophobicContact CG-CD1 4.28Å; L510-L544 HydrophobicContact CD2-CD2 4.23Å
511	F	97.4	Very high	93.4	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63	-42.3	165.1	-179.6	-119.1	0	0	0	112.3	V453 L498 E507 M508 A513 V514 V515 L541 L559 K562 L563 L566	V453-F511 HydrophobicContact CG1-CD1 3.96Å; V453-F511 HydrophobicContact CG1-CE1 4.23Å; V453-F511 HydrophobicContact CG2-CD1 4.33Å; V453-F511 HydrophobicContact CG2-CE1 3.81Å; L498-F511 HydrophobicContact CD1-CD1 4.46Å; L498-F511 HydrophobicContact CD1-CE1 4.17Å; E507-F511 VanDerWaalsContact O-CB 3.26Å; E507-F511 WeakPolarHBondContact O-CB 3.49Å; E507-F511 PolarHBondContact O-N 3.37Å; M508-F511 PolarHBondContact O-N 2.82Å; F511-A513 VanDerWaalsContact C-N 3.29Å; F511-A513 PolarHBondContact O-N 3.48Å; F511-V514 PolarHBondContact O-N 3.3Å; F511-V514 VanDerWaalsContact O-N 3.15Å; F511-V515 HydrophobicContact CD1-CG2 4.31Å; F511-V515 HydrophobicContact CD2-CG2 4.25Å; F511-V515 HydrophobicContact CE1-CG2 3.91Å; F511-V515 HydrophobicContact CE2-CG2 3.85Å; F511-V515 HydrophobicContact CG-CG2 4.46Å; F511-V515 HydrophobicContact CZ-CG2 3.65Å; F511-V515 WeakPolarHBondContact O-CG2 3.08Å; F511-V515 PolarHBondContact O-N 3.47Å; F511-L541 HydrophobicContact CB-CD2 4.36Å; F511-L541 HydrophobicContact CD2-CD2 4.35Å; F511-L559 HydrophobicContact CB-CD2 4.27Å; F511-L559 HydrophobicContact CD1-CD1 3.81Å; F511-L559 HydrophobicContact CD2-CD1 3.58Å; F511-L559 HydrophobicContact CD2-CD2 4.05Å; F511-L559 HydrophobicContact CD2-CG 3.62Å; F511-L559 HydrophobicContact CE1-CD1 3.83Å; F511-L559 HydrophobicContact CE2-CD1 3.61Å; F511-L559 HydrophobicContact CE2-CG 3.84Å; F511-L559 HydrophobicContact CG-CD1 3.7Å; F511-L559 HydrophobicContact CG-CD2 4.21Å; F511-L559 HydrophobicContact CG-CG 4.08Å; F511-L559 HydrophobicContact CZ-CD1 3.75Å; F511-L559 HydrophobicContact CZ-CG 4.47Å; F511-K562 HydrophobicContact CZ-CB 3.84Å; F511-L563 HydrophobicContact CE2-CD2 3.86Å; F511-L563 HydrophobicContact CE2-CG 4.49Å; F511-L563 HydrophobicContact CZ-CD2 4.22Å; F511-L566 HydrophobicContact CE1-CD1 4.45Å; F511-L566 HydrophobicContact CZ-CD1 4.15Å
512	M	96.6	Very high	93	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.3	-39	173.7	-74.3	170.5	65.8	0	0	112.3	H269 F273 F424 V450 V453 R454 M508 S509 V515 L516	H269-M512 PolarHBondContact CE1-SD 2.87Å; F273-M512 HydrophobicContact CD2-CE 4.03Å; F273-M512 HydrophobicContact CE2-CE 3.48Å; F273-M512 VanDerWaalsContact CE2-CE 3.48Å; F273-M512 HydrophobicContact CZ-CE 3.87Å; F424-M512 HydrophobicContact CE1-CB 4.12Å; F424-M512 HydrophobicContact CZ-CB 4.33Å; V450-M512 HydrophobicContact CG1-CB 4.43Å; V450-M512 HydrophobicContact CG1-CE 3.57Å; V453-M512 HydrophobicContact CB-CG 4.03Å; V453-M512 HydrophobicContact CG1-CG 3.4Å; V453-M512 VanDerWaalsContact CG1-CG 3.4Å; V453-M512 HydrophobicContact CG1-SD 4.19Å; R454-M512 HydrophobicContact CB-CE 3.95Å; R454-M512 HydrophobicContact CG-CE 4.49Å; M508-M512 WeakPolarHBondContact O-CG 3.22Å; M508-M512 PolarHBondContact O-N 2.83Å; S509-M512 WeakPolarHBondContact O-CB 3.43Å; S509-M512 PolarHBondContact O-N 3.37Å; M512-V515 PolarHBondContact O-N 3.04Å; M512-L516 PolarHBondContact O-N 2.67Å
513	A	97.6	Very high	92.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.6	-42	173.8	0	0	0	0	0	112.5	V265 F424 I428 S509 L510 F511 L516 V517 L537	V265-A513 HydrophobicContact CG1-CB 3.86Å; F424-A513 HydrophobicContact CZ-CB 4.31Å; I428-A513 HydrophobicContact CD1-CB 3.81Å; I428-A513 HydrophobicContact CG1-CB 4.27Å; S509-A513 PolarHBondContact O-N 3.41Å; S509-A513 VanDerWaalsContact O-N 3.12Å; L510-A513 HydrophobicContact CD1-CB 4.49Å; L510-A513 PolarHBondContact O-N 3.42Å; F511-A513 VanDerWaalsContact C-N 3.29Å; F511-A513 PolarHBondContact O-N 3.48Å; A513-L516 PolarHBondContact O-N 2.75Å; A513-V517 PolarHBondContact O-N 3.33Å; A513-L537 HydrophobicContact CB-CD1 4.18Å; A513-L537 HydrophobicContact CB-CD2 4.16Å
514	V	97.1	Very high	92.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-35.6	175.7	171.6	0	0	0	0	112.7	L510 F511 V517 S518 L537 I538 L541	L510-V514 WeakPolarHBondContact O-CG2 3.42Å; L510-V514 PolarHBondContact O-N 3.43Å; L510-V514 VanDerWaalsContact O-N 3.08Å; F511-V514 PolarHBondContact O-N 3.3Å; F511-V514 VanDerWaalsContact O-N 3.15Å; V514-V517 CarbonylContact O-C 3.58Å; V514-S518 PolarHBondContact O-OG 2.84Å; V514-L537 HydrophobicContact CG2-CB 3.68Å; V514-I538 HydrophobicContact CB-CG1 4.43Å; V514-I538 HydrophobicContact CG1-CD1 4.07Å; V514-I538 HydrophobicContact CG1-CG1 3.65Å; V514-I538 HydrophobicContact CG2-CG1 3.82Å; V514-L541 HydrophobicContact CG2-CD2 4.14Å
515	V	96.4	Very high	92.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-42.5	174.6	166.8	0	0	0	0	111.2	E449 V450 V453 F511 M512 S518 R521 L563 L566	E449-V515 HydrophobicContact CB-CG1 3.56Å; V450-V515 HydrophobicContact CG2-CG1 4.1Å; V453-V515 HydrophobicContact CG2-CG2 4.47Å; F511-V515 HydrophobicContact CD1-CG2 4.31Å; F511-V515 HydrophobicContact CD2-CG2 4.25Å; F511-V515 HydrophobicContact CE1-CG2 3.91Å; F511-V515 HydrophobicContact CE2-CG2 3.85Å; F511-V515 HydrophobicContact CG-CG2 4.46Å; F511-V515 HydrophobicContact CZ-CG2 3.65Å; F511-V515 WeakPolarHBondContact O-CG2 3.08Å; F511-V515 PolarHBondContact O-N 3.47Å; M512-V515 PolarHBondContact O-N 3.04Å; V515-S518 PolarHBondContact O-OG 3.46Å; V515-R521 PolarHBondContact O-NH2 2.73Å; V515-L563 HydrophobicContact CG2-CD2 3.65Å; V515-L566 HydrophobicContact CB-CD1 4.46Å; V515-L566 HydrophobicContact CG1-CD1 3.95Å; V515-L566 HydrophobicContact CG2-CD1 3.58Å
516	L	96.8	Very high	93.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-70.1	-55.3	177.9	-177.1	57.6	0	0	0	111.9	A425 I428 L443 V450 M512 A513 S518	A425-L516 HydrophobicContact CB-CD2 3.55Å; I428-L516 HydrophobicContact CD1-CD2 4.06Å; L443-L516 HydrophobicContact CD2-CD1 4.25Å; V450-L516 HydrophobicContact CG2-CB 3.75Å; V450-L516 HydrophobicContact CG2-CD1 4.22Å; V450-L516 HydrophobicContact CG2-CG 4.44Å; M512-L516 PolarHBondContact O-N 2.67Å; A513-L516 PolarHBondContact O-N 2.75Å; L516-S518 VanDerWaalsContact C-N 3.26Å; L516-S518 PolarHBondContact O-N 3.38Å
517	V	96.4	Very high	93.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-82.7	75.4	179.2	-169.5	0	0	0	0	109.4	I428 F431 L442 A513 V514 V530 L533 Q534 L537	I428-V517 HydrophobicContact CD1-CG2 4.43Å; F431-V517 HydrophobicContact CD2-CG2 4Å; L442-V517 HydrophobicContact CD1-CG1 4.48Å; A513-V517 PolarHBondContact O-N 3.33Å; V514-V517 CarbonylContact O-C 3.58Å; V517-V530 HydrophobicContact CG1-CG1 3.99Å; V517-L533 HydrophobicContact CG1-CB 4.21Å; V517-L533 HydrophobicContact CG1-CD2 3.74Å; V517-L533 HydrophobicContact CG1-CG 3.87Å; V517-L533 HydrophobicContact CG2-CD2 4.17Å; V517-Q534 HydrophobicContact CG1-CB 4.3Å; V517-Q534 WeakPolarHBondContact O-CB 3.35Å; V517-Q534 WeakPolarHBondContact O-CG 3.36Å; V517-Q534 PolarHBondContact O-NE2 3.49Å; V517-L537 HydrophobicContact CB-CD1 3.85Å; V517-L537 HydrophobicContact CG1-CD1 4.4Å; V517-L537 HydrophobicContact CG2-CD1 3.81Å
518	S	90.8	Very high	93.1	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.007	20%	0.198	C	C	.	.			trans	-107.6	125.6	172.2	-71.7	0	0	0	0	110.6	L442 V514 V515 L516 D520 R521 R567	L442-S518 WeakPolarHBondContact CD2-O 3.32Å; V514-S518 PolarHBondContact O-OG 2.84Å; V515-S518 PolarHBondContact O-OG 3.46Å; L516-S518 VanDerWaalsContact C-N 3.26Å; L516-S518 PolarHBondContact O-N 3.38Å; S518-D520 WeakPolarHBondContact CB-OD1 3.17Å; S518-R521 WeakPolarHBondContact O-CG 3.43Å; S518-R567 PolarHBondContact OG-NH2 3.39Å; S518-R567 VanDerWaalsContact OG-NH2 3.09Å
519	A	84.1	Confident	93.2	Very high	6 Å²	6	35.4 Å²	35.4	5%	0.05	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-16.4	-178.3	0	0	0	0	0	114.6	R521 V527 V530 E531	A519-R521 PolarHBondContact O-N 3.47Å; A519-V527 HydrophobicContact CB-CG1 4.31Å; A519-V530 HydrophobicContact CB-CB 4.02Å; A519-V530 HydrophobicContact CB-CG1 3.77Å; A519-E531 HydrophobicContact CB-CB 4.29Å; A519-E531 HydrophobicContact CB-CG 3.4Å; A519-E531 VanDerWaalsContact CB-CG 3.4Å
520	D	85.3	Confident	93.3	Very high	110 Å²	110	35.4 Å²	35.4	59%	0.588	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	11.1	-178.9	73.7	-43.1	0	0	0	114.1	S518 R567	S518-D520 WeakPolarHBondContact CB-OD1 3.17Å; D520-R567 VanDerWaalsContact CG-NH1 3.29Å; D520-R567 IonicContact OD1-CZ 3.84Å; D520-R567 IonicContact OD1-NH1 2.69Å; D520-R567 PolarHBondContact OD1-NH1 2.84Å; D520-R567 IonicContact OD1-NH2 2.67Å; D520-R567 PolarHBondContact OD1-NH2 3.35Å; D520-R567 IonicContact OD2-CZ 2.69Å; D520-R567 IonicContact OD2-NH1 2.68Å; D520-R567 PolarHBondContact OD2-NH1 2.98Å; D520-R567 IonicContact OD2-NH2 3.46Å
521	R	83.9	Confident	93.2	Very high	21 Å²	21	40 Å²	40	8%	0.079	23%	0.231	C	C	.	.	S	Bend	trans	-74.3	146.7	176.6	-53.9	-64.9	-168.7	177.4	-12.3	110.8	L442 A445 E449 V515 S518 A519 I524 R567	L442-R521 HydrophobicContact CD2-CG 4.31Å; A445-R521 HydrophobicContact CB-CB 4.31Å; A445-R521 HydrophobicContact CB-CG 4.1Å; A445-R521 PolarHBondContact O-NH1 3.34Å; A445-R521 VanDerWaalsContact O-NH1 3.14Å; E449-R521 VanDerWaalsContact CD-NH1 3.31Å; E449-R521 IonicContact OE1-CZ 2.64Å; E449-R521 IonicContact OE1-NH1 2.72Å; E449-R521 PolarHBondContact OE1-NH1 3.3Å; E449-R521 IonicContact OE1-NH2 3.36Å; E449-R521 IonicContact OE2-CZ 2.67Å; E449-R521 IonicContact OE2-NH1 3.05Å; E449-R521 PolarHBondContact OE2-NH1 3.33Å; E449-R521 IonicContact OE2-NH2 3.94Å; E449-R521 PolarHBondContact OE2-NH2 2.84Å; V515-R521 PolarHBondContact O-NH2 2.73Å; S518-R521 WeakPolarHBondContact O-CG 3.43Å; A519-R521 PolarHBondContact O-N 3.47Å; R521-I524 HydrophobicContact CB-CD1 4.42Å; R521-I524 HydrophobicContact CB-CG1 4.12Å; R521-R567 VanDerWaalsContact NH1-NE 3.15Å
522	S	84.2	Confident	93.2	Very high	115 Å²	115	42.6 Å²	42.6	80%	0.804	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	132.1	172.7	56.6	0	0	0	0	111.3
523	G	87.1	Confident	93.2	Very high	44 Å²	44	43.5 Å²	43.5	45%	0.454	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	27.8	179	0	0	0	0	0	114.3	H437 S441	H437-G523 PolarHBondContact CD2-O 2.61Å; H437-G523 PolarHBondContact NE2-O 3.43Å; S441-G523 VanDerWaalsContact CB-O 3.23Å; S441-G523 WeakPolarHBondContact CB-O 3.47Å; S441-G523 PolarHBondContact OG-O 2.99Å
524	I	94.4	Very high	93.2	Very high	21 Å²	21	44.7 Å²	44.7	11%	0.108	26%	0.263	C	S	.	.			trans	-88.5	128.7	162.7	-58.4	-59.2	0	0	0	107.9	D438 L442 R521 V527 V530	D438-I524 HydrophobicContact CB-CD1 4.48Å; D438-I524 VanDerWaalsContact OD1-CA 3.32Å; D438-I524 WeakPolarHBondContact OD1-CA 3.35Å; D438-I524 WeakPolarHBondContact OD1-CG2 3.45Å; L442-I524 HydrophobicContact CD2-CD1 3.93Å; L442-I524 HydrophobicContact CG-CD1 3.89Å; R521-I524 HydrophobicContact CB-CD1 4.42Å; R521-I524 HydrophobicContact CB-CG1 4.12Å; I524-V527 HydrophobicContact CB-CG2 4.21Å; I524-V527 HydrophobicContact CG2-CB 4.43Å; I524-V527 HydrophobicContact CG2-CG2 3.96Å; I524-V530 HydrophobicContact CG2-CB 4.38Å; I524-V530 HydrophobicContact CG2-CG2 3.72Å
525	E	93.6	Very high	93.2	Very high	132 Å²	132	50.5 Å²	50.5	62%	0.617	29%	0.29	S	S	*	.	S	Bend	trans	-81.1	-48.4	177.4	-67.1	-173.8	160.8	0	0	110.8	H437 D438	H437-E525 HydrophobicContact CB-CG 4.23Å; H437-E525 IonicContact CE1-OE1 2.87Å; H437-E525 PolarHBondContact CE1-OE1 3.21Å; H437-E525 IonicContact CG-OE1 3.5Å; H437-E525 IonicContact ND1-OE1 3.62Å; H437-E525 PolarHBondContact ND1-OE1 2.92Å; H437-E525 IonicContact ND1-OE2 3.5Å; D438-E525 PolarHBondContact OD1-N 2.91Å
526	N	94.1	Very high	93.2	Very high	67 Å²	67	52.9 Å²	52.9	36%	0.358	31%	0.305	S	S	.	.			trans	-112.8	77.2	179.5	-175.4	2.4	0	0	0	112.1	N528 S529 V530	N526-N528 VanDerWaalsContact C-N 3.26Å; N526-N528 PolarHBondContact O-N 3.49Å; N526-S529 WeakPolarHBondContact ND2-CB 3.14Å; N526-S529 PolarHBondContact ND2-OG 2.83Å; N526-S529 PolarHBondContact O-N 2.93Å; N526-S529 PolarHBondContact OD1-N 3.25Å; N526-V530 PolarHBondContact O-N 3.29Å
527	V	95.6	Very high	93.2	Very high	53 Å²	53	53 Å²	53	32%	0.321	31%	0.305	S	S	.	.	H	α-helix	trans	-53.7	-41.9	-179.9	-177.7	0	0	0	0	111.8	A519 I524 S529 V530 E531	A519-V527 HydrophobicContact CB-CG1 4.31Å; I524-V527 HydrophobicContact CB-CG2 4.21Å; I524-V527 HydrophobicContact CG2-CB 4.43Å; I524-V527 HydrophobicContact CG2-CG2 3.96Å; V527-S529 VanDerWaalsContact C-N 3.34Å; V527-S529 PolarHBondContact O-N 3.2Å; V527-V530 PolarHBondContact O-N 3.09Å; V527-V530 VanDerWaalsContact O-N 3.14Å; V527-E531 HydrophobicContact CG1-CG 4.1Å; V527-E531 WeakPolarHBondContact O-CB 3.43Å; V527-E531 PolarHBondContact O-N 3.14Å
528	N	95.8	Very high	93.2	Very high	120 Å²	120	55 Å²	55	64%	0.642	32%	0.316	S	S	*	.	H	α-helix	trans	-60.2	-39.8	-177	-57.4	-12.8	0	0	0	112.8	N526 A532	N526-N528 VanDerWaalsContact C-N 3.26Å; N526-N528 PolarHBondContact O-N 3.49Å; N528-A532 WeakPolarHBondContact O-CB 3.31Å; N528-A532 PolarHBondContact O-N 3.24Å
529	S	96.8	Very high	93.5	Very high	54 Å²	54	60.1 Å²	60.1	38%	0.378	34%	0.335	S	S	.	.	H	α-helix	trans	-73.3	-32.7	178.3	-72	0	0	0	0	112.3	N526 V527 L533	N526-S529 WeakPolarHBondContact ND2-CB 3.14Å; N526-S529 PolarHBondContact ND2-OG 2.83Å; N526-S529 PolarHBondContact O-N 2.93Å; N526-S529 PolarHBondContact OD1-N 3.25Å; V527-S529 VanDerWaalsContact C-N 3.34Å; V527-S529 PolarHBondContact O-N 3.2Å; S529-L533 PolarHBondContact O-N 2.8Å
530	V	97.1	Very high	94.1	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-71.3	-39.5	172.8	-175.1	0	0	0	0	111	L434 D438 L442 V517 A519 I524 N526 V527 L533 Q534	L434-V530 HydrophobicContact CD1-CG2 4.22Å; L434-V530 HydrophobicContact CD2-CG2 4.09Å; D438-V530 HydrophobicContact CB-CG2 4.35Å; L442-V530 HydrophobicContact CD1-CG1 4.1Å; L442-V530 HydrophobicContact CD1-CG2 4.39Å; L442-V530 HydrophobicContact CD2-CG1 3.99Å; V517-V530 HydrophobicContact CG1-CG1 3.99Å; A519-V530 HydrophobicContact CB-CB 4.02Å; A519-V530 HydrophobicContact CB-CG1 3.77Å; I524-V530 HydrophobicContact CG2-CB 4.38Å; I524-V530 HydrophobicContact CG2-CG2 3.72Å; N526-V530 PolarHBondContact O-N 3.29Å; V527-V530 PolarHBondContact O-N 3.09Å; V527-V530 VanDerWaalsContact O-N 3.14Å; V530-L533 PolarHBondContact O-N 3.36Å; V530-Q534 VanDerWaalsContact O-CB 3.28Å; V530-Q534 WeakPolarHBondContact O-CB 3.33Å; V530-Q534 PolarHBondContact O-N 2.96Å
531	E	96.3	Very high	94.6	Very high	96 Å²	96	54.7 Å²	54.7	45%	0.449	31%	0.305	S	S	.	.	H	α-helix	trans	-59.7	-47.4	172.9	-80.2	178.8	162.5	0	0	111.1	A519 V527 L533 Q534 E535	A519-E531 HydrophobicContact CB-CB 4.29Å; A519-E531 HydrophobicContact CB-CG 3.4Å; A519-E531 VanDerWaalsContact CB-CG 3.4Å; V527-E531 HydrophobicContact CG1-CG 4.1Å; V527-E531 WeakPolarHBondContact O-CB 3.43Å; V527-E531 PolarHBondContact O-N 3.14Å; E531-L533 VanDerWaalsContact C-N 3.34Å; E531-L533 PolarHBondContact O-N 3.45Å; E531-Q534 PolarHBondContact O-N 2.91Å; E531-E535 WeakPolarHBondContact O-CB 3.4Å; E531-E535 WeakPolarHBondContact O-CG 3.41Å; E531-E535 PolarHBondContact O-N 3.11Å
532	A	97.1	Very high	95.2	Very high	55 Å²	55	61.1 Å²	61.1	46%	0.455	33%	0.329	S	S	.	.	H	α-helix	trans	-62.4	-37.3	178.6	0	0	0	0	0	113.6	N528 T536	N528-A532 WeakPolarHBondContact O-CB 3.31Å; N528-A532 PolarHBondContact O-N 3.24Å; A532-T536 PolarHBondContact O-N 3.1Å; A532-T536 PolarHBondContact O-OG1 3.07Å
533	L	97.6	Very high	95.7	Very high	18 Å²	18	57.5 Å²	57.5	9%	0.094	30%	0.304	C	S	.	.	H	α-helix	trans	-69.8	-46.1	173.3	180	59.3	0	0	0	111.3	P429 F431 L434 V517 S529 V530 E531 E535 T536 L537	P429-L533 WeakPolarHBondContact O-CD1 3.17Å; F431-L533 HydrophobicContact CB-CD2 4.4Å; L434-L533 HydrophobicContact CD1-CD2 3.95Å; L434-L533 HydrophobicContact CG-CD2 4.34Å; V517-L533 HydrophobicContact CG1-CB 4.21Å; V517-L533 HydrophobicContact CG1-CD2 3.74Å; V517-L533 HydrophobicContact CG1-CG 3.87Å; V517-L533 HydrophobicContact CG2-CD2 4.17Å; S529-L533 PolarHBondContact O-N 2.8Å; V530-L533 PolarHBondContact O-N 3.36Å; E531-L533 VanDerWaalsContact C-N 3.34Å; E531-L533 PolarHBondContact O-N 3.45Å; L533-E535 PolarHBondContact O-N 3.17Å; L533-T536 WeakPolarHBondContact O-CB 3.49Å; L533-T536 PolarHBondContact O-N 2.86Å; L533-T536 VanDerWaalsContact O-N 3.1Å; L533-L537 HydrophobicContact CD1-CD1 4.46Å; L533-L537 HydrophobicContact CG-CD1 4.27Å; L533-L537 PolarHBondContact O-N 3.34Å
534	Q	97.3	Very high	96.1	Very high	26 Å²	26	55.4 Å²	55.4	12%	0.121	28%	0.283	C	S	.	.	H	α-helix	trans	-60.5	-43.4	178.1	-176.2	170.8	23.3	0	0	111.6	V517 V530 E531 T536 L537 I538	V517-Q534 HydrophobicContact CG1-CB 4.3Å; V517-Q534 WeakPolarHBondContact O-CB 3.35Å; V517-Q534 WeakPolarHBondContact O-CG 3.36Å; V517-Q534 PolarHBondContact O-NE2 3.49Å; V530-Q534 VanDerWaalsContact O-CB 3.28Å; V530-Q534 WeakPolarHBondContact O-CB 3.33Å; V530-Q534 PolarHBondContact O-N 2.96Å; E531-Q534 PolarHBondContact O-N 2.91Å; Q534-T536 VanDerWaalsContact C-N 3.25Å; Q534-T536 PolarHBondContact O-N 2.97Å; Q534-L537 PolarHBondContact O-N 2.81Å; Q534-I538 HydrophobicContact CG-CD1 3.71Å; Q534-I538 HydrophobicContact CG-CG1 4.26Å; Q534-I538 WeakPolarHBondContact O-CB 3.23Å; Q534-I538 VanDerWaalsContact O-CG1 3.25Å; Q534-I538 WeakPolarHBondContact O-CG1 3.4Å; Q534-I538 PolarHBondContact O-N 2.83Å
535	E	95.9	Very high	96.1	Very high	121 Å²	121	54.6 Å²	54.6	57%	0.565	28%	0.278	S	S	*	.	H	α-helix	trans	-58.8	-37.7	174.2	-80.1	-164.9	178.7	0	0	112.1	E531 L533 I538 R539	E531-E535 WeakPolarHBondContact O-CB 3.4Å; E531-E535 WeakPolarHBondContact O-CG 3.41Å; E531-E535 PolarHBondContact O-N 3.11Å; L533-E535 PolarHBondContact O-N 3.17Å; E535-I538 PolarHBondContact O-N 2.89Å; E535-R539 VanDerWaalsContact O-CB 3.24Å; E535-R539 WeakPolarHBondContact O-CB 3.3Å; E535-R539 PolarHBondContact O-N 3.41Å; E535-R539 IonicContact OE2-NH2 2.73Å
536	T	96.9	Very high	96.1	Very high	51 Å²	51	52.4 Å²	52.4	31%	0.313	27%	0.274	S	S	.	.	H	α-helix	trans	-69.1	-43	179.8	-60.5	0	0	0	0	111.6	V261 A532 L533 Q534 R539 A540	V261-T536 HydrophobicContact CG2-CG2 4.5Å; A532-T536 PolarHBondContact O-N 3.1Å; A532-T536 PolarHBondContact O-OG1 3.07Å; L533-T536 WeakPolarHBondContact O-CB 3.49Å; L533-T536 PolarHBondContact O-N 2.86Å; L533-T536 VanDerWaalsContact O-N 3.1Å; Q534-T536 VanDerWaalsContact C-N 3.25Å; Q534-T536 PolarHBondContact O-N 2.97Å; T536-R539 PolarHBondContact O-N 3.11Å; T536-R539 PolarHBondContact OG1-NH1 2.92Å; T536-A540 PolarHBondContact O-N 3.31Å; T536-A540 VanDerWaalsContact O-N 3.08Å
537	L	97.6	Very high	96.1	Very high	1 Å²	1	55 Å²	55	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-65.9	-40	173.3	-63.5	167.8	0	0	0	112.2	V261 V265 I428 L510 A513 V514 V517 L533 Q534 L541	V261-L537 HydrophobicContact CG1-CD2 3.98Å; V265-L537 HydrophobicContact CG2-CD2 4.17Å; I428-L537 HydrophobicContact CG2-CD1 4.08Å; I428-L537 HydrophobicContact CG2-CD2 3.99Å; L510-L537 HydrophobicContact CD1-CD2 3.91Å; A513-L537 HydrophobicContact CB-CD1 4.18Å; A513-L537 HydrophobicContact CB-CD2 4.16Å; V514-L537 HydrophobicContact CG2-CB 3.68Å; V517-L537 HydrophobicContact CB-CD1 3.85Å; V517-L537 HydrophobicContact CG1-CD1 4.4Å; V517-L537 HydrophobicContact CG2-CD1 3.81Å; L533-L537 HydrophobicContact CD1-CD1 4.46Å; L533-L537 HydrophobicContact CG-CD1 4.27Å; L533-L537 PolarHBondContact O-N 3.34Å; Q534-L537 PolarHBondContact O-N 2.81Å; L537-L541 VanDerWaalsContact O-CB 3.3Å; L537-L541 WeakPolarHBondContact O-CB 3.4Å; L537-L541 PolarHBondContact O-N 3.08Å
538	I	96.2	Very high	96.1	Very high	43 Å²	43	55.6 Å²	55.6	22%	0.221	28%	0.28	C	S	.	.	H	α-helix	trans	-66.5	-36.5	176.3	-72.9	176.2	0	0	0	111.6	V514 Q534 E535 R542 F556	V514-I538 HydrophobicContact CB-CG1 4.43Å; V514-I538 HydrophobicContact CG1-CD1 4.07Å; V514-I538 HydrophobicContact CG1-CG1 3.65Å; V514-I538 HydrophobicContact CG2-CG1 3.82Å; Q534-I538 HydrophobicContact CG-CD1 3.71Å; Q534-I538 HydrophobicContact CG-CG1 4.26Å; Q534-I538 WeakPolarHBondContact O-CB 3.23Å; Q534-I538 VanDerWaalsContact O-CG1 3.25Å; Q534-I538 WeakPolarHBondContact O-CG1 3.4Å; Q534-I538 PolarHBondContact O-N 2.83Å; E535-I538 PolarHBondContact O-N 2.89Å; I538-R542 WeakPolarHBondContact O-CB 3.31Å; I538-R542 PolarHBondContact O-N 3.05Å; I538-F556 HydrophobicContact CG2-CE2 4.3Å; I538-F556 HydrophobicContact CG2-CZ 3.81Å
539	R	96.4	Very high	95.9	Very high	108 Å²	108	51.7 Å²	51.7	41%	0.408	26%	0.258	S	S	.	.	H	α-helix	trans	-66.2	-50.8	177.3	-162.8	-174.6	-56.5	105.6	9.1	110.8	E258 E535 T536 L541 R542 S543	E258-R539 WeakPolarHBondContact OE1-CD 3.39Å; E258-R539 WeakPolarHBondContact OE1-CG 3.44Å; E535-R539 VanDerWaalsContact O-CB 3.24Å; E535-R539 WeakPolarHBondContact O-CB 3.3Å; E535-R539 PolarHBondContact O-N 3.41Å; E535-R539 IonicContact OE2-NH2 2.73Å; T536-R539 PolarHBondContact O-N 3.11Å; T536-R539 PolarHBondContact OG1-NH1 2.92Å; R539-L541 VanDerWaalsContact C-N 3.34Å; R539-L541 PolarHBondContact O-N 3.11Å; R539-R542 WeakPolarHBondContact O-CB 3.42Å; R539-R542 PolarHBondContact O-N 2.64Å; R539-R542 VanDerWaalsContact O-N 3.1Å; R539-S543 PolarHBondContact O-N 2.88Å
540	A	97.2	Very high	95.5	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-56.8	-44.6	173.5	0	0	0	0	0	112.1	V261 I262 L510 T536 R542 S543 L544	V261-A540 HydrophobicContact CB-CB 4.42Å; V261-A540 HydrophobicContact CG1-CB 4.06Å; I262-A540 HydrophobicContact CG1-CB 4.09Å; L510-A540 HydrophobicContact CD2-CB 3.89Å; T536-A540 PolarHBondContact O-N 3.31Å; T536-A540 VanDerWaalsContact O-N 3.08Å; A540-R542 VanDerWaalsContact C-N 3.33Å; A540-R542 PolarHBondContact O-N 3.15Å; A540-S543 WeakPolarHBondContact O-CB 3.32Å; A540-S543 PolarHBondContact O-N 3.26Å; A540-L544 WeakPolarHBondContact O-CB 3.46Å; A540-L544 PolarHBondContact O-N 2.79Å
541	L	96.4	Very high	95.1	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-60.5	-40.9	175.4	-176.2	57.9	0	0	0	112.2	L510 F511 V514 L537 R539 I545 F556 L559	L510-L541 HydrophobicContact CB-CD1 4.19Å; L510-L541 HydrophobicContact CD2-CB 4.16Å; L510-L541 HydrophobicContact CG-CB 4.05Å; L510-L541 HydrophobicContact CG-CD1 4.28Å; F511-L541 HydrophobicContact CB-CD2 4.36Å; F511-L541 HydrophobicContact CD2-CD2 4.35Å; V514-L541 HydrophobicContact CG2-CD2 4.14Å; L537-L541 VanDerWaalsContact O-CB 3.3Å; L537-L541 WeakPolarHBondContact O-CB 3.4Å; L537-L541 PolarHBondContact O-N 3.08Å; R539-L541 VanDerWaalsContact C-N 3.34Å; R539-L541 PolarHBondContact O-N 3.11Å; L541-I545 HydrophobicContact CD1-CG1 4.03Å; L541-I545 HydrophobicContact CG-CG1 4.39Å; L541-I545 WeakPolarHBondContact O-CB 3.12Å; L541-I545 WeakPolarHBondContact O-CG1 3.23Å; L541-I545 PolarHBondContact O-N 3.43Å; L541-F556 HydrophobicContact CG-CE2 4.44Å; L541-L559 HydrophobicContact CD1-CD2 4.35Å; L541-L559 HydrophobicContact CD2-CD2 4.22Å
542	R	95.6	Very high	94.7	Very high	157 Å²	157	61.3 Å²	61.3	59%	0.592	31%	0.31	S	S	*	.	H	α-helix	trans	-65.5	-42.3	176.8	-170.2	177.8	172.6	-174.4	-4.7	111.7	I538 R539 A540 T546 F556	I538-R542 WeakPolarHBondContact O-CB 3.31Å; I538-R542 PolarHBondContact O-N 3.05Å; R539-R542 WeakPolarHBondContact O-CB 3.42Å; R539-R542 PolarHBondContact O-N 2.64Å; R539-R542 VanDerWaalsContact O-N 3.1Å; A540-R542 VanDerWaalsContact C-N 3.33Å; A540-R542 PolarHBondContact O-N 3.15Å; R542-T546 VanDerWaalsContact O-CB 3.31Å; R542-T546 WeakPolarHBondContact O-CB 3.44Å; R542-T546 PolarHBondContact O-N 3.47Å; R542-T546 PolarHBondContact O-OG1 3.38Å; R542-F556 HydrophobicContact CB-CD2 3.89Å; R542-F556 HydrophobicContact CB-CE1 4.25Å; R542-F556 HydrophobicContact CB-CE2 3.47Å; R542-F556 VanDerWaalsContact CB-CE2 3.47Å; R542-F556 HydrophobicContact CB-CG 4.43Å; R542-F556 HydrophobicContact CB-CZ 3.67Å; R542-F556 HydrophobicContact CG-CD1 4.08Å; R542-F556 HydrophobicContact CG-CD2 4.11Å; R542-F556 HydrophobicContact CG-CE1 3.96Å; R542-F556 HydrophobicContact CG-CE2 4Å; R542-F556 HydrophobicContact CG-CG 4.15Å; R542-F556 HydrophobicContact CG-CZ 3.91Å
543	S	94.9	Very high	93.9	Very high	39 Å²	39	64 Å²	64	27%	0.273	33%	0.325	S	S	.	.	H	α-helix	trans	-59.5	-54.5	178.3	-143.2	0	0	0	0	110.3	E258 R539 A540 I545 T546 R547	E258-S543 WeakPolarHBondContact OE2-CB 3.42Å; E258-S543 PolarHBondContact OE2-OG 2.98Å; R539-S543 PolarHBondContact O-N 2.88Å; A540-S543 WeakPolarHBondContact O-CB 3.32Å; A540-S543 PolarHBondContact O-N 3.26Å; S543-I545 PolarHBondContact O-N 3.09Å; S543-T546 PolarHBondContact O-N 3.35Å; S543-T546 VanDerWaalsContact O-N 3.14Å; S543-R547 PolarHBondContact O-N 2.89Å
544	L	95.5	Very high	93.7	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-57.1	-51	177.7	-175.9	61.8	0	0	0	113.1	I262 E506 E507 L510 A540 T546 R547 N548	I262-L544 HydrophobicContact CD1-CB 3.97Å; I262-L544 HydrophobicContact CD1-CD1 4.44Å; I262-L544 HydrophobicContact CG1-CB 4.44Å; I262-L544 HydrophobicContact CG2-CD1 4.21Å; I262-L544 HydrophobicContact CG2-CD2 4.03Å; E506-L544 HydrophobicContact CB-CD2 3.79Å; E507-L544 HydrophobicContact CB-CD2 4.43Å; E507-L544 HydrophobicContact CG-CD2 3.69Å; E507-L544 HydrophobicContact CG-CG 3.8Å; L510-L544 HydrophobicContact CD2-CD2 4.23Å; A540-L544 WeakPolarHBondContact O-CB 3.46Å; A540-L544 PolarHBondContact O-N 2.79Å; L544-T546 VanDerWaalsContact C-N 3.26Å; L544-T546 PolarHBondContact O-N 2.99Å; L544-R547 WeakPolarHBondContact O-CB 3.47Å; L544-R547 PolarHBondContact O-N 3.1Å; L544-R547 VanDerWaalsContact O-N 3.16Å; L544-N548 WeakPolarHBondContact CD1-ND2 3.45Å; L544-N548 WeakPolarHBondContact O-CB 3.38Å; L544-N548 PolarHBondContact O-N 2.87Å
545	I	95.4	Very high	93.5	Very high	4 Å²	4	64.2 Å²	64.2	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-61.5	-35.8	178.4	-66.3	-82.8	0	0	0	111.2	L503 E507 L541 S543 H549 I555 F556 L559	L503-I545 HydrophobicContact CD2-CD1 3.77Å; E507-I545 HydrophobicContact CB-CD1 4.03Å; E507-I545 VanDerWaalsContact CD-CD1 3.45Å; E507-I545 HydrophobicContact CG-CD1 3.65Å; E507-I545 HydrophobicContact CG-CG1 4.22Å; L541-I545 HydrophobicContact CD1-CG1 4.03Å; L541-I545 HydrophobicContact CG-CG1 4.39Å; L541-I545 WeakPolarHBondContact O-CB 3.12Å; L541-I545 WeakPolarHBondContact O-CG1 3.23Å; L541-I545 PolarHBondContact O-N 3.43Å; S543-I545 PolarHBondContact O-N 3.09Å; I545-H549 WeakPolarHBondContact O-CA 3.42Å; I545-H549 WeakPolarHBondContact O-CB 3.44Å; I545-H549 PolarHBondContact O-CD2 3.33Å; I545-H549 PolarHBondContact O-N 2.96Å; I545-I555 HydrophobicContact CD1-CG2 4.07Å; I545-I555 HydrophobicContact CG2-CB 4.18Å; I545-I555 HydrophobicContact CG2-CG2 4.02Å; I545-F556 HydrophobicContact CG2-CB 3.91Å; I545-L559 HydrophobicContact CD1-CD2 4.24Å
546	T	93.4	Very high	93.4	Very high	85 Å²	85	59.9 Å²	59.9	52%	0.521	31%	0.313	S	S	.	.	H	α-helix	trans	-73	-34.9	178.1	-52.7	0	0	0	0	111.7	R542 S543 L544	R542-T546 VanDerWaalsContact O-CB 3.31Å; R542-T546 WeakPolarHBondContact O-CB 3.44Å; R542-T546 PolarHBondContact O-N 3.47Å; R542-T546 PolarHBondContact O-OG1 3.38Å; S543-T546 PolarHBondContact O-N 3.35Å; S543-T546 VanDerWaalsContact O-N 3.14Å; L544-T546 VanDerWaalsContact C-N 3.26Å; L544-T546 PolarHBondContact O-N 2.99Å
547	R	93.9	Very high	93.3	Very high	122 Å²	122	61.3 Å²	61.3	46%	0.46	32%	0.322	S	S	.	.	H	α-helix	trans	-66.4	-44.8	175.1	179.8	164.9	72.5	-163.4	4	112.1	D259 S543 L544	D259-R547 IonicContact OD1-CZ 2.88Å; D259-R547 VanDerWaalsContact OD1-CZ 3.27Å; D259-R547 IonicContact OD1-NH1 3.27Å; D259-R547 PolarHBondContact OD1-NH1 3.21Å; D259-R547 IonicContact OD1-NH2 3.02Å; D259-R547 PolarHBondContact OD1-NH2 3.12Å; D259-R547 IonicContact OD2-CZ 3.19Å; D259-R547 IonicContact OD2-NH1 3.94Å; D259-R547 PolarHBondContact OD2-NH1 3.17Å; S543-R547 PolarHBondContact O-N 2.89Å; L544-R547 WeakPolarHBondContact O-CB 3.47Å; L544-R547 PolarHBondContact O-N 3.1Å; L544-R547 VanDerWaalsContact O-N 3.16Å
548	N	94.2	Very high	93.1	Very high	65 Å²	65	65.2 Å²	65.2	35%	0.348	34%	0.339	S	S	.	.	H	α-helix	trans	-84.1	-33.5	-174.6	-64.1	-12.4	0	0	0	113	E507 L544 P550	E507-N548 WeakPolarHBondContact OE1-CB 3.4Å; E507-N548 PolarHBondContact OE1-ND2 2.87Å; L544-N548 WeakPolarHBondContact CD1-ND2 3.45Å; L544-N548 WeakPolarHBondContact O-CB 3.38Å; L544-N548 PolarHBondContact O-N 2.87Å; N548-P550 VanDerWaalsContact O-CD 3.27Å; N548-P550 WeakPolarHBondContact O-CD 3.33Å
549	H	93.4	Very high	93	Very high	39 Å²	39	63.2 Å²	63.2	18%	0.181	33%	0.329	C	S	.	.			trans	-119.9	55.6	-175.7	-52.5	-92.5	0	0	0	112.8	E507 I545 N551 E552 I555	E507-H549 VanDerWaalsContact CD-NE2 3.32Å; E507-H549 IonicContact OE1-CD2 2.95Å; E507-H549 PolarHBondContact OE1-CD2 3.28Å; E507-H549 IonicContact OE1-NE2 3.77Å; E507-H549 PolarHBondContact OE1-NE2 3.22Å; E507-H549 IonicContact OE2-CD2 2.96Å; E507-H549 IonicContact OE2-CE1 2.7Å; E507-H549 IonicContact OE2-NE2 3.89Å; E507-H549 PolarHBondContact OE2-NE2 3.49Å; I545-H549 WeakPolarHBondContact O-CA 3.42Å; I545-H549 WeakPolarHBondContact O-CB 3.44Å; I545-H549 PolarHBondContact O-CD2 3.33Å; I545-H549 PolarHBondContact O-N 2.96Å; H549-N551 PolarHBondContact O-N 3.49Å; H549-E552 HydrophobicContact CB-CB 4.32Å; H549-E552 PolarHBondContact O-N 2.75Å; H549-I555 HydrophobicContact CB-CD1 3.95Å; H549-I555 WeakPolarHBondContact ND1-CD1 3.36Å
550	P	87.7	Confident	92.8	Very high	93 Å²	93	60.4 Å²	60.4	60%	0.604	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-25.3	-170.7	24.9	-35.6	0	0	0	114.1	N548	N548-P550 VanDerWaalsContact O-CD 3.27Å; N548-P550 WeakPolarHBondContact O-CD 3.33Å
551	N	88.6	Confident	92.6	Very high	160 Å²	160	65.7 Å²	65.7	86%	0.856	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-13.1	177.5	-63.2	-45	0	0	0	113.8	H549	H549-N551 PolarHBondContact O-N 3.49Å
552	E	87.2	Confident	92.5	Very high	99 Å²	99	66.9 Å²	66.9	46%	0.463	35%	0.354	S	S	.	.			trans	-120	54.8	-173.4	-80.2	-145.8	-129.3	0	0	112.7	H549 A554 I555 K558	H549-E552 HydrophobicContact CB-CB 4.32Å; H549-E552 PolarHBondContact O-N 2.75Å; E552-A554 PolarHBondContact O-N 2.77Å; E552-I555 HydrophobicContact CB-CD1 3.56Å; E552-I555 HydrophobicContact CB-CG1 3.94Å; E552-I555 HydrophobicContact CG-CD1 4.34Å; E552-I555 PolarHBondContact O-N 3.21Å; E552-K558 IonicContact OE2-NZ 3.26Å; E552-K558 PolarHBondContact OE2-NZ 3.34Å
553	S	81.3	Confident	92.4	Very high	111 Å²	111	60.7 Å²	60.7	78%	0.776	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-15	177.7	67.6	0	0	0	0	115.6
554	A	91.8	Very high	92.3	Very high	46 Å²	46	62.2 Å²	62.2	38%	0.38	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-25.1	173.3	0	0	0	0	0	114.2	E552 F556 T557 K558	E552-A554 PolarHBondContact O-N 2.77Å; A554-F556 PolarHBondContact O-N 3.27Å; A554-T557 WeakPolarHBondContact O-CA 3.42Å; A554-T557 WeakPolarHBondContact O-CB 3.23Å; A554-T557 PolarHBondContact O-N 3.48Å; A554-K558 WeakPolarHBondContact O-CG 3.47Å; A554-K558 PolarHBondContact O-N 3.14Å
555	I	93.4	Very high	92.1	Very high	3 Å²	3	65 Å²	65	2%	0.015	36%	0.357	C	S	.	.	H	α-helix	trans	-56.8	-48.2	-172.8	-72.1	171.5	0	0	0	111.9	L503 I545 H549 E552 T557 K558 L559	L503-I555 HydrophobicContact CD2-CG2 3.8Å; I545-I555 HydrophobicContact CD1-CG2 4.07Å; I545-I555 HydrophobicContact CG2-CB 4.18Å; I545-I555 HydrophobicContact CG2-CG2 4.02Å; H549-I555 HydrophobicContact CB-CD1 3.95Å; H549-I555 WeakPolarHBondContact ND1-CD1 3.36Å; E552-I555 HydrophobicContact CB-CD1 3.56Å; E552-I555 HydrophobicContact CB-CG1 3.94Å; E552-I555 HydrophobicContact CG-CD1 4.34Å; E552-I555 PolarHBondContact O-N 3.21Å; I555-T557 PolarHBondContact O-N 3.35Å; I555-K558 HydrophobicContact CG1-CD 4.49Å; I555-K558 WeakPolarHBondContact O-CB 3.39Å; I555-K558 PolarHBondContact O-N 2.83Å; I555-K558 VanDerWaalsContact O-N 3.09Å; I555-L559 WeakPolarHBondContact O-CB 3.24Å; I555-L559 PolarHBondContact O-N 3.43Å
556	F	94.6	Very high	92.1	Very high	29 Å²	29	64.8 Å²	64.8	13%	0.127	36%	0.356	C	S	.	.	H	α-helix	trans	-54.4	-38.2	176	177.5	-104.9	0	0	0	112.7	I538 L541 R542 I545 A554 L560	I538-F556 HydrophobicContact CG2-CE2 4.3Å; I538-F556 HydrophobicContact CG2-CZ 3.81Å; L541-F556 HydrophobicContact CG-CE2 4.44Å; R542-F556 HydrophobicContact CB-CD2 3.89Å; R542-F556 HydrophobicContact CB-CE1 4.25Å; R542-F556 HydrophobicContact CB-CE2 3.47Å; R542-F556 VanDerWaalsContact CB-CE2 3.47Å; R542-F556 HydrophobicContact CB-CG 4.43Å; R542-F556 HydrophobicContact CB-CZ 3.67Å; R542-F556 HydrophobicContact CG-CD1 4.08Å; R542-F556 HydrophobicContact CG-CD2 4.11Å; R542-F556 HydrophobicContact CG-CE1 3.96Å; R542-F556 HydrophobicContact CG-CE2 4Å; R542-F556 HydrophobicContact CG-CG 4.15Å; R542-F556 HydrophobicContact CG-CZ 3.91Å; I545-F556 HydrophobicContact CG2-CB 3.91Å; A554-F556 PolarHBondContact O-N 3.27Å; F556-L560 HydrophobicContact CD1-CD1 4.32Å; F556-L560 HydrophobicContact CE1-CD1 3.66Å; F556-L560 HydrophobicContact CE2-CD1 4.28Å; F556-L560 HydrophobicContact CE2-CG 4.46Å; F556-L560 HydrophobicContact CZ-CD1 3.64Å; F556-L560 HydrophobicContact CZ-CG 4.3Å; F556-L560 WeakPolarHBondContact O-CG 3.35Å; F556-L560 PolarHBondContact O-N 3.33Å
557	T	93.8	Very high	92	Very high	81 Å²	81	63 Å²	63	50%	0.497	34%	0.339	S	S	.	.	H	α-helix	trans	-75	-42	176.9	-54.8	0	0	0	0	111.8	A554 I555 L559 L560 L561	A554-T557 WeakPolarHBondContact O-CA 3.42Å; A554-T557 WeakPolarHBondContact O-CB 3.23Å; A554-T557 PolarHBondContact O-N 3.48Å; I555-T557 PolarHBondContact O-N 3.35Å; T557-L559 PolarHBondContact O-N 3.07Å; T557-L560 PolarHBondContact O-N 3.36Å; T557-L561 HydrophobicContact CG2-CD1 4.28Å; T557-L561 WeakPolarHBondContact O-CB 3.48Å; T557-L561 VanDerWaalsContact O-CG 3.27Å; T557-L561 WeakPolarHBondContact O-CG 3.04Å; T557-L561 PolarHBondContact O-N 2.72Å; T557-L561 VanDerWaalsContact O-N 3.11Å
558	K	93.8	Very high	91.9	Very high	83 Å²	83	60.4 Å²	60.4	36%	0.361	34%	0.34	S	S	.	.	H	α-helix	trans	-56.5	-37.2	172.9	-63.2	170.9	-168.4	165.4	0	110.9	L501 E552 A554 I555	L501-K558 HydrophobicContact CD1-CB 4.33Å; L501-K558 HydrophobicContact CD2-CB 3.72Å; L501-K558 HydrophobicContact CD2-CD 3.57Å; L501-K558 HydrophobicContact CD2-CG 4.26Å; E552-K558 IonicContact OE2-NZ 3.26Å; E552-K558 PolarHBondContact OE2-NZ 3.34Å; A554-K558 WeakPolarHBondContact O-CG 3.47Å; A554-K558 PolarHBondContact O-N 3.14Å; I555-K558 HydrophobicContact CG1-CD 4.49Å; I555-K558 WeakPolarHBondContact O-CB 3.39Å; I555-K558 PolarHBondContact O-N 2.83Å; I555-K558 VanDerWaalsContact O-N 3.09Å
559	L	94.3	Very high	91.8	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-75.1	-45.5	-178.2	-173.9	54.7	0	0	0	112.8	L498 L501 L503 F511 L541 I545 I555 T557 L561 K562	L498-L559 HydrophobicContact CD1-CD1 3.81Å; L501-L559 HydrophobicContact CD1-CB 4.22Å; L501-L559 HydrophobicContact CD1-CD1 4.09Å; L503-L559 HydrophobicContact CD1-CD1 3.82Å; L503-L559 HydrophobicContact CD1-CD2 3.97Å; L503-L559 HydrophobicContact CD2-CD2 4.29Å; F511-L559 HydrophobicContact CB-CD2 4.27Å; F511-L559 HydrophobicContact CD1-CD1 3.81Å; F511-L559 HydrophobicContact CD2-CD1 3.58Å; F511-L559 HydrophobicContact CD2-CD2 4.05Å; F511-L559 HydrophobicContact CD2-CG 3.62Å; F511-L559 HydrophobicContact CE1-CD1 3.83Å; F511-L559 HydrophobicContact CE2-CD1 3.61Å; F511-L559 HydrophobicContact CE2-CG 3.84Å; F511-L559 HydrophobicContact CG-CD1 3.7Å; F511-L559 HydrophobicContact CG-CD2 4.21Å; F511-L559 HydrophobicContact CG-CG 4.08Å; F511-L559 HydrophobicContact CZ-CD1 3.75Å; F511-L559 HydrophobicContact CZ-CG 4.47Å; L541-L559 HydrophobicContact CD1-CD2 4.35Å; L541-L559 HydrophobicContact CD2-CD2 4.22Å; I545-L559 HydrophobicContact CD1-CD2 4.24Å; I555-L559 WeakPolarHBondContact O-CB 3.24Å; I555-L559 PolarHBondContact O-N 3.43Å; T557-L559 PolarHBondContact O-N 3.07Å; L559-L561 PolarHBondContact O-N 3.12Å; L559-K562 HydrophobicContact CD1-CG 4.36Å; L559-K562 WeakPolarHBondContact O-CB 3.36Å; L559-K562 PolarHBondContact O-N 2.83Å
560	L	91.9	Very high	91.6	Very high	50 Å²	50	57 Å²	57	26%	0.262	32%	0.323	S	S	.	.	H	α-helix	trans	-62	-30.2	172.4	-69.1	-179.3	0	0	0	112.3	F556 T557 K562 L563	F556-L560 HydrophobicContact CD1-CD1 4.32Å; F556-L560 HydrophobicContact CE1-CD1 3.66Å; F556-L560 HydrophobicContact CE2-CD1 4.28Å; F556-L560 HydrophobicContact CE2-CG 4.46Å; F556-L560 HydrophobicContact CZ-CD1 3.64Å; F556-L560 HydrophobicContact CZ-CG 4.3Å; F556-L560 WeakPolarHBondContact O-CG 3.35Å; F556-L560 PolarHBondContact O-N 3.33Å; T557-L560 PolarHBondContact O-N 3.36Å; L560-K562 PolarHBondContact O-N 3.23Å; L560-L563 HydrophobicContact CD2-CD1 4.13Å; L560-L563 WeakPolarHBondContact O-CB 3.34Å; L560-L563 WeakPolarHBondContact O-CG 3.38Å; L560-L563 PolarHBondContact O-N 3.23Å
561	L	93.3	Very high	91.7	Very high	112 Å²	112	57.5 Å²	57.5	59%	0.586	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-2.6	171.6	-69.3	170.5	0	0	0	114.2	T557 L559	T557-L561 HydrophobicContact CG2-CD1 4.28Å; T557-L561 WeakPolarHBondContact O-CB 3.48Å; T557-L561 VanDerWaalsContact O-CG 3.27Å; T557-L561 WeakPolarHBondContact O-CG 3.04Å; T557-L561 PolarHBondContact O-N 2.72Å; T557-L561 VanDerWaalsContact O-N 3.11Å; L559-L561 PolarHBondContact O-N 3.12Å
562	K	94.6	Very high	91.6	Very high	26 Å²	26	52.4 Å²	52.4	11%	0.113	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-19.9	167.6	-64	-61.1	99.1	-161.7	0	113.2	F494 L498 F511 L559 L560 D565 L566	F494-K562 HydrophobicContact CD2-CD 4.45Å; F494-K562 HydrophobicContact CE2-CB 3.89Å; F494-K562 HydrophobicContact CE2-CD 3.96Å; F494-K562 HydrophobicContact CE2-CG 4.34Å; F494-K562 HydrophobicContact CZ-CB 4.26Å; L498-K562 HydrophobicContact CD1-CG 4.38Å; F511-K562 HydrophobicContact CZ-CB 3.84Å; L559-K562 HydrophobicContact CD1-CG 4.36Å; L559-K562 WeakPolarHBondContact O-CB 3.36Å; L559-K562 PolarHBondContact O-N 2.83Å; L560-K562 PolarHBondContact O-N 3.23Å; K562-D565 IonicContact NZ-OD2 3.14Å; K562-D565 PolarHBondContact NZ-OD2 3.43Å; K562-D565 WeakPolarHBondContact O-CB 3.41Å; K562-D565 PolarHBondContact O-N 3.44Å; K562-L566 PolarHBondContact O-N 2.93Å; K562-L566 VanDerWaalsContact O-N 3.13Å
563	L	92.8	Very high	91.6	Very high	27 Å²	27	49.8 Å²	49.8	14%	0.141	28%	0.28	C	S	.	.	H	α-helix	trans	-60.9	-42.9	-178.7	-59.2	175.7	0	0	0	113	F511 V515 L560 D565 L566 R567	F511-L563 HydrophobicContact CE2-CD2 3.86Å; F511-L563 HydrophobicContact CE2-CG 4.49Å; F511-L563 HydrophobicContact CZ-CD2 4.22Å; V515-L563 HydrophobicContact CG2-CD2 3.65Å; L560-L563 HydrophobicContact CD2-CD1 4.13Å; L560-L563 WeakPolarHBondContact O-CB 3.34Å; L560-L563 WeakPolarHBondContact O-CG 3.38Å; L560-L563 PolarHBondContact O-N 3.23Å; L563-D565 PolarHBondContact O-N 3.4Å; L563-L566 PolarHBondContact O-N 2.87Å; L563-R567 WeakPolarHBondContact O-CG 3.24Å; L563-R567 PolarHBondContact O-N 3.25Å
564	P	92.4	Very high	91.7	Very high	71 Å²	71	46.9 Å²	46.9	46%	0.461	26%	0.259	S	S	.	.	H	α-helix	trans	-66.2	-33.2	175.6	-21.6	35.1	0	0	0	114	R567 S568	P564-R567 PolarHBondContact O-N 2.68Å; P564-S568 PolarHBondContact O-N 3.44Å; P564-S568 VanDerWaalsContact O-N 3.09Å; P564-S568 PolarHBondContact O-OG 2.8Å; P564-S568 VanDerWaalsContact O-OG 3.05Å
565	D	93.2	Very high	91.2	Very high	58 Å²	58	51 Å²	51	31%	0.31	27%	0.271	S	S	.	.	H	α-helix	trans	-62.6	-45.7	175.5	-63.3	-18.8	0	0	0	109.9	F494 K562 L563 R567 S568 L569	F494-D565 HydrophobicContact CD2-CB 3.7Å; F494-D565 HydrophobicContact CE2-CB 3.97Å; K562-D565 IonicContact NZ-OD2 3.14Å; K562-D565 PolarHBondContact NZ-OD2 3.43Å; K562-D565 WeakPolarHBondContact O-CB 3.41Å; K562-D565 PolarHBondContact O-N 3.44Å; L563-D565 PolarHBondContact O-N 3.4Å; D565-R567 VanDerWaalsContact C-N 3.34Å; D565-R567 PolarHBondContact O-N 2.8Å; D565-S568 WeakPolarHBondContact O-CB 3.28Å; D565-S568 PolarHBondContact O-N 3.38Å; D565-S568 VanDerWaalsContact O-N 3.08Å; D565-L569 WeakPolarHBondContact O-CG 3.27Å; D565-L569 PolarHBondContact O-N 3.45Å
566	L	93.9	Very high	90.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.4	-40.8	175.9	-74.8	168.9	0	0	0	112.5	E449 V452 V453 F494 F511 V515 K562 L563 S568 L569 N570	E449-L566 HydrophobicContact CB-CB 4.17Å; E449-L566 HydrophobicContact CB-CD2 4.15Å; E449-L566 HydrophobicContact CG-CB 3.94Å; V452-L566 HydrophobicContact CB-CD2 4.1Å; V452-L566 HydrophobicContact CG1-CD2 3.94Å; V453-L566 HydrophobicContact CG2-CD1 3.9Å; V453-L566 HydrophobicContact CG2-CD2 4.03Å; F494-L566 HydrophobicContact CD1-CD2 4.45Å; F494-L566 HydrophobicContact CE1-CD2 3.77Å; F494-L566 HydrophobicContact CE1-CG 4.36Å; F494-L566 HydrophobicContact CE2-CD1 4.38Å; F494-L566 HydrophobicContact CE2-CD2 3.91Å; F494-L566 HydrophobicContact CE2-CG 3.67Å; F494-L566 HydrophobicContact CZ-CD1 3.95Å; F494-L566 HydrophobicContact CZ-CD2 3.47Å; F494-L566 VanDerWaalsContact CZ-CD2 3.47Å; F494-L566 HydrophobicContact CZ-CG 3.54Å; F511-L566 HydrophobicContact CE1-CD1 4.45Å; F511-L566 HydrophobicContact CZ-CD1 4.15Å; V515-L566 HydrophobicContact CB-CD1 4.46Å; V515-L566 HydrophobicContact CG1-CD1 3.95Å; V515-L566 HydrophobicContact CG2-CD1 3.58Å; K562-L566 PolarHBondContact O-N 2.93Å; K562-L566 VanDerWaalsContact O-N 3.13Å; L563-L566 PolarHBondContact O-N 2.87Å; L566-S568 VanDerWaalsContact C-N 3.29Å; L566-S568 PolarHBondContact O-N 3.08Å; L566-L569 PolarHBondContact O-N 3.24Å; L566-N570 WeakPolarHBondContact O-CB 3.42Å; L566-N570 PolarHBondContact O-N 2.95Å
567	R	91.8	Very high	89.3	Confident	48 Å²	48	55.7 Å²	55.7	18%	0.181	29%	0.294	C	S	.	.	H	α-helix	trans	-63.2	-37	174.4	-56.4	-43.5	173.6	69.3	0.1	112.2	E449 S518 D520 R521 L563 P564 D565 N570 N571	E449-R567 WeakPolarHBondContact OE1-CD 3.43Å; E449-R567 IonicContact OE1-NE 3.85Å; E449-R567 WeakPolarHBondContact OE2-CD 3.27Å; E449-R567 IonicContact OE2-NE 3.57Å; E449-R567 PolarHBondContact OE2-NE 3.22Å; E449-R567 VanDerWaalsContact OE2-NE 3.15Å; S518-R567 PolarHBondContact OG-NH2 3.39Å; S518-R567 VanDerWaalsContact OG-NH2 3.09Å; D520-R567 VanDerWaalsContact CG-NH1 3.29Å; D520-R567 IonicContact OD1-CZ 3.84Å; D520-R567 IonicContact OD1-NH1 2.69Å; D520-R567 PolarHBondContact OD1-NH1 2.84Å; D520-R567 IonicContact OD1-NH2 2.67Å; D520-R567 PolarHBondContact OD1-NH2 3.35Å; D520-R567 IonicContact OD2-CZ 2.69Å; D520-R567 IonicContact OD2-NH1 2.68Å; D520-R567 PolarHBondContact OD2-NH1 2.98Å; D520-R567 IonicContact OD2-NH2 3.46Å; R521-R567 VanDerWaalsContact NH1-NE 3.15Å; L563-R567 WeakPolarHBondContact O-CG 3.24Å; L563-R567 PolarHBondContact O-N 3.25Å; P564-R567 PolarHBondContact O-N 2.68Å; D565-R567 VanDerWaalsContact C-N 3.34Å; D565-R567 PolarHBondContact O-N 2.8Å; R567-N570 PolarHBondContact O-N 3.16Å; R567-N571 VanDerWaalsContact O-CG 3.29Å; R567-N571 PolarHBondContact O-N 3.24Å; R567-N571 VanDerWaalsContact O-N 3.08Å; R567-N571 PolarHBondContact O-ND2 2.81Å; R567-N571 VanDerWaalsContact O-ND2 3.08Å
568	S	92.6	Very high	88.3	Confident	67 Å²	67	57.4 Å²	57.4	47%	0.469	30%	0.3	S	S	.	.	H	α-helix	trans	-66	-44.2	176.4	-56.4	0	0	0	0	111.2	P564 D565 L566 N570 N571 M572	P564-S568 PolarHBondContact O-N 3.44Å; P564-S568 VanDerWaalsContact O-N 3.09Å; P564-S568 PolarHBondContact O-OG 2.8Å; P564-S568 VanDerWaalsContact O-OG 3.05Å; D565-S568 WeakPolarHBondContact O-CB 3.28Å; D565-S568 PolarHBondContact O-N 3.38Å; D565-S568 VanDerWaalsContact O-N 3.08Å; L566-S568 VanDerWaalsContact C-N 3.29Å; L566-S568 PolarHBondContact O-N 3.08Å; S568-N570 PolarHBondContact O-N 3.01Å; S568-N571 PolarHBondContact O-N 3.13Å; S568-M572 WeakPolarHBondContact O-CG 3.32Å; S568-M572 PolarHBondContact O-N 3.26Å
569	L	91.8	Very high	86.9	Confident	7 Å²	7	55.4 Å²	55.4	4%	0.037	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-40.4	174.5	-65.9	176.7	0	0	0	112.7	F448 V452 L487 M491 F494 D565 L566 M572 H573	F448-L569 HydrophobicContact CE1-CB 4.07Å; V452-L569 HydrophobicContact CG1-CD1 3.92Å; L487-L569 HydrophobicContact CD1-CD2 4.49Å; M491-L569 HydrophobicContact CG-CD1 4.38Å; M491-L569 HydrophobicContact CG-CD2 4.28Å; F494-L569 HydrophobicContact CB-CD1 3.78Å; F494-L569 HydrophobicContact CD1-CD1 4.33Å; F494-L569 HydrophobicContact CD2-CD1 4.25Å; F494-L569 HydrophobicContact CG-CD1 3.86Å; D565-L569 WeakPolarHBondContact O-CG 3.27Å; D565-L569 PolarHBondContact O-N 3.45Å; L566-L569 PolarHBondContact O-N 3.24Å; L569-M572 PolarHBondContact O-N 3.41Å; L569-H573 WeakPolarHBondContact O-CB 3.36Å; L569-H573 PolarHBondContact O-N 3.19Å
570	N	89.8	Confident	85.4	Confident	25 Å²	25	58.7 Å²	58.7	13%	0.134	31%	0.313	C	S	.	.	H	α-helix	trans	-66.8	-36.5	179.2	-164.4	7.3	0	0	0	112.4	A445 F448 E449 L566 R567 S568 H573 S574	A445-N570 PolarHBondContact O-ND2 3.11Å; F448-N570 HydrophobicContact CD1-CB 4Å; E449-N570 HydrophobicContact CG-CB 3.89Å; E449-N570 WeakPolarHBondContact OE1-CB 3.13Å; E449-N570 PolarHBondContact OE1-ND2 3.34Å; L566-N570 WeakPolarHBondContact O-CB 3.42Å; L566-N570 PolarHBondContact O-N 2.95Å; R567-N570 PolarHBondContact O-N 3.16Å; S568-N570 PolarHBondContact O-N 3.01Å; N570-H573 PolarHBondContact O-N 3.03Å; N570-S574 WeakPolarHBondContact O-CB 3.31Å; N570-S574 PolarHBondContact O-N 3.37Å; N570-S574 PolarHBondContact O-OG 2.91Å
571	N	89	Confident	83.7	Confident	103 Å²	103	62.1 Å²	62.1	55%	0.551	33%	0.326	S	S	*	.	H	α-helix	trans	-63.3	-48.1	170.2	-69	-36.2	0	0	0	111.2	R567 S568 H573 S574 E575	R567-N571 VanDerWaalsContact O-CG 3.29Å; R567-N571 PolarHBondContact O-N 3.24Å; R567-N571 VanDerWaalsContact O-N 3.08Å; R567-N571 PolarHBondContact O-ND2 2.81Å; R567-N571 VanDerWaalsContact O-ND2 3.08Å; S568-N571 PolarHBondContact O-N 3.13Å; N571-H573 VanDerWaalsContact C-N 3.31Å; N571-H573 PolarHBondContact O-N 3.32Å; N571-S574 WeakPolarHBondContact O-CB 3.44Å; N571-S574 PolarHBondContact O-N 3.08Å; N571-S574 VanDerWaalsContact O-N 3.16Å; N571-E575 WeakPolarHBondContact O-CG 3.33Å; N571-E575 PolarHBondContact O-N 3.43Å
572	M	87.1	Confident	81.7	Confident	54 Å²	54	62.2 Å²	62.2	27%	0.266	33%	0.331	S	S	.	.	H	α-helix	trans	-60.4	-39.1	176.6	-68.7	175.7	74.4	0	0	112.3	D486 L487 S568 L569 E575 Q576	D486-M572 HydrophobicContact CB-CE 3.81Å; L487-M572 HydrophobicContact CD1-CB 3.87Å; S568-M572 WeakPolarHBondContact O-CG 3.32Å; S568-M572 PolarHBondContact O-N 3.26Å; L569-M572 PolarHBondContact O-N 3.41Å; M572-E575 PolarHBondContact O-N 3.21Å; M572-Q576 VanDerWaalsContact O-CG 3.31Å; M572-Q576 WeakPolarHBondContact O-CG 3.35Å; M572-Q576 PolarHBondContact O-N 3.06Å
573	H	85.8	Confident	79.4	Confident	43 Å²	43	67.2 Å²	67.2	20%	0.199	36%	0.355	C	S	.	.	H	α-helix	trans	-62.8	-45.7	173.7	176.5	59.1	0	0	0	111.8	F448 L487 L569 N570 N571 E575 Q576 L577	F448-H573 HydrophobicContact CD1-CB 3.97Å; F448-H573 HydrophobicContact CD2-CB 4.13Å; F448-H573 AromaticContact CD2-CD2 3.26Å; F448-H573 WeakPolarHBondContact CD2-CD2 3.47Å; F448-H573 AromaticContact CD2-CE1 3.83Å; F448-H573 AromaticContact CD2-CG 3.5Å; F448-H573 AromaticContact CD2-ND1 3.85Å; F448-H573 AromaticContact CD2-NE2 3.49Å; F448-H573 WeakPolarHBondContact CD2-NE2 3.21Å; F448-H573 HydrophobicContact CE1-CB 3.67Å; F448-H573 HydrophobicContact CE2-CB 3.84Å; F448-H573 AromaticContact CE2-CD2 3.77Å; F448-H573 AromaticContact CE2-CE1 3.97Å; F448-H573 AromaticContact CE2-CG 3.48Å; F448-H573 VanDerWaalsContact CE2-CG 3.48Å; F448-H573 AromaticContact CE2-ND1 3.62Å; F448-H573 HydrophobicContact CG-CB 4.19Å; F448-H573 AromaticContact CG-CD2 3.42Å; F448-H573 VanDerWaalsContact CG-CD2 3.42Å; F448-H573 WeakPolarHBondContact CG-CD2 3.33Å; F448-H573 AromaticContact CG-CG 3.86Å; F448-H573 HydrophobicContact CZ-CB 3.61Å; F448-H573 AromaticContact CZ-CG 3.82Å; L487-H573 HydrophobicContact CD1-CB 4.29Å; L487-H573 HydrophobicContact CD2-CB 4.12Å; L569-H573 WeakPolarHBondContact O-CB 3.36Å; L569-H573 PolarHBondContact O-N 3.19Å; N570-H573 PolarHBondContact O-N 3.03Å; N571-H573 VanDerWaalsContact C-N 3.31Å; N571-H573 PolarHBondContact O-N 3.32Å; H573-E575 VanDerWaalsContact C-N 3.33Å; H573-E575 PolarHBondContact O-N 3.28Å; H573-Q576 PolarHBondContact O-N 3.5Å; H573-L577 WeakPolarHBondContact O-CG 3.41Å; H573-L577 PolarHBondContact O-N 3.35Å
574	S	84.9	Confident	76.9	Confident	50 Å²	50	69.7 Å²	69.7	35%	0.35	37%	0.374	S	S	.	.	H	α-helix	trans	-60.8	-40.6	176.1	-60.1	0	0	0	0	112.2	N570 N571 L577 L578	N570-S574 WeakPolarHBondContact O-CB 3.31Å; N570-S574 PolarHBondContact O-N 3.37Å; N570-S574 PolarHBondContact O-OG 2.91Å; N571-S574 WeakPolarHBondContact O-CB 3.44Å; N571-S574 PolarHBondContact O-N 3.08Å; N571-S574 VanDerWaalsContact O-N 3.16Å; S574-L577 PolarHBondContact O-N 3.21Å; S574-L578 VanDerWaalsContact O-CG 3.3Å; S574-L578 WeakPolarHBondContact O-CG 3.46Å; S574-L578 PolarHBondContact O-N 3.2Å
575	E	81.3	Confident	76.1	Confident	133 Å²	133	69.6 Å²	69.6	62%	0.621	37%	0.37	S	S	*	.	H	α-helix	trans	-64.4	-41.3	174.4	-73.1	177.4	174.6	0	0	112.2	N571 M572 H573 L578 A579	N571-E575 WeakPolarHBondContact O-CG 3.33Å; N571-E575 PolarHBondContact O-N 3.43Å; M572-E575 PolarHBondContact O-N 3.21Å; H573-E575 VanDerWaalsContact C-N 3.33Å; H573-E575 PolarHBondContact O-N 3.28Å; E575-L578 PolarHBondContact O-N 2.85Å; E575-A579 WeakPolarHBondContact O-CB 3.41Å; E575-A579 PolarHBondContact O-N 3.5Å
576	Q	75.9	Confident	75.2	Confident	75 Å²	75	70.2 Å²	70.2	35%	0.35	37%	0.373	S	S	.	.	H	α-helix	trans	-63.9	-46.2	174.3	-69.2	-66.6	-34.7	0	0	111.7	L487 M572 H573 L578 A579 F580	L487-Q576 HydrophobicContact CB-CG 4.42Å; L487-Q576 HydrophobicContact CD2-CG 4.14Å; M572-Q576 VanDerWaalsContact O-CG 3.31Å; M572-Q576 WeakPolarHBondContact O-CG 3.35Å; M572-Q576 PolarHBondContact O-N 3.06Å; H573-Q576 PolarHBondContact O-N 3.5Å; Q576-L578 VanDerWaalsContact C-N 3.29Å; Q576-L578 PolarHBondContact O-N 2.9Å; Q576-A579 PolarHBondContact O-N 3.31Å; Q576-A579 VanDerWaalsContact O-N 3.14Å; Q576-F580 WeakPolarHBondContact O-CD2 3.11Å; Q576-F580 PolarHBondContact O-N 3.5Å
577	L	72.3	Confident	74.2	Confident	55 Å²	55	74.1 Å²	74.1	29%	0.288	39%	0.394	S	S	.	.	H	α-helix	trans	-57.1	-42.4	175.9	-70.5	179.2	0	0	0	112.1	W407 H573 S574 K581	W407-L577 HydrophobicContact CH2-CD2 3.79Å; H573-L577 WeakPolarHBondContact O-CG 3.41Å; H573-L577 PolarHBondContact O-N 3.35Å; S574-L577 PolarHBondContact O-N 3.21Å; L577-K581 WeakPolarHBondContact O-CB 3.48Å; L577-K581 PolarHBondContact O-N 2.84Å; L577-K581 VanDerWaalsContact O-N 3.07Å
578	L	71.3	Confident	73.2	Confident	117 Å²	117	75.6 Å²	75.6	61%	0.613	41%	0.406	S	S	*	.	H	α-helix	trans	-67.2	-41.1	175.5	-71.9	170.4	0	0	0	112	S574 E575 Q576 K581 V582	S574-L578 VanDerWaalsContact O-CG 3.3Å; S574-L578 WeakPolarHBondContact O-CG 3.46Å; S574-L578 PolarHBondContact O-N 3.2Å; E575-L578 PolarHBondContact O-N 2.85Å; Q576-L578 VanDerWaalsContact C-N 3.29Å; Q576-L578 PolarHBondContact O-N 2.9Å; L578-K581 PolarHBondContact O-N 3.13Å; L578-V582 WeakPolarHBondContact O-CG2 3.28Å; L578-V582 PolarHBondContact O-N 2.66Å
579	A	65.6	Low	72	Confident	42 Å²	42	76.2 Å²	76.2	35%	0.347	40%	0.402	S	S	.	.	H	α-helix	trans	-61.3	-47.1	176.9	0	0	0	0	0	111.4	E575 Q576 K581 V582 H583	E575-A579 WeakPolarHBondContact O-CB 3.41Å; E575-A579 PolarHBondContact O-N 3.5Å; Q576-A579 PolarHBondContact O-N 3.31Å; Q576-A579 VanDerWaalsContact O-N 3.14Å; A579-K581 PolarHBondContact O-N 3.03Å; A579-V582 PolarHBondContact O-N 3.07Å; A579-H583 PolarHBondContact O-ND1 3.42Å
580	F	61.8	Low	70.6	Confident	69 Å²	69	80.8 Å²	80.8	30%	0.303	43%	0.427	S	S	.	.	H	α-helix	trans	-61.1	-43.8	175.3	-87.1	-90.4	0	0	0	111.9	L387 W407 Q576 V582 H583 S584	L387-F580 HydrophobicContact CD2-CE1 4.4Å; W407-F580 HydrophobicContact CE3-CB 4.35Å; W407-F580 HydrophobicContact CE3-CD1 4.35Å; W407-F580 HydrophobicContact CZ3-CB 4Å; W407-F580 HydrophobicContact CZ3-CD1 4.44Å; W407-F580 HydrophobicContact CZ3-CG 4.23Å; Q576-F580 WeakPolarHBondContact O-CD2 3.11Å; Q576-F580 PolarHBondContact O-N 3.5Å; F580-V582 PolarHBondContact O-N 2.58Å; F580-V582 VanDerWaalsContact O-N 3.13Å; F580-H583 PolarHBondContact O-N 3.26Å; F580-S584 PolarHBondContact O-N 2.91Å; F580-S584 PolarHBondContact O-OG 2.98Å
581	K	55.7	Low	69.3	Low	122 Å²	122	84.8 Å²	84.8	53%	0.53	45%	0.448	S	S	.	.	H	α-helix	trans	-67.7	-9.9	179.6	-169.3	155.2	-172.4	154	0	115.1	L577 L578 A579	L577-K581 WeakPolarHBondContact O-CB 3.48Å; L577-K581 PolarHBondContact O-N 2.84Å; L577-K581 VanDerWaalsContact O-N 3.07Å; L578-K581 PolarHBondContact O-N 3.13Å; A579-K581 PolarHBondContact O-N 3.03Å
582	V	52.7	Low	67.8	Low	114 Å²	114	83.4 Å²	83.4	69%	0.691	44%	0.44	S	S	*	.	H	α-helix	trans	-96.5	-10.6	173.3	171.9	0	0	0	0	112.3	L578 A579 F580	L578-V582 WeakPolarHBondContact O-CG2 3.28Å; L578-V582 PolarHBondContact O-N 2.66Å; A579-V582 PolarHBondContact O-N 3.07Å; F580-V582 PolarHBondContact O-N 2.58Å; F580-V582 VanDerWaalsContact O-N 3.13Å
583	H	46	Very low	66.1	Low	131 Å²	131	85.8 Å²	85.8	61%	0.606	45%	0.454	S	S	*	.			trans	-121.3	23	-177	-60.7	89.6	0	0	0	113.4	R384 A579 F580	R384-H583 PolarHBondContact NH1-O 3.37Å; R384-H583 PolarHBondContact NH2-O 2.64Å; A579-H583 PolarHBondContact O-ND1 3.42Å; F580-H583 PolarHBondContact O-N 3.26Å
584	S	40.7	Very low	64.4	Low	79 Å²	79	89.7 Å²	89.7	55%	0.552	48%	0.477	S	S	*	.			trans	-133.7	0	179.3	-68.2	0	0	0	0	111.5	Q404 F580	Q404-S584 PolarHBondContact NE2-O 3.04Å; F580-S584 PolarHBondContact O-N 2.91Å; F580-S584 PolarHBondContact O-OG 2.98Å

Retrieved 584 of 584 residues in 682.3 ms (Link to these results)

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