A0A096NVN3_PAPAN Loading...

Protein PALS1

AlphaFold DB (A0A2K5UDI3), UniProt , Accession A0A096NVN3, Species PAPAN (Papio anubis, Olive baboon), Gene PALS1, Length 675 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.6	Very low	26.8	Very low	250 Å²	250	153.3 Å²	153.3	100%	1.232	86%	0.862	S	S	*	*				0	117.8	0	-81.3	178.3	178	0	0	107.6
2	T	30.4	Very low	26.8	Very low	135 Å²	135	155.3 Å²	155.3	83%	0.828	86%	0.859	S	S	*	*			trans	-71.2	140.9	177	25.8	0	0	0	0	111.2
3	T	27.6	Very low	26.7	Very low	143 Å²	143	157 Å²	157	88%	0.877	86%	0.857	S	S	*	*				-170	124.4	128.2	33.8	0	0	0	0	110.3
4	S	26.9	Very low	26.8	Very low	104 Å²	104	152.9 Å²	152.9	73%	0.727	85%	0.846	S	S	*	*			trans	-85.7	152.9	170.1	40.2	0	0	0	0	110.2
5	H	26.2	Very low	26.8	Very low	198 Å²	198	153 Å²	153	92%	0.917	84%	0.844	S	S	*	*			trans	-152.8	117.3	146.4	-95.2	-59.4	0	0	0	111.1
6	M	25.3	Very low	26.7	Very low	166 Å²	166	149.6 Å²	149.6	82%	0.818	84%	0.835	S	S	*	*			trans	-85.8	149.3	161.9	-83.1	168.3	56.8	0	0	110.6
7	N	26.6	Very low	26.6	Very low	166 Å²	166	151.1 Å²	151.1	89%	0.888	83%	0.834	S	S	*	*			trans	160.6	125.4	141.3	-84.1	-10.5	0	0	0	105.8
8	G	24.4	Very low	26.7	Very low	69 Å²	69	149.2 Å²	149.2	71%	0.711	83%	0.827	S	S	*	*			cis	118.6	99.6	20.6	0	0	0	0	0	108.7
9	H	25.1	Very low	26.7	Very low	198 Å²	198	152 Å²	152	92%	0.917	83%	0.83	S	S	*	*			trans	-161.7	135.3	146.7	-127	48.5	0	0	0	113.3
10	V	25.7	Very low	26.7	Very low	113 Å²	113	151.4 Å²	151.4	69%	0.685	83%	0.826	S	S	*	*			trans	-98.3	144.7	178.8	168.1	0	0	0	0	108
11	T	26.1	Very low	26.7	Very low	144 Å²	144	150.5 Å²	150.5	88%	0.883	83%	0.825	S	S	*	*			trans	-149.5	127.1	144.5	20.6	0	0	0	0	108.7
12	E	26.1	Very low	26.4	Very low	177 Å²	177	145.2 Å²	145.2	83%	0.827	80%	0.801	S	S	*	*			trans	-83	-179.1	172.9	-70.3	-173.8	144.3	0	0	111.9
13	E	26	Very low	26.2	Very low	178 Å²	178	146.6 Å²	146.6	83%	0.832	80%	0.803	S	S	*	*			trans	105.1	98.7	168.7	-65	-170.7	161.6	0	0	113.6
14	S	28.2	Very low	26.1	Very low	100 Å²	100	144.2 Å²	144.2	70%	0.699	80%	0.798	S	S	*	*				84.7	117.7	64.8	72.6	0	0	0	0	114.2
15	D	26.3	Very low	26	Very low	154 Å²	154	144.5 Å²	144.5	82%	0.824	80%	0.8	S	S	*	*			trans	59.9	131.3	144.6	-78.2	-15.9	0	0	0	124.4
16	S	25.9	Very low	26.6	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	79%	0.79	S	S	*	*			trans	98	112.9	131.8	69.8	0	0	0	0	119.9
17	E	25.2	Very low	26.8	Very low	175 Å²	175	141.5 Å²	141.5	82%	0.818	79%	0.794	S	S	*	*				79.7	113.9	125.5	-70.9	-169	152.4	0	0	121.7
18	V	27.8	Very low	26.8	Very low	117 Å²	117	141.4 Å²	141.4	71%	0.709	79%	0.788	S	S	*	*				65.7	115.5	124.6	-173.7	0	0	0	0	117.6
19	K	25.9	Very low	27	Very low	202 Å²	202	144.1 Å²	144.1	88%	0.878	78%	0.782	S	S	*	*				-158.6	108.2	127	-107.6	166.9	-168.9	179.7	0	111.9
20	N	28.1	Very low	27.1	Very low	140 Å²	140	141.1 Å²	141.1	75%	0.749	77%	0.768	S	S	*	*			trans	-64.3	145.3	155.6	-89.3	-30.2	0	0	0	110.7
21	V	26.6	Very low	27.2	Very low	133 Å²	133	144 Å²	144	81%	0.806	77%	0.772	S	S	*	*			trans	-145.5	97	146.8	-174.9	0	0	0	0	104.8
22	D	23.7	Very low	27.2	Very low	138 Å²	138	145.7 Å²	145.7	74%	0.738	77%	0.769	S	S	*	*				66.1	137.5	77.5	-92.1	-21.4	0	0	0	117
23	L	26.4	Very low	27.2	Very low	164 Å²	164	146.5 Å²	146.5	86%	0.859	76%	0.764	S	S	*	*			trans	98.2	120.1	165.2	-57.5	150.1	0	0	0	115.1
24	A	26.4	Very low	27.2	Very low	94 Å²	94	144.4 Å²	144.4	78%	0.777	76%	0.755	S	S	*	*			cis	-156.4	143	28.6	0	0	0	0	0	114.7
25	S	24.7	Very low	27	Very low	110 Å²	110	148.1 Å²	148.1	77%	0.769	76%	0.763	S	S	*	*			trans	-74.8	-167.1	163	-2.9	0	0	0	0	112
26	P	38.7	Very low	27.3	Very low	111 Å²	111	145 Å²	145	72%	0.721	76%	0.759	S	S	*	*			cis	-130.9	150.9	-17	22.7	1.3	0	0	0	113.8
27	E	28.7	Very low	27.3	Very low	189 Å²	189	147.4 Å²	147.4	88%	0.883	77%	0.769	S	S	*	*				47.4	134.4	105.2	-65.8	-163.9	157.1	0	0	120.2
28	E	27.4	Very low	27.3	Very low	165 Å²	165	146.2 Å²	146.2	77%	0.771	77%	0.768	S	S	*	*				-174.1	142.3	119.8	-88.1	-168	163.9	0	0	107.2
29	H	27.1	Very low	27.6	Very low	126 Å²	126	146.4 Å²	146.4	58%	0.583	77%	0.774	S	S	*	*			cis	-165.4	139.1	19.2	-108	-1.2	0	0	0	112.6
30	Q	28.2	Very low	28	Very low	135 Å²	135	143 Å²	143	63%	0.631	77%	0.772	S	S	*	*				48.7	144.9	128.7	-65	-176.4	12.5	0	0	121.3
31	K	26.8	Very low	28	Very low	174 Å²	174	139.9 Å²	139.9	76%	0.757	77%	0.773	S	S	*	*			cis	-170.3	156.9	7.8	-116.1	167.4	-172.5	156.8	0	109.7
32	H	26.2	Very low	28.1	Very low	178 Å²	178	140.6 Å²	140.6	82%	0.824	77%	0.772	S	S	*	*			trans	-61.8	151.7	176.9	-93.2	-93.4	0	0	0	117.8
33	R	26.7	Very low	28.3	Very low	194 Å²	194	141.7 Å²	141.7	73%	0.732	78%	0.777	S	S	*	*				125.3	125.4	110.5	-115	-177.7	164.1	173	-11	118.9
34	E	26.6	Very low	28.3	Very low	134 Å²	134	137.5 Å²	137.5	63%	0.626	77%	0.773	S	S	*	*				69.9	125.4	129.6	-90.6	167.3	-153.7	0	0	124.7
35	M	24.7	Very low	29	Very low	178 Å²	178	139.9 Å²	139.9	88%	0.877	78%	0.779	S	S	*	*			trans	92	142.5	134.4	-68	-130.6	-51.2	0	0	122.8
36	A	32.3	Very low	29.3	Very low	90 Å²	90	146.4 Å²	146.4	74%	0.744	79%	0.786	S	S	*	*			trans	-75	159.4	-168.9	0	0	0	0	0	115.8
37	V	26.2	Very low	29.4	Very low	148 Å²	148	149 Å²	149	90%	0.897	79%	0.791	S	S	*	*			trans	-157.6	154	143.6	-130	0	0	0	0	112.9
38	D	24.4	Very low	29.8	Very low	151 Å²	151	148.2 Å²	148.2	81%	0.807	79%	0.789	S	S	*	*			trans	-51.8	164.2	-175.6	-73.5	-56.9	0	0	0	120.7
39	C	34.3	Very low	30.2	Very low	121 Å²	121	145.1 Å²	145.1	82%	0.818	78%	0.784	S	S	*	*			trans	-57.8	159.8	162.7	-58.4	0	0	0	0	114.4
40	P	34.9	Very low	31.1	Very low	131 Å²	131	145.8 Å²	145.8	85%	0.851	79%	0.79	S	S	*	*				-139.6	161.4	117.8	34	-18.9	0	0	0	110.9
41	G	26.6	Very low	32.1	Very low	73 Å²	73	150.5 Å²	150.5	75%	0.753	80%	0.802	S	S	*	*			cis	131.6	103.4	21.8	0	0	0	0	0	109
42	D	29.3	Very low	33.2	Very low	149 Å²	149	152.5 Å²	152.5	80%	0.797	80%	0.804	S	S	*	*			trans	69.7	138.6	149.2	-112.5	-5.1	0	0	0	125.8
43	L	28.7	Very low	34.5	Very low	161 Å²	161	147.2 Å²	147.2	84%	0.843	79%	0.788	S	S	*	*			trans	58	122.4	151.8	-60.3	166.4	0	0	0	121.6
44	G	26.5	Very low	35.8	Very low	76 Å²	76	140.2 Å²	140.2	78%	0.784	77%	0.771	S	S	*	*			trans	149	100.1	148.6	0	0	0	0	0	117.4
45	T	40	Very low	36.9	Very low	144 Å²	144	139.8 Å²	139.8	88%	0.883	77%	0.769	S	S	*	*			trans	-32.4	123.3	165.5	-42.4	0	0	0	0	115.6
46	R	31.8	Very low	38.3	Very low	247 Å²	247	137.2 Å²	137.2	93%	0.932	76%	0.759	S	S	*	*			trans	-158.6	131.6	149.4	-115.1	172.1	-176.7	-176.9	1.4	112.5
47	M	40.6	Very low	39.7	Very low	166 Å²	166	138.9 Å²	138.9	82%	0.818	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-61.8	139	-168.1	-64.6	166.5	55.1	0	0	114.5
48	M	35.8	Very low	41.6	Very low	171 Å²	171	139.8 Å²	139.8	84%	0.842	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-83.6	154.6	163.9	-82.5	-77.1	-153.3	0	0	111.4
49	P	36.1	Very low	43.5	Very low	101 Å²	101	136.3 Å²	136.3	66%	0.656	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-73.8	137.9	-167.5	-5.5	20.6	0	0	0	113.2	R51	P49-R51 PolarHBondContact O-N 2.79Å
50	I	46.7	Very low	45.1	Very low	139 Å²	139	138.5 Å²	138.5	71%	0.713	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	0.9	-174.6	-71.8	160.4	0	0	0	116.1
51	R	49.4	Very low	46.7	Very low	234 Å²	234	138.1 Å²	138.1	88%	0.883	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-11.6	-178	-82.8	-172.3	177.5	-179.3	0.2	116.5	P49	P49-R51 PolarHBondContact O-N 2.79Å
52	R	49.1	Very low	48.6	Very low	216 Å²	216	141.1 Å²	141.1	82%	0.815	69%	0.691	S	S	*	*	S	Bend	trans	-97.2	-16.6	177.8	-85.9	-173.7	178.4	177.4	0	115.3
53	S	53.3	Low	50.3	Low	67 Å²	67	140.1 Å²	140.1	47%	0.469	68%	0.682	S	S	.	*	H	α-helix	trans	-76.7	-40.1	178.1	53.3	0	0	0	0	113.2	Q55 L56 E57	S53-Q55 PolarHBondContact O-N 3.17Å; S53-Q55 VanDerWaalsContact O-N 3.12Å; S53-L56 PolarHBondContact O-N 3.12Å; S53-E57 PolarHBondContact O-N 3.44Å
54	A	53.8	Low	52.2	Low	47 Å²	47	138.1 Å²	138.1	39%	0.388	67%	0.668	S	S	.	*	H	α-helix	trans	-67.6	-13.2	-177.9	0	0	0	0	0	115.1	R58	A54-R58 PolarHBondContact O-NE 2.73Å
55	Q	50.7	Low	54.3	Low	126 Å²	126	139 Å²	139	59%	0.589	66%	0.655	S	S	*	*	H	α-helix	trans	-88.7	-37.9	174.6	-169.3	174.1	-3	0	0	111.2	S53 I59	S53-Q55 PolarHBondContact O-N 3.17Å; S53-Q55 VanDerWaalsContact O-N 3.12Å; Q55-I59 HydrophobicContact CG-CD1 4.39Å; Q55-I59 WeakPolarHBondContact O-CD1 3.5Å; Q55-I59 VanDerWaalsContact O-CG1 3.3Å; Q55-I59 WeakPolarHBondContact O-CG1 3.36Å; Q55-I59 PolarHBondContact O-N 3.45Å
56	L	52.9	Low	55.4	Low	124 Å²	124	138 Å²	138	65%	0.649	64%	0.641	S	S	*	*	H	α-helix	trans	-70.1	-37.6	175.2	-79.8	157.2	0	0	0	112	S53 R58 I59 R60	S53-L56 PolarHBondContact O-N 3.12Å; L56-R58 PolarHBondContact O-N 3.04Å; L56-I59 PolarHBondContact O-N 3.47Å; L56-R60 PolarHBondContact O-N 3Å
57	E	62.5	Low	57.1	Low	124 Å²	124	134.9 Å²	134.9	58%	0.579	63%	0.63	S	S	*	*	H	α-helix	trans	-62.1	-42.1	174.7	-139.3	100.2	-145.1	0	0	111.6	S53 R60 Q61	S53-E57 PolarHBondContact O-N 3.44Å; E57-R60 PolarHBondContact O-N 3Å; E57-Q61 WeakPolarHBondContact O-CB 3.45Å; E57-Q61 PolarHBondContact O-N 2.99Å
58	R	65.3	Low	58.4	Low	168 Å²	168	135 Å²	135	63%	0.634	62%	0.621	S	S	*	*	H	α-helix	trans	-65.8	-39.1	178	-93	-175.8	-80.9	-162.8	-4.2	113	A54 L56 Q62	A54-R58 PolarHBondContact O-NE 2.73Å; L56-R58 PolarHBondContact O-N 3.04Å; R58-Q62 WeakPolarHBondContact O-CB 3.49Å; R58-Q62 WeakPolarHBondContact O-CG 3.45Å; R58-Q62 PolarHBondContact O-N 2.91Å
59	I	65.7	Low	59.7	Low	78 Å²	78	135.1 Å²	135.1	40%	0.4	61%	0.612	S	S	.	*	H	α-helix	trans	-67.3	-40.8	177.5	-68.6	166.2	0	0	0	110.3	Q55 L56 Q62 Q63	Q55-I59 HydrophobicContact CG-CD1 4.39Å; Q55-I59 WeakPolarHBondContact O-CD1 3.5Å; Q55-I59 VanDerWaalsContact O-CG1 3.3Å; Q55-I59 WeakPolarHBondContact O-CG1 3.36Å; Q55-I59 PolarHBondContact O-N 3.45Å; L56-I59 PolarHBondContact O-N 3.47Å; I59-Q62 PolarHBondContact O-N 3.03Å; I59-Q63 WeakPolarHBondContact O-CG 3.34Å; I59-Q63 PolarHBondContact O-N 3.17Å; I59-Q63 VanDerWaalsContact O-N 3.08Å
60	R	67.7	Low	60.9	Low	167 Å²	167	139.3 Å²	139.3	63%	0.63	62%	0.615	S	S	*	*	H	α-helix	trans	-65.4	-42.4	177.3	-166.7	177	-178.9	169.6	2.4	112	L56 E57 Q63 E64	L56-R60 PolarHBondContact O-N 3Å; E57-R60 PolarHBondContact O-N 3Å; R60-Q63 PolarHBondContact O-N 3.23Å; R60-E64 PolarHBondContact O-N 3.49Å
61	Q	68.7	Low	61.4	Low	123 Å²	123	138.7 Å²	138.7	58%	0.575	61%	0.609	S	S	*	*	H	α-helix	trans	-68.8	-35.5	179.6	-149.9	158.5	21	0	0	112.3	E57 D65	E57-Q61 WeakPolarHBondContact O-CB 3.45Å; E57-Q61 PolarHBondContact O-N 2.99Å; Q61-D65 WeakPolarHBondContact O-CB 3.45Å; Q61-D65 PolarHBondContact O-N 2.64Å
62	Q	65.9	Low	61.5	Low	136 Å²	136	133.5 Å²	133.5	64%	0.636	60%	0.595	S	S	*	*	H	α-helix	trans	-67.1	-35.3	171.4	-79.9	-175.4	-34.9	0	0	113.2	R58 I59 M66	R58-Q62 WeakPolarHBondContact O-CB 3.49Å; R58-Q62 WeakPolarHBondContact O-CG 3.45Å; R58-Q62 PolarHBondContact O-N 2.91Å; I59-Q62 PolarHBondContact O-N 3.03Å; Q62-M66 PolarHBondContact O-N 3.2Å; Q62-M66 VanDerWaalsContact O-N 3.09Å
63	Q	64.4	Low	61.6	Low	128 Å²	128	129.6 Å²	129.6	60%	0.598	59%	0.586	S	S	*	*	H	α-helix	trans	-71.6	-37.9	176.7	-76.7	179.6	-8.1	0	0	112.3	I59 R60 R67	I59-Q63 WeakPolarHBondContact O-CG 3.34Å; I59-Q63 PolarHBondContact O-N 3.17Å; I59-Q63 VanDerWaalsContact O-N 3.08Å; R60-Q63 PolarHBondContact O-N 3.23Å; Q63-R67 WeakPolarHBondContact O-CB 3.3Å; Q63-R67 PolarHBondContact O-N 3.06Å; Q63-R67 VanDerWaalsContact O-N 3.08Å
64	E	69.8	Low	61.4	Low	119 Å²	119	129.4 Å²	129.4	56%	0.556	59%	0.594	S	S	*	*	H	α-helix	trans	-68.3	-41	173.8	-89.1	174	169.9	0	0	112.5	R60 M66 R67 R68	R60-E64 PolarHBondContact O-N 3.49Å; E64-M66 PolarHBondContact O-N 3.49Å; E64-R67 PolarHBondContact O-N 3.33Å; E64-R68 WeakPolarHBondContact O-CB 3.45Å; E64-R68 PolarHBondContact O-N 3.39Å
65	D	70.1	Confident	60.9	Low	94 Å²	94	136.3 Å²	136.3	50%	0.503	62%	0.615	S	S	.	*	H	α-helix	trans	-64.3	-37.9	175	-91.6	-4.6	0	0	0	112.4	Q61 R69	Q61-D65 WeakPolarHBondContact O-CB 3.45Å; Q61-D65 PolarHBondContact O-N 2.64Å; D65-R69 WeakPolarHBondContact O-CG 3.47Å; D65-R69 PolarHBondContact O-N 3.37Å
66	M	62.1	Low	60.8	Low	122 Å²	122	139.3 Å²	139.3	60%	0.601	63%	0.626	S	S	*	*	H	α-helix	trans	-66.6	-36	173.2	-81.9	-142.7	-65.8	0	0	112.6	Q62 E64 R70	Q62-M66 PolarHBondContact O-N 3.2Å; Q62-M66 VanDerWaalsContact O-N 3.09Å; E64-M66 PolarHBondContact O-N 3.49Å; M66-R70 PolarHBondContact O-N 3.03Å; M66-R70 VanDerWaalsContact O-N 3.1Å
67	R	68.6	Low	60.4	Low	182 Å²	182	140.4 Å²	140.4	69%	0.687	63%	0.628	S	S	*	*	H	α-helix	trans	-69.8	-40	178.1	-152.2	176.1	-171.2	174.8	2.7	111.2	Q63 E64 R70 E71	Q63-R67 WeakPolarHBondContact O-CB 3.3Å; Q63-R67 PolarHBondContact O-N 3.06Å; Q63-R67 VanDerWaalsContact O-N 3.08Å; E64-R67 PolarHBondContact O-N 3.33Å; R67-R70 PolarHBondContact O-N 2.98Å; R67-E71 PolarHBondContact O-N 3.02Å
68	R	67.3	Low	59.4	Low	168 Å²	168	144 Å²	144	63%	0.634	65%	0.645	S	S	*	*	H	α-helix	trans	-67.7	-37.8	177.1	-149.9	175.9	179.8	-172.4	-0.4	112.4	E64 E71 E72	E64-R68 WeakPolarHBondContact O-CB 3.45Å; E64-R68 PolarHBondContact O-N 3.39Å; R68-E71 PolarHBondContact O-N 3.25Å; R68-E72 WeakPolarHBondContact O-CG 3.49Å; R68-E72 PolarHBondContact O-N 3.05Å
69	R	63.9	Low	58.1	Low	175 Å²	175	142.3 Å²	142.3	66%	0.66	65%	0.648	S	S	*	*	H	α-helix	trans	-64.6	-40.2	171.3	-76.9	-176.9	-177.7	-176.8	1.8	112.8	D65 E72 E73	D65-R69 WeakPolarHBondContact O-CG 3.47Å; D65-R69 PolarHBondContact O-N 3.37Å; R69-E72 PolarHBondContact O-N 3.08Å; R69-E73 WeakPolarHBondContact O-CB 3.39Å; R69-E73 WeakPolarHBondContact O-CG 3.43Å; R69-E73 PolarHBondContact O-N 3.49Å
70	R	60.1	Low	57.3	Low	188 Å²	188	143.7 Å²	143.7	71%	0.709	66%	0.656	S	S	*	*	H	α-helix	trans	-65.7	-35.5	174.9	-79.4	-177.3	176.9	-179.4	-0.7	112.9	M66 R67 G74	M66-R70 PolarHBondContact O-N 3.03Å; M66-R70 VanDerWaalsContact O-N 3.1Å; R67-R70 PolarHBondContact O-N 2.98Å; R70-G74 PolarHBondContact O-N 3.34Å
71	E	57.4	Low	56	Low	126 Å²	126	143.3 Å²	143.3	59%	0.589	67%	0.665	S	S	*	*	H	α-helix	trans	-74.2	-32	175.3	-75.4	178.2	-177.2	0	0	113	R67 R68 K75	R67-E71 PolarHBondContact O-N 3.02Å; R68-E71 PolarHBondContact O-N 3.25Å; E71-K75 PolarHBondContact O-N 2.85Å
72	E	52.3	Low	55.1	Low	125 Å²	125	143 Å²	143	58%	0.584	67%	0.668	S	S	*	*	H	α-helix	trans	-74.5	-35	172.8	-76.2	-179.6	177.5	0	0	112.9	R68 R69	R68-E72 WeakPolarHBondContact O-CG 3.49Å; R68-E72 PolarHBondContact O-N 3.05Å; R69-E72 PolarHBondContact O-N 3.08Å
73	E	51.7	Low	54.2	Low	135 Å²	135	140.6 Å²	140.6	63%	0.631	67%	0.666	S	S	*	*	H	α-helix	trans	-71.5	-38.1	172.5	-75.2	175.9	171	0	0	111.7	R69 K75 K76	R69-E73 WeakPolarHBondContact O-CB 3.39Å; R69-E73 WeakPolarHBondContact O-CG 3.43Å; R69-E73 PolarHBondContact O-N 3.49Å; E73-K75 VanDerWaalsContact C-N 3.3Å; E73-K75 PolarHBondContact O-N 2.94Å; E73-K76 PolarHBondContact O-N 3.37Å
74	G	47.8	Very low	53.8	Low	62 Å²	62	136.7 Å²	136.7	64%	0.639	65%	0.653	S	S	*	*	H	α-helix	trans	-67.7	-22	176.6	0	0	0	0	0	114.9	R70	R70-G74 PolarHBondContact O-N 3.34Å
75	K	45.1	Very low	52.8	Low	192 Å²	192	138.7 Å²	138.7	84%	0.835	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	0.2	174.9	-80.3	-177.9	177.3	175.8	0	114.4	E71 E73	E71-K75 PolarHBondContact O-N 2.85Å; E73-K75 VanDerWaalsContact C-N 3.3Å; E73-K75 PolarHBondContact O-N 2.94Å
76	K	47.1	Very low	51.7	Low	189 Å²	189	144 Å²	144	82%	0.822	68%	0.677	S	S	*	*	S	Bend	trans	-115.1	12.2	-177.6	-99	-177.3	178.1	177.2	0	115.2	E73	E73-K76 PolarHBondContact O-N 3.37Å
77	Q	44.3	Very low	51.1	Low	148 Å²	148	143.5 Å²	143.5	69%	0.692	68%	0.677	S	S	*	*			trans	-130.7	47.7	-176.6	-123.4	170.1	19.5	0	0	113.7	L79	Q77-L79 HydrophobicContact CG-CD1 3.98Å; Q77-L79 HydrophobicContact CG-CG 4.15Å; Q77-L79 PolarHBondContact O-N 3.43Å
78	E	41.6	Very low	50.4	Low	200 Å²	200	140.1 Å²	140.1	94%	0.935	67%	0.667	S	S	*	*			trans	-79.2	93.1	143.8	-87.8	-174.2	156.7	0	0	107.2	D80	E78-D80 PolarHBondContact O-N 3.03Å
79	L	39	Very low	49.6	Very low	131 Å²	131	139.8 Å²	139.8	69%	0.686	67%	0.67	S	S	*	*			trans	-80	102.5	171	-80.2	161.5	0	0	0	108.4	Q77 L81	Q77-L79 HydrophobicContact CG-CD1 3.98Å; Q77-L79 HydrophobicContact CG-CG 4.15Å; Q77-L79 PolarHBondContact O-N 3.43Å; L79-L81 PolarHBondContact O-N 3.09Å
80	D	48.2	Very low	48.8	Very low	107 Å²	107	136.8 Å²	136.8	57%	0.572	67%	0.666	S	S	*	*			trans	-59	106.4	167.7	178.7	8.1	0	0	0	109.8	E78 N82 S83	E78-D80 PolarHBondContact O-N 3.03Å; D80-N82 PolarHBondContact O-N 3.47Å; D80-N82 PolarHBondContact OD1-N 3.44Å; D80-S83 PolarHBondContact O-N 3.17Å; D80-S83 PolarHBondContact O-OG 2.9Å
81	L	41.8	Very low	48.3	Very low	159 Å²	159	132.1 Å²	132.1	83%	0.832	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-7.6	-175.4	-75.8	157.1	0	0	0	113.9	L79	L79-L81 PolarHBondContact O-N 3.09Å
82	N	47.9	Very low	47.8	Very low	116 Å²	116	133.6 Å²	133.6	62%	0.62	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-0.8	179.7	-80.5	-47.2	0	0	0	115.8	D80 K88	D80-N82 PolarHBondContact O-N 3.47Å; D80-N82 PolarHBondContact OD1-N 3.44Å; N82-K88 PolarHBondContact O-NZ 2.88Å
83	S	48.7	Very low	47.6	Very low	87 Å²	87	132.7 Å²	132.7	61%	0.608	67%	0.673	S	S	*	*			trans	-85.8	-14.5	-173.9	62.5	0	0	0	0	114.8	D80 M85	D80-S83 PolarHBondContact O-N 3.17Å; D80-S83 PolarHBondContact O-OG 2.9Å; S83-M85 PolarHBondContact O-N 3.21Å
84	S	55.8	Low	47.5	Very low	46 Å²	46	131.2 Å²	131.2	32%	0.322	68%	0.675	S	S	.	*			trans	-86.5	104.1	-176.4	-177.7	0	0	0	0	112.9	R86 L87 K88	S84-R86 PolarHBondContact O-N 3Å; S84-R86 VanDerWaalsContact O-N 3.12Å; S84-L87 PolarHBondContact O-N 2.72Å; S84-K88 PolarHBondContact O-N 2.96Å
85	M	47.6	Very low	47.5	Very low	160 Å²	160	134.3 Å²	134.3	79%	0.788	68%	0.684	S	S	*	*	H	α-helix	trans	-56.5	-23.1	172.2	-74.6	-85.8	-77.7	0	0	113.5	S83 K89	S83-M85 PolarHBondContact O-N 3.21Å; M85-K89 PolarHBondContact O-N 3.02Å
86	R	48.2	Very low	47.3	Very low	206 Å²	206	134.4 Å²	134.4	78%	0.777	68%	0.684	S	S	*	*	H	α-helix	trans	-78.7	-37.6	179.4	-161.9	174.8	-179.9	175.6	-1.3	111.9	S84 K89 L90	S84-R86 PolarHBondContact O-N 3Å; S84-R86 VanDerWaalsContact O-N 3.12Å; R86-K89 PolarHBondContact O-N 3.34Å; R86-L90 PolarHBondContact O-N 3.31Å
87	L	48	Very low	47.4	Very low	112 Å²	112	132.2 Å²	132.2	59%	0.586	69%	0.687	S	S	*	*	H	α-helix	trans	-72	-37.3	176.5	-83.1	159.1	0	0	0	112	S84 K89 L90 A91	S84-L87 PolarHBondContact O-N 2.72Å; L87-K89 VanDerWaalsContact C-N 3.28Å; L87-K89 PolarHBondContact O-N 3.13Å; L87-L90 PolarHBondContact O-N 3.21Å; L87-L90 VanDerWaalsContact O-N 3.17Å; L87-A91 PolarHBondContact O-N 3.39Å; L87-A91 VanDerWaalsContact O-N 3.1Å
88	K	53.8	Low	47	Very low	111 Å²	111	128.1 Å²	128.1	48%	0.483	69%	0.685	S	S	.	*	H	α-helix	trans	-61.1	-35.3	171.1	-80.6	179.8	176.6	167	0	113	N82 S84 Q92	N82-K88 PolarHBondContact O-NZ 2.88Å; S84-K88 PolarHBondContact O-N 2.96Å; K88-Q92 WeakPolarHBondContact O-CG 3.41Å
89	K	52.5	Low	47	Very low	160 Å²	160	126.9 Å²	126.9	70%	0.696	68%	0.683	S	S	*	*	H	α-helix	trans	-71.6	-29.5	175.4	-106	-178.8	177.5	179.4	0	113.4	M85 R86 L87 I93	M85-K89 PolarHBondContact O-N 3.02Å; R86-K89 PolarHBondContact O-N 3.34Å; L87-K89 VanDerWaalsContact C-N 3.28Å; L87-K89 PolarHBondContact O-N 3.13Å; K89-I93 WeakPolarHBondContact O-CG1 3.29Å
90	L	45.4	Very low	46.9	Very low	112 Å²	112	127.7 Å²	127.7	59%	0.586	69%	0.688	S	S	*	*	H	α-helix	trans	-74.8	-36.7	176.4	-99.7	137.7	0	0	0	112.3	R86 L87 Q92 I93	R86-L90 PolarHBondContact O-N 3.31Å; L87-L90 PolarHBondContact O-N 3.21Å; L87-L90 VanDerWaalsContact O-N 3.17Å; L90-Q92 PolarHBondContact O-N 3.37Å; L90-I93 PolarHBondContact O-N 3.39Å
91	A	49.7	Very low	46.2	Very low	90 Å²	90	128.4 Å²	128.4	74%	0.744	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-14.9	177.1	0	0	0	0	0	114.3	L87	L87-A91 PolarHBondContact O-N 3.39Å; L87-A91 VanDerWaalsContact O-N 3.1Å
92	Q	47.8	Very low	46.1	Very low	158 Å²	158	125.8 Å²	125.8	74%	0.738	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-0	178.9	-70.2	178.8	3.7	0	0	113.5	K88 L90	K88-Q92 WeakPolarHBondContact O-CG 3.41Å; L90-Q92 PolarHBondContact O-N 3.37Å
93	I	48.3	Very low	45.4	Very low	106 Å²	106	128 Å²	128	54%	0.544	69%	0.693	S	S	.	*	S	Bend	trans	-87.1	117.5	175.7	-61.4	168.1	0	0	0	107.1	K89 L90	K89-I93 WeakPolarHBondContact O-CG1 3.29Å; L90-I93 PolarHBondContact O-N 3.39Å
94	P	50.2	Low	44.8	Very low	103 Å²	103	131.9 Å²	131.9	67%	0.669	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-60.8	141.3	172.6	-4	14.6	0	0	0	108.8	K96	P94-K96 PolarHBondContact O-N 3.24Å
95	P	46.8	Very low	43.6	Very low	128 Å²	128	135.9 Å²	135.9	83%	0.831	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-58.9	118.8	-177.2	24	-31.7	0	0	0	109	T97	P95-T97 PolarHBondContact O-N 3.31Å
96	K	39.9	Very low	42.9	Very low	193 Å²	193	133.7 Å²	133.7	84%	0.839	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-69	124.4	165.6	-74.9	-173.6	176.4	-176.5	0	106.5	P94 G98	P94-K96 PolarHBondContact O-N 3.24Å; K96-G98 PolarHBondContact O-N 3.12Å
97	T	50.1	Low	42	Very low	143 Å²	143	132.2 Å²	132.2	88%	0.877	71%	0.714	S	S	*	*			trans	-51.4	109	168.5	35.7	0	0	0	0	109	P95	P95-T97 PolarHBondContact O-N 3.31Å
98	G	36.2	Very low	41.3	Very low	63 Å²	63	135.4 Å²	135.4	65%	0.649	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-72.5	145.2	165.8	0	0	0	0	0	109	K96	K96-G98 PolarHBondContact O-N 3.12Å
99	I	41.9	Very low	40	Very low	174 Å²	174	133.1 Å²	133.1	89%	0.892	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-74.5	125.6	175	-65.2	165.5	0	0	0	107.3
100	D	36	Very low	38.8	Very low	148 Å²	148	132.3 Å²	132.3	79%	0.791	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-58	135.5	178.2	-69.1	-43.6	0	0	0	111.6	P102	D100-P102 WeakPolarHBondContact O-CD 3.42Å
101	N	34.6	Very low	37.9	Very low	122 Å²	122	133.3 Å²	133.3	65%	0.652	74%	0.741	S	S	*	*			trans	-98.3	106.2	171.1	-175.9	16.9	0	0	0	107.9	M103	N101-M103 PolarHBondContact O-N 3.41Å
102	P	38.4	Very low	36.9	Very low	104 Å²	104	136.1 Å²	136.1	68%	0.675	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	22.3	-167.9	32.3	-35.8	0	0	0	114.4	D100	D100-P102 WeakPolarHBondContact O-CD 3.42Å
103	M	33.9	Very low	35.9	Very low	161 Å²	161	136.2 Å²	136.2	79%	0.793	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	-2.1	174.5	-148.7	-168.7	-75.5	0	0	113	N101	N101-M103 PolarHBondContact O-N 3.41Å
104	F	35.9	Very low	34.8	Very low	169 Å²	169	134.6 Å²	134.6	74%	0.741	74%	0.741	S	S	*	*			trans	-135.2	57.5	169.6	-80.8	-88.7	0	0	0	108.7	T106	F104-T106 PolarHBondContact O-N 3.18Å
105	D	30.3	Very low	33.9	Very low	130 Å²	130	134.9 Å²	134.9	70%	0.695	74%	0.743	S	S	*	*			trans	-72.4	88	153.6	-94	-28.1	0	0	0	106.6	E107	D105-E107 PolarHBondContact O-N 3.15Å
106	T	32.4	Very low	33.2	Very low	114 Å²	114	136.5 Å²	136.5	70%	0.699	74%	0.739	S	S	*	*			trans	-66.2	86.3	150.3	43.8	0	0	0	0	106.3	F104 E108	F104-T106 PolarHBondContact O-N 3.18Å; T106-E108 PolarHBondContact O-N 3.33Å
107	E	30.8	Very low	33.2	Very low	175 Å²	175	137.4 Å²	137.4	82%	0.818	74%	0.739	S	S	*	*	S	Bend	trans	-59	119.1	159.3	-76.7	-163.7	158.8	0	0	107.3	D105	D105-E107 PolarHBondContact O-N 3.15Å
108	E	31.3	Very low	32.7	Very low	179 Å²	179	133.8 Å²	133.8	84%	0.836	72%	0.723	S	S	*	*	S	Bend	trans	63.8	101.8	-179.6	-57	-165.9	165.8	0	0	115.1	T106 I110	T106-E108 PolarHBondContact O-N 3.33Å; E108-I110 PolarHBondContact O-N 2.98Å
109	G	26.7	Very low	33.2	Very low	64 Å²	64	134.6 Å²	134.6	66%	0.66	72%	0.716	S	S	*	*			trans	-50	107.1	161.3	0	0	0	0	0	109.4	I111	G109-I111 PolarHBondContact O-N 3.45Å
110	I	27.4	Very low	33.7	Very low	143 Å²	143	135.2 Å²	135.2	73%	0.733	71%	0.712	S	S	*	*			trans	-62.4	84.2	147.5	-54.4	173.9	0	0	0	104.2	E108 L112	E108-I110 PolarHBondContact O-N 2.98Å; I110-L112 HydrophobicContact CG2-CD2 3.85Å; I110-L112 HydrophobicContact CG2-CG 3.99Å; I110-L112 PolarHBondContact O-N 3.45Å
111	I	26.3	Very low	34.9	Very low	133 Å²	133	131.4 Å²	131.4	68%	0.682	69%	0.691	S	S	*	*			trans	-47.8	105.1	139.3	-64.3	170.2	0	0	0	102.3	G109 E113	G109-I111 PolarHBondContact O-N 3.45Å; I111-E113 HydrophobicContact CG2-CB 4.17Å; I111-E113 HydrophobicContact CG2-CG 3.81Å; I111-E113 PolarHBondContact O-N 3.3Å
112	L	29.3	Very low	36.6	Very low	148 Å²	148	130.2 Å²	130.2	78%	0.775	68%	0.684	S	S	*	*			trans	-65.5	65.8	160.7	-75.5	168.2	0	0	0	106.3	I110 S114	I110-L112 HydrophobicContact CG2-CD2 3.85Å; I110-L112 HydrophobicContact CG2-CG 3.99Å; I110-L112 PolarHBondContact O-N 3.45Å; L112-S114 PolarHBondContact O-N 2.97Å
113	E	27.2	Very low	38.6	Very low	160 Å²	160	131 Å²	131	75%	0.748	68%	0.679	S	S	*	*			trans	-62.8	85.3	137.5	-90.2	178.9	-168.8	0	0	102.5	I111 P115	I111-E113 HydrophobicContact CG2-CB 4.17Å; I111-E113 HydrophobicContact CG2-CG 3.81Å; I111-E113 PolarHBondContact O-N 3.3Å; E113-P115 VanDerWaalsContact O-N 3.15Å
114	S	26.1	Very low	40.9	Very low	72 Å²	72	124.6 Å²	124.6	50%	0.503	65%	0.647	S	S	.	*			trans	-41.3	127.6	150.5	-80.7	0	0	0	0	105.2	L112 H116	L112-S114 PolarHBondContact O-N 2.97Å; S114-H116 PolarHBondContact O-N 3.22Å
115	P	30.6	Very low	43.1	Very low	110 Å²	110	123.2 Å²	123.2	71%	0.714	64%	0.643	S	S	*	*			trans	-56.9	105.3	161.1	24.5	-28.3	0	0	0	103.4	E113 Y117	E113-P115 VanDerWaalsContact O-N 3.15Å; P115-Y117 PolarHBondContact O-N 3.35Å
116	H	32.6	Very low	45.6	Very low	162 Å²	162	120.4 Å²	120.4	75%	0.75	63%	0.628	S	S	*	*			trans	-63.3	86.1	173.8	-81.5	-70.5	0	0	0	105.3	S114 A118	S114-H116 PolarHBondContact O-N 3.22Å; H116-A118 VanDerWaalsContact CA-N 3.35Å; H116-A118 HydrophobicContact CB-CB 4.01Å; H116-A118 PolarHBondContact O-N 2.77Å
117	Y	38.4	Very low	48	Very low	212 Å²	212	117.4 Å²	117.4	83%	0.831	61%	0.607	S	S	*	*				-65.7	63.3	128.4	-64.9	-80.8	0	0	0	106	P115 V119	P115-Y117 PolarHBondContact O-N 3.35Å; Y117-V119 PolarHBondContact O-N 2.86Å
118	A	40.5	Very low	50.6	Low	66 Å²	66	111.2 Å²	111.2	55%	0.545	58%	0.578	S	S	.	*			trans	-61.1	95.7	153.7	0	0	0	0	0	102.4	H116 K120	H116-A118 VanDerWaalsContact CA-N 3.35Å; H116-A118 HydrophobicContact CB-CB 4.01Å; H116-A118 PolarHBondContact O-N 2.77Å; A118-K120 PolarHBondContact O-N 2.73Å
119	V	45.7	Very low	53.1	Low	81 Å²	81	106.3 Å²	106.3	49%	0.491	56%	0.563	S	S	.	*			trans	-47.6	107.9	161.3	174.4	0	0	0	0	103.1	Y117 I121	Y117-V119 PolarHBondContact O-N 2.86Å; V119-I121 WeakPolarHBondContact O-CG1 3.25Å; V119-I121 PolarHBondContact O-N 3.11Å
120	K	52.8	Low	55.9	Low	187 Å²	187	106.2 Å²	106.2	81%	0.813	55%	0.552	S	S	*	*			trans	-69	94.7	-178.2	-169.1	179.7	-178.3	-173.9	0	104.7	A118 L122	A118-K120 PolarHBondContact O-N 2.73Å; K120-L122 PolarHBondContact O-N 3.28Å
121	I	62.2	Low	58.6	Low	68 Å²	68	100.4 Å²	100.4	35%	0.349	52%	0.523	S	S	.	.			trans	-67	112	-177.9	-68	147.4	0	0	0	105.9	V119 E123 N167 V171	V119-I121 WeakPolarHBondContact O-CG1 3.25Å; V119-I121 PolarHBondContact O-N 3.11Å; I121-E123 PolarHBondContact O-N 3.44Å; I121-N167 HydrophobicContact CG2-CB 3.82Å; I121-N167 VanDerWaalsContact CG2-CG 3.48Å; I121-N167 WeakPolarHBondContact CG2-ND2 3.44Å; I121-V171 HydrophobicContact CD1-CB 4.49Å; I121-V171 HydrophobicContact CD1-CG2 3.15Å; I121-V171 HydrophobicContact CG1-CG2 4.29Å
122	L	69.4	Low	61.4	Low	96 Å²	96	98.7 Å²	98.7	50%	0.503	51%	0.51	S	S	.	.			trans	-68.6	127.3	175.8	-74.1	157.6	0	0	0	108.1	K120 D126 F163 N167	K120-L122 PolarHBondContact O-N 3.28Å; L122-D126 HydrophobicContact CD2-CB 3.9Å; L122-F163 WeakPolarHBondContact O-CE1 3.39Å; L122-N167 PolarHBondContact O-ND2 3.32Å
123	E	80.9	Confident	64.1	Low	122 Å²	122	97.8 Å²	97.8	57%	0.57	50%	0.502	S	S	*	.			trans	-77.4	158.4	169.1	-63.3	-164.9	168.3	0	0	109.8	I121 E125 D126 L127	I121-E123 PolarHBondContact O-N 3.44Å; E123-E125 PolarHBondContact O-N 2.92Å; E123-D126 PolarHBondContact N-OD2 3.39Å; E123-D126 WeakPolarHBondContact O-CB 3.48Å; E123-D126 PolarHBondContact O-N 2.77Å; E123-L127 PolarHBondContact O-N 2.94Å; E123-L127 VanDerWaalsContact O-N 3.16Å
124	I	81.6	Confident	66.8	Low	26 Å²	26	93.8 Å²	93.8	13%	0.133	49%	0.485	C	S	.	.	H	α-helix	trans	-57.2	-31.9	175	-100	147.6	0	0	0	111.6	D126 L127 F128 Q160 F163 K164	I124-D126 VanDerWaalsContact C-N 3.34Å; I124-L127 PolarHBondContact O-N 3.02Å; I124-F128 VanDerWaalsContact O-CB 3.31Å; I124-F128 WeakPolarHBondContact O-CB 3.36Å; I124-F128 PolarHBondContact O-N 3.19Å; I124-Q160 HydrophobicContact CD1-CB 3.72Å; I124-Q160 HydrophobicContact CD1-CG 3.79Å; I124-Q160 HydrophobicContact CG1-CG 4.44Å; I124-Q160 HydrophobicContact CG2-CG 4.49Å; I124-F163 HydrophobicContact CD1-CB 4.04Å; I124-F163 HydrophobicContact CD1-CD1 3.61Å; I124-F163 HydrophobicContact CD1-CE1 4.49Å; I124-F163 HydrophobicContact CD1-CG 4.19Å; I124-F163 HydrophobicContact CG1-CD1 3.54Å; I124-F163 HydrophobicContact CG1-CE1 4Å; I124-F163 HydrophobicContact CG1-CG 4.23Å; I124-K164 HydrophobicContact CD1-CG 4.48Å
125	E	82.4	Confident	69.5	Low	140 Å²	140	92.8 Å²	92.8	65%	0.654	47%	0.472	S	S	*	.	H	α-helix	trans	-68.7	-34.1	178	-62.8	-172.6	-179.7	0	0	112	E123 F128 S129	E123-E125 PolarHBondContact O-N 2.92Å; E125-F128 PolarHBondContact O-N 3.15Å; E125-S129 VanDerWaalsContact O-CB 3.3Å; E125-S129 WeakPolarHBondContact O-CB 3.31Å; E125-S129 PolarHBondContact O-N 3.05Å; E125-S129 PolarHBondContact O-OG 3.45Å
126	D	83.4	Confident	71.9	Confident	70 Å²	70	95 Å²	95	37%	0.374	47%	0.473	S	S	.	.	H	α-helix	trans	-66.3	-47.4	173.7	-61.7	-44.4	0	0	0	110.3	L122 E123 I124 F128 S129 S130	L122-D126 HydrophobicContact CD2-CB 3.9Å; E123-D126 PolarHBondContact N-OD2 3.39Å; E123-D126 WeakPolarHBondContact O-CB 3.48Å; E123-D126 PolarHBondContact O-N 2.77Å; I124-D126 VanDerWaalsContact C-N 3.34Å; D126-F128 VanDerWaalsContact C-N 3.31Å; D126-F128 PolarHBondContact O-N 3.44Å; D126-S129 PolarHBondContact O-N 3.27Å; D126-S130 PolarHBondContact O-N 2.93Å; D126-S130 PolarHBondContact O-OG 3.4Å
127	L	82.8	Confident	74.3	Confident	52 Å²	52	91.6 Å²	91.6	27%	0.272	46%	0.463	S	S	.	.	H	α-helix	trans	-60.5	-42.3	177.6	-176.3	64	0	0	0	111.4	E123 I124 S130 L131 V154	E123-L127 PolarHBondContact O-N 2.94Å; E123-L127 VanDerWaalsContact O-N 3.16Å; I124-L127 PolarHBondContact O-N 3.02Å; L127-S130 PolarHBondContact O-N 3.32Å; L127-L131 HydrophobicContact CG-CD1 4.24Å; L127-L131 WeakPolarHBondContact O-CB 3.49Å; L127-L131 VanDerWaalsContact O-CG 3.32Å; L127-L131 WeakPolarHBondContact O-CG 3.07Å; L127-L131 PolarHBondContact O-N 3.08Å; L127-V154 HydrophobicContact CD2-CG1 4.28Å; L127-V154 HydrophobicContact CD2-CG2 3.74Å; L127-V154 HydrophobicContact CG-CG2 4.27Å
128	F	84.3	Confident	76.4	Confident	44 Å²	44	84.7 Å²	84.7	19%	0.193	44%	0.441	C	S	.	.	H	α-helix	trans	-65.8	-39.5	177.7	-165.8	-104.8	0	0	0	112.2	I124 E125 D126 K132 L151 V154 Q155	I124-F128 VanDerWaalsContact O-CB 3.31Å; I124-F128 WeakPolarHBondContact O-CB 3.36Å; I124-F128 PolarHBondContact O-N 3.19Å; E125-F128 PolarHBondContact O-N 3.15Å; D126-F128 VanDerWaalsContact C-N 3.31Å; D126-F128 PolarHBondContact O-N 3.44Å; F128-K132 HydrophobicContact CD1-CD 4.23Å; F128-K132 HydrophobicContact CE1-CD 3.86Å; F128-K132 HydrophobicContact CE1-CG 4.46Å; F128-K132 HydrophobicContact CZ-CD 4.44Å; F128-K132 PolarHBondContact O-N 2.97Å; F128-L151 HydrophobicContact CD2-CD2 3.67Å; F128-L151 HydrophobicContact CE2-CD2 3.45Å; F128-L151 VanDerWaalsContact CE2-CD2 3.45Å; F128-L151 HydrophobicContact CG-CD2 4.47Å; F128-L151 HydrophobicContact CZ-CD2 4.13Å; F128-V154 HydrophobicContact CB-CG1 4.49Å; F128-V154 HydrophobicContact CD2-CG1 4.19Å; F128-Q155 HydrophobicContact CD2-CG 4.48Å; F128-Q155 HydrophobicContact CE2-CG 3.73Å; F128-Q155 VanDerWaalsContact CE2-NE2 3.27Å; F128-Q155 HydrophobicContact CZ-CG 4.39Å
129	S	83.8	Confident	78.2	Confident	76 Å²	76	88 Å²	88	53%	0.531	45%	0.454	S	S	.	.	H	α-helix	trans	-67.9	-41	177	-61.1	0	0	0	0	111.8	E125 D126 K132 H133	E125-S129 VanDerWaalsContact O-CB 3.3Å; E125-S129 WeakPolarHBondContact O-CB 3.31Å; E125-S129 PolarHBondContact O-N 3.05Å; E125-S129 PolarHBondContact O-OG 3.45Å; D126-S129 PolarHBondContact O-N 3.27Å; S129-K132 PolarHBondContact O-N 3.35Å; S129-H133 WeakPolarHBondContact O-CB 3.44Å; S129-H133 PolarHBondContact O-N 2.82Å
130	S	85.4	Confident	80.3	Confident	62 Å²	62	87.7 Å²	87.7	43%	0.434	45%	0.449	S	S	.	.	H	α-helix	trans	-64.2	-44.8	174.8	-64.3	0	0	0	0	112.1	D126 L127 K132 H133 I134	D126-S130 PolarHBondContact O-N 2.93Å; D126-S130 PolarHBondContact O-OG 3.4Å; L127-S130 PolarHBondContact O-N 3.32Å; S130-K132 PolarHBondContact O-N 3.34Å; S130-H133 WeakPolarHBondContact O-CB 3.43Å; S130-H133 PolarHBondContact O-N 2.64Å; S130-I134 VanDerWaalsContact O-CG1 3.27Å; S130-I134 WeakPolarHBondContact O-CG1 3.49Å; S130-I134 PolarHBondContact O-N 2.94Å
131	L	85.8	Confident	81.6	Confident	22 Å²	22	83 Å²	83	12%	0.115	44%	0.44	C	S	.	.	H	α-helix	trans	-63.8	-40	177.5	-73.7	172	0	0	0	112.1	L127 I134 Q135 L150 L151 V154	L127-L131 HydrophobicContact CG-CD1 4.24Å; L127-L131 WeakPolarHBondContact O-CB 3.49Å; L127-L131 VanDerWaalsContact O-CG 3.32Å; L127-L131 WeakPolarHBondContact O-CG 3.07Å; L127-L131 PolarHBondContact O-N 3.08Å; L131-I134 PolarHBondContact O-N 2.93Å; L131-Q135 WeakPolarHBondContact O-CB 3.33Å; L131-Q135 PolarHBondContact O-N 3.29Å; L131-L150 HydrophobicContact CD1-CB 4.39Å; L131-L150 HydrophobicContact CD2-CB 4.42Å; L131-L150 HydrophobicContact CD2-CD1 4.34Å; L131-L151 HydrophobicContact CB-CD2 3.77Å; L131-L151 HydrophobicContact CB-CG 4.31Å; L131-L151 HydrophobicContact CD1-CD2 4.42Å; L131-V154 HydrophobicContact CD1-CG2 3.76Å
132	K	83.8	Confident	82.7	Confident	96 Å²	96	86.6 Å²	86.6	42%	0.417	46%	0.455	S	S	.	.	H	α-helix	trans	-64.3	-39.1	172.4	-81.9	-172.5	168.2	-177.2	0	112.8	F128 S129 S130 Q135 H136 L151	F128-K132 HydrophobicContact CD1-CD 4.23Å; F128-K132 HydrophobicContact CE1-CD 3.86Å; F128-K132 HydrophobicContact CE1-CG 4.46Å; F128-K132 HydrophobicContact CZ-CD 4.44Å; F128-K132 PolarHBondContact O-N 2.97Å; S129-K132 PolarHBondContact O-N 3.35Å; S130-K132 PolarHBondContact O-N 3.34Å; K132-Q135 WeakPolarHBondContact O-CB 3.46Å; K132-Q135 PolarHBondContact O-N 3.06Å; K132-H136 PolarHBondContact O-CD2 3.14Å; K132-H136 PolarHBondContact O-N 3.48Å; K132-H136 VanDerWaalsContact O-N 3.14Å; K132-L151 HydrophobicContact CG-CD2 4.24Å
133	H	85.9	Confident	83.3	Confident	130 Å²	130	83.5 Å²	83.5	60%	0.602	44%	0.442	S	S	*	.	H	α-helix	trans	-62.5	-46.3	176.6	-171.8	64.2	0	0	0	111.1	S129 S130 Q135 H136 T137	S129-H133 WeakPolarHBondContact O-CB 3.44Å; S129-H133 PolarHBondContact O-N 2.82Å; S130-H133 WeakPolarHBondContact O-CB 3.43Å; S130-H133 PolarHBondContact O-N 2.64Å; H133-Q135 VanDerWaalsContact C-N 3.3Å; H133-Q135 PolarHBondContact O-N 3.39Å; H133-H136 PolarHBondContact O-N 2.87Å; H133-T137 PolarHBondContact O-N 2.89Å; H133-T137 PolarHBondContact O-OG1 3.49Å; H133-T137 VanDerWaalsContact O-OG1 3.11Å
134	I	83.3	Confident	83.5	Confident	76 Å²	76	80.4 Å²	80.4	39%	0.39	43%	0.428	S	S	.	.	H	α-helix	trans	-61.8	-38.9	176	-65	165.2	0	0	0	110.8	S130 L131 H136 T137 L138 I147	S130-I134 VanDerWaalsContact O-CG1 3.27Å; S130-I134 WeakPolarHBondContact O-CG1 3.49Å; S130-I134 PolarHBondContact O-N 2.94Å; L131-I134 PolarHBondContact O-N 2.93Å; I134-H136 PolarHBondContact O-N 3.45Å; I134-T137 PolarHBondContact O-N 3.13Å; I134-L138 HydrophobicContact CG2-CD1 3.69Å; I134-L138 HydrophobicContact CG2-CG 4.21Å; I134-L138 PolarHBondContact O-N 3.04Å; I134-I147 HydrophobicContact CG2-CD1 3.86Å
135	Q	83.1	Confident	83.7	Confident	51 Å²	51	85.4 Å²	85.4	24%	0.238	45%	0.45	C	S	.	.	H	α-helix	trans	-58.9	-34.1	174	-162.4	178.3	22.6	0	0	112.7	L131 K132 H133 Q144 I147	L131-Q135 WeakPolarHBondContact O-CB 3.33Å; L131-Q135 PolarHBondContact O-N 3.29Å; K132-Q135 WeakPolarHBondContact O-CB 3.46Å; K132-Q135 PolarHBondContact O-N 3.06Å; H133-Q135 VanDerWaalsContact C-N 3.3Å; H133-Q135 PolarHBondContact O-N 3.39Å; Q135-Q144 PolarHBondContact O-NE2 2.97Å; Q135-I147 HydrophobicContact CB-CD1 4.47Å; Q135-I147 HydrophobicContact CB-CG2 3.79Å; Q135-I147 HydrophobicContact CG-CG2 4Å
136	H	80.8	Confident	83.9	Confident	157 Å²	157	83 Å²	83	73%	0.727	44%	0.442	S	S	*	.	H	α-helix	trans	-80.4	-17.8	177	-75.3	-63.7	0	0	0	113.3	K132 H133 I134	K132-H136 PolarHBondContact O-CD2 3.14Å; K132-H136 PolarHBondContact O-N 3.48Å; K132-H136 VanDerWaalsContact O-N 3.14Å; H133-H136 PolarHBondContact O-N 2.87Å; I134-H136 PolarHBondContact O-N 3.45Å
137	T	84.1	Confident	84.1	Confident	89 Å²	89	80.1 Å²	80.1	55%	0.546	43%	0.426	S	S	.	.	H	α-helix	trans	-91.3	-37.3	-178.8	-52	0	0	0	0	112.8	H133 I134	H133-T137 PolarHBondContact O-N 2.89Å; H133-T137 PolarHBondContact O-OG1 3.49Å; H133-T137 VanDerWaalsContact O-OG1 3.11Å; I134-T137 PolarHBondContact O-N 3.13Å
138	L	81.8	Confident	84.2	Confident	68 Å²	68	80.7 Å²	80.7	36%	0.356	44%	0.435	S	S	.	.			trans	-88.3	131.6	179.9	-61.9	179.1	0	0	0	109.7	I134 Q144 I147	I134-L138 HydrophobicContact CG2-CD1 3.69Å; I134-L138 HydrophobicContact CG2-CG 4.21Å; I134-L138 PolarHBondContact O-N 3.04Å; L138-Q144 PolarHBondContact O-NE2 3.2Å; L138-I147 HydrophobicContact CB-CD1 4.44Å; L138-I147 HydrophobicContact CD1-CD1 4.05Å
139	V	78.6	Confident	84.4	Confident	136 Å²	136	84.1 Å²	84.1	82%	0.824	46%	0.455	S	S	*	.			trans	-116	-6.5	-170.8	-144.2	0	0	0	0	112.6
140	D	89.1	Confident	84.5	Confident	73 Å²	73	84.3 Å²	84.3	39%	0.39	45%	0.449	S	S	.	.	S	Bend	trans	-77.9	143.3	179.7	64.3	-74.7	0	0	0	111.7	Q142 S143 Q144	D140-Q142 VanDerWaalsContact C-N 3.26Å; D140-Q142 PolarHBondContact O-N 3.47Å; D140-S143 PolarHBondContact O-N 3.03Å; D140-S143 WeakPolarHBondContact OD1-CB 3.35Å; D140-S143 PolarHBondContact OD1-OG 2.93Å; D140-S143 VanDerWaalsContact OD1-OG 3.11Å; D140-S143 WeakPolarHBondContact OD2-CB 3.37Å; D140-S143 PolarHBondContact OD2-N 3.05Å; D140-S143 PolarHBondContact OD2-OG 3.29Å; D140-Q144 VanDerWaalsContact O-CG 3.31Å; D140-Q144 WeakPolarHBondContact O-CG 3.42Å; D140-Q144 PolarHBondContact O-N 3.46Å; D140-Q144 VanDerWaalsContact O-N 3.1Å
141	S	80.8	Confident	84.6	Confident	89 Å²	89	82 Å²	82	62%	0.622	43%	0.432	S	S	*	.	H	α-helix	trans	-61.9	-33.3	-172.3	-164.1	0	0	0	0	113	E145	S141-E145 WeakPolarHBondContact O-CG 3.37Å; S141-E145 PolarHBondContact O-N 3.08Å
142	Q	84.8	Confident	84.8	Confident	143 Å²	143	87.6 Å²	87.6	67%	0.668	46%	0.457	S	S	*	.	H	α-helix	trans	-76.9	-44.6	-175.5	-168.3	157.4	-3.9	0	0	111.5	D140 Q144 E145 D146	D140-Q142 VanDerWaalsContact C-N 3.26Å; D140-Q142 PolarHBondContact O-N 3.47Å; Q142-Q144 VanDerWaalsContact C-N 3.25Å; Q142-Q144 PolarHBondContact O-N 2.89Å; Q142-E145 PolarHBondContact O-N 2.92Å; Q142-E145 VanDerWaalsContact O-N 3.16Å; Q142-D146 PolarHBondContact O-N 3.15Å
143	S	82.7	Confident	85	Confident	32 Å²	32	87 Å²	87	22%	0.224	46%	0.458	C	S	.	.	H	α-helix	trans	-64.6	-31.4	173.3	-56.8	0	0	0	0	112.2	D140 D146 I147	D140-S143 PolarHBondContact O-N 3.03Å; D140-S143 WeakPolarHBondContact OD1-CB 3.35Å; D140-S143 PolarHBondContact OD1-OG 2.93Å; D140-S143 VanDerWaalsContact OD1-OG 3.11Å; D140-S143 WeakPolarHBondContact OD2-CB 3.37Å; D140-S143 PolarHBondContact OD2-N 3.05Å; D140-S143 PolarHBondContact OD2-OG 3.29Å; S143-D146 PolarHBondContact O-N 3.04Å; S143-I147 WeakPolarHBondContact O-CB 3.45Å; S143-I147 VanDerWaalsContact O-CD1 3.29Å; S143-I147 WeakPolarHBondContact O-CD1 3.39Å; S143-I147 WeakPolarHBondContact O-CG1 3.32Å; S143-I147 PolarHBondContact O-N 2.98Å
144	Q	84.8	Confident	85	Confident	57 Å²	57	81 Å²	81	27%	0.266	43%	0.431	S	S	.	.	H	α-helix	trans	-63.8	-40.8	173.2	-76.2	-65.1	-29.7	0	0	112.7	Q135 L138 D140 Q142 S148	Q135-Q144 PolarHBondContact O-NE2 2.97Å; L138-Q144 PolarHBondContact O-NE2 3.2Å; D140-Q144 VanDerWaalsContact O-CG 3.31Å; D140-Q144 WeakPolarHBondContact O-CG 3.42Å; D140-Q144 PolarHBondContact O-N 3.46Å; D140-Q144 VanDerWaalsContact O-N 3.1Å; Q142-Q144 VanDerWaalsContact C-N 3.25Å; Q142-Q144 PolarHBondContact O-N 2.89Å; Q144-S148 WeakPolarHBondContact O-CB 3.29Å; Q144-S148 PolarHBondContact O-N 3.26Å
145	E	85.7	Confident	85.1	Confident	130 Å²	130	82.8 Å²	82.8	61%	0.607	44%	0.438	S	S	*	.	H	α-helix	trans	-67.1	-44.1	175.2	-74.7	175.5	-168.2	0	0	111.6	S141 Q142 I147 S148 L149	S141-E145 WeakPolarHBondContact O-CG 3.37Å; S141-E145 PolarHBondContact O-N 3.08Å; Q142-E145 PolarHBondContact O-N 2.92Å; Q142-E145 VanDerWaalsContact O-N 3.16Å; E145-I147 PolarHBondContact O-N 3.16Å; E145-S148 WeakPolarHBondContact O-CB 3.32Å; E145-S148 PolarHBondContact O-N 3.22Å; E145-L149 PolarHBondContact O-N 3.31Å
146	D	86.1	Confident	85.5	Confident	89 Å²	89	83.7 Å²	83.7	48%	0.476	44%	0.444	S	S	.	.	H	α-helix	trans	-63.8	-42.3	179	-69.9	-25.9	0	0	0	112	Q142 S143 S148 L149 L150	Q142-D146 PolarHBondContact O-N 3.15Å; S143-D146 PolarHBondContact O-N 3.04Å; D146-S148 VanDerWaalsContact C-N 3.33Å; D146-L149 WeakPolarHBondContact O-CB 3.35Å; D146-L149 PolarHBondContact O-N 2.69Å; D146-L150 WeakPolarHBondContact O-CG 3.24Å; D146-L150 PolarHBondContact O-N 3.45Å
147	I	87.7	Confident	85.9	Confident	10 Å²	10	83.9 Å²	83.9	5%	0.051	44%	0.443	C	S	.	.	H	α-helix	trans	-67.7	-36.5	176.1	-65	161.8	0	0	0	111	I134 Q135 L138 S143 E145 L149 L150 L151	I134-I147 HydrophobicContact CG2-CD1 3.86Å; Q135-I147 HydrophobicContact CB-CD1 4.47Å; Q135-I147 HydrophobicContact CB-CG2 3.79Å; Q135-I147 HydrophobicContact CG-CG2 4Å; L138-I147 HydrophobicContact CB-CD1 4.44Å; L138-I147 HydrophobicContact CD1-CD1 4.05Å; S143-I147 WeakPolarHBondContact O-CB 3.45Å; S143-I147 VanDerWaalsContact O-CD1 3.29Å; S143-I147 WeakPolarHBondContact O-CD1 3.39Å; S143-I147 WeakPolarHBondContact O-CG1 3.32Å; S143-I147 PolarHBondContact O-N 2.98Å; E145-I147 PolarHBondContact O-N 3.16Å; I147-L149 VanDerWaalsContact C-N 3.31Å; I147-L149 PolarHBondContact O-N 3.21Å; I147-L150 PolarHBondContact O-N 3.42Å; I147-L151 HydrophobicContact CG2-CD1 3.94Å; I147-L151 HydrophobicContact CG2-CG 4.25Å; I147-L151 WeakPolarHBondContact O-CB 3.29Å; I147-L151 VanDerWaalsContact O-CG 3.3Å; I147-L151 WeakPolarHBondContact O-CG 3.26Å; I147-L151 PolarHBondContact O-N 3.28Å
148	S	85.3	Confident	86.1	Confident	64 Å²	64	85.3 Å²	85.3	45%	0.448	45%	0.447	S	S	.	.	H	α-helix	trans	-61	-41.6	174.4	-170	0	0	0	0	111.4	Q144 E145 D146 L151 Q152	Q144-S148 WeakPolarHBondContact O-CB 3.29Å; Q144-S148 PolarHBondContact O-N 3.26Å; E145-S148 WeakPolarHBondContact O-CB 3.32Å; E145-S148 PolarHBondContact O-N 3.22Å; D146-S148 VanDerWaalsContact C-N 3.33Å; S148-L151 PolarHBondContact O-N 3.18Å; S148-Q152 WeakPolarHBondContact O-CB 3.4Å; S148-Q152 PolarHBondContact O-N 3.12Å
149	L	88.6	Confident	86.5	Confident	117 Å²	117	85.3 Å²	85.3	61%	0.613	45%	0.445	S	S	*	.	H	α-helix	trans	-63.6	-44.1	175	-166.6	105.6	0	0	0	111.9	E145 D146 I147 Q152 L153	E145-L149 PolarHBondContact O-N 3.31Å; D146-L149 WeakPolarHBondContact O-CB 3.35Å; D146-L149 PolarHBondContact O-N 2.69Å; I147-L149 VanDerWaalsContact C-N 3.31Å; I147-L149 PolarHBondContact O-N 3.21Å; L149-Q152 WeakPolarHBondContact O-CB 3.41Å; L149-Q152 PolarHBondContact O-N 2.94Å; L149-L153 PolarHBondContact O-N 3.2Å
150	L	86.3	Confident	86.8	Confident	79 Å²	79	81.3 Å²	81.3	41%	0.414	42%	0.417	S	S	.	.	H	α-helix	trans	-64.8	-39.7	176.4	-70.1	172.9	0	0	0	112.1	L131 D146 I147 Q152 L153 V154	L131-L150 HydrophobicContact CD1-CB 4.39Å; L131-L150 HydrophobicContact CD2-CB 4.42Å; L131-L150 HydrophobicContact CD2-CD1 4.34Å; D146-L150 WeakPolarHBondContact O-CG 3.24Å; D146-L150 PolarHBondContact O-N 3.45Å; I147-L150 PolarHBondContact O-N 3.42Å; L150-Q152 VanDerWaalsContact C-N 3.32Å; L150-Q152 PolarHBondContact O-N 2.99Å; L150-L153 PolarHBondContact O-N 3.02Å; L150-V154 WeakPolarHBondContact O-CG2 3.32Å; L150-V154 PolarHBondContact O-N 3.1Å
151	L	87.8	Confident	86.6	Confident	15 Å²	15	81.9 Å²	81.9	8%	0.079	42%	0.42	C	S	.	.	H	α-helix	trans	-63.1	-39.8	173.8	-75.8	168	0	0	0	111.2	F128 L131 K132 I147 S148 L153 V154 Q155	F128-L151 HydrophobicContact CD2-CD2 3.67Å; F128-L151 HydrophobicContact CE2-CD2 3.45Å; F128-L151 VanDerWaalsContact CE2-CD2 3.45Å; F128-L151 HydrophobicContact CG-CD2 4.47Å; F128-L151 HydrophobicContact CZ-CD2 4.13Å; L131-L151 HydrophobicContact CB-CD2 3.77Å; L131-L151 HydrophobicContact CB-CG 4.31Å; L131-L151 HydrophobicContact CD1-CD2 4.42Å; K132-L151 HydrophobicContact CG-CD2 4.24Å; I147-L151 HydrophobicContact CG2-CD1 3.94Å; I147-L151 HydrophobicContact CG2-CG 4.25Å; I147-L151 WeakPolarHBondContact O-CB 3.29Å; I147-L151 VanDerWaalsContact O-CG 3.3Å; I147-L151 WeakPolarHBondContact O-CG 3.26Å; I147-L151 PolarHBondContact O-N 3.28Å; S148-L151 PolarHBondContact O-N 3.18Å; L151-L153 VanDerWaalsContact C-N 3.34Å; L151-V154 PolarHBondContact O-N 2.9Å; L151-Q155 WeakPolarHBondContact O-CB 3.5Å; L151-Q155 WeakPolarHBondContact O-CG 3.4Å; L151-Q155 PolarHBondContact O-N 2.92Å
152	Q	89.2	Confident	86.8	Confident	138 Å²	138	80.2 Å²	80.2	65%	0.645	41%	0.412	S	S	*	.	H	α-helix	trans	-64.7	-38.3	174.5	-173.1	-179.7	-28.5	0	0	111.9	S148 L149 L150 Q155 N156	S148-Q152 WeakPolarHBondContact O-CB 3.4Å; S148-Q152 PolarHBondContact O-N 3.12Å; L149-Q152 WeakPolarHBondContact O-CB 3.41Å; L149-Q152 PolarHBondContact O-N 2.94Å; L150-Q152 VanDerWaalsContact C-N 3.32Å; L150-Q152 PolarHBondContact O-N 2.99Å; Q152-Q155 PolarHBondContact O-N 3.37Å; Q152-N156 PolarHBondContact O-N 2.95Å; Q152-N156 VanDerWaalsContact O-N 3.14Å
153	L	87.6	Confident	86.8	Confident	83 Å²	83	75.4 Å²	75.4	44%	0.435	39%	0.389	S	S	.	.	H	α-helix	trans	-66.2	-45.9	175.3	-176.4	67.9	0	0	0	111.8	L149 L150 L151 Q155 N156 F159	L149-L153 PolarHBondContact O-N 3.2Å; L150-L153 PolarHBondContact O-N 3.02Å; L151-L153 VanDerWaalsContact C-N 3.34Å; L153-Q155 VanDerWaalsContact C-N 3.26Å; L153-Q155 PolarHBondContact O-N 3.31Å; L153-N156 WeakPolarHBondContact O-CB 3.44Å; L153-N156 PolarHBondContact O-N 2.97Å; L153-F159 HydrophobicContact CD1-CD2 4.39Å; L153-F159 HydrophobicContact CD2-CE2 4.47Å; L153-F159 HydrophobicContact CG-CD2 4.18Å; L153-F159 HydrophobicContact CG-CG 4.35Å; L153-F159 WeakPolarHBondContact O-CB 3.05Å
154	V	86.2	Confident	86.7	Confident	6 Å²	6	79.9 Å²	79.9	4%	0.036	40%	0.404	C	S	.	.	H	α-helix	trans	-67.4	-28.2	177.9	175.1	0	0	0	0	111.7	L127 F128 L131 L150 L151 N156 F159 Q160	L127-V154 HydrophobicContact CD2-CG1 4.28Å; L127-V154 HydrophobicContact CD2-CG2 3.74Å; L127-V154 HydrophobicContact CG-CG2 4.27Å; F128-V154 HydrophobicContact CB-CG1 4.49Å; F128-V154 HydrophobicContact CD2-CG1 4.19Å; L131-V154 HydrophobicContact CD1-CG2 3.76Å; L150-V154 WeakPolarHBondContact O-CG2 3.32Å; L150-V154 PolarHBondContact O-N 3.1Å; L151-V154 PolarHBondContact O-N 2.9Å; V154-N156 VanDerWaalsContact C-N 3.3Å; V154-F159 HydrophobicContact CG2-CE1 4.08Å; V154-Q160 WeakPolarHBondContact O-CG 3.46Å; V154-Q160 PolarHBondContact O-NE2 3.01Å
155	Q	86.1	Confident	86.6	Confident	112 Å²	112	82 Å²	82	52%	0.523	42%	0.416	S	S	.	.	H	α-helix	trans	-77	-14	171.8	-74.9	176.8	0.7	0	0	113.8	F128 L151 Q152 L153 K157	F128-Q155 HydrophobicContact CD2-CG 4.48Å; F128-Q155 HydrophobicContact CE2-CG 3.73Å; F128-Q155 VanDerWaalsContact CE2-NE2 3.27Å; F128-Q155 HydrophobicContact CZ-CG 4.39Å; L151-Q155 WeakPolarHBondContact O-CB 3.5Å; L151-Q155 WeakPolarHBondContact O-CG 3.4Å; L151-Q155 PolarHBondContact O-N 2.92Å; Q152-Q155 PolarHBondContact O-N 3.37Å; L153-Q155 VanDerWaalsContact C-N 3.26Å; L153-Q155 PolarHBondContact O-N 3.31Å; Q155-K157 PolarHBondContact O-N 3.39Å
156	N	92.4	Very high	86.4	Confident	71 Å²	71	80.9 Å²	80.9	38%	0.38	41%	0.411	S	S	.	.			trans	-67.9	125.2	178.7	-172.9	-36.2	0	0	0	110.3	Q152 L153 V154 D158 F159 Q160	Q152-N156 PolarHBondContact O-N 2.95Å; Q152-N156 VanDerWaalsContact O-N 3.14Å; L153-N156 WeakPolarHBondContact O-CB 3.44Å; L153-N156 PolarHBondContact O-N 2.97Å; V154-N156 VanDerWaalsContact C-N 3.3Å; N156-D158 VanDerWaalsContact C-N 3.26Å; N156-D158 PolarHBondContact O-N 3.23Å; N156-D158 PolarHBondContact OD1-N 3.35Å; N156-F159 HydrophobicContact CB-CB 4.23Å; N156-F159 PolarHBondContact O-N 2.84Å; N156-Q160 WeakPolarHBondContact O-CG 3.43Å; N156-Q160 PolarHBondContact O-N 3.33Å
157	K	87.8	Confident	86	Confident	160 Å²	160	78 Å²	78	70%	0.696	40%	0.396	S	S	*	.	H	α-helix	trans	-58.2	-35.5	-178.8	-71.5	-175.7	176.5	178.5	0	113.4	Q155 Q160 N161	Q155-K157 PolarHBondContact O-N 3.39Å; K157-Q160 PolarHBondContact O-N 2.93Å; K157-N161 WeakPolarHBondContact O-CB 3.38Å; K157-N161 PolarHBondContact O-N 3.26Å; K157-N161 PolarHBondContact O-ND2 3.33Å
158	D	88.6	Confident	85.5	Confident	120 Å²	120	80.1 Å²	80.1	64%	0.642	41%	0.414	S	S	*	.	H	α-helix	trans	-70.4	-42.1	-179.1	-63.8	-28.4	0	0	0	110.9	N156 N161 A162	N156-D158 VanDerWaalsContact C-N 3.26Å; N156-D158 PolarHBondContact O-N 3.23Å; N156-D158 PolarHBondContact OD1-N 3.35Å; D158-N161 PolarHBondContact O-N 3.3Å; D158-A162 WeakPolarHBondContact O-CB 3.42Å; D158-A162 PolarHBondContact O-N 3.39Å
159	F	89.5	Confident	84.9	Confident	68 Å²	68	81.4 Å²	81.4	30%	0.298	42%	0.415	S	S	.	.	H	α-helix	trans	-62.9	-43.5	172.7	-178.7	-93.1	0	0	0	111	L153 V154 N156 N161 A162 F163	L153-F159 HydrophobicContact CD1-CD2 4.39Å; L153-F159 HydrophobicContact CD2-CE2 4.47Å; L153-F159 HydrophobicContact CG-CD2 4.18Å; L153-F159 HydrophobicContact CG-CG 4.35Å; L153-F159 WeakPolarHBondContact O-CB 3.05Å; V154-F159 HydrophobicContact CG2-CE1 4.08Å; N156-F159 HydrophobicContact CB-CB 4.23Å; N156-F159 PolarHBondContact O-N 2.84Å; F159-N161 VanDerWaalsContact C-N 3.3Å; F159-N161 PolarHBondContact O-N 3.17Å; F159-A162 PolarHBondContact O-N 3.35Å; F159-F163 HydrophobicContact CE1-CB 4.45Å; F159-F163 VanDerWaalsContact O-CB 3.32Å; F159-F163 WeakPolarHBondContact O-CB 3.42Å; F159-F163 PolarHBondContact O-N 2.76Å
160	Q	86.7	Confident	83.9	Confident	51 Å²	51	77.4 Å²	77.4	24%	0.238	40%	0.396	C	S	.	.	H	α-helix	trans	-61.5	-40	178.3	-70.1	-176.4	7.7	0	0	112.5	I124 V154 N156 K157 K164	I124-Q160 HydrophobicContact CD1-CB 3.72Å; I124-Q160 HydrophobicContact CD1-CG 3.79Å; I124-Q160 HydrophobicContact CG1-CG 4.44Å; I124-Q160 HydrophobicContact CG2-CG 4.49Å; V154-Q160 WeakPolarHBondContact O-CG 3.46Å; V154-Q160 PolarHBondContact O-NE2 3.01Å; N156-Q160 WeakPolarHBondContact O-CG 3.43Å; N156-Q160 PolarHBondContact O-N 3.33Å; K157-Q160 PolarHBondContact O-N 2.93Å; Q160-K164 WeakPolarHBondContact O-CB 3.19Å; Q160-K164 VanDerWaalsContact O-CG 3.29Å; Q160-K164 WeakPolarHBondContact O-CG 3.19Å; Q160-K164 PolarHBondContact O-N 3.24Å
161	N	84.9	Confident	82.9	Confident	85 Å²	85	76.7 Å²	76.7	46%	0.455	40%	0.395	S	S	.	.	H	α-helix	trans	-67.9	-44.6	175.9	-70.7	-24.6	0	0	0	111.3	K157 D158 F159 F163 K164 I165	K157-N161 WeakPolarHBondContact O-CB 3.38Å; K157-N161 PolarHBondContact O-N 3.26Å; K157-N161 PolarHBondContact O-ND2 3.33Å; D158-N161 PolarHBondContact O-N 3.3Å; F159-N161 VanDerWaalsContact C-N 3.3Å; F159-N161 PolarHBondContact O-N 3.17Å; N161-F163 VanDerWaalsContact C-N 3.33Å; N161-F163 PolarHBondContact O-N 3.37Å; N161-K164 PolarHBondContact O-N 3.1Å; N161-I165 VanDerWaalsContact O-CG1 3.29Å; N161-I165 WeakPolarHBondContact O-CG1 3.44Å; N161-I165 PolarHBondContact O-N 3.17Å
162	A	83.4	Confident	81.4	Confident	55 Å²	55	82.1 Å²	82.1	46%	0.455	42%	0.419	S	S	.	.	H	α-helix	trans	-61.2	-41.6	176.8	0	0	0	0	0	112.1	D158 F159 I165 H166	D158-A162 WeakPolarHBondContact O-CB 3.42Å; D158-A162 PolarHBondContact O-N 3.39Å; F159-A162 PolarHBondContact O-N 3.35Å; A162-I165 PolarHBondContact O-N 2.97Å; A162-H166 WeakPolarHBondContact O-CB 3.28Å; A162-H166 PolarHBondContact O-N 2.97Å
163	F	84.5	Confident	79.8	Confident	42 Å²	42	82.8 Å²	82.8	18%	0.184	42%	0.424	C	S	.	.	H	α-helix	trans	-67.4	-38.3	177.4	-172.2	-96.6	0	0	0	112.2	L122 I124 F159 N161 H166 N167	L122-F163 WeakPolarHBondContact O-CE1 3.39Å; I124-F163 HydrophobicContact CD1-CB 4.04Å; I124-F163 HydrophobicContact CD1-CD1 3.61Å; I124-F163 HydrophobicContact CD1-CE1 4.49Å; I124-F163 HydrophobicContact CD1-CG 4.19Å; I124-F163 HydrophobicContact CG1-CD1 3.54Å; I124-F163 HydrophobicContact CG1-CE1 4Å; I124-F163 HydrophobicContact CG1-CG 4.23Å; F159-F163 HydrophobicContact CE1-CB 4.45Å; F159-F163 VanDerWaalsContact O-CB 3.32Å; F159-F163 WeakPolarHBondContact O-CB 3.42Å; F159-F163 PolarHBondContact O-N 2.76Å; N161-F163 VanDerWaalsContact C-N 3.33Å; N161-F163 PolarHBondContact O-N 3.37Å; F163-H166 PolarHBondContact O-N 3.3Å; F163-N167 WeakPolarHBondContact CE1-ND2 3.19Å; F163-N167 WeakPolarHBondContact O-CB 3.48Å; F163-N167 PolarHBondContact O-N 3.01Å
164	K	82.3	Confident	78.1	Confident	125 Å²	125	83.8 Å²	83.8	54%	0.543	43%	0.43	S	S	.	.	H	α-helix	trans	-63	-42	171.7	-75.9	173.6	-178.4	178.4	0	112.2	I124 Q160 N161 N167 A168	I124-K164 HydrophobicContact CD1-CG 4.48Å; Q160-K164 WeakPolarHBondContact O-CB 3.19Å; Q160-K164 VanDerWaalsContact O-CG 3.29Å; Q160-K164 WeakPolarHBondContact O-CG 3.19Å; Q160-K164 PolarHBondContact O-N 3.24Å; N161-K164 PolarHBondContact O-N 3.1Å; K164-N167 PolarHBondContact O-N 2.92Å; K164-A168 WeakPolarHBondContact O-CB 3.41Å; K164-A168 PolarHBondContact O-N 2.69Å
165	I	82	Confident	76.3	Confident	102 Å²	102	89.6 Å²	89.6	52%	0.523	46%	0.455	S	S	.	.	H	α-helix	trans	-64	-45.9	175.6	-68.3	164.4	0	0	0	110.1	N161 A162 N167 A168 I169	N161-I165 VanDerWaalsContact O-CG1 3.29Å; N161-I165 WeakPolarHBondContact O-CG1 3.44Å; N161-I165 PolarHBondContact O-N 3.17Å; A162-I165 PolarHBondContact O-N 2.97Å; I165-N167 PolarHBondContact O-N 3.22Å; I165-A168 PolarHBondContact O-N 3.3Å; I165-I169 HydrophobicContact CG2-CD1 3.66Å; I165-I169 HydrophobicContact CG2-CG1 4.34Å; I165-I169 VanDerWaalsContact O-CG1 3.28Å; I165-I169 WeakPolarHBondContact O-CG1 3.4Å; I165-I169 PolarHBondContact O-N 2.71Å
166	H	81.2	Confident	74.3	Confident	107 Å²	107	88.9 Å²	88.9	50%	0.495	47%	0.468	S	S	.	.	H	α-helix	trans	-56.2	-50.9	175.2	175	77.2	0	0	0	111.4	A162 F163 A168 I169 T170	A162-H166 WeakPolarHBondContact O-CB 3.28Å; A162-H166 PolarHBondContact O-N 2.97Å; F163-H166 PolarHBondContact O-N 3.3Å; H166-A168 VanDerWaalsContact C-N 3.33Å; H166-A168 PolarHBondContact O-N 3.48Å; H166-I169 PolarHBondContact O-N 3.42Å; H166-T170 WeakPolarHBondContact O-CB 3.44Å; H166-T170 PolarHBondContact O-N 3.42Å; H166-T170 PolarHBondContact O-OG1 2.87Å
167	N	78.8	Confident	72.1	Confident	29 Å²	29	90.4 Å²	90.4	16%	0.155	48%	0.484	C	S	.	.	H	α-helix	trans	-60	-41.4	177.5	-77.5	-4.5	0	0	0	112.1	I121 L122 F163 K164 I165 T170 V171	I121-N167 HydrophobicContact CG2-CB 3.82Å; I121-N167 VanDerWaalsContact CG2-CG 3.48Å; I121-N167 WeakPolarHBondContact CG2-ND2 3.44Å; L122-N167 PolarHBondContact O-ND2 3.32Å; F163-N167 WeakPolarHBondContact CE1-ND2 3.19Å; F163-N167 WeakPolarHBondContact O-CB 3.48Å; F163-N167 PolarHBondContact O-N 3.01Å; K164-N167 PolarHBondContact O-N 2.92Å; I165-N167 PolarHBondContact O-N 3.22Å; N167-T170 PolarHBondContact O-N 3.08Å; N167-V171 WeakPolarHBondContact O-CG2 3.48Å; N167-V171 PolarHBondContact O-N 3.29Å
168	A	75.3	Confident	70.4	Confident	54 Å²	54	87.9 Å²	87.9	45%	0.446	48%	0.484	S	S	.	.	H	α-helix	trans	-64.6	-39.4	176.6	0	0	0	0	0	112.6	K164 I165 H166 H172	K164-A168 WeakPolarHBondContact O-CB 3.41Å; K164-A168 PolarHBondContact O-N 2.69Å; I165-A168 PolarHBondContact O-N 3.3Å; H166-A168 VanDerWaalsContact C-N 3.33Å; H166-A168 PolarHBondContact O-N 3.48Å; A168-H172 PolarHBondContact O-CD2 2.79Å; A168-H172 PolarHBondContact O-N 2.95Å
169	I	73.6	Confident	68.8	Low	90 Å²	90	87.9 Å²	87.9	46%	0.462	49%	0.491	S	S	.	.	H	α-helix	trans	-67.5	-45.5	175.5	-68.4	168.7	0	0	0	110.3	I165 H166 V171 H172 M173	I165-I169 HydrophobicContact CG2-CD1 3.66Å; I165-I169 HydrophobicContact CG2-CG1 4.34Å; I165-I169 VanDerWaalsContact O-CG1 3.28Å; I165-I169 WeakPolarHBondContact O-CG1 3.4Å; I165-I169 PolarHBondContact O-N 2.71Å; H166-I169 PolarHBondContact O-N 3.42Å; I169-V171 VanDerWaalsContact C-N 3.32Å; I169-V171 PolarHBondContact O-N 2.96Å; I169-H172 CarbonylContact O-C 3.55Å; I169-H172 PolarHBondContact O-N 3.2Å; I169-M173 HydrophobicContact CG2-CG 3.95Å; I169-M173 HydrophobicContact CG2-SD 4.44Å; I169-M173 WeakPolarHBondContact O-CB 3.35Å; I169-M173 WeakPolarHBondContact O-CG 3.42Å; I169-M173 PolarHBondContact O-N 2.9Å
170	T	68.3	Low	67.3	Low	34 Å²	34	91 Å²	91	21%	0.209	50%	0.504	C	S	.	.	H	α-helix	trans	-61.3	-38.2	178.8	-59.6	0	0	0	0	112.1	H166 N167 H172 N174	H166-T170 WeakPolarHBondContact O-CB 3.44Å; H166-T170 PolarHBondContact O-N 3.42Å; H166-T170 PolarHBondContact O-OG1 2.87Å; N167-T170 PolarHBondContact O-N 3.08Å; T170-H172 VanDerWaalsContact C-N 3.3Å; T170-H172 PolarHBondContact O-N 3.36Å; T170-N174 WeakPolarHBondContact O-CB 3.3Å; T170-N174 PolarHBondContact O-N 2.85Å; T170-N174 PolarHBondContact O-ND2 2.95Å
171	V	63.7	Low	66.3	Low	64 Å²	64	89.1 Å²	89.1	39%	0.388	50%	0.497	S	S	.	.	H	α-helix	trans	-61.3	-39.5	171.7	171.7	0	0	0	0	111.8	I121 N167 I169	I121-V171 HydrophobicContact CD1-CB 4.49Å; I121-V171 HydrophobicContact CD1-CG2 3.15Å; I121-V171 HydrophobicContact CG1-CG2 4.29Å; N167-V171 WeakPolarHBondContact O-CG2 3.48Å; N167-V171 PolarHBondContact O-N 3.29Å; I169-V171 VanDerWaalsContact C-N 3.32Å; I169-V171 PolarHBondContact O-N 2.96Å
172	H	57.3	Low	65.4	Low	128 Å²	128	93 Å²	93	59%	0.593	52%	0.516	S	S	*	.	H	α-helix	trans	-82.7	-31.4	-175.7	-94.4	-87.5	0	0	0	113.6	A168 I169 T170	A168-H172 PolarHBondContact O-CD2 2.79Å; A168-H172 PolarHBondContact O-N 2.95Å; I169-H172 CarbonylContact O-C 3.55Å; I169-H172 PolarHBondContact O-N 3.2Å; T170-H172 VanDerWaalsContact C-N 3.3Å; T170-H172 PolarHBondContact O-N 3.36Å
173	M	54.8	Low	65	Low	152 Å²	152	93.6 Å²	93.6	75%	0.749	51%	0.511	S	S	*	.	H	α-helix	trans	-79.1	-22.2	177	-68.3	-134.8	140.1	0	0	113.3	I169	I169-M173 HydrophobicContact CG2-CG 3.95Å; I169-M173 HydrophobicContact CG2-SD 4.44Å; I169-M173 WeakPolarHBondContact O-CB 3.35Å; I169-M173 WeakPolarHBondContact O-CG 3.42Å; I169-M173 PolarHBondContact O-N 2.9Å
174	N	53.3	Low	64.9	Low	104 Å²	104	94.3 Å²	94.3	56%	0.556	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	9.7	175.1	-72.8	-26.4	0	0	0	114	T170	T170-N174 WeakPolarHBondContact O-CB 3.3Å; T170-N174 PolarHBondContact O-N 2.85Å; T170-N174 PolarHBondContact O-ND2 2.95Å
175	K	48.5	Very low	65.2	Low	129 Å²	129	91.5 Å²	91.5	56%	0.561	51%	0.513	S	S	*	.	S	Bend	trans	-70.6	133.3	162.3	-77.7	-177.9	176.3	177.8	0	107.4	S177	K175-S177 PolarHBondContact O-N 3.15Å
176	A	44.1	Very low	65.5	Low	97 Å²	97	87.4 Å²	87.4	80%	0.802	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-47.3	117.1	169	0	0	0	0	0	108.1
177	S	46.3	Very low	65.9	Low	103 Å²	103	85.2 Å²	85.2	72%	0.72	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-51.5	139.6	168.5	-60.3	0	0	0	0	107.3	K175	K175-S177 PolarHBondContact O-N 3.15Å
178	P	50.8	Low	66.3	Low	107 Å²	107	88.2 Å²	88.2	70%	0.695	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-52.2	144.9	170.5	23.4	-31	0	0	0	108.7	F180	P178-F180 PolarHBondContact O-N 2.95Å
179	P	56.1	Low	66.9	Low	120 Å²	120	88.8 Å²	88.8	78%	0.779	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-54.4	143.4	179.5	23.9	-33.3	0	0	0	109.6
180	F	57.1	Low	67.6	Low	132 Å²	132	85.1 Å²	85.1	58%	0.579	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-52	134.8	175.9	-167.1	-94.4	0	0	0	109.3	P178 L182 E231 M232	P178-F180 PolarHBondContact O-N 2.95Å; F180-L182 PolarHBondContact O-N 3.21Å; F180-E231 HydrophobicContact CE2-CB 4.49Å; F180-E231 VanDerWaalsContact CZ-O 3.31Å; F180-E231 WeakPolarHBondContact CZ-O 3.42Å; F180-M232 HydrophobicContact CE1-CG 3.94Å; F180-M232 HydrophobicContact CZ-CG 4.26Å
181	P	65.6	Low	68.5	Low	13 Å²	13	88.4 Å²	88.4	8%	0.084	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-59.3	123	-178.5	19.5	-28.7	0	0	0	110.3	I183 A228 E231 M232	P181-I183 VanDerWaalsContact C-N 3.31Å; P181-A228 HydrophobicContact CB-CB 3.51Å; P181-A228 HydrophobicContact CG-CB 3.9Å; P181-E231 WeakPolarHBondContact CD-OE2 3.42Å; P181-E231 HydrophobicContact CG-CB 4.05Å; P181-M232 HydrophobicContact CB-CG 4.43Å; P181-M232 HydrophobicContact CB-SD 4.39Å; P181-M232 HydrophobicContact CG-CG 3.92Å; P181-M232 WeakPolarHBondContact O-CE 3.23Å
182	L	66.7	Low	69.7	Low	165 Å²	165	91.2 Å²	91.2	86%	0.864	50%	0.5	S	S	*	.	S	Bend	trans	-74.5	-24.6	-178.8	-67.4	169.6	0	0	0	112.4	F180	F180-L182 PolarHBondContact O-N 3.21Å
183	I	74.7	Confident	71.1	Confident	68 Å²	68	88 Å²	88	35%	0.349	49%	0.49	S	S	.	.			trans	-145.9	154	-176.3	57.8	169.9	0	0	0	109.8	P181 A186 L189 H224 A228 M232	P181-I183 VanDerWaalsContact C-N 3.31Å; I183-A186 HydrophobicContact CD1-CB 4.05Å; I183-L189 HydrophobicContact CD1-CD1 3.56Å; I183-H224 PolarHBondContact O-CE1 3.1Å; I183-H224 VanDerWaalsContact O-CE1 3.23Å; I183-A228 WeakPolarHBondContact O-CB 3.23Å; I183-M232 VanDerWaalsContact C-SD 3.53Å
184	S	83	Confident	72.4	Confident	58 Å²	58	82.5 Å²	82.5	41%	0.406	46%	0.462	S	S	.	.	S	Bend	trans	-111.4	4.7	177.8	53.6	0	0	0	0	114.1	D225	S184-D225 WeakPolarHBondContact O-CB 3.27Å; S184-D225 VanDerWaalsContact O-CG 3.31Å
185	N	87.5	Confident	74	Confident	66 Å²	66	81.3 Å²	81.3	35%	0.353	46%	0.459	S	S	.	.			trans	-130.8	37.4	-169.7	68.5	-33	0	0	0	113.4	Q187 D188 L189	N185-Q187 PolarHBondContact O-N 3.11Å; N185-D188 HydrophobicContact CB-CB 4.34Å; N185-D188 PolarHBondContact O-N 3.43Å; N185-D188 VanDerWaalsContact O-N 3.16Å; N185-L189 PolarHBondContact O-N 3.37Å; N185-L189 VanDerWaalsContact O-N 3.15Å
186	A	88	Confident	75.7	Confident	15 Å²	15	79.8 Å²	79.8	12%	0.124	46%	0.46	C	S	.	.	H	α-helix	trans	-62.5	-28.8	-179.1	0	0	0	0	0	112.7	I183 A190 L221 D225	I183-A186 HydrophobicContact CD1-CB 4.05Å; A186-A190 WeakPolarHBondContact O-CB 3.41Å; A186-A190 PolarHBondContact O-N 3.23Å; A186-L221 HydrophobicContact CB-CD2 3.87Å; A186-D225 VanDerWaalsContact CB-OD1 3.23Å; A186-D225 WeakPolarHBondContact CB-OD1 3.36Å; A186-D225 VanDerWaalsContact N-CG 3.34Å; A186-D225 PolarHBondContact N-OD1 2.91Å; A186-D225 PolarHBondContact N-OD2 2.82Å; A186-D225 VanDerWaalsContact N-OD2 3.13Å
187	Q	90	Very high	77.6	Confident	61 Å²	61	76.7 Å²	76.7	29%	0.285	43%	0.429	S	S	.	.	H	α-helix	trans	-67.9	-40.6	174.4	-176.5	170.6	77.1	0	0	112.4	N185 A190 Q191 L221 D225	N185-Q187 PolarHBondContact O-N 3.11Å; Q187-A190 PolarHBondContact O-N 3.38Å; Q187-Q191 WeakPolarHBondContact O-CG 3.42Å; Q187-Q191 PolarHBondContact O-N 2.8Å; Q187-Q191 VanDerWaalsContact O-N 3.11Å; Q187-L221 HydrophobicContact CB-CB 4.47Å; Q187-D225 WeakPolarHBondContact CB-OD2 3.42Å; Q187-D225 PolarHBondContact N-OD2 2.99Å
188	D	87.1	Confident	79.1	Confident	92 Å²	92	79.1 Å²	79.1	49%	0.492	43%	0.427	S	S	.	.	H	α-helix	trans	-68	-42.1	177.9	-69.2	-27.1	0	0	0	110.9	N185 A190 Q191 E192	N185-D188 HydrophobicContact CB-CB 4.34Å; N185-D188 PolarHBondContact O-N 3.43Å; N185-D188 VanDerWaalsContact O-N 3.16Å; D188-A190 VanDerWaalsContact C-N 3.33Å; D188-A190 PolarHBondContact O-N 2.89Å; D188-Q191 WeakPolarHBondContact O-CB 3.44Å; D188-Q191 PolarHBondContact O-N 2.97Å; D188-Q191 VanDerWaalsContact O-N 3.1Å; D188-E192 PolarHBondContact O-N 3.16Å
189	L	88.3	Confident	80.3	Confident	66 Å²	66	78.7 Å²	78.7	35%	0.346	42%	0.424	S	S	.	.	H	α-helix	trans	-59.7	-42.6	173.6	-77.7	159.7	0	0	0	111.8	I183 N185 Q191 E192 V193	I183-L189 HydrophobicContact CD1-CD1 3.56Å; N185-L189 PolarHBondContact O-N 3.37Å; N185-L189 VanDerWaalsContact O-N 3.15Å; L189-Q191 VanDerWaalsContact C-N 3.28Å; L189-Q191 PolarHBondContact O-N 3.43Å; L189-E192 PolarHBondContact O-N 3.02Å; L189-V193 VanDerWaalsContact O-CG2 3.31Å; L189-V193 WeakPolarHBondContact O-CG2 3.39Å; L189-V193 PolarHBondContact O-N 2.74Å
190	A	89.3	Confident	81	Confident	13 Å²	13	75.4 Å²	75.4	11%	0.107	40%	0.402	C	S	.	.	H	α-helix	trans	-61.6	-36.7	175.2	0	0	0	0	0	112.1	A186 Q187 D188 Q194 L212 L221	A186-A190 WeakPolarHBondContact O-CB 3.41Å; A186-A190 PolarHBondContact O-N 3.23Å; Q187-A190 PolarHBondContact O-N 3.38Å; D188-A190 VanDerWaalsContact C-N 3.33Å; D188-A190 PolarHBondContact O-N 2.89Å; A190-Q194 VanDerWaalsContact O-CG 3.28Å; A190-Q194 WeakPolarHBondContact O-CG 3.48Å; A190-Q194 PolarHBondContact O-N 2.92Å; A190-L212 HydrophobicContact CB-CD2 4.29Å; A190-L221 HydrophobicContact CB-CD1 3.67Å
191	Q	86.8	Confident	82	Confident	103 Å²	103	76.9 Å²	76.9	48%	0.481	41%	0.41	S	S	.	.	H	α-helix	trans	-71.2	-34.9	175.4	-68.8	178	26.5	0	0	112.9	Q187 D188 L189 Q194 T195	Q187-Q191 WeakPolarHBondContact O-CG 3.42Å; Q187-Q191 PolarHBondContact O-N 2.8Å; Q187-Q191 VanDerWaalsContact O-N 3.11Å; D188-Q191 WeakPolarHBondContact O-CB 3.44Å; D188-Q191 PolarHBondContact O-N 2.97Å; D188-Q191 VanDerWaalsContact O-N 3.1Å; L189-Q191 VanDerWaalsContact C-N 3.28Å; L189-Q191 PolarHBondContact O-N 3.43Å; Q191-Q194 PolarHBondContact O-N 2.96Å; Q191-T195 PolarHBondContact O-N 2.92Å; Q191-T195 PolarHBondContact O-OG1 3.03Å
192	E	87.9	Confident	82.8	Confident	123 Å²	123	82.6 Å²	82.6	58%	0.575	44%	0.436	S	S	*	.	H	α-helix	trans	-65.5	-48	174.1	-171.8	175.9	-174.4	0	0	110.8	D188 L189 Q194 T195 V196	D188-E192 PolarHBondContact O-N 3.16Å; L189-E192 PolarHBondContact O-N 3.02Å; E192-Q194 VanDerWaalsContact C-N 3.29Å; E192-Q194 PolarHBondContact O-N 2.9Å; E192-T195 CarbonylContact O-C 3.54Å; E192-T195 WeakPolarHBondContact O-CA 3.43Å; E192-T195 WeakPolarHBondContact O-CB 3.43Å; E192-T195 PolarHBondContact O-N 3.21Å; E192-V196 WeakPolarHBondContact O-CG2 3.38Å; E192-V196 PolarHBondContact O-N 2.63Å
193	V	86.6	Confident	83.6	Confident	62 Å²	62	82.2 Å²	82.2	38%	0.376	43%	0.427	S	S	.	.	H	α-helix	trans	-55.7	-45.7	174	170	0	0	0	0	110.6	L189 T195 V196 L197 L208 L212	L189-V193 VanDerWaalsContact O-CG2 3.31Å; L189-V193 WeakPolarHBondContact O-CG2 3.39Å; L189-V193 PolarHBondContact O-N 2.74Å; V193-T195 VanDerWaalsContact C-N 3.28Å; V193-T195 PolarHBondContact O-N 2.72Å; V193-V196 PolarHBondContact O-N 3.47Å; V193-L197 HydrophobicContact CG1-CD1 3.66Å; V193-L197 HydrophobicContact CG1-CG 4.33Å; V193-L197 WeakPolarHBondContact O-CB 3.48Å; V193-L197 WeakPolarHBondContact O-CG 3.4Å; V193-L197 PolarHBondContact O-N 3.45Å; V193-L208 HydrophobicContact CG1-CD2 4.32Å; V193-L212 HydrophobicContact CB-CD1 4.42Å; V193-L212 HydrophobicContact CG1-CD1 3.9Å
194	Q	83.2	Confident	84	Confident	36 Å²	36	85 Å²	85	17%	0.168	44%	0.439	C	S	.	.	H	α-helix	trans	-60.8	-37.2	174.6	-74.3	-178.8	11.5	0	0	112.7	A190 Q191 E192 L197 K198 L212 N213	A190-Q194 VanDerWaalsContact O-CG 3.28Å; A190-Q194 WeakPolarHBondContact O-CG 3.48Å; A190-Q194 PolarHBondContact O-N 2.92Å; Q191-Q194 PolarHBondContact O-N 2.96Å; E192-Q194 VanDerWaalsContact C-N 3.29Å; E192-Q194 PolarHBondContact O-N 2.9Å; Q194-L197 PolarHBondContact O-N 3.26Å; Q194-K198 WeakPolarHBondContact O-CG 3.11Å; Q194-K198 PolarHBondContact O-N 3.46Å; Q194-L212 HydrophobicContact CG-CB 4.36Å; Q194-L212 HydrophobicContact CG-CD1 4.24Å; Q194-N213 PolarHBondContact NE2-OD1 3Å; Q194-N213 PolarHBondContact OE1-OD1 3.38Å
195	T	85.8	Confident	83.9	Confident	79 Å²	79	82.7 Å²	82.7	49%	0.485	42%	0.424	S	S	.	.	H	α-helix	trans	-70	-37.1	179.1	-62.1	0	0	0	0	112.1	Q191 E192 V193 L197	Q191-T195 PolarHBondContact O-N 2.92Å; Q191-T195 PolarHBondContact O-OG1 3.03Å; E192-T195 CarbonylContact O-C 3.54Å; E192-T195 WeakPolarHBondContact O-CA 3.43Å; E192-T195 WeakPolarHBondContact O-CB 3.43Å; E192-T195 PolarHBondContact O-N 3.21Å; V193-T195 VanDerWaalsContact C-N 3.28Å; V193-T195 PolarHBondContact O-N 2.72Å; T195-L197 VanDerWaalsContact C-N 3.33Å
196	V	85.9	Confident	83.7	Confident	97 Å²	97	84.9 Å²	84.9	59%	0.588	43%	0.432	S	S	*	.	H	α-helix	trans	-68.1	-33	172.8	175.2	0	0	0	0	111.7	E192 V193 P199	E192-V196 WeakPolarHBondContact O-CG2 3.38Å; E192-V196 PolarHBondContact O-N 2.63Å; V193-V196 PolarHBondContact O-N 3.47Å; V196-P199 VanDerWaalsContact O-CD 3.29Å; V196-P199 WeakPolarHBondContact O-CD 3.35Å
197	L	82.4	Confident	83.7	Confident	31 Å²	31	90.7 Å²	90.7	16%	0.162	46%	0.456	C	S	.	.	H	α-helix	trans	-81	-18.6	179.2	-68.7	171.1	0	0	0	114	V193 Q194 T195 V200 L208	V193-L197 HydrophobicContact CG1-CD1 3.66Å; V193-L197 HydrophobicContact CG1-CG 4.33Å; V193-L197 WeakPolarHBondContact O-CB 3.48Å; V193-L197 WeakPolarHBondContact O-CG 3.4Å; V193-L197 PolarHBondContact O-N 3.45Å; Q194-L197 PolarHBondContact O-N 3.26Å; T195-L197 VanDerWaalsContact C-N 3.33Å; L197-V200 WeakPolarHBondContact O-CB 3.34Å; L197-V200 PolarHBondContact O-N 3.07Å; L197-L208 HydrophobicContact CD1-CB 4.37Å; L197-L208 HydrophobicContact CD1-CD2 3.82Å; L197-L208 HydrophobicContact CD1-CG 4.07Å
198	K	77.5	Confident	83.6	Confident	154 Å²	154	91.2 Å²	91.2	67%	0.67	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-45.1	177.3	-82.8	169.8	-169.2	163	0	115.1	Q194 V200	Q194-K198 WeakPolarHBondContact O-CG 3.11Å; Q194-K198 PolarHBondContact O-N 3.46Å; K198-V200 VanDerWaalsContact C-N 3.26Å; K198-V200 PolarHBondContact O-N 3.49Å
199	P	76.8	Confident	83.6	Confident	98 Å²	98	88.7 Å²	88.7	64%	0.636	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-5	177.2	29.4	-35.7	0	0	0	114.2	V196	V196-P199 VanDerWaalsContact O-CD 3.29Å; V196-P199 WeakPolarHBondContact O-CD 3.35Å
200	V	71.4	Confident	83.6	Confident	52 Å²	52	88.4 Å²	88.4	32%	0.315	46%	0.456	S	S	.	.			trans	-98.5	120.2	-169.7	-174.6	0	0	0	0	110.8	L197 K198 H202	L197-V200 WeakPolarHBondContact O-CB 3.34Å; L197-V200 PolarHBondContact O-N 3.07Å; K198-V200 VanDerWaalsContact C-N 3.26Å; K198-V200 PolarHBondContact O-N 3.49Å; V200-H202 HydrophobicContact CG1-CB 4.01Å; V200-H202 VanDerWaalsContact CG1-CD2 3.49Å; V200-H202 WeakPolarHBondContact CG1-CD2 3.45Å
201	H	77.4	Confident	83.7	Confident	163 Å²	163	92.3 Å²	92.3	76%	0.755	48%	0.475	S	S	*	.			trans	-94.5	10.6	-179.2	-64.8	-59.5	0	0	0	114.5
202	H	81.7	Confident	83.8	Confident	132 Å²	132	88.7 Å²	88.7	61%	0.611	46%	0.458	S	S	*	.			trans	-68.8	144.5	176.7	-69.2	-66.9	0	0	0	111.6	V200 E204 G205 Q206	V200-H202 HydrophobicContact CG1-CB 4.01Å; V200-H202 VanDerWaalsContact CG1-CD2 3.49Å; V200-H202 WeakPolarHBondContact CG1-CD2 3.45Å; H202-E204 VanDerWaalsContact C-N 3.3Å; H202-E204 PolarHBondContact O-N 3.39Å; H202-G205 PolarHBondContact O-N 3.02Å; H202-Q206 PolarHBondContact O-N 2.86Å; H202-Q206 VanDerWaalsContact O-N 3.13Å
203	K	83.5	Confident	83.9	Confident	157 Å²	157	86.3 Å²	86.3	68%	0.683	45%	0.449	S	S	*	.	H	α-helix	trans	-64.4	-38	-173.8	-173.5	-176.3	174	-166.9	0	111.6	Q206 E207	K203-Q206 PolarHBondContact O-N 3.47Å; K203-E207 PolarHBondContact O-N 3.39Å
204	E	83.8	Confident	84.3	Confident	128 Å²	128	85.7 Å²	85.7	60%	0.598	45%	0.446	S	S	*	.	H	α-helix	trans	-66.4	-39.2	178.2	-59.7	71.3	-156.2	0	0	110.8	H202 E207 L208	H202-E204 VanDerWaalsContact C-N 3.3Å; H202-E204 PolarHBondContact O-N 3.39Å; E204-E207 PolarHBondContact O-N 3.45Å; E204-L208 WeakPolarHBondContact O-CB 3.46Å; E204-L208 PolarHBondContact O-N 3Å
205	G	81.9	Confident	84.6	Confident	9 Å²	9	88.2 Å²	88.2	9%	0.093	47%	0.465	C	S	.	.	H	α-helix	trans	-66.6	-35.8	175	0	0	0	0	0	112.9	H202 T209	H202-G205 PolarHBondContact O-N 3.02Å; G205-T209 VanDerWaalsContact O-CB 3.31Å; G205-T209 WeakPolarHBondContact O-CB 3.33Å; G205-T209 PolarHBondContact O-N 2.89Å; G205-T209 PolarHBondContact O-OG1 3.05Å
206	Q	83.2	Confident	84.8	Confident	111 Å²	111	91.9 Å²	91.9	52%	0.519	48%	0.477	S	S	.	.	H	α-helix	trans	-69.4	-39.1	174	-68.3	176.1	15	0	0	112	H202 K203 T209 A210	H202-Q206 PolarHBondContact O-N 2.86Å; H202-Q206 VanDerWaalsContact O-N 3.13Å; K203-Q206 PolarHBondContact O-N 3.47Å; Q206-T209 PolarHBondContact O-N 2.93Å; Q206-A210 WeakPolarHBondContact O-CB 3.36Å; Q206-A210 PolarHBondContact O-N 3.24Å
207	E	87.7	Confident	85	Confident	137 Å²	137	89.6 Å²	89.6	64%	0.64	46%	0.461	S	S	*	.	H	α-helix	trans	-65.2	-45.9	176	-175.7	171.1	-174.8	0	0	111.6	K203 E204 T209 A210 L211	K203-E207 PolarHBondContact O-N 3.39Å; E204-E207 PolarHBondContact O-N 3.45Å; E207-T209 VanDerWaalsContact C-N 3.33Å; E207-T209 PolarHBondContact O-N 3.36Å; E207-A210 WeakPolarHBondContact O-CB 3.47Å; E207-A210 PolarHBondContact O-N 3.01Å; E207-L211 PolarHBondContact O-N 3.39Å
208	L	86.9	Confident	85.3	Confident	73 Å²	73	91.9 Å²	91.9	38%	0.382	47%	0.471	S	S	.	.	H	α-helix	trans	-61.9	-41.7	174.8	-178.7	57.2	0	0	0	111.6	V193 L197 E204 A210 L211 L212	V193-L208 HydrophobicContact CG1-CD2 4.32Å; L197-L208 HydrophobicContact CD1-CB 4.37Å; L197-L208 HydrophobicContact CD1-CD2 3.82Å; L197-L208 HydrophobicContact CD1-CG 4.07Å; E204-L208 WeakPolarHBondContact O-CB 3.46Å; E204-L208 PolarHBondContact O-N 3Å; L208-A210 VanDerWaalsContact C-N 3.32Å; L208-A210 PolarHBondContact O-N 3.04Å; L208-L211 PolarHBondContact O-N 2.65Å; L208-L212 HydrophobicContact CD1-CD1 4.08Å; L208-L212 HydrophobicContact CD1-CG 4.06Å; L208-L212 HydrophobicContact CG-CD1 4.07Å; L208-L212 HydrophobicContact CG-CG 4.46Å; L208-L212 WeakPolarHBondContact O-CB 3.13Å; L208-L212 WeakPolarHBondContact O-CG 3.46Å; L208-L212 PolarHBondContact O-N 3.49Å
209	T	87.2	Confident	85.8	Confident	39 Å²	39	87.2 Å²	87.2	24%	0.239	46%	0.461	C	S	.	.	H	α-helix	trans	-62.2	-40	174.9	-60.1	0	0	0	0	111.6	G205 Q206 E207 N213	G205-T209 VanDerWaalsContact O-CB 3.31Å; G205-T209 WeakPolarHBondContact O-CB 3.33Å; G205-T209 PolarHBondContact O-N 2.89Å; G205-T209 PolarHBondContact O-OG1 3.05Å; Q206-T209 PolarHBondContact O-N 2.93Å; E207-T209 VanDerWaalsContact C-N 3.33Å; E207-T209 PolarHBondContact O-N 3.36Å; T209-N213 WeakPolarHBondContact O-CB 3.21Å; T209-N213 PolarHBondContact O-N 3.33Å; T209-N213 PolarHBondContact O-ND2 3.27Å
210	A	88.1	Confident	86.5	Confident	60 Å²	60	87.9 Å²	87.9	50%	0.496	46%	0.458	S	S	.	.	H	α-helix	trans	-66.2	-42.1	176.5	0	0	0	0	0	111.6	Q206 E207 L208 N213 T214	Q206-A210 WeakPolarHBondContact O-CB 3.36Å; Q206-A210 PolarHBondContact O-N 3.24Å; E207-A210 WeakPolarHBondContact O-CB 3.47Å; E207-A210 PolarHBondContact O-N 3.01Å; L208-A210 VanDerWaalsContact C-N 3.32Å; L208-A210 PolarHBondContact O-N 3.04Å; A210-N213 PolarHBondContact O-N 2.93Å; A210-T214 WeakPolarHBondContact O-CG2 3.46Å; A210-T214 PolarHBondContact O-N 2.9Å
211	L	91.3	Very high	87.4	Confident	95 Å²	95	87.1 Å²	87.1	50%	0.497	45%	0.452	S	S	.	.	H	α-helix	trans	-63.8	-49.4	178.8	-175.6	67.1	0	0	0	112	E207 L208 N213 T214 I217	E207-L211 PolarHBondContact O-N 3.39Å; L208-L211 PolarHBondContact O-N 2.65Å; L211-N213 PolarHBondContact O-N 3.37Å; L211-T214 WeakPolarHBondContact O-CB 3.5Å; L211-T214 PolarHBondContact O-N 3Å; L211-T214 PolarHBondContact O-OG1 3.25Å; L211-I217 HydrophobicContact CD1-CG1 4.34Å; L211-I217 HydrophobicContact CG-CG1 4.49Å
212	L	90.1	Very high	88	Confident	26 Å²	26	83.2 Å²	83.2	14%	0.136	44%	0.437	C	S	.	.	H	α-helix	trans	-65.1	-20.5	178.5	-67.2	175.3	0	0	0	112.8	A190 V193 Q194 L208 I217 Q218	A190-L212 HydrophobicContact CB-CD2 4.29Å; V193-L212 HydrophobicContact CB-CD1 4.42Å; V193-L212 HydrophobicContact CG1-CD1 3.9Å; Q194-L212 HydrophobicContact CG-CB 4.36Å; Q194-L212 HydrophobicContact CG-CD1 4.24Å; L208-L212 HydrophobicContact CD1-CD1 4.08Å; L208-L212 HydrophobicContact CD1-CG 4.06Å; L208-L212 HydrophobicContact CG-CD1 4.07Å; L208-L212 HydrophobicContact CG-CG 4.46Å; L208-L212 WeakPolarHBondContact O-CB 3.13Å; L208-L212 WeakPolarHBondContact O-CG 3.46Å; L208-L212 PolarHBondContact O-N 3.49Å; L212-I217 HydrophobicContact CD2-CG2 4.35Å; L212-Q218 WeakPolarHBondContact O-CG 3.44Å
213	N	89.2	Confident	88.2	Confident	73 Å²	73	79.4 Å²	79.4	39%	0.39	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-0.2	173.8	-77.3	-48	0	0	0	113.9	Q194 T209 A210 L211 Q218	Q194-N213 PolarHBondContact NE2-OD1 3Å; Q194-N213 PolarHBondContact OE1-OD1 3.38Å; T209-N213 WeakPolarHBondContact O-CB 3.21Å; T209-N213 PolarHBondContact O-N 3.33Å; T209-N213 PolarHBondContact O-ND2 3.27Å; A210-N213 PolarHBondContact O-N 2.93Å; L211-N213 PolarHBondContact O-N 3.37Å; N213-Q218 PolarHBondContact OD1-NE2 2.87Å
214	T	94.4	Very high	88.4	Confident	49 Å²	49	75.2 Å²	75.2	30%	0.301	41%	0.411	S	S	.	.	S	Bend	trans	-69.4	137.8	173.8	61.3	0	0	0	0	110.3	A210 L211 H216 I217 Q218	A210-T214 WeakPolarHBondContact O-CG2 3.46Å; A210-T214 PolarHBondContact O-N 2.9Å; L211-T214 WeakPolarHBondContact O-CB 3.5Å; L211-T214 PolarHBondContact O-N 3Å; L211-T214 PolarHBondContact O-OG1 3.25Å; T214-H216 PolarHBondContact O-N 2.77Å; T214-H216 VanDerWaalsContact O-N 3.15Å; T214-I217 PolarHBondContact O-N 3.29Å; T214-I217 VanDerWaalsContact O-N 3.16Å; T214-I217 WeakPolarHBondContact OG1-CB 3.35Å; T214-I217 WeakPolarHBondContact OG1-CG1 3.37Å; T214-Q218 PolarHBondContact O-N 3.46Å
215	P	90.3	Very high	88.7	Confident	89 Å²	89	70 Å²	70	58%	0.578	39%	0.387	S	S	*	.	H	α-helix	trans	-62	-28	-176.1	23.2	-33.5	0	0	0	112.5	A219	P215-A219 WeakPolarHBondContact O-CB 3.31Å; P215-A219 PolarHBondContact O-N 2.7Å
216	H	89.9	Confident	88.8	Confident	156 Å²	156	74.8 Å²	74.8	72%	0.722	41%	0.405	S	S	*	.	H	α-helix	trans	-72.5	-40.6	178.7	-58.7	-24	0	0	0	112.3	T214 L220	T214-H216 PolarHBondContact O-N 2.77Å; T214-H216 VanDerWaalsContact O-N 3.15Å; H216-L220 VanDerWaalsContact O-CB 3.29Å; H216-L220 WeakPolarHBondContact O-CB 3.2Å; H216-L220 PolarHBondContact O-N 2.62Å
217	I	90.5	Very high	88.6	Confident	49 Å²	49	73 Å²	73	25%	0.251	40%	0.401	S	S	.	.	H	α-helix	trans	-69.7	-42	175.9	-66.1	-63.7	0	0	0	110.4	L211 L212 T214 A219 L220 L221	L211-I217 HydrophobicContact CD1-CG1 4.34Å; L211-I217 HydrophobicContact CG-CG1 4.49Å; L212-I217 HydrophobicContact CD2-CG2 4.35Å; T214-I217 PolarHBondContact O-N 3.29Å; T214-I217 VanDerWaalsContact O-N 3.16Å; T214-I217 WeakPolarHBondContact OG1-CB 3.35Å; T214-I217 WeakPolarHBondContact OG1-CG1 3.37Å; I217-A219 VanDerWaalsContact C-N 3.34Å; I217-A219 PolarHBondContact O-N 2.98Å; I217-L220 PolarHBondContact O-N 2.91Å; I217-L221 HydrophobicContact CG2-CD1 4.03Å; I217-L221 HydrophobicContact CG2-CG 4.35Å; I217-L221 VanDerWaalsContact O-CG 3.3Å; I217-L221 WeakPolarHBondContact O-CG 3.5Å; I217-L221 PolarHBondContact O-N 2.78Å
218	Q	89.5	Confident	88.2	Confident	80 Å²	80	66.5 Å²	66.5	37%	0.374	37%	0.371	S	S	.	.	H	α-helix	trans	-61.6	-42.1	175.3	-69.3	-178.9	-15.6	0	0	112.4	L212 N213 T214 L222	L212-Q218 WeakPolarHBondContact O-CG 3.44Å; N213-Q218 PolarHBondContact OD1-NE2 2.87Å; T214-Q218 PolarHBondContact O-N 3.46Å; Q218-L222 VanDerWaalsContact O-CB 3.29Å; Q218-L222 WeakPolarHBondContact O-CB 3.4Å; Q218-L222 PolarHBondContact O-N 2.89Å
219	A	88.1	Confident	87.8	Confident	55 Å²	55	67.1 Å²	67.1	46%	0.455	37%	0.372	S	S	.	.	H	α-helix	trans	-67.1	-36.5	175.9	0	0	0	0	0	112.2	P215 I217 A223	P215-A219 WeakPolarHBondContact O-CB 3.31Å; P215-A219 PolarHBondContact O-N 2.7Å; I217-A219 VanDerWaalsContact C-N 3.34Å; I217-A219 PolarHBondContact O-N 2.98Å; A219-A223 VanDerWaalsContact O-CB 3.29Å; A219-A223 WeakPolarHBondContact O-CB 3.3Å; A219-A223 PolarHBondContact O-N 3Å
220	L	90.1	Very high	87.1	Confident	112 Å²	112	72.1 Å²	72.1	59%	0.586	39%	0.393	S	S	*	.	H	α-helix	trans	-65.8	-46.8	175.9	-179	65	0	0	0	111.6	H216 I217 L222 A223 H224	H216-L220 VanDerWaalsContact O-CB 3.29Å; H216-L220 WeakPolarHBondContact O-CB 3.2Å; H216-L220 PolarHBondContact O-N 2.62Å; I217-L220 PolarHBondContact O-N 2.91Å; L220-L222 VanDerWaalsContact C-N 3.33Å; L220-L222 PolarHBondContact O-N 2.86Å; L220-A223 PolarHBondContact O-N 3.4Å; L220-H224 WeakPolarHBondContact O-CB 3.5Å; L220-H224 PolarHBondContact O-N 3.46Å
221	L	90.8	Very high	86.1	Confident	37 Å²	37	74 Å²	74	19%	0.194	39%	0.391	C	S	.	.	H	α-helix	trans	-63.3	-40.3	176.2	-66.6	173.5	0	0	0	111.4	A186 Q187 A190 I217 H224 D225	A186-L221 HydrophobicContact CB-CD2 3.87Å; Q187-L221 HydrophobicContact CB-CB 4.47Å; A190-L221 HydrophobicContact CB-CD1 3.67Å; I217-L221 HydrophobicContact CG2-CD1 4.03Å; I217-L221 HydrophobicContact CG2-CG 4.35Å; I217-L221 VanDerWaalsContact O-CG 3.3Å; I217-L221 WeakPolarHBondContact O-CG 3.5Å; I217-L221 PolarHBondContact O-N 2.78Å; L221-H224 WeakPolarHBondContact O-CB 3.29Å; L221-H224 PolarHBondContact O-N 3.13Å; L221-D225 WeakPolarHBondContact O-CB 3.41Å; L221-D225 VanDerWaalsContact O-CG 3.28Å; L221-D225 PolarHBondContact O-N 2.83Å
222	L	89.6	Confident	85.1	Confident	81 Å²	81	72.8 Å²	72.8	42%	0.424	38%	0.384	S	S	.	.	H	α-helix	trans	-63.6	-43.6	174.6	179.6	66.2	0	0	0	112.1	Q218 L220 D225 K226	Q218-L222 VanDerWaalsContact O-CB 3.29Å; Q218-L222 WeakPolarHBondContact O-CB 3.4Å; Q218-L222 PolarHBondContact O-N 2.89Å; L220-L222 VanDerWaalsContact C-N 3.33Å; L220-L222 PolarHBondContact O-N 2.86Å; L222-D225 PolarHBondContact O-N 3.15Å; L222-K226 HydrophobicContact CD1-CG 4.47Å; L222-K226 WeakPolarHBondContact O-CB 3.29Å; L222-K226 VanDerWaalsContact O-CG 3.26Å; L222-K226 WeakPolarHBondContact O-CG 3.36Å; L222-K226 PolarHBondContact O-N 3.27Å
223	A	86.3	Confident	83.4	Confident	52 Å²	52	76.9 Å²	76.9	43%	0.43	40%	0.402	S	S	.	.	H	α-helix	trans	-65.6	-42.5	177.8	0	0	0	0	0	111.1	A219 L220 K226 V227	A219-A223 VanDerWaalsContact O-CB 3.29Å; A219-A223 WeakPolarHBondContact O-CB 3.3Å; A219-A223 PolarHBondContact O-N 3Å; L220-A223 PolarHBondContact O-N 3.4Å; A223-K226 PolarHBondContact O-N 3.29Å; A223-V227 VanDerWaalsContact O-CG2 3.31Å; A223-V227 WeakPolarHBondContact O-CG2 3.41Å; A223-V227 PolarHBondContact O-N 3.43Å
224	H	88.1	Confident	81.4	Confident	69 Å²	69	81.2 Å²	81.2	32%	0.319	43%	0.425	S	S	.	.	H	α-helix	trans	-55.8	-55.9	171.8	169.5	-85.5	0	0	0	110.9	I183 L220 L221 K226 V227 A228	I183-H224 PolarHBondContact O-CE1 3.1Å; I183-H224 VanDerWaalsContact O-CE1 3.23Å; L220-H224 WeakPolarHBondContact O-CB 3.5Å; L220-H224 PolarHBondContact O-N 3.46Å; L221-H224 WeakPolarHBondContact O-CB 3.29Å; L221-H224 PolarHBondContact O-N 3.13Å; H224-K226 PolarHBondContact O-N 2.88Å; H224-V227 CarbonylContact O-C 3.47Å; H224-V227 PolarHBondContact O-N 2.89Å; H224-A228 VanDerWaalsContact O-CB 3.3Å; H224-A228 WeakPolarHBondContact O-CB 3.49Å; H224-A228 PolarHBondContact O-N 3.12Å
225	D	89.4	Confident	78.7	Confident	17 Å²	17	86.6 Å²	86.6	9%	0.091	45%	0.447	C	S	.	.	H	α-helix	trans	-62.4	-33.2	-176.7	-71.7	-1.1	0	0	0	111.8	S184 A186 Q187 L221 L222 E229	S184-D225 WeakPolarHBondContact O-CB 3.27Å; S184-D225 VanDerWaalsContact O-CG 3.31Å; A186-D225 VanDerWaalsContact CB-OD1 3.23Å; A186-D225 WeakPolarHBondContact CB-OD1 3.36Å; A186-D225 VanDerWaalsContact N-CG 3.34Å; A186-D225 PolarHBondContact N-OD1 2.91Å; A186-D225 PolarHBondContact N-OD2 2.82Å; A186-D225 VanDerWaalsContact N-OD2 3.13Å; Q187-D225 WeakPolarHBondContact CB-OD2 3.42Å; Q187-D225 PolarHBondContact N-OD2 2.99Å; L221-D225 WeakPolarHBondContact O-CB 3.41Å; L221-D225 VanDerWaalsContact O-CG 3.28Å; L221-D225 PolarHBondContact O-N 2.83Å; L222-D225 PolarHBondContact O-N 3.15Å; D225-E229 WeakPolarHBondContact O-CB 3.36Å; D225-E229 PolarHBondContact O-N 2.89Å
226	K	84.3	Confident	76	Confident	110 Å²	110	86.9 Å²	86.9	48%	0.478	45%	0.448	S	S	.	.	H	α-helix	trans	-69.5	-37.7	174.4	-73.9	-72.4	153.8	-149.2	0	113.4	L222 A223 H224 E229 Q230	L222-K226 HydrophobicContact CD1-CG 4.47Å; L222-K226 WeakPolarHBondContact O-CB 3.29Å; L222-K226 VanDerWaalsContact O-CG 3.26Å; L222-K226 WeakPolarHBondContact O-CG 3.36Å; L222-K226 PolarHBondContact O-N 3.27Å; A223-K226 PolarHBondContact O-N 3.29Å; H224-K226 PolarHBondContact O-N 2.88Å; K226-E229 IonicContact NZ-OE2 3.58Å; K226-E229 PolarHBondContact NZ-OE2 2.83Å; K226-Q230 WeakPolarHBondContact O-CG 3.27Å; K226-Q230 PolarHBondContact O-N 3.5Å
227	V	79.4	Confident	73.7	Confident	73 Å²	73	87.2 Å²	87.2	44%	0.442	45%	0.454	S	S	.	.	H	α-helix	trans	-71.7	-45.3	174.6	172.2	0	0	0	0	109.9	A223 H224 E229 Q230 E231	A223-V227 VanDerWaalsContact O-CG2 3.31Å; A223-V227 WeakPolarHBondContact O-CG2 3.41Å; A223-V227 PolarHBondContact O-N 3.43Å; H224-V227 CarbonylContact O-C 3.47Å; H224-V227 PolarHBondContact O-N 2.89Å; V227-E229 PolarHBondContact O-N 3.3Å; V227-Q230 CarbonylContact O-C 3.59Å; V227-Q230 PolarHBondContact O-N 3.2Å; V227-Q230 VanDerWaalsContact O-N 3.09Å; V227-E231 HydrophobicContact CG1-CG 4.24Å; V227-E231 PolarHBondContact O-N 3.19Å
228	A	79.4	Confident	71.1	Confident	1 Å²	1	90 Å²	90	1%	0.008	47%	0.473	C	S	.	.	H	α-helix	trans	-62.9	-40.4	176.7	0	0	0	0	0	112.3	P181 I183 H224 Q230 E231 M232	P181-A228 HydrophobicContact CB-CB 3.51Å; P181-A228 HydrophobicContact CG-CB 3.9Å; I183-A228 WeakPolarHBondContact O-CB 3.23Å; H224-A228 VanDerWaalsContact O-CB 3.3Å; H224-A228 WeakPolarHBondContact O-CB 3.49Å; H224-A228 PolarHBondContact O-N 3.12Å; A228-Q230 PolarHBondContact O-N 3.04Å; A228-E231 PolarHBondContact O-N 3.34Å; A228-M232 HydrophobicContact CB-SD 4.31Å; A228-M232 WeakPolarHBondContact O-CA 3.49Å; A228-M232 WeakPolarHBondContact O-CB 3.41Å; A228-M232 WeakPolarHBondContact O-CG 3.24Å; A228-M232 PolarHBondContact O-N 3.49Å
229	E	78.8	Confident	68.8	Low	86 Å²	86	93.5 Å²	93.5	40%	0.402	50%	0.495	S	S	.	.	H	α-helix	trans	-61.6	-34.1	173.5	-177.9	178.7	-158.1	0	0	111.6	D225 K226 V227 Q233	D225-E229 WeakPolarHBondContact O-CB 3.36Å; D225-E229 PolarHBondContact O-N 2.89Å; K226-E229 IonicContact NZ-OE2 3.58Å; K226-E229 PolarHBondContact NZ-OE2 2.83Å; V227-E229 PolarHBondContact O-N 3.3Å; E229-Q233 WeakPolarHBondContact O-CB 3.17Å; E229-Q233 WeakPolarHBondContact O-CG 3.45Å; E229-Q233 PolarHBondContact O-N 3.19Å; E229-Q233 PolarHBondContact O-NE2 3.36Å
230	Q	71.2	Confident	66.6	Low	144 Å²	144	99.5 Å²	99.5	67%	0.673	51%	0.513	S	S	*	.	H	α-helix	trans	-79.5	-39.5	176.5	-74.1	-179.3	-14.9	0	0	113.3	K226 V227 A228	K226-Q230 WeakPolarHBondContact O-CG 3.27Å; K226-Q230 PolarHBondContact O-N 3.5Å; V227-Q230 CarbonylContact O-C 3.59Å; V227-Q230 PolarHBondContact O-N 3.2Å; V227-Q230 VanDerWaalsContact O-N 3.09Å; A228-Q230 PolarHBondContact O-N 3.04Å
231	E	68	Low	64.2	Low	100 Å²	100	105.5 Å²	105.5	47%	0.467	53%	0.528	S	S	.	.	H	α-helix	trans	-82.1	-29.7	-178.8	-68.6	-167.2	172.4	0	0	113.1	F180 P181 V227 A228	F180-E231 HydrophobicContact CE2-CB 4.49Å; F180-E231 VanDerWaalsContact CZ-O 3.31Å; F180-E231 WeakPolarHBondContact CZ-O 3.42Å; P181-E231 WeakPolarHBondContact CD-OE2 3.42Å; P181-E231 HydrophobicContact CG-CB 4.05Å; V227-E231 HydrophobicContact CG1-CG 4.24Å; V227-E231 PolarHBondContact O-N 3.19Å; A228-E231 PolarHBondContact O-N 3.34Å
232	M	69.5	Low	61.8	Low	69 Å²	69	108.5 Å²	108.5	34%	0.34	55%	0.548	S	S	.	.	S	Bend	trans	-88.6	-10.9	172.9	-55.9	179.7	91.8	0	0	112.6	F180 P181 I183 A228 L234	F180-M232 HydrophobicContact CE1-CG 3.94Å; F180-M232 HydrophobicContact CZ-CG 4.26Å; P181-M232 HydrophobicContact CB-CG 4.43Å; P181-M232 HydrophobicContact CB-SD 4.39Å; P181-M232 HydrophobicContact CG-CG 3.92Å; P181-M232 WeakPolarHBondContact O-CE 3.23Å; I183-M232 VanDerWaalsContact C-SD 3.53Å; A228-M232 HydrophobicContact CB-SD 4.31Å; A228-M232 WeakPolarHBondContact O-CA 3.49Å; A228-M232 WeakPolarHBondContact O-CB 3.41Å; A228-M232 WeakPolarHBondContact O-CG 3.24Å; A228-M232 PolarHBondContact O-N 3.49Å; M232-L234 PolarHBondContact O-N 2.94Å; M232-L234 VanDerWaalsContact O-N 3.09Å
233	Q	55.1	Low	59.7	Low	112 Å²	112	111 Å²	111	52%	0.523	55%	0.552	S	S	.	*	S	Bend	trans	-61.8	113.9	162.8	-95.5	168	33.2	0	0	106.9	E229 E235	E229-Q233 WeakPolarHBondContact O-CB 3.17Å; E229-Q233 WeakPolarHBondContact O-CG 3.45Å; E229-Q233 PolarHBondContact O-N 3.19Å; E229-Q233 PolarHBondContact O-NE2 3.36Å; Q233-E235 PolarHBondContact O-N 3.32Å
234	L	46.3	Very low	57.8	Low	164 Å²	164	114.3 Å²	114.3	86%	0.859	56%	0.559	S	S	*	*			trans	-50.4	114.6	159.8	-70.8	166.3	0	0	0	105.5	M232 P236	M232-L234 PolarHBondContact O-N 2.94Å; M232-L234 VanDerWaalsContact O-N 3.09Å; L234-P236 WeakPolarHBondContact O-CD 3.26Å
235	E	37.6	Very low	56	Low	163 Å²	163	114.2 Å²	114.2	76%	0.762	57%	0.566	S	S	*	*			trans	-48.7	121.9	170.7	-74.3	-165.7	161.8	0	0	105.8	Q233 I237	Q233-E235 PolarHBondContact O-N 3.32Å; E235-I237 PolarHBondContact O-N 2.89Å; E235-I237 VanDerWaalsContact O-N 3.1Å
236	P	34.6	Very low	54.3	Low	95 Å²	95	119.7 Å²	119.7	62%	0.617	59%	0.594	S	S	*	*			trans	-53.9	129.8	168.5	23.8	-29.9	0	0	0	104.4	L234 T238	L234-P236 WeakPolarHBondContact O-CD 3.26Å; P236-T238 HydrophobicContact CG-CG2 4.47Å; P236-T238 PolarHBondContact O-N 3.34Å; P236-T238 PolarHBondContact O-OG1 3.49Å
237	I	42.3	Very low	52.9	Low	162 Å²	162	115.6 Å²	115.6	83%	0.831	58%	0.583	S	S	*	*			trans	-56.8	83.9	178.7	-57.4	162.6	0	0	0	107	E235 D239	E235-I237 PolarHBondContact O-N 2.89Å; E235-I237 VanDerWaalsContact O-N 3.1Å; I237-D239 VanDerWaalsContact C-N 3.29Å; I237-D239 PolarHBondContact O-N 3.03Å
238	T	34.9	Very low	51.7	Low	107 Å²	107	120.2 Å²	120.2	66%	0.656	60%	0.6	S	S	*	*			trans	-97.2	76	167.6	50.5	0	0	0	0	104	P236 E240	P236-T238 HydrophobicContact CG-CG2 4.47Å; P236-T238 PolarHBondContact O-N 3.34Å; P236-T238 PolarHBondContact O-OG1 3.49Å; T238-E240 PolarHBondContact O-N 3.44Å
239	D	42.2	Very low	50.4	Low	155 Å²	155	126.1 Å²	126.1	83%	0.829	62%	0.623	S	S	*	*	S	Bend	trans	24.2	6.3	148.2	-95.7	-16.1	0	0	0	123.2	I237	I237-D239 VanDerWaalsContact C-N 3.29Å; I237-D239 PolarHBondContact O-N 3.03Å
240	E	40.2	Very low	49.4	Very low	181 Å²	181	126.3 Å²	126.3	85%	0.846	65%	0.648	S	S	*	*			trans	-139.3	8.2	-167.5	-81	-161.4	159.1	0	0	118.7	T238	T238-E240 PolarHBondContact O-N 3.44Å
241	R	40.4	Very low	49	Very low	237 Å²	237	122.7 Å²	122.7	89%	0.894	65%	0.65	S	S	*	*	S	Bend	trans	-142.7	104.2	166.3	-66.4	-173.3	-177.4	-179.7	1.8	111.8
242	V	39.3	Very low	49	Very low	101 Å²	101	122.9 Å²	122.9	61%	0.612	65%	0.65	S	S	*	*	S	Bend	trans	151.1	104.4	141.4	165.7	0	0	0	0	110.5	E244	V242-E244 PolarHBondContact O-N 3.01Å
243	Y	46.1	Very low	49.5	Very low	133 Å²	133	123.7 Å²	123.7	52%	0.522	66%	0.659	S	S	.	*			trans	43.6	55.9	152.2	-44.9	-67.7	0	0	0	120.8	R258	Y243-R258 VanDerWaalsContact CE1-NH1 3.25Å
244	E	46.2	Very low	50.9	Low	121 Å²	121	118.7 Å²	118.7	57%	0.565	64%	0.636	S	S	*	*			trans	-119.4	104.4	154.8	-73.6	-173.4	164.8	0	0	108.9	V242 K255	V242-E244 PolarHBondContact O-N 3.01Å; E244-K255 WeakPolarHBondContact OE1-CE 3.42Å; E244-K255 IonicContact OE1-NZ 3.62Å
245	S	51.3	Low	52.9	Low	67 Å²	67	112 Å²	112	47%	0.469	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.6	106.6	163.7	44.8	0	0	0	0	107.7	G247	S245-G247 PolarHBondContact O-N 3.38Å; S245-G247 VanDerWaalsContact O-N 3.15Å
246	I	52.9	Low	55.3	Low	133 Å²	133	106.3 Å²	106.3	68%	0.682	58%	0.575	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.4	105.7	172.2	-58.4	173.1	0	0	0	107.2	T253 V254	I246-T253 HydrophobicContact CG2-CG2 4.29Å; I246-V254 VanDerWaalsContact CA-O 3.3Å; I246-V254 WeakPolarHBondContact CA-O 3.42Å
247	G	55.3	Low	57.9	Low	24 Å²	24	101.8 Å²	101.8	25%	0.247	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	167.1	174.8	0	0	0	0	0	111.5	S245 V254	S245-G247 PolarHBondContact O-N 3.38Å; S245-G247 VanDerWaalsContact O-N 3.15Å; G247-V254 PolarHBondContact N-O 2.87Å; G247-V254 WeakPolarHBondContact O-CG2 3.38Å; G247-V254 PolarHBondContact O-N 3.24Å
248	Q	54.1	Low	60.1	Low	170 Å²	170	99.8 Å²	99.8	79%	0.794	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	119.1	163.2	-79.5	-178	-17.2	0	0	108.6	E252	Q248-E252 WeakPolarHBondContact CA-O 3.23Å
249	Y	52.3	Low	62.8	Low	124 Å²	124	95 Å²	95	49%	0.486	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	118.3	171.5	-149.5	-81.2	0	0	0	107.5	G251 E252 E303	Y249-G251 PolarHBondContact O-N 2.97Å; Y249-E252 PolarHBondContact N-O 3.48Å; Y249-E252 VanDerWaalsContact N-O 3.16Å; Y249-E252 PolarHBondContact O-N 3.37Å; Y249-E252 VanDerWaalsContact O-N 3.08Å; Y249-E303 WeakPolarHBondContact CE2-OE1 3.29Å; Y249-E303 VanDerWaalsContact CZ-OE1 3.23Å; Y249-E303 PolarHBondContact OH-OE1 3.26Å
250	G	58	Low	64.9	Low	90 Å²	90	93.1 Å²	93.1	93%	0.928	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	10.7	178.1	0	0	0	0	0	116.9
251	G	63.2	Low	67.1	Low	69 Å²	69	85 Å²	85	71%	0.711	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.5	-3.3	-177.5	0	0	0	0	0	115.3	Y249	Y249-G251 PolarHBondContact O-N 2.97Å
252	E	68.4	Low	69.3	Low	103 Å²	103	76.3 Å²	76.3	48%	0.481	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	147.3	178.2	-66.2	175.1	157.1	0	0	111.1	Q248 Y249 V254 I333	Q248-E252 WeakPolarHBondContact CA-O 3.23Å; Y249-E252 PolarHBondContact N-O 3.48Å; Y249-E252 VanDerWaalsContact N-O 3.16Å; Y249-E252 PolarHBondContact O-N 3.37Å; Y249-E252 VanDerWaalsContact O-N 3.08Å; E252-V254 PolarHBondContact O-N 3.35Å; E252-I333 WeakPolarHBondContact OE2-CD1 3.43Å
253	T	78.7	Confident	71.4	Confident	87 Å²	87	79.2 Å²	79.2	53%	0.534	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	114.8	176.8	48.5	0	0	0	0	109.6	I246	I246-T253 HydrophobicContact CG2-CG2 4.29Å
254	V	85.4	Confident	73.1	Confident	6 Å²	6	79.5 Å²	79.5	4%	0.036	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	140.9	179.5	-61.8	0	0	0	0	111.6	I246 G247 E252 L302 V331 L332 I333	I246-V254 VanDerWaalsContact CA-O 3.3Å; I246-V254 WeakPolarHBondContact CA-O 3.42Å; G247-V254 PolarHBondContact N-O 2.87Å; G247-V254 WeakPolarHBondContact O-CG2 3.38Å; G247-V254 PolarHBondContact O-N 3.24Å; E252-V254 PolarHBondContact O-N 3.35Å; V254-L302 HydrophobicContact CG1-CD1 3.67Å; V254-V331 HydrophobicContact CB-CG1 3.93Å; V254-V331 HydrophobicContact CG1-CG1 4.26Å; V254-V331 HydrophobicContact CG2-CG1 4.05Å; V254-L332 CarbonylContact C-O 3.6Å; V254-L332 VanDerWaalsContact CA-O 3.23Å; V254-L332 WeakPolarHBondContact CA-O 3.28Å; V254-I333 HydrophobicContact CG1-CG1 4.33Å
255	K	87.3	Confident	75	Confident	24 Å²	24	77.6 Å²	77.6	10%	0.104	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	118.8	174	-172.9	-166	-172.3	-177.9	0	108.7	E244 V257 L294 L332	E244-K255 WeakPolarHBondContact OE1-CE 3.42Å; E244-K255 IonicContact OE1-NZ 3.62Å; K255-V257 HydrophobicContact CD-CG1 3.79Å; K255-V257 VanDerWaalsContact CE-CG1 3.49Å; K255-V257 HydrophobicContact CG-CG1 3.83Å; K255-L294 PolarHBondContact NZ-O 3.41Å; K255-L332 HydrophobicContact CB-CB 4.39Å; K255-L332 PolarHBondContact N-O 3.35Å; K255-L332 PolarHBondContact O-N 3.09Å
256	I	87.5	Confident	76.9	Confident	43 Å²	43	78.2 Å²	78.2	22%	0.221	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.6	175	-57.5	177.4	0	0	0	108.7	T329 F330 V331	I256-T329 HydrophobicContact CG2-CG2 3.72Å; I256-F330 CarbonylContact C-O 3.45Å; I256-F330 VanDerWaalsContact CA-O 3.27Å; I256-F330 WeakPolarHBondContact CA-O 3.45Å; I256-V331 HydrophobicContact CG1-CG1 4.49Å; I256-V331 HydrophobicContact CG1-CG2 4.32Å
257	V	90.8	Very high	78.7	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	153.1	-179.6	-57.9	0	0	0	0	111.4	K255 L294 L295 T329 F330 L332	K255-V257 HydrophobicContact CD-CG1 3.79Å; K255-V257 VanDerWaalsContact CE-CG1 3.49Å; K255-V257 HydrophobicContact CG-CG1 3.83Å; V257-L294 HydrophobicContact CB-CB 3.99Å; V257-L294 HydrophobicContact CB-CD1 4.12Å; V257-L294 HydrophobicContact CG1-CB 4.06Å; V257-L294 HydrophobicContact CG2-CB 4.33Å; V257-L295 HydrophobicContact CG2-CD2 3.93Å; V257-T329 CarbonylContact O-C 3.48Å; V257-T329 WeakPolarHBondContact O-CA 3.44Å; V257-F330 HydrophobicContact CG2-CB 3.7Å; V257-F330 HydrophobicContact CG2-CD2 4.39Å; V257-F330 HydrophobicContact CG2-CG 4.35Å; V257-F330 PolarHBondContact N-O 3.33Å; V257-F330 PolarHBondContact O-N 2.92Å; V257-L332 HydrophobicContact CG2-CD1 3.68Å; V257-L332 HydrophobicContact CG2-CG 4.45Å
258	R	88.7	Confident	80.5	Confident	120 Å²	120	71.7 Å²	71.7	45%	0.453	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.9	179.4	-66.8	-177.6	-179.2	140.5	2.6	110.7	Y243 L294 T327 L328 T329	Y243-R258 VanDerWaalsContact CE1-NH1 3.25Å; R258-L294 WeakPolarHBondContact O-CD1 3.42Å; R258-T327 HydrophobicContact CB-CG2 4.15Å; R258-L328 CarbonylContact C-O 3.6Å; R258-L328 VanDerWaalsContact CA-O 3.29Å; R258-L328 WeakPolarHBondContact CA-O 3.47Å; R258-T329 HydrophobicContact CG-CG2 4.23Å
259	I	90.4	Very high	82.4	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.031	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	132.6	-177.3	-51.8	173.3	0	0	0	109	L267 A288 L294 L295 L328 F330	I259-L267 HydrophobicContact CB-CD1 4.45Å; I259-L267 HydrophobicContact CD1-CD2 4.47Å; I259-L267 HydrophobicContact CG2-CD1 3.76Å; I259-A288 HydrophobicContact CG2-CB 4.26Å; I259-L294 HydrophobicContact CD1-CB 4.37Å; I259-L294 HydrophobicContact CG1-CB 4.49Å; I259-L294 HydrophobicContact CG1-CD1 4.24Å; I259-L295 HydrophobicContact CD1-CD1 3.63Å; I259-L295 HydrophobicContact CD1-CD2 3.83Å; I259-L295 HydrophobicContact CD1-CG 3.44Å; I259-L295 VanDerWaalsContact CD1-CG 3.44Å; I259-L328 PolarHBondContact N-O 3.09Å; I259-L328 PolarHBondContact O-N 2.73Å; I259-F330 HydrophobicContact CB-CE2 4.47Å; I259-F330 HydrophobicContact CD1-CD2 4.35Å; I259-F330 HydrophobicContact CD1-CE2 4.22Å
260	E	86.4	Confident	84.3	Confident	116 Å²	116	60.4 Å²	60.4	54%	0.542	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	122.6	174.8	-70.5	-60.5	147.3	0	0	110.7	G326 T327	E260-G326 VanDerWaalsContact OE2-C 3.32Å; E260-T327 VanDerWaalsContact OE1-CB 3.31Å; E260-T327 WeakPolarHBondContact OE1-CB 3.46Å; E260-T327 WeakPolarHBondContact OE1-CG2 3.29Å; E260-T327 PolarHBondContact OE1-OG1 3.43Å; E260-T327 PolarHBondContact OE2-N 2.97Å
261	K	87.2	Confident	86.1	Confident	12 Å²	12	58.3 Å²	58.3	5%	0.052	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.8	173.1	-179.6	171.6	-177.5	-72	0	110.4	I265 L267 L321 M324 G326 L328	K261-I265 WeakPolarHBondContact CE-O 3.3Å; K261-L267 HydrophobicContact CB-CD1 4.15Å; K261-L321 WeakPolarHBondContact CE-O 3.48Å; K261-L321 PolarHBondContact NZ-O 2.63Å; K261-M324 WeakPolarHBondContact CD-O 3.35Å; K261-M324 PolarHBondContact NZ-O 2.64Å; K261-G326 PolarHBondContact N-O 2.89Å; K261-G326 PolarHBondContact O-N 3.28Å; K261-L328 HydrophobicContact CB-CD1 3.72Å; K261-L328 HydrophobicContact CB-CG 3.87Å; K261-L328 HydrophobicContact CD-CD1 3.69Å; K261-L328 HydrophobicContact CG-CD1 4.31Å
262	A	85.6	Confident	87.5	Confident	53 Å²	53	59.4 Å²	59.4	44%	0.438	30%	0.303	S	S	.	.			trans	-71.1	152.1	169.9	0	0	0	0	0	111.4	I265	A262-I265 HydrophobicContact CB-CB 4.03Å; A262-I265 HydrophobicContact CB-CD1 3.86Å; A262-I265 HydrophobicContact CB-CG1 4.22Å
263	R	83.3	Confident	88.7	Confident	163 Å²	163	57 Å²	57	62%	0.615	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	137.3	176	-175.3	-178.3	-68.6	-169	-5.6	109.8	I265 H325	R263-I265 PolarHBondContact O-N 3.31Å; R263-H325 HydrophobicContact CB-CB 4.16Å; R263-H325 PolarHBondContact NH2-NE2 3.41Å
264	D	83.1	Confident	89.4	Confident	138 Å²	138	57.5 Å²	57.5	74%	0.738	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	7	178.7	-50.1	-36.8	0	0	0	115.6
265	I	85.8	Confident	89.7	Confident	82 Å²	82	65.8 Å²	65.8	42%	0.421	33%	0.33	S	S	.	.			trans	-108.1	124.8	175.3	-59.2	179.9	0	0	0	108.3	K261 A262 R263	K261-I265 WeakPolarHBondContact CE-O 3.3Å; A262-I265 HydrophobicContact CB-CB 4.03Å; A262-I265 HydrophobicContact CB-CD1 3.86Å; A262-I265 HydrophobicContact CB-CG1 4.22Å; R263-I265 PolarHBondContact O-N 3.31Å
266	P	89.7	Confident	89.8	Confident	80 Å²	80	68.9 Å²	68.9	52%	0.519	35%	0.347	S	S	.	.			trans	-65.3	151.8	176.3	-15.6	27.7	0	0	0	111.5	G268 L403	P266-G268 PolarHBondContact O-N 3.14Å; P266-L403 HydrophobicContact CB-CD1 3.9Å; P266-L403 HydrophobicContact CG-CD1 4.1Å
267	L	91.3	Very high	90	Very high	17 Å²	17	67.5 Å²	67.5	9%	0.089	34%	0.341	C	S	.	.			trans	-65.5	-26.8	-179.4	-160.4	74.8	0	0	0	112.7	I259 K261 G287 A288 A289 L295 F330	I259-L267 HydrophobicContact CB-CD1 4.45Å; I259-L267 HydrophobicContact CD1-CD2 4.47Å; I259-L267 HydrophobicContact CG2-CD1 3.76Å; K261-L267 HydrophobicContact CB-CD1 4.15Å; L267-G287 CarbonylContact O-C 3.55Å; L267-A288 HydrophobicContact CD1-CB 4.04Å; L267-A288 PolarHBondContact O-N 3.07Å; L267-A289 HydrophobicContact CD2-CB 4.14Å; L267-A289 HydrophobicContact CG-CB 3.97Å; L267-A289 WeakPolarHBondContact O-CB 3.47Å; L267-A289 PolarHBondContact O-N 3.31Å; L267-L295 HydrophobicContact CD2-CD1 3.73Å; L267-F330 HydrophobicContact CD2-CE2 4.24Å; L267-F330 HydrophobicContact CD2-CZ 3.82Å
268	G	92.8	Very high	90.3	Very high	3 Å²	3	67.5 Å²	67.5	3%	0.031	34%	0.342	C	S	.	.	S	Bend	trans	84.5	40.1	-172.5	0	0	0	0	0	113.1	P266 V284	P266-G268 PolarHBondContact O-N 3.14Å; G268-V284 WeakPolarHBondContact O-CA 3.21Å; G268-V284 WeakPolarHBondContact O-CB 3.39Å; G268-V284 PolarHBondContact O-N 2.9Å
269	A	94.2	Very high	90.5	Very high	36 Å²	36	62.5 Å²	62.5	30%	0.298	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	141.6	169.1	0	0	0	0	0	109	R282 I283 A289 L295	A269-R282 WeakPolarHBondContact CA-O 3.17Å; A269-I283 HydrophobicContact CB-CD1 4.02Å; A269-A289 HydrophobicContact CB-CB 3.98Å; A269-L295 HydrophobicContact CB-CD1 4.4Å
270	T	93.4	Very high	90.7	Very high	21 Å²	21	62.3 Å²	62.3	13%	0.129	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	149.9	172.9	63.6	0	0	0	0	110.1	S281 R282 V284 C366 L369	T270-S281 VanDerWaalsContact C-OG 3.26Å; T270-S281 WeakPolarHBondContact CB-OG 3.39Å; T270-S281 PolarHBondContact O-N 3.32Å; T270-S281 PolarHBondContact O-OG 3.49Å; T270-S281 VanDerWaalsContact O-OG 3.09Å; T270-S281 PolarHBondContact OG1-OG 3.17Å; T270-R282 PolarHBondContact N-O 2.93Å; T270-R282 PolarHBondContact O-N 3.4Å; T270-R282 WeakPolarHBondContact OG1-CB 3.38Å; T270-R282 PolarHBondContact OG1-N 2.72Å; T270-V284 HydrophobicContact CG2-CG2 4.42Å; T270-C366 HydrophobicContact CG2-CB 4.25Å; T270-L369 HydrophobicContact CG2-CD1 3.4Å
271	V	94.4	Very high	91	Very high	45 Å²	45	58.5 Å²	58.5	27%	0.273	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	155.9	177.5	-65.9	0	0	0	0	110.7	V278 I279 V314 V317	V271-V278 HydrophobicContact CB-CG1 3.82Å; V271-V278 HydrophobicContact CG1-CG1 4.02Å; V271-V278 HydrophobicContact CG2-CG1 4.22Å; V271-I279 CarbonylContact C-O 3.53Å; V271-I279 VanDerWaalsContact CA-O 3.28Å; V271-I279 WeakPolarHBondContact CA-O 3.35Å; V271-V314 HydrophobicContact CG2-CB 4.34Å; V271-V314 HydrophobicContact CG2-CG1 3.96Å; V271-V317 HydrophobicContact CG2-CG1 4.26Å
272	R	93.1	Very high	91.3	Very high	93 Å²	93	59 Å²	59	35%	0.351	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	148.9	170.3	70.9	-178.7	-171.5	-83.2	-11.5	109.4	E274 I279	R272-E274 IonicContact CZ-OE2 3.51Å; R272-E274 IonicContact NE-OE2 2.67Å; R272-E274 IonicContact NH2-OE2 3.17Å; R272-E274 PolarHBondContact NH2-OE2 3.15Å; R272-I279 HydrophobicContact CG-CB 4.35Å; R272-I279 PolarHBondContact N-O 3.36Å; R272-I279 PolarHBondContact O-N 2.85Å
273	N	94.1	Very high	91.7	Very high	53 Å²	53	57.7 Å²	57.7	28%	0.283	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	130.8	169	-73.1	109.4	0	0	0	110.1	S277 K312 D313 V314	N273-S277 WeakPolarHBondContact CA-O 3.2Å; N273-K312 PolarHBondContact ND2-O 2.93Å; N273-D313 PolarHBondContact OD1-OD1 2.91Å; N273-V314 HydrophobicContact CB-CG1 4.43Å; N273-V314 WeakPolarHBondContact OD1-CG1 3.31Å; N273-V314 PolarHBondContact OD1-N 3.42Å
274	E	92.9	Very high	92.2	Very high	97 Å²	97	50 Å²	50	45%	0.453	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	100.1	168.5	-167.9	161.8	172	0	0	107.2	R272 D276 S277 I279	R272-E274 IonicContact CZ-OE2 3.51Å; R272-E274 IonicContact NE-OE2 2.67Å; R272-E274 IonicContact NH2-OE2 3.17Å; R272-E274 PolarHBondContact NH2-OE2 3.15Å; E274-D276 PolarHBondContact O-N 3.08Å; E274-S277 PolarHBondContact N-O 3.33Å; E274-S277 WeakPolarHBondContact O-CB 3.45Å; E274-S277 PolarHBondContact O-N 3.44Å; E274-I279 HydrophobicContact CB-CG1 3.77Å
275	M	90.9	Very high	92.6	Very high	180 Å²	180	45.1 Å²	45.1	89%	0.887	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	-121.2	-165.6	-49.4	-173.7	-163	0	0	111.5
276	D	89.8	Confident	92.7	Very high	88 Å²	88	42 Å²	42	47%	0.471	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-4.7	174.7	62.8	-21.7	0	0	0	113	E274 R310 G311	E274-D276 PolarHBondContact O-N 3.08Å; D276-R310 WeakPolarHBondContact O-CG 3.37Å; D276-G311 PolarHBondContact O-N 2.99Å
277	S	93.1	Very high	92.6	Very high	14 Å²	14	38.4 Å²	38.4	10%	0.098	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	145.4	-173.8	-56.7	0	0	0	0	111.1	N273 E274 E300	N273-S277 WeakPolarHBondContact CA-O 3.2Å; E274-S277 PolarHBondContact N-O 3.33Å; E274-S277 WeakPolarHBondContact O-CB 3.45Å; E274-S277 PolarHBondContact O-N 3.44Å; S277-E300 WeakPolarHBondContact CB-OE1 3.31Å; S277-E300 PolarHBondContact OG-OE1 3.37Å; S277-E300 VanDerWaalsContact OG-OE1 3.1Å
278	V	95.4	Very high	92.6	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	111.2	175.9	177.9	0	0	0	0	107.9	V271 V301 I309 V317	V271-V278 HydrophobicContact CB-CG1 3.82Å; V271-V278 HydrophobicContact CG1-CG1 4.02Å; V271-V278 HydrophobicContact CG2-CG1 4.22Å; V278-V301 PolarHBondContact O-N 3.27Å; V278-I309 HydrophobicContact CB-CG2 3.78Å; V278-I309 HydrophobicContact CG1-CG2 4.01Å; V278-I309 HydrophobicContact CG2-CG2 3.72Å; V278-V317 HydrophobicContact CG1-CG2 4.45Å; V278-V317 HydrophobicContact CG2-CG2 4.22Å
279	I	94.7	Very high	92.5	Very high	14 Å²	14	39.1 Å²	39.1	7%	0.072	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134.1	-173.4	-51	-59.1	0	0	0	109.8	V271 R272 E274 S281 D299 E300	V271-I279 CarbonylContact C-O 3.53Å; V271-I279 VanDerWaalsContact CA-O 3.28Å; V271-I279 WeakPolarHBondContact CA-O 3.35Å; R272-I279 HydrophobicContact CG-CB 4.35Å; R272-I279 PolarHBondContact N-O 3.36Å; R272-I279 PolarHBondContact O-N 2.85Å; E274-I279 HydrophobicContact CB-CG1 3.77Å; I279-S281 PolarHBondContact O-N 3.11Å; I279-D299 WeakPolarHBondContact CA-O 3.42Å; I279-E300 HydrophobicContact CD1-CB 3.52Å; I279-E300 HydrophobicContact CD1-CG 3.7Å
280	I	94.7	Very high	92.4	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	116.5	169.7	-59.5	-172.1	0	0	0	108.3	I283 L295 H296 G298 D299 V301	I280-I283 HydrophobicContact CG2-CD1 3.74Å; I280-L295 HydrophobicContact CD1-CB 3.86Å; I280-L295 HydrophobicContact CD1-CD1 3.99Å; I280-L295 HydrophobicContact CD1-CD2 3.85Å; I280-L295 HydrophobicContact CD1-CG 4.09Å; I280-H296 WeakPolarHBondContact CB-O 3.39Å; I280-H296 WeakPolarHBondContact CG2-O 3.3Å; I280-G298 PolarHBondContact O-N 3Å; I280-D299 HydrophobicContact CB-CB 4.49Å; I280-D299 HydrophobicContact CD1-CB 4.05Å; I280-D299 HydrophobicContact CG1-CB 4.31Å; I280-D299 PolarHBondContact N-O 2.91Å; I280-V301 HydrophobicContact CD1-CG2 4.28Å; I280-V301 HydrophobicContact CG1-CG2 3.87Å
281	S	92.1	Very high	92.1	Very high	35 Å²	35	46.3 Å²	46.3	25%	0.245	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-33.2	-175.2	58.8	0	0	0	0	113.5	T270 I279	T270-S281 VanDerWaalsContact C-OG 3.26Å; T270-S281 WeakPolarHBondContact CB-OG 3.39Å; T270-S281 PolarHBondContact O-N 3.32Å; T270-S281 PolarHBondContact O-OG 3.49Å; T270-S281 VanDerWaalsContact O-OG 3.09Å; T270-S281 PolarHBondContact OG1-OG 3.17Å; I279-S281 PolarHBondContact O-N 3.11Å
282	R	92.6	Very high	91.8	Very high	24 Å²	24	46.2 Å²	46.2	9%	0.091	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	145.8	179.2	-168.7	-178.7	-64.5	-82.4	1	111.2	A269 T270 E297 D386	A269-R282 WeakPolarHBondContact CA-O 3.17Å; T270-R282 PolarHBondContact N-O 2.93Å; T270-R282 PolarHBondContact O-N 3.4Å; T270-R282 WeakPolarHBondContact OG1-CB 3.38Å; T270-R282 PolarHBondContact OG1-N 2.72Å; R282-E297 WeakPolarHBondContact CA-OE1 3.44Å; R282-D386 IonicContact CZ-OD2 3.63Å; R282-D386 IonicContact NH1-OD2 3.37Å; R282-D386 IonicContact NH2-OD2 2.67Å; R282-D386 PolarHBondContact NH2-OD2 3.15Å
283	I	93.6	Very high	91.6	Very high	24 Å²	24	43.9 Å²	43.9	12%	0.123	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.3	164.8	-57.6	-58	0	0	0	109.4	A269 I280 E290 L295 E297 Q391	A269-I283 HydrophobicContact CB-CD1 4.02Å; I280-I283 HydrophobicContact CG2-CD1 3.74Å; I283-E290 HydrophobicContact CG2-CB 3.58Å; I283-E290 HydrophobicContact CG2-CG 3.97Å; I283-L295 HydrophobicContact CD1-CB 3.79Å; I283-E297 HydrophobicContact CG1-CG 4.18Å; I283-E297 PolarHBondContact N-OE1 2.83Å; I283-Q391 PolarHBondContact O-NE2 3.5Å
284	V	94.1	Very high	91.3	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.012	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-93.4	125.7	-178.5	-172.8	0	0	0	0	109.6	G268 T270 G287 L369 L403 A404	G268-V284 WeakPolarHBondContact O-CA 3.21Å; G268-V284 WeakPolarHBondContact O-CB 3.39Å; G268-V284 PolarHBondContact O-N 2.9Å; T270-V284 HydrophobicContact CG2-CG2 4.42Å; V284-G287 PolarHBondContact O-N 3.07Å; V284-L369 HydrophobicContact CG1-CD2 4.36Å; V284-L369 HydrophobicContact CG2-CD1 3.56Å; V284-L369 HydrophobicContact CG2-CD2 4.34Å; V284-L403 HydrophobicContact CG1-CB 4.05Å; V284-L403 HydrophobicContact CG1-CD2 4.42Å; V284-A404 VanDerWaalsContact CG1-O 3.23Å; V284-A404 WeakPolarHBondContact CG1-O 3.39Å
285	K	91.3	Very high	91.3	Very high	35 Å²	35	38.3 Å²	38.3	15%	0.152	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	143.5	179.4	-69.3	-77.5	167.4	-174	0	111.5	G287 E290 E345 I382 Y393 A404	K285-G287 VanDerWaalsContact C-N 3.28Å; K285-G287 PolarHBondContact O-N 3.22Å; K285-E290 HydrophobicContact CD-CG 3.98Å; K285-E290 WeakPolarHBondContact CD-OE1 3.16Å; K285-E290 IonicContact NZ-OE1 2.77Å; K285-E290 PolarHBondContact NZ-OE1 3.23Å; K285-E345 IonicContact NZ-OE1 3.08Å; K285-E345 PolarHBondContact NZ-OE1 2.89Å; K285-I382 HydrophobicContact CB-CD1 3.27Å; K285-I382 HydrophobicContact CB-CG1 4.2Å; K285-I382 HydrophobicContact CG-CD1 3.81Å; K285-I382 HydrophobicContact CG-CG1 4.21Å; K285-Y393 PolarHBondContact O-OH 2.76Å; K285-A404 HydrophobicContact CB-CB 4.15Å; K285-A404 PolarHBondContact O-N 3.01Å; K285-A404 VanDerWaalsContact O-N 3.08Å
286	G	87.8	Confident	91.3	Very high	18 Å²	18	33.6 Å²	33.6	19%	0.186	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	-16.9	-176.9	0	0	0	0	0	114.5	K291	G286-K291 VanDerWaalsContact O-CE 3.3Å; G286-K291 WeakPolarHBondContact O-CE 3.07Å; G286-K291 PolarHBondContact O-NZ 3.31Å
287	G	89.6	Confident	91.4	Very high	3 Å²	3	31.3 Å²	31.3	3%	0.031	18%	0.177	C	C	.	.	S	Bend	trans	-78.6	165.5	179.6	0	0	0	0	0	114.8	L267 V284 K285 A289 E290 K291	L267-G287 CarbonylContact O-C 3.55Å; V284-G287 PolarHBondContact O-N 3.07Å; K285-G287 VanDerWaalsContact C-N 3.28Å; K285-G287 PolarHBondContact O-N 3.22Å; G287-A289 VanDerWaalsContact C-N 3.3Å; G287-A289 PolarHBondContact O-N 3.4Å; G287-E290 PolarHBondContact O-N 2.77Å; G287-K291 WeakPolarHBondContact O-CG 3.32Å; G287-K291 PolarHBondContact O-N 2.87Å; G287-K291 VanDerWaalsContact O-N 3.14Å
288	A	89.9	Confident	91.4	Very high	35 Å²	35	31.3 Å²	31.3	29%	0.289	18%	0.18	S	C	.	.	H	α-helix	trans	-65.3	-32.8	175.6	0	0	0	0	0	112.6	I259 L267 S292	I259-A288 HydrophobicContact CG2-CB 4.26Å; L267-A288 HydrophobicContact CD1-CB 4.04Å; L267-A288 PolarHBondContact O-N 3.07Å; A288-S292 WeakPolarHBondContact O-CB 3.45Å; A288-S292 PolarHBondContact O-N 3.04Å; A288-S292 PolarHBondContact O-OG 2.8Å
289	A	91.9	Very high	91.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.7	-49.4	174.7	0	0	0	0	0	111.4	L267 A269 G287 S292 G293 L295	L267-A289 HydrophobicContact CD2-CB 4.14Å; L267-A289 HydrophobicContact CG-CB 3.97Å; L267-A289 WeakPolarHBondContact O-CB 3.47Å; L267-A289 PolarHBondContact O-N 3.31Å; A269-A289 HydrophobicContact CB-CB 3.98Å; G287-A289 VanDerWaalsContact C-N 3.3Å; G287-A289 PolarHBondContact O-N 3.4Å; A289-S292 PolarHBondContact O-OG 3.24Å; A289-G293 PolarHBondContact O-N 2.73Å; A289-L295 HydrophobicContact CB-CD1 3.95Å
290	E	90.6	Very high	91.2	Very high	50 Å²	50	31.9 Å²	31.9	23%	0.234	18%	0.182	C	C	.	.	H	α-helix	trans	-68.2	-48.7	-178.5	-171.9	-97.4	170.9	0	0	112.1	I283 K285 G287 S292 G293	I283-E290 HydrophobicContact CG2-CB 3.58Å; I283-E290 HydrophobicContact CG2-CG 3.97Å; K285-E290 HydrophobicContact CD-CG 3.98Å; K285-E290 WeakPolarHBondContact CD-OE1 3.16Å; K285-E290 IonicContact NZ-OE1 2.77Å; K285-E290 PolarHBondContact NZ-OE1 3.23Å; G287-E290 PolarHBondContact O-N 2.77Å; E290-S292 PolarHBondContact O-N 3.47Å; E290-G293 PolarHBondContact O-N 2.86Å
291	K	87.8	Confident	91.2	Very high	159 Å²	159	31.9 Å²	31.9	69%	0.691	18%	0.182	S	C	*	.	H	α-helix	trans	-59.5	-30.8	178.2	-70	171.8	-179.2	165.8	0	113.4	G286 G287	G286-K291 VanDerWaalsContact O-CE 3.3Å; G286-K291 WeakPolarHBondContact O-CE 3.07Å; G286-K291 PolarHBondContact O-NZ 3.31Å; G287-K291 WeakPolarHBondContact O-CG 3.32Å; G287-K291 PolarHBondContact O-N 2.87Å; G287-K291 VanDerWaalsContact O-N 3.14Å
292	S	87.9	Confident	91.2	Very high	42 Å²	42	30.9 Å²	30.9	29%	0.294	17%	0.174	S	C	.	.	H	α-helix	trans	-72	-30.3	176.5	76	0	0	0	0	112.9	A288 A289 E290 L294	A288-S292 WeakPolarHBondContact O-CB 3.45Å; A288-S292 PolarHBondContact O-N 3.04Å; A288-S292 PolarHBondContact O-OG 2.8Å; A289-S292 PolarHBondContact O-OG 3.24Å; E290-S292 PolarHBondContact O-N 3.47Å; S292-L294 WeakPolarHBondContact O-CG 3.45Å; S292-L294 PolarHBondContact O-N 3.45Å; S292-L294 VanDerWaalsContact O-N 3.16Å; S292-L294 PolarHBondContact OG-N 3.05Å
293	G	88.3	Confident	91.2	Very high	44 Å²	44	31.4 Å²	31.4	45%	0.454	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	11.7	-170.5	0	0	0	0	0	114.5	A289 E290 H296	A289-G293 PolarHBondContact O-N 2.73Å; E290-G293 PolarHBondContact O-N 2.86Å; G293-H296 PolarHBondContact O-CE1 2.8Å; G293-H296 VanDerWaalsContact O-CE1 3.25Å
294	L	89.5	Confident	91.2	Very high	27 Å²	27	30.4 Å²	30.4	14%	0.141	17%	0.172	C	C	.	.			trans	-91.4	-26.3	-172.9	-64	179.5	0	0	0	113.3	K255 V257 R258 I259 S292	K255-L294 PolarHBondContact NZ-O 3.41Å; V257-L294 HydrophobicContact CB-CB 3.99Å; V257-L294 HydrophobicContact CB-CD1 4.12Å; V257-L294 HydrophobicContact CG1-CB 4.06Å; V257-L294 HydrophobicContact CG2-CB 4.33Å; R258-L294 WeakPolarHBondContact O-CD1 3.42Å; I259-L294 HydrophobicContact CD1-CB 4.37Å; I259-L294 HydrophobicContact CG1-CB 4.49Å; I259-L294 HydrophobicContact CG1-CD1 4.24Å; S292-L294 WeakPolarHBondContact O-CG 3.45Å; S292-L294 PolarHBondContact O-N 3.45Å; S292-L294 VanDerWaalsContact O-N 3.16Å; S292-L294 PolarHBondContact OG-N 3.05Å
295	L	92.4	Very high	91	Very high	6 Å²	6	33.6 Å²	33.6	3%	0.031	19%	0.19	C	C	.	.			trans	-100.3	138	177.7	-57.9	-176	0	0	0	111.2	V257 I259 L267 A269 I280 I283 A289 L332	V257-L295 HydrophobicContact CG2-CD2 3.93Å; I259-L295 HydrophobicContact CD1-CD1 3.63Å; I259-L295 HydrophobicContact CD1-CD2 3.83Å; I259-L295 HydrophobicContact CD1-CG 3.44Å; I259-L295 VanDerWaalsContact CD1-CG 3.44Å; L267-L295 HydrophobicContact CD2-CD1 3.73Å; A269-L295 HydrophobicContact CB-CD1 4.4Å; I280-L295 HydrophobicContact CD1-CB 3.86Å; I280-L295 HydrophobicContact CD1-CD1 3.99Å; I280-L295 HydrophobicContact CD1-CD2 3.85Å; I280-L295 HydrophobicContact CD1-CG 4.09Å; I283-L295 HydrophobicContact CD1-CB 3.79Å; A289-L295 HydrophobicContact CB-CD1 3.95Å; L295-L332 HydrophobicContact CD2-CD1 3.5Å
296	H	91.2	Very high	90.8	Very high	82 Å²	82	35 Å²	35	38%	0.38	21%	0.213	S	C	.	.			trans	-127	152.3	178.9	-56.4	80.3	0	0	0	111.2	I280 G293 G298 D299	I280-H296 WeakPolarHBondContact CB-O 3.39Å; I280-H296 WeakPolarHBondContact CG2-O 3.3Å; G293-H296 PolarHBondContact O-CE1 2.8Å; G293-H296 VanDerWaalsContact O-CE1 3.25Å; H296-G298 PolarHBondContact O-N 3.11Å; H296-D299 PolarHBondContact N-OD2 2.93Å; H296-D299 IonicContact ND1-OD2 2.95Å; H296-D299 WeakPolarHBondContact O-CB 3.4Å; H296-D299 PolarHBondContact O-N 2.92Å
297	E	91.6	Very high	91	Very high	39 Å²	39	37.2 Å²	37.2	18%	0.182	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	128.4	171.9	-64	179.6	170.4	0	0	109.9	R282 I283 S335 K339	R282-E297 WeakPolarHBondContact CA-OE1 3.44Å; I283-E297 HydrophobicContact CG1-CG 4.18Å; I283-E297 PolarHBondContact N-OE1 2.83Å; E297-S335 PolarHBondContact O-OG 2.86Å; E297-K339 VanDerWaalsContact CD-NZ 3.3Å; E297-K339 IonicContact OE1-NZ 3.55Å; E297-K339 WeakPolarHBondContact OE2-CE 3.33Å; E297-K339 IonicContact OE2-NZ 3.77Å; E297-K339 PolarHBondContact OE2-NZ 2.78Å
298	G	91.6	Very high	91.1	Very high	14 Å²	14	43.1 Å²	43.1	14%	0.144	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.2	-1	-176.3	0	0	0	0	0	114.9	I280 H296 S335	I280-G298 PolarHBondContact O-N 3Å; H296-G298 PolarHBondContact O-N 3.11Å; G298-S335 VanDerWaalsContact C-CB 3.46Å; G298-S335 WeakPolarHBondContact CA-OG 3.47Å; G298-S335 WeakPolarHBondContact O-CB 3.46Å; G298-S335 PolarHBondContact O-OG 3.44Å
299	D	93.1	Very high	91.3	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.011	23%	0.234	C	C	.	.			trans	-66.8	134.7	169.7	-70.5	-14.3	0	0	0	109.8	I279 I280 H296 L332 I333 P334 S335	I279-D299 WeakPolarHBondContact CA-O 3.42Å; I280-D299 HydrophobicContact CB-CB 4.49Å; I280-D299 HydrophobicContact CD1-CB 4.05Å; I280-D299 HydrophobicContact CG1-CB 4.31Å; I280-D299 PolarHBondContact N-O 2.91Å; H296-D299 PolarHBondContact N-OD2 2.93Å; H296-D299 IonicContact ND1-OD2 2.95Å; H296-D299 WeakPolarHBondContact O-CB 3.4Å; H296-D299 PolarHBondContact O-N 2.92Å; D299-L332 HydrophobicContact CB-CD1 4.5Å; D299-I333 WeakPolarHBondContact CA-O 3.27Å; D299-P334 WeakPolarHBondContact OD1-CA 3.43Å; D299-S335 PolarHBondContact OD1-N 2.92Å
300	E	94.3	Very high	91.2	Very high	25 Å²	25	45.7 Å²	45.7	12%	0.117	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.4	172.6	-179	178.7	167	0	0	110.3	S277 I279 L302 R310 L332 I333	S277-E300 WeakPolarHBondContact CB-OE1 3.31Å; S277-E300 PolarHBondContact OG-OE1 3.37Å; S277-E300 VanDerWaalsContact OG-OE1 3.1Å; I279-E300 HydrophobicContact CD1-CB 3.52Å; I279-E300 HydrophobicContact CD1-CG 3.7Å; E300-L302 HydrophobicContact CG-CD2 4.32Å; E300-R310 IonicContact OE1-CZ 3.12Å; E300-R310 IonicContact OE1-NE 3.13Å; E300-R310 PolarHBondContact OE1-NE 3.01Å; E300-R310 IonicContact OE1-NH2 3.99Å; E300-R310 PolarHBondContact OE1-NH2 3.24Å; E300-R310 IonicContact OE2-NH2 2.98Å; E300-L332 CarbonylContact O-C 3.52Å; E300-L332 WeakPolarHBondContact O-CA 3.39Å; E300-I333 HydrophobicContact CB-CB 4.1Å; E300-I333 PolarHBondContact N-O 2.75Å; E300-I333 PolarHBondContact O-N 2.76Å
301	V	94.7	Very high	91.1	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.024	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	111	179	-171.6	0	0	0	0	110.1	V278 I280 I304 I309 F330 L332	V278-V301 PolarHBondContact O-N 3.27Å; I280-V301 HydrophobicContact CD1-CG2 4.28Å; I280-V301 HydrophobicContact CG1-CG2 3.87Å; V301-I304 HydrophobicContact CG1-CD1 4.01Å; V301-I304 HydrophobicContact CG1-CG1 3.84Å; V301-I309 HydrophobicContact CB-CG2 4.19Å; V301-I309 HydrophobicContact CG1-CB 4.08Å; V301-I309 HydrophobicContact CG1-CG1 4.01Å; V301-I309 HydrophobicContact CG1-CG2 3.97Å; V301-F330 HydrophobicContact CG1-CD1 4.16Å; V301-L332 HydrophobicContact CB-CD2 4.15Å; V301-L332 HydrophobicContact CG1-CD2 4.21Å; V301-L332 HydrophobicContact CG2-CD2 3.81Å
302	L	92	Very high	91.3	Very high	14 Å²	14	41.5 Å²	41.5	7%	0.073	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-49.2	177	-61.7	-179.5	0	0	0	111.8	V254 E300 I309 V331 I333	V254-L302 HydrophobicContact CG1-CD1 3.67Å; E300-L302 HydrophobicContact CG-CD2 4.32Å; L302-I309 PolarHBondContact O-N 2.88Å; L302-V331 HydrophobicContact CB-CB 4.44Å; L302-V331 HydrophobicContact CB-CG1 4.36Å; L302-V331 WeakPolarHBondContact CB-O 3.19Å; L302-V331 HydrophobicContact CD1-CG1 4.32Å; L302-V331 PolarHBondContact N-O 2.82Å; L302-I333 HydrophobicContact CD1-CD1 4Å; L302-I333 HydrophobicContact CD1-CG1 3.82Å; L302-I333 HydrophobicContact CD2-CD1 3.93Å; L302-I333 HydrophobicContact CD2-CG1 4.42Å; L302-I333 HydrophobicContact CG-CD1 4.21Å; L302-I333 HydrophobicContact CG-CG1 4.16Å
303	E	92.3	Very high	91.6	Very high	35 Å²	35	42.9 Å²	42.9	16%	0.164	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	148.5	-176.3	-58.5	-179.7	-175.7	0	0	112.2	Y249 I307 F330 V331	Y249-E303 WeakPolarHBondContact CE2-OE1 3.29Å; Y249-E303 VanDerWaalsContact CZ-OE1 3.23Å; Y249-E303 PolarHBondContact OH-OE1 3.26Å; E303-I307 CarbonylContact C-O 3.58Å; E303-I307 VanDerWaalsContact CA-O 3.22Å; E303-I307 WeakPolarHBondContact CA-O 3.41Å; E303-F330 CarbonylContact O-C 3.57Å; E303-F330 WeakPolarHBondContact O-CA 2.97Å; E303-V331 HydrophobicContact CB-CB 4Å; E303-V331 HydrophobicContact CB-CG2 3.95Å; E303-V331 PolarHBondContact N-O 3.42Å; E303-V331 PolarHBondContact O-N 3.25Å
304	I	93.7	Very high	91.7	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	118.7	169.3	-57.5	170.6	0	0	0	108.7	V301 G306 I307 I309 L321 M324 L328 T329 F330	V301-I304 HydrophobicContact CG1-CD1 4.01Å; V301-I304 HydrophobicContact CG1-CG1 3.84Å; I304-G306 PolarHBondContact O-N 2.9Å; I304-I307 PolarHBondContact N-O 2.97Å; I304-I307 WeakPolarHBondContact O-CB 3.45Å; I304-I307 PolarHBondContact O-N 3.4Å; I304-I309 HydrophobicContact CB-CD1 4.3Å; I304-I309 HydrophobicContact CB-CG1 4.24Å; I304-I309 HydrophobicContact CD1-CD1 3.98Å; I304-I309 HydrophobicContact CD1-CG1 3.89Å; I304-I309 HydrophobicContact CG1-CD1 4.14Å; I304-I309 HydrophobicContact CG1-CG1 3.74Å; I304-L321 HydrophobicContact CD1-CD1 4.02Å; I304-L321 HydrophobicContact CD1-CD2 4.25Å; I304-L321 HydrophobicContact CD1-CG 4.26Å; I304-M324 HydrophobicContact CG2-CE 3.85Å; I304-M324 HydrophobicContact CG2-SD 4.21Å; I304-L328 HydrophobicContact CG2-CB 4.44Å; I304-T329 CarbonylContact C-O 2.91Å; I304-T329 WeakPolarHBondContact CA-O 3.48Å; I304-F330 HydrophobicContact CD1-CD1 4.01Å; I304-F330 HydrophobicContact CD1-CE1 3.52Å; I304-F330 HydrophobicContact CD1-CZ 4.28Å; I304-F330 HydrophobicContact CG1-CD1 3.64Å; I304-F330 HydrophobicContact CG1-CE1 3.66Å; I304-F330 HydrophobicContact CG1-CG 4.41Å; I304-F330 HydrophobicContact CG1-CZ 4.44Å; I304-F330 HydrophobicContact CG2-CE1 4.47Å; I304-F330 HydrophobicContact CG2-CZ 4.48Å
305	N	90.5	Very high	91.8	Very high	70 Å²	70	46.2 Å²	46.2	37%	0.374	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	36.4	-176.1	-72.6	-10.2	0	0	0	113.8	I307 M324 T327 T329	N305-I307 VanDerWaalsContact C-N 3.29Å; N305-I307 PolarHBondContact O-N 3.3Å; N305-M324 HydrophobicContact CB-CE 3.73Å; N305-M324 WeakPolarHBondContact ND2-CE 3.41Å; N305-T327 PolarHBondContact ND2-O 2.81Å; N305-T327 PolarHBondContact OD1-O 3.13Å; N305-T329 PolarHBondContact N-O 3.05Å; N305-T329 PolarHBondContact OD1-N 3.09Å
306	G	86	Confident	91.9	Very high	63 Å²	63	50.7 Å²	50.7	65%	0.649	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	6.8	-178.8	0	0	0	0	0	114.8	I304	I304-G306 PolarHBondContact O-N 2.9Å
307	I	91.5	Very high	91.9	Very high	66 Å²	66	46.9 Å²	46.9	34%	0.338	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	123.4	171.7	-54.2	174.1	0	0	0	108.1	E303 I304 N305 I309 L320 M324	E303-I307 CarbonylContact C-O 3.58Å; E303-I307 VanDerWaalsContact CA-O 3.22Å; E303-I307 WeakPolarHBondContact CA-O 3.41Å; I304-I307 PolarHBondContact N-O 2.97Å; I304-I307 WeakPolarHBondContact O-CB 3.45Å; I304-I307 PolarHBondContact O-N 3.4Å; N305-I307 VanDerWaalsContact C-N 3.29Å; N305-I307 PolarHBondContact O-N 3.3Å; I307-I309 PolarHBondContact O-N 3.11Å; I307-L320 HydrophobicContact CD1-CD1 3.87Å; I307-L320 HydrophobicContact CD1-CD2 4.28Å; I307-L320 HydrophobicContact CG2-CD2 3.99Å; I307-M324 HydrophobicContact CD1-CE 4.45Å
308	E	92.4	Very high	91.8	Very high	127 Å²	127	50.9 Å²	50.9	59%	0.593	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.6	124.2	175.8	-168.5	175.5	-171.5	0	0	110.5	K312	E308-K312 WeakPolarHBondContact O-CD 2.67Å; E308-K312 WeakPolarHBondContact O-CE 3.38Å
309	I	94.1	Very high	91.8	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.298	C	S	.	.			trans	-100.5	-29.8	-179.2	-59.8	-53.6	0	0	0	111.6	V278 V301 L302 I304 I307 G311 K312 V317 L320	V278-I309 HydrophobicContact CB-CG2 3.78Å; V278-I309 HydrophobicContact CG1-CG2 4.01Å; V278-I309 HydrophobicContact CG2-CG2 3.72Å; V301-I309 HydrophobicContact CB-CG2 4.19Å; V301-I309 HydrophobicContact CG1-CB 4.08Å; V301-I309 HydrophobicContact CG1-CG1 4.01Å; V301-I309 HydrophobicContact CG1-CG2 3.97Å; L302-I309 PolarHBondContact O-N 2.88Å; I304-I309 HydrophobicContact CB-CD1 4.3Å; I304-I309 HydrophobicContact CB-CG1 4.24Å; I304-I309 HydrophobicContact CD1-CD1 3.98Å; I304-I309 HydrophobicContact CD1-CG1 3.89Å; I304-I309 HydrophobicContact CG1-CD1 4.14Å; I304-I309 HydrophobicContact CG1-CG1 3.74Å; I307-I309 PolarHBondContact O-N 3.11Å; I309-G311 PolarHBondContact O-N 2.92Å; I309-K312 HydrophobicContact CD1-CD 4.36Å; I309-K312 VanDerWaalsContact O-CB 3.29Å; I309-K312 WeakPolarHBondContact O-CB 2.97Å; I309-K312 PolarHBondContact O-N 3.41Å; I309-K312 VanDerWaalsContact O-N 3.09Å; I309-V317 HydrophobicContact CG2-CG2 3.86Å; I309-L320 HydrophobicContact CD1-CD2 3.69Å
310	R	89.5	Confident	91.7	Very high	89 Å²	89	56.6 Å²	56.6	34%	0.336	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	137.7	174.5	-171.1	178.3	-101.6	178.6	-9.4	110.2	D276 E300 K312	D276-R310 WeakPolarHBondContact O-CG 3.37Å; E300-R310 IonicContact OE1-CZ 3.12Å; E300-R310 IonicContact OE1-NE 3.13Å; E300-R310 PolarHBondContact OE1-NE 3.01Å; E300-R310 IonicContact OE1-NH2 3.99Å; E300-R310 PolarHBondContact OE1-NH2 3.24Å; E300-R310 IonicContact OE2-NH2 2.98Å; R310-K312 VanDerWaalsContact C-N 3.26Å; R310-K312 PolarHBondContact O-N 2.82Å
311	G	87.9	Confident	91.5	Very high	59 Å²	59	57 Å²	57	61%	0.608	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	-6.9	-176.1	0	0	0	0	0	115.1	D276 I309	D276-G311 PolarHBondContact O-N 2.99Å; I309-G311 PolarHBondContact O-N 2.92Å
312	K	93.6	Very high	91.2	Very high	62 Å²	62	59.2 Å²	59.2	27%	0.27	33%	0.326	S	S	.	.			trans	-82.4	146.4	173.2	-63.6	-171.8	166.7	-72.4	0	111.8	N273 E308 I309 R310 E316 V317	N273-K312 PolarHBondContact ND2-O 2.93Å; E308-K312 WeakPolarHBondContact O-CD 2.67Å; E308-K312 WeakPolarHBondContact O-CE 3.38Å; I309-K312 HydrophobicContact CD1-CD 4.36Å; I309-K312 VanDerWaalsContact O-CB 3.29Å; I309-K312 WeakPolarHBondContact O-CB 2.97Å; I309-K312 PolarHBondContact O-N 3.41Å; I309-K312 VanDerWaalsContact O-N 3.09Å; R310-K312 VanDerWaalsContact C-N 3.26Å; R310-K312 PolarHBondContact O-N 2.82Å; K312-E316 HydrophobicContact CB-CB 4.46Å; K312-E316 IonicContact NZ-OE2 3.66Å; K312-V317 HydrophobicContact CB-CG2 3.86Å
313	D	93.4	Very high	91.1	Very high	71 Å²	71	65.2 Å²	65.2	38%	0.38	36%	0.358	S	S	.	.			trans	-75	149.3	170.1	-175.8	69.3	0	0	0	110.9	N273 N315 E316 V317	N273-D313 PolarHBondContact OD1-OD1 2.91Å; D313-N315 PolarHBondContact O-N 3.13Å; D313-N315 VanDerWaalsContact O-N 3.12Å; D313-N315 WeakPolarHBondContact OD2-CB 3.17Å; D313-N315 PolarHBondContact OD2-N 3.34Å; D313-N315 VanDerWaalsContact OD2-N 3.14Å; D313-N315 PolarHBondContact OD2-ND2 3.32Å; D313-E316 HydrophobicContact CB-CG 4.32Å; D313-E316 WeakPolarHBondContact O-CB 3.37Å; D313-E316 PolarHBondContact O-N 3.37Å; D313-V317 WeakPolarHBondContact O-CG2 3.45Å; D313-V317 PolarHBondContact O-N 3.05Å; D313-V317 VanDerWaalsContact O-N 3.07Å
314	V	91.4	Very high	90.9	Very high	38 Å²	38	64.8 Å²	64.8	23%	0.23	36%	0.357	C	S	.	.	H	α-helix	trans	-55.6	-31.2	179.8	-72.9	0	0	0	0	113.3	V271 N273 V317 F318	V271-V314 HydrophobicContact CG2-CB 4.34Å; V271-V314 HydrophobicContact CG2-CG1 3.96Å; N273-V314 HydrophobicContact CB-CG1 4.43Å; N273-V314 WeakPolarHBondContact OD1-CG1 3.31Å; N273-V314 PolarHBondContact OD1-N 3.42Å; V314-V317 PolarHBondContact O-N 3.36Å; V314-F318 WeakPolarHBondContact O-CB 3.07Å; V314-F318 PolarHBondContact O-N 2.93Å
315	N	91.3	Very high	90.7	Very high	103 Å²	103	69.3 Å²	69.3	55%	0.551	38%	0.377	S	S	*	.	H	α-helix	trans	-69.5	-38.9	177.5	-60.5	-59.1	0	0	0	111.3	D313 V317 F318 D319	D313-N315 PolarHBondContact O-N 3.13Å; D313-N315 VanDerWaalsContact O-N 3.12Å; D313-N315 WeakPolarHBondContact OD2-CB 3.17Å; D313-N315 PolarHBondContact OD2-N 3.34Å; D313-N315 VanDerWaalsContact OD2-N 3.14Å; D313-N315 PolarHBondContact OD2-ND2 3.32Å; N315-V317 VanDerWaalsContact C-N 3.31Å; N315-V317 PolarHBondContact O-N 3.41Å; N315-F318 WeakPolarHBondContact O-CB 3.38Å; N315-F318 PolarHBondContact O-N 3.47Å; N315-D319 PolarHBondContact O-N 3.16Å
316	E	92.9	Very high	90.5	Very high	100 Å²	100	67.2 Å²	67.2	47%	0.467	37%	0.372	S	S	.	.	H	α-helix	trans	-65.8	-37.7	174.6	-60.8	-177.5	178.7	0	0	111.5	K312 D313 L320	K312-E316 HydrophobicContact CB-CB 4.46Å; K312-E316 IonicContact NZ-OE2 3.66Å; D313-E316 HydrophobicContact CB-CG 4.32Å; D313-E316 WeakPolarHBondContact O-CB 3.37Å; D313-E316 PolarHBondContact O-N 3.37Å; E316-L320 VanDerWaalsContact O-CB 3.24Å; E316-L320 WeakPolarHBondContact O-CB 3.33Å; E316-L320 PolarHBondContact O-N 3.03Å
317	V	92.6	Very high	90.7	Very high	2 Å²	2	67.3 Å²	67.3	1%	0.012	36%	0.36	C	S	.	.	H	α-helix	trans	-66.5	-41.5	176.2	176.5	0	0	0	0	110.5	V271 V278 I309 K312 D313 V314 N315 L320 L321	V271-V317 HydrophobicContact CG2-CG1 4.26Å; V278-V317 HydrophobicContact CG1-CG2 4.45Å; V278-V317 HydrophobicContact CG2-CG2 4.22Å; I309-V317 HydrophobicContact CG2-CG2 3.86Å; K312-V317 HydrophobicContact CB-CG2 3.86Å; D313-V317 WeakPolarHBondContact O-CG2 3.45Å; D313-V317 PolarHBondContact O-N 3.05Å; D313-V317 VanDerWaalsContact O-N 3.07Å; V314-V317 PolarHBondContact O-N 3.36Å; N315-V317 VanDerWaalsContact C-N 3.31Å; N315-V317 PolarHBondContact O-N 3.41Å; V317-L320 PolarHBondContact O-N 2.8Å; V317-L321 HydrophobicContact CG1-CD1 3.62Å; V317-L321 WeakPolarHBondContact O-CB 3.38Å; V317-L321 WeakPolarHBondContact O-CD1 3.5Å; V317-L321 PolarHBondContact O-N 3.12Å
318	F	90.1	Very high	90.6	Very high	123 Å²	123	64.2 Å²	64.2	54%	0.539	34%	0.344	S	S	.	.	H	α-helix	trans	-59.7	-51.6	174.2	173.5	-94.7	0	0	0	111.7	V314 N315 L320 L321 S322	V314-F318 WeakPolarHBondContact O-CB 3.07Å; V314-F318 PolarHBondContact O-N 2.93Å; N315-F318 WeakPolarHBondContact O-CB 3.38Å; N315-F318 PolarHBondContact O-N 3.47Å; F318-L320 VanDerWaalsContact C-N 3.35Å; F318-L320 PolarHBondContact O-N 2.64Å; F318-L321 PolarHBondContact O-N 3.1Å; F318-S322 WeakPolarHBondContact O-CB 3.39Å; F318-S322 PolarHBondContact O-N 3.02Å
319	D	90.5	Very high	90.5	Very high	94 Å²	94	60 Å²	60	50%	0.503	33%	0.327	S	S	.	.	H	α-helix	trans	-59.3	-47.1	178.7	-71.7	-18.8	0	0	0	110.5	N315 L321 S322 D323	N315-D319 PolarHBondContact O-N 3.16Å; D319-L321 PolarHBondContact O-N 3.43Å; D319-S322 PolarHBondContact O-N 3.44Å; D319-S322 PolarHBondContact O-OG 3.18Å; D319-D323 PolarHBondContact O-N 2.81Å
320	L	92	Very high	90.5	Very high	42 Å²	42	60.3 Å²	60.3	22%	0.22	33%	0.329	C	S	.	.	H	α-helix	trans	-57.2	-50.9	177.6	179.4	66.7	0	0	0	112.4	I307 I309 E316 V317 F318 S322 D323 M324	I307-L320 HydrophobicContact CD1-CD1 3.87Å; I307-L320 HydrophobicContact CD1-CD2 4.28Å; I307-L320 HydrophobicContact CG2-CD2 3.99Å; I309-L320 HydrophobicContact CD1-CD2 3.69Å; E316-L320 VanDerWaalsContact O-CB 3.24Å; E316-L320 WeakPolarHBondContact O-CB 3.33Å; E316-L320 PolarHBondContact O-N 3.03Å; V317-L320 PolarHBondContact O-N 2.8Å; F318-L320 VanDerWaalsContact C-N 3.35Å; F318-L320 PolarHBondContact O-N 2.64Å; L320-S322 VanDerWaalsContact C-N 3.28Å; L320-S322 PolarHBondContact O-N 3.35Å; L320-D323 PolarHBondContact O-N 3.47Å; L320-M324 HydrophobicContact CD1-SD 4.19Å; L320-M324 HydrophobicContact CD2-SD 4.45Å; L320-M324 HydrophobicContact CG-SD 3.88Å; L320-M324 VanDerWaalsContact O-CG 3.23Å; L320-M324 WeakPolarHBondContact O-CG 3.47Å; L320-M324 PolarHBondContact O-N 3.08Å
321	L	90.3	Very high	90.6	Very high	33 Å²	33	56.9 Å²	56.9	17%	0.173	32%	0.317	C	S	.	.	H	α-helix	trans	-68.6	-27	-178.5	-87.1	148.5	0	0	0	112.7	K261 I304 V317 F318 D319 D323 M324 L328 F330	K261-L321 WeakPolarHBondContact CE-O 3.48Å; K261-L321 PolarHBondContact NZ-O 2.63Å; I304-L321 HydrophobicContact CD1-CD1 4.02Å; I304-L321 HydrophobicContact CD1-CD2 4.25Å; I304-L321 HydrophobicContact CD1-CG 4.26Å; V317-L321 HydrophobicContact CG1-CD1 3.62Å; V317-L321 WeakPolarHBondContact O-CB 3.38Å; V317-L321 WeakPolarHBondContact O-CD1 3.5Å; V317-L321 PolarHBondContact O-N 3.12Å; F318-L321 PolarHBondContact O-N 3.1Å; D319-L321 PolarHBondContact O-N 3.43Å; L321-D323 VanDerWaalsContact C-N 3.34Å; L321-M324 PolarHBondContact O-N 3.36Å; L321-L328 HydrophobicContact CD2-CD1 3.79Å; L321-F330 HydrophobicContact CD2-CZ 4.49Å
322	S	87.9	Confident	90.8	Very high	51 Å²	51	54 Å²	54	36%	0.357	29%	0.288	S	S	.	.	H	α-helix	trans	-63.8	-40.8	177.7	74.1	0	0	0	0	111.7	F318 D319 L320	F318-S322 WeakPolarHBondContact O-CB 3.39Å; F318-S322 PolarHBondContact O-N 3.02Å; D319-S322 PolarHBondContact O-N 3.44Å; D319-S322 PolarHBondContact O-OG 3.18Å; L320-S322 VanDerWaalsContact C-N 3.28Å; L320-S322 PolarHBondContact O-N 3.35Å
323	D	89.3	Confident	90.7	Very high	140 Å²	140	52.5 Å²	52.5	75%	0.749	28%	0.283	S	S	*	.	H	α-helix	trans	-78.8	-20.4	178.8	-72.9	-25.2	0	0	0	114	D319 L320 L321	D319-D323 PolarHBondContact O-N 2.81Å; L320-D323 PolarHBondContact O-N 3.47Å; L321-D323 VanDerWaalsContact C-N 3.34Å
324	M	87.8	Confident	90.5	Very high	26 Å²	26	51.6 Å²	51.6	13%	0.128	28%	0.281	C	S	.	.			trans	-80.3	144.4	-178.1	-69.4	176.7	90.6	0	0	112.6	K261 I304 N305 I307 L320 L321 L328	K261-M324 WeakPolarHBondContact CD-O 3.35Å; K261-M324 PolarHBondContact NZ-O 2.64Å; I304-M324 HydrophobicContact CG2-CE 3.85Å; I304-M324 HydrophobicContact CG2-SD 4.21Å; N305-M324 HydrophobicContact CB-CE 3.73Å; N305-M324 WeakPolarHBondContact ND2-CE 3.41Å; I307-M324 HydrophobicContact CD1-CE 4.45Å; L320-M324 HydrophobicContact CD1-SD 4.19Å; L320-M324 HydrophobicContact CD2-SD 4.45Å; L320-M324 HydrophobicContact CG-SD 3.88Å; L320-M324 VanDerWaalsContact O-CG 3.23Å; L320-M324 WeakPolarHBondContact O-CG 3.47Å; L320-M324 PolarHBondContact O-N 3.08Å; L321-M324 PolarHBondContact O-N 3.36Å; M324-L328 HydrophobicContact CB-CD2 4.01Å; M324-L328 HydrophobicContact CE-CD2 3.95Å
325	H	89.7	Confident	90.2	Very high	97 Å²	97	51.4 Å²	51.4	45%	0.449	28%	0.281	S	S	.	.			trans	-152.4	166.9	174.2	65.6	66.3	0	0	0	111.4	R263	R263-H325 HydrophobicContact CB-CB 4.16Å; R263-H325 PolarHBondContact NH2-NE2 3.41Å
326	G	85.9	Confident	89.6	Confident	25 Å²	25	55.7 Å²	55.7	26%	0.258	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	81.6	-156.5	-172.2	0	0	0	0	0	112.1	E260 K261 L328	E260-G326 VanDerWaalsContact OE2-C 3.32Å; K261-G326 PolarHBondContact N-O 2.89Å; K261-G326 PolarHBondContact O-N 3.28Å; G326-L328 PolarHBondContact O-N 2.99Å
327	T	89.9	Confident	88.4	Confident	66 Å²	66	56.8 Å²	56.8	41%	0.405	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	117.9	-179.8	-39.6	0	0	0	0	111.2	R258 E260 N305	R258-T327 HydrophobicContact CB-CG2 4.15Å; E260-T327 VanDerWaalsContact OE1-CB 3.31Å; E260-T327 WeakPolarHBondContact OE1-CB 3.46Å; E260-T327 WeakPolarHBondContact OE1-CG2 3.29Å; E260-T327 PolarHBondContact OE1-OG1 3.43Å; E260-T327 PolarHBondContact OE2-N 2.97Å; N305-T327 PolarHBondContact ND2-O 2.81Å; N305-T327 PolarHBondContact OD1-O 3.13Å
328	L	90	Very high	87.1	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	122.2	171.3	-56.8	-170.5	0	0	0	109.5	R258 I259 K261 I304 L321 M324 G326 F330	R258-L328 CarbonylContact C-O 3.6Å; R258-L328 VanDerWaalsContact CA-O 3.29Å; R258-L328 WeakPolarHBondContact CA-O 3.47Å; I259-L328 PolarHBondContact N-O 3.09Å; I259-L328 PolarHBondContact O-N 2.73Å; K261-L328 HydrophobicContact CB-CD1 3.72Å; K261-L328 HydrophobicContact CB-CG 3.87Å; K261-L328 HydrophobicContact CD-CD1 3.69Å; K261-L328 HydrophobicContact CG-CD1 4.31Å; I304-L328 HydrophobicContact CG2-CB 4.44Å; L321-L328 HydrophobicContact CD2-CD1 3.79Å; M324-L328 HydrophobicContact CB-CD2 4.01Å; M324-L328 HydrophobicContact CE-CD2 3.95Å; G326-L328 PolarHBondContact O-N 2.99Å; L328-F330 HydrophobicContact CB-CD2 4.19Å; L328-F330 HydrophobicContact CB-CE2 3.55Å; L328-F330 HydrophobicContact CB-CZ 4.26Å; L328-F330 HydrophobicContact CD1-CE2 4.16Å; L328-F330 HydrophobicContact CD1-CZ 4.12Å
329	T	91.1	Very high	85.9	Confident	39 Å²	39	63 Å²	63	24%	0.239	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	113.8	173.8	-56.3	0	0	0	0	108.9	I256 V257 R258 I304 N305	I256-T329 HydrophobicContact CG2-CG2 3.72Å; V257-T329 CarbonylContact O-C 3.48Å; V257-T329 WeakPolarHBondContact O-CA 3.44Å; R258-T329 HydrophobicContact CG-CG2 4.23Å; I304-T329 CarbonylContact C-O 2.91Å; I304-T329 WeakPolarHBondContact CA-O 3.48Å; N305-T329 PolarHBondContact N-O 3.05Å; N305-T329 PolarHBondContact OD1-N 3.09Å
330	F	93.6	Very high	84.8	Confident	7 Å²	7	63.6 Å²	63.6	3%	0.031	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	138.9	177.3	-67.5	-102.4	0	0	0	110.1	I256 V257 I259 L267 V301 E303 I304 L321 L328 L332	I256-F330 CarbonylContact C-O 3.45Å; I256-F330 VanDerWaalsContact CA-O 3.27Å; I256-F330 WeakPolarHBondContact CA-O 3.45Å; V257-F330 HydrophobicContact CG2-CB 3.7Å; V257-F330 HydrophobicContact CG2-CD2 4.39Å; V257-F330 HydrophobicContact CG2-CG 4.35Å; V257-F330 PolarHBondContact N-O 3.33Å; V257-F330 PolarHBondContact O-N 2.92Å; I259-F330 HydrophobicContact CB-CE2 4.47Å; I259-F330 HydrophobicContact CD1-CD2 4.35Å; I259-F330 HydrophobicContact CD1-CE2 4.22Å; L267-F330 HydrophobicContact CD2-CE2 4.24Å; L267-F330 HydrophobicContact CD2-CZ 3.82Å; V301-F330 HydrophobicContact CG1-CD1 4.16Å; E303-F330 CarbonylContact O-C 3.57Å; E303-F330 WeakPolarHBondContact O-CA 2.97Å; I304-F330 HydrophobicContact CD1-CD1 4.01Å; I304-F330 HydrophobicContact CD1-CE1 3.52Å; I304-F330 HydrophobicContact CD1-CZ 4.28Å; I304-F330 HydrophobicContact CG1-CD1 3.64Å; I304-F330 HydrophobicContact CG1-CE1 3.66Å; I304-F330 HydrophobicContact CG1-CG 4.41Å; I304-F330 HydrophobicContact CG1-CZ 4.44Å; I304-F330 HydrophobicContact CG2-CE1 4.47Å; I304-F330 HydrophobicContact CG2-CZ 4.48Å; L321-F330 HydrophobicContact CD2-CZ 4.49Å; L328-F330 HydrophobicContact CB-CD2 4.19Å; L328-F330 HydrophobicContact CB-CE2 3.55Å; L328-F330 HydrophobicContact CB-CZ 4.26Å; L328-F330 HydrophobicContact CD1-CE2 4.16Å; L328-F330 HydrophobicContact CD1-CZ 4.12Å; F330-L332 HydrophobicContact CB-CD1 4.31Å; F330-L332 HydrophobicContact CB-CD2 3.9Å; F330-L332 HydrophobicContact CB-CG 3.94Å; F330-L332 HydrophobicContact CD1-CD2 4.22Å; F330-L332 HydrophobicContact CG-CD2 4.5Å
331	V	92.1	Very high	83.5	Confident	16 Å²	16	67.1 Å²	67.1	10%	0.097	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.8	165.2	-175	0	0	0	0	107.1	V254 I256 L302 E303	V254-V331 HydrophobicContact CB-CG1 3.93Å; V254-V331 HydrophobicContact CG1-CG1 4.26Å; V254-V331 HydrophobicContact CG2-CG1 4.05Å; I256-V331 HydrophobicContact CG1-CG1 4.49Å; I256-V331 HydrophobicContact CG1-CG2 4.32Å; L302-V331 HydrophobicContact CB-CB 4.44Å; L302-V331 HydrophobicContact CB-CG1 4.36Å; L302-V331 WeakPolarHBondContact CB-O 3.19Å; L302-V331 HydrophobicContact CD1-CG1 4.32Å; L302-V331 PolarHBondContact N-O 2.82Å; E303-V331 HydrophobicContact CB-CB 4Å; E303-V331 HydrophobicContact CB-CG2 3.95Å; E303-V331 PolarHBondContact N-O 3.42Å; E303-V331 PolarHBondContact O-N 3.25Å
332	L	92.3	Very high	82	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	150.3	-169.9	-53.7	174.1	0	0	0	111.7	V254 K255 V257 L295 D299 E300 V301 F330	V254-L332 CarbonylContact C-O 3.6Å; V254-L332 VanDerWaalsContact CA-O 3.23Å; V254-L332 WeakPolarHBondContact CA-O 3.28Å; K255-L332 HydrophobicContact CB-CB 4.39Å; K255-L332 PolarHBondContact N-O 3.35Å; K255-L332 PolarHBondContact O-N 3.09Å; V257-L332 HydrophobicContact CG2-CD1 3.68Å; V257-L332 HydrophobicContact CG2-CG 4.45Å; L295-L332 HydrophobicContact CD2-CD1 3.5Å; D299-L332 HydrophobicContact CB-CD1 4.5Å; E300-L332 CarbonylContact O-C 3.52Å; E300-L332 WeakPolarHBondContact O-CA 3.39Å; V301-L332 HydrophobicContact CB-CD2 4.15Å; V301-L332 HydrophobicContact CG1-CD2 4.21Å; V301-L332 HydrophobicContact CG2-CD2 3.81Å; F330-L332 HydrophobicContact CB-CD1 4.31Å; F330-L332 HydrophobicContact CB-CD2 3.9Å; F330-L332 HydrophobicContact CB-CG 3.94Å; F330-L332 HydrophobicContact CD1-CD2 4.22Å; F330-L332 HydrophobicContact CG-CD2 4.5Å
333	I	90.6	Very high	80.8	Confident	30 Å²	30	73.6 Å²	73.6	15%	0.154	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	116	157.8	-58.2	164.1	0	0	0	106.4	E252 V254 D299 E300 L302	E252-I333 WeakPolarHBondContact OE2-CD1 3.43Å; V254-I333 HydrophobicContact CG1-CG1 4.33Å; D299-I333 WeakPolarHBondContact CA-O 3.27Å; E300-I333 HydrophobicContact CB-CB 4.1Å; E300-I333 PolarHBondContact N-O 2.75Å; E300-I333 PolarHBondContact O-N 2.76Å; L302-I333 HydrophobicContact CD1-CD1 4Å; L302-I333 HydrophobicContact CD1-CG1 3.82Å; L302-I333 HydrophobicContact CD2-CD1 3.93Å; L302-I333 HydrophobicContact CD2-CG1 4.42Å; L302-I333 HydrophobicContact CG-CD1 4.21Å; L302-I333 HydrophobicContact CG-CG1 4.16Å
334	P	89.5	Confident	79.4	Confident	52 Å²	52	76.2 Å²	76.2	34%	0.338	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-65.7	143	-174.6	27	-33.7	0	0	0	111	D299	D299-P334 WeakPolarHBondContact OD1-CA 3.43Å
335	S	85.6	Confident	78.3	Confident	33 Å²	33	81.4 Å²	81.4	23%	0.231	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-60.5	140.6	177.4	-160.9	0	0	0	0	112	E297 G298 D299 Q337	E297-S335 PolarHBondContact O-OG 2.86Å; G298-S335 VanDerWaalsContact C-CB 3.46Å; G298-S335 WeakPolarHBondContact CA-OG 3.47Å; G298-S335 WeakPolarHBondContact O-CB 3.46Å; G298-S335 PolarHBondContact O-OG 3.44Å; D299-S335 PolarHBondContact OD1-N 2.92Å; S335-Q337 PolarHBondContact O-N 3.18Å; S335-Q337 WeakPolarHBondContact OG-CB 3.45Å; S335-Q337 WeakPolarHBondContact OG-CG 3.32Å; S335-Q337 PolarHBondContact OG-N 2.84Å
336	Q	77.1	Confident	77.7	Confident	194 Å²	194	81.6 Å²	81.6	91%	0.907	46%	0.457	S	S	*	.			trans	-80.5	-0.4	168.9	-61.6	-179.7	9.8	0	0	112.5	I338	Q336-I338 PolarHBondContact O-N 2.8Å
337	Q	68.8	Low	77.9	Confident	122 Å²	122	83.9 Å²	83.9	57%	0.57	47%	0.466	S	S	*	.			trans	-73.4	116.4	-179	-65.2	-175.4	25.1	0	0	110.8	S335 K339	S335-Q337 PolarHBondContact O-N 3.18Å; S335-Q337 WeakPolarHBondContact OG-CB 3.45Å; S335-Q337 WeakPolarHBondContact OG-CG 3.32Å; S335-Q337 PolarHBondContact OG-N 2.84Å; Q337-K339 PolarHBondContact O-N 3.47Å
338	I	65.1	Low	78.1	Confident	169 Å²	169	82.4 Å²	82.4	87%	0.867	46%	0.455	S	S	*	.			trans	-79.1	99.3	173.5	-57.1	171.9	0	0	0	107.8	Q336	Q336-I338 PolarHBondContact O-N 2.8Å
339	K	64.6	Low	78.3	Confident	86 Å²	86	85.3 Å²	85.3	37%	0.374	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-73.7	143.2	168.3	-78.4	-162.7	173.7	-161	0	110.1	E297 Q337 E385	E297-K339 VanDerWaalsContact CD-NZ 3.3Å; E297-K339 IonicContact OE1-NZ 3.55Å; E297-K339 WeakPolarHBondContact OE2-CE 3.33Å; E297-K339 IonicContact OE2-NZ 3.77Å; E297-K339 PolarHBondContact OE2-NZ 2.78Å; Q337-K339 PolarHBondContact O-N 3.47Å; K339-E385 IonicContact NZ-OE2 3.23Å; K339-E385 PolarHBondContact NZ-OE2 2.97Å; K339-E385 VanDerWaalsContact NZ-OE2 3.08Å
340	P	67.1	Low	78.6	Confident	108 Å²	108	83.8 Å²	83.8	70%	0.701	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-59.6	153	169.8	27.1	-33.3	0	0	0	109.9
341	P	64.4	Low	78.7	Confident	115 Å²	115	85.2 Å²	85.2	75%	0.747	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-54.3	145.3	176.1	21.5	-31.5	0	0	0	110.5	A343	P341-A343 PolarHBondContact O-N 2.86Å
342	P	60.8	Low	78.9	Confident	133 Å²	133	84.4 Å²	84.4	86%	0.864	46%	0.461	S	S	*	.			trans	-56	113.8	-173	21.4	-32.1	0	0	0	110
343	A	61.8	Low	78.9	Confident	87 Å²	87	85.1 Å²	85.1	72%	0.719	46%	0.464	S	S	*	.			trans	-67.9	148.6	171	0	0	0	0	0	108.6	P341 E345	P341-A343 PolarHBondContact O-N 2.86Å; A343-E345 PolarHBondContact O-N 3.39Å
344	K	59.2	Low	79	Confident	195 Å²	195	84.8 Å²	84.8	85%	0.848	46%	0.461	S	S	*	.			trans	-55	126.8	173.7	-75.3	-175	175.6	-175.1	0	109.1	T346	K344-T346 PolarHBondContact O-N 2.8Å
345	E	64.2	Low	79.2	Confident	136 Å²	136	87.7 Å²	87.7	64%	0.636	47%	0.474	S	S	*	.			trans	-62.6	110.4	176.6	-62.2	-174.9	152.1	0	0	108.9	K285 A343	K285-E345 IonicContact NZ-OE1 3.08Å; K285-E345 PolarHBondContact NZ-OE1 2.89Å; A343-E345 PolarHBondContact O-N 3.39Å
346	T	78.3	Confident	79.6	Confident	101 Å²	101	86.7 Å²	86.7	62%	0.62	47%	0.465	S	S	*	.			trans	-105.8	102.5	173.7	57.2	0	0	0	0	107.9	K344 I348	K344-T346 PolarHBondContact O-N 2.8Å; T346-I348 PolarHBondContact O-N 3.33Å
347	V	90.4	Very high	80.5	Confident	73 Å²	73	80.9 Å²	80.9	44%	0.442	44%	0.44	S	S	.	.			trans	-67.2	129.5	170.2	-176	0	0	0	0	108.4	H380 V381 I382	V347-H380 HydrophobicContact CG1-CB 4.28Å; V347-V381 WeakPolarHBondContact CA-O 3.15Å; V347-I382 HydrophobicContact CG1-CG2 4.29Å; V347-I382 HydrophobicContact CG2-CG2 4.15Å
348	I	92.8	Very high	81.7	Confident	35 Å²	35	75.5 Å²	75.5	18%	0.179	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125	177.2	-58.3	167.1	0	0	0	107.6	T346 V350 V381 E468	T346-I348 PolarHBondContact O-N 3.33Å; I348-V350 HydrophobicContact CG2-CG1 3.87Å; I348-V381 HydrophobicContact CB-CB 4.49Å; I348-V381 PolarHBondContact N-O 2.71Å; I348-V381 WeakPolarHBondContact O-CB 3.46Å; I348-V381 PolarHBondContact O-N 3.46Å; I348-E468 HydrophobicContact CG2-CG 3.71Å
349	H	95.9	Very high	83.1	Confident	61 Å²	61	69.7 Å²	69.7	28%	0.282	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.9	175.5	-51.1	-94.2	0	0	0	108.4	L379 H380 M469 W668	H349-L379 WeakPolarHBondContact CA-O 3.08Å; H349-H380 AromaticContact CE1-ND1 3.62Å; H349-H380 AromaticContact CG-ND1 3.97Å; H349-H380 AromaticContact ND1-CE1 3.41Å; H349-H380 PolarHBondContact ND1-CE1 3.01Å; H349-H380 AromaticContact ND1-CG 3.95Å; H349-H380 AromaticContact ND1-ND1 2.9Å; H349-H380 PolarHBondContact ND1-ND1 3.45Å; H349-M469 PolarHBondContact O-N 2.91Å; H349-W668 HydrophobicContact CB-CE3 4.36Å; H349-W668 HydrophobicContact CB-CH2 3.76Å; H349-W668 HydrophobicContact CB-CZ3 3.49Å; H349-W668 VanDerWaalsContact CB-CZ3 3.49Å; H349-W668 AromaticContact CG-CH2 3.5Å; H349-W668 AromaticContact CG-CZ3 3.63Å; H349-W668 AromaticContact ND1-CH2 3.36Å; H349-W668 WeakPolarHBondContact ND1-CH2 3.29Å; H349-W668 AromaticContact ND1-CZ3 4Å
350	V	96.1	Very high	84.4	Confident	7 Å²	7	72 Å²	72	4%	0.042	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	145.7	179.2	-57.3	0	0	0	0	110.9	I348 I378 L379 V381 Y466 E467	I348-V350 HydrophobicContact CG2-CG1 3.87Å; V350-I378 CarbonylContact O-C 3.57Å; V350-I378 WeakPolarHBondContact O-CA 3.38Å; V350-L379 HydrophobicContact CG2-CB 3.85Å; V350-L379 PolarHBondContact N-O 2.95Å; V350-L379 PolarHBondContact O-N 3.17Å; V350-V381 HydrophobicContact CG1-CG2 4.45Å; V350-V381 HydrophobicContact CG2-CG2 3.79Å; V350-Y466 HydrophobicContact CB-CD1 4.43Å; V350-Y466 HydrophobicContact CG2-CD1 3.8Å; V350-Y466 HydrophobicContact CG2-CE1 4.47Å; V350-Y466 HydrophobicContact CG2-CG 4.24Å; V350-E467 CarbonylContact C-O 3.48Å; V350-E467 VanDerWaalsContact CA-O 3.25Å; V350-E467 WeakPolarHBondContact CA-O 3.32Å
351	K	95.9	Very high	85.5	Confident	36 Å²	36	67 Å²	67	16%	0.157	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	127.8	167.7	-174.3	171.1	-176.5	178.4	0	109.4	D377 I378 Y466 E467 M469	K351-D377 WeakPolarHBondContact CA-O 3.42Å; K351-I378 HydrophobicContact CB-CD1 3.79Å; K351-I378 HydrophobicContact CD-CD1 4.43Å; K351-I378 HydrophobicContact CG-CD1 4.06Å; K351-Y466 WeakPolarHBondContact O-CA 3.44Å; K351-E467 PolarHBondContact N-O 3.08Å; K351-E467 PolarHBondContact O-N 3.47Å; K351-M469 HydrophobicContact CB-CE 4.26Å; K351-M469 HydrophobicContact CB-CG 3.64Å; K351-M469 HydrophobicContact CB-SD 4.02Å; K351-M469 HydrophobicContact CD-CE 3.97Å
352	A	95.6	Very high	86.7	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	133.8	174.6	0	0	0	0	0	111.1	F373 G376 D377 Y466	A352-F373 HydrophobicContact CB-CD2 3.48Å; A352-F373 VanDerWaalsContact CB-CD2 3.48Å; A352-F373 HydrophobicContact CB-CE2 3.56Å; A352-F373 HydrophobicContact CB-CG 4.49Å; A352-G376 PolarHBondContact O-N 3.46Å; A352-D377 PolarHBondContact N-O 2.91Å; A352-Y466 HydrophobicContact CB-CD1 4.27Å; A352-Y466 HydrophobicContact CB-CE1 4.09Å
353	H	93.1	Very high	88.2	Confident	15 Å²	15	68 Å²	68	7%	0.069	36%	0.361	C	S	.	.	S	Bend	trans	-108.3	11.7	176.5	-69.4	-50.7	0	0	0	113.9	L464 T465 E467 H637	H353-L464 HydrophobicContact CB-CB 3.81Å; H353-T465 PolarHBondContact N-O 3.43Å; H353-E467 IonicContact CE1-OE2 2.83Å; H353-E467 VanDerWaalsContact NE2-CB 3.28Å; H353-E467 WeakPolarHBondContact NE2-CB 3.4Å; H353-E467 IonicContact NE2-OE2 3.64Å; H353-E467 PolarHBondContact NE2-OE2 2.93Å; H353-E467 VanDerWaalsContact NE2-OE2 3.15Å; H353-H637 VanDerWaalsContact CE1-CB 3.5Å; H353-H637 WeakPolarHBondContact CE1-CB 3.27Å; H353-H637 WeakPolarHBondContact ND1-CB 3.3Å
354	F	92.6	Very high	89.6	Confident	22 Å²	22	64.7 Å²	64.7	10%	0.096	33%	0.332	C	S	.	.	S	Bend	trans	-144.7	162.9	177.8	67.8	-77.1	0	0	0	110.1	F373 K375 Q413 T465 Y466	F354-F373 HydrophobicContact CD2-CE2 4.28Å; F354-F373 HydrophobicContact CD2-CZ 4.5Å; F354-F373 HydrophobicContact CE1-CE2 4.16Å; F354-F373 HydrophobicContact CE1-CZ 4.19Å; F354-F373 AromaticContact CE2-CE2 3.94Å; F354-F373 HydrophobicContact CE2-CE2 3.94Å; F354-F373 AromaticContact CE2-CZ 3.73Å; F354-F373 HydrophobicContact CE2-CZ 3.73Å; F354-F373 AromaticContact CZ-CE2 3.89Å; F354-F373 HydrophobicContact CZ-CE2 3.89Å; F354-F373 AromaticContact CZ-CZ 3.55Å; F354-F373 HydrophobicContact CZ-CZ 3.55Å; F354-F373 WeakPolarHBondContact O-CE2 3.4Å; F354-K375 PolarHBondContact O-N 3.12Å; F354-Q413 HydrophobicContact CD1-CG 4.31Å; F354-Q413 HydrophobicContact CD2-CG 4.44Å; F354-Q413 HydrophobicContact CE1-CG 3.8Å; F354-Q413 VanDerWaalsContact CE2-CD 3.45Å; F354-Q413 HydrophobicContact CE2-CG 3.93Å; F354-Q413 HydrophobicContact CZ-CB 4.31Å; F354-Q413 HydrophobicContact CZ-CG 3.57Å; F354-T465 WeakPolarHBondContact CD1-O 3.27Å; F354-Y466 HydrophobicContact CE1-CD1 4.35Å; F354-Y466 HydrophobicContact CE1-CD2 4.38Å; F354-Y466 AromaticContact CE1-CE1 3.8Å; F354-Y466 HydrophobicContact CE1-CE1 3.8Å; F354-Y466 AromaticContact CE1-CE2 3.85Å; F354-Y466 HydrophobicContact CE1-CE2 3.85Å; F354-Y466 AromaticContact CE1-CZ 3.55Å; F354-Y466 HydrophobicContact CZ-CE1 4.2Å; F354-Y466 HydrophobicContact CZ-CE2 4.03Å; F354-Y466 AromaticContact CZ-CZ 3.61Å; F354-Y466 WeakPolarHBondContact CZ-OH 3.36Å
355	D	93.7	Very high	91.1	Very high	113 Å²	113	59 Å²	59	60%	0.604	32%	0.315	S	S	*	.			trans	-90.8	141.4	174.4	-54.8	-43.3	0	0	0	110	Q374 K375	D355-Q374 WeakPolarHBondContact OD1-CA 3.02Å; D355-K375 WeakPolarHBondContact OD1-CB 3.48Å; D355-K375 PolarHBondContact OD1-N 2.62Å
356	Y	95	Very high	92.3	Very high	13 Å²	13	53.9 Å²	53.9	5%	0.051	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-135	120.5	176.9	179.3	-115.1	0	0	0	111.1	P358 D361 L371 S372 F373 W389 P408	Y356-P358 HydrophobicContact CE1-CB 3.93Å; Y356-P358 HydrophobicContact CE1-CG 4.4Å; Y356-D361 HydrophobicContact CE2-CB 4.13Å; Y356-D361 VanDerWaalsContact CE2-OD2 3.31Å; Y356-D361 WeakPolarHBondContact CE2-OD2 3.38Å; Y356-D361 PolarHBondContact OH-OD2 2.97Å; Y356-L371 VanDerWaalsContact CD1-O 3.26Å; Y356-L371 WeakPolarHBondContact CD1-O 3.42Å; Y356-S372 WeakPolarHBondContact O-CA 3.32Å; Y356-F373 VanDerWaalsContact CB-CE1 3.46Å; Y356-F373 HydrophobicContact CD1-CD1 4.05Å; Y356-F373 AromaticContact CD1-CE1 3.54Å; Y356-F373 HydrophobicContact CD1-CE1 3.54Å; Y356-F373 HydrophobicContact CD1-CZ 4.16Å; Y356-F373 HydrophobicContact CG-CD1 4.49Å; Y356-F373 AromaticContact CG-CE1 3.81Å; Y356-F373 HydrophobicContact CG-CE1 3.81Å; Y356-F373 AromaticContact CG-CZ 3.95Å; Y356-F373 HydrophobicContact CG-CZ 3.95Å; Y356-F373 PolarHBondContact N-O 3.41Å; Y356-F373 PolarHBondContact O-N 2.89Å; Y356-F373 VanDerWaalsContact O-N 3.08Å; Y356-W389 WeakPolarHBondContact OH-CH2 3.5Å; Y356-W389 VanDerWaalsContact OH-CZ3 3.27Å; Y356-W389 WeakPolarHBondContact OH-CZ3 3.31Å; Y356-P408 HydrophobicContact CD1-CG 4.28Å; Y356-P408 HydrophobicContact CD2-CG 3.73Å; Y356-P408 HydrophobicContact CE1-CG 4.11Å; Y356-P408 HydrophobicContact CE2-CG 3.54Å; Y356-P408 HydrophobicContact CG-CG 4.11Å
357	D	95.4	Very high	92.8	Very high	71 Å²	71	55.4 Å²	55.4	38%	0.38	29%	0.288	S	S	.	.			trans	-112.6	111.4	167.2	-172.9	-1.7	0	0	0	109.5	S359 D360	D357-S359 PolarHBondContact O-N 2.94Å; D357-S359 WeakPolarHBondContact OD1-CB 3.41Å; D357-S359 PolarHBondContact OD1-N 3.18Å; D357-S359 PolarHBondContact OD1-OG 3.16Å; D357-S359 VanDerWaalsContact OD1-OG 3.14Å; D357-S359 PolarHBondContact OD2-OG 3.07Å; D357-D360 PolarHBondContact O-N 3.17Å
358	P	94.6	Very high	92.7	Very high	10 Å²	10	58.8 Å²	58.8	7%	0.065	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-62.6	-19	175.1	27.9	-35.6	0	0	0	112.6	Y356 D360 D361	Y356-P358 HydrophobicContact CE1-CB 3.93Å; Y356-P358 HydrophobicContact CE1-CG 4.4Å; P358-D360 VanDerWaalsContact C-N 3.25Å; P358-D360 PolarHBondContact O-N 3.35Å; P358-D361 PolarHBondContact O-N 2.98Å
359	S	93.5	Very high	92.7	Very high	46 Å²	46	58.4 Å²	58.4	32%	0.322	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-69.6	-23.2	177.6	98.3	0	0	0	0	113.1	D357 R367	D357-S359 PolarHBondContact O-N 2.94Å; D357-S359 WeakPolarHBondContact OD1-CB 3.41Å; D357-S359 PolarHBondContact OD1-N 3.18Å; D357-S359 PolarHBondContact OD1-OG 3.16Å; D357-S359 VanDerWaalsContact OD1-OG 3.14Å; D357-S359 PolarHBondContact OD2-OG 3.07Å; S359-R367 VanDerWaalsContact CA-CZ 3.46Å; S359-R367 VanDerWaalsContact CA-NH2 3.26Å; S359-R367 PolarHBondContact O-NH1 2.95Å; S359-R367 PolarHBondContact O-NH2 2.9Å
360	D	91.9	Very high	92.6	Very high	134 Å²	134	56.4 Å²	56.4	72%	0.717	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-97	-2.3	177	-72.3	-28.7	0	0	0	112.8	D357 P358 P362	D357-D360 PolarHBondContact O-N 3.17Å; P358-D360 VanDerWaalsContact C-N 3.25Å; P358-D360 PolarHBondContact O-N 3.35Å; D360-P362 WeakPolarHBondContact O-CD 3.36Å
361	D	91	Very high	92.5	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.021	29%	0.292	C	S	.	.			trans	-98.3	110.2	-173.1	-161.2	-22.1	0	0	0	112.6	Y356 P358 Y363 V364 W389 R416	Y356-D361 HydrophobicContact CE2-CB 4.13Å; Y356-D361 VanDerWaalsContact CE2-OD2 3.31Å; Y356-D361 WeakPolarHBondContact CE2-OD2 3.38Å; Y356-D361 PolarHBondContact OH-OD2 2.97Å; P358-D361 PolarHBondContact O-N 2.98Å; D361-Y363 PolarHBondContact O-N 2.8Å; D361-Y363 WeakPolarHBondContact OD1-CB 3.28Å; D361-Y363 PolarHBondContact OD1-N 2.78Å; D361-V364 HydrophobicContact CB-CB 4.41Å; D361-V364 VanDerWaalsContact O-CG1 3.31Å; D361-V364 WeakPolarHBondContact O-CG1 3.37Å; D361-W389 WeakPolarHBondContact OD2-CH2 3.39Å; D361-R416 IonicContact OD1-NH2 2.64Å; D361-R416 IonicContact OD2-CZ 3.83Å; D361-R416 VanDerWaalsContact OD2-CZ 3.23Å; D361-R416 IonicContact OD2-NH1 3.79Å; D361-R416 PolarHBondContact OD2-NH1 3.09Å; D361-R416 IonicContact OD2-NH2 3.01Å; D361-R416 PolarHBondContact OD2-NH2 2.88Å
362	P	89.6	Confident	92.5	Very high	107 Å²	107	57.1 Å²	57.1	70%	0.695	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-9.8	176.8	32.4	-35.9	0	0	0	113.3	D360	D360-P362 WeakPolarHBondContact O-CD 3.36Å
363	Y	90.7	Very high	92.5	Very high	161 Å²	161	57.4 Å²	57.4	63%	0.631	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-6	-176.9	-56.4	-74.7	0	0	0	113.4	D361 P365 W389	D361-Y363 PolarHBondContact O-N 2.8Å; D361-Y363 WeakPolarHBondContact OD1-CB 3.28Å; D361-Y363 PolarHBondContact OD1-N 2.78Å; Y363-P365 WeakPolarHBondContact O-CD 3.28Å; Y363-W389 VanDerWaalsContact O-CZ2 3.24Å; Y363-W389 WeakPolarHBondContact O-CZ2 3.31Å
364	V	92.2	Very high	92.5	Very high	18 Å²	18	63.1 Å²	63.1	11%	0.109	33%	0.331	C	S	.	.			trans	-62.4	125.3	177.4	69.4	0	0	0	0	109.7	D361 C366 R367 W389	D361-V364 HydrophobicContact CB-CB 4.41Å; D361-V364 VanDerWaalsContact O-CG1 3.31Å; D361-V364 WeakPolarHBondContact O-CG1 3.37Å; V364-C366 VanDerWaalsContact C-N 3.32Å; V364-C366 PolarHBondContact O-N 2.91Å; V364-R367 HydrophobicContact CG1-CB 4.16Å; V364-R367 HydrophobicContact CG1-CG 4.41Å; V364-W389 HydrophobicContact CB-CH2 3.89Å; V364-W389 HydrophobicContact CB-CZ2 4.35Å; V364-W389 HydrophobicContact CB-CZ3 4.35Å; V364-W389 HydrophobicContact CG2-CH2 4.11Å; V364-W389 HydrophobicContact CG2-CZ3 4.06Å
365	P	90.1	Very high	92.5	Very high	77 Å²	77	65.9 Å²	65.9	50%	0.5	34%	0.343	S	S	.	.	S	Bend	trans	-65.4	-34.9	-173.7	-25.5	34.1	0	0	0	113.6	Y363 W389	Y363-P365 WeakPolarHBondContact O-CD 3.28Å; P365-W389 VanDerWaalsContact CG-CD1 3.45Å; P365-W389 HydrophobicContact CG-CD2 4.13Å; P365-W389 HydrophobicContact CG-CG 3.82Å
366	C	89.2	Confident	92.4	Very high	28 Å²	28	62 Å²	62	19%	0.189	33%	0.33	C	S	.	.			trans	-143.5	112.8	178	173.4	0	0	0	0	107.3	T270 V364 E368 L369 G370	T270-C366 HydrophobicContact CG2-CB 4.25Å; V364-C366 VanDerWaalsContact C-N 3.32Å; V364-C366 PolarHBondContact O-N 2.91Å; C366-E368 VanDerWaalsContact C-N 3.29Å; C366-E368 PolarHBondContact O-N 3.15Å; C366-E368 PolarHBondContact SG-OE2 3.41Å; C366-L369 HydrophobicContact CB-CB 4.41Å; C366-L369 HydrophobicContact CB-CD1 4.2Å; C366-L369 HydrophobicContact CB-CG 4.44Å; C366-L369 PolarHBondContact O-N 3.34Å; C366-G370 PolarHBondContact O-N 3Å
367	R	89.4	Confident	92.3	Very high	133 Å²	133	63.8 Å²	63.8	50%	0.502	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-69.6	-31.3	-170.5	-171	177.7	172.3	101.3	-5	111.5	S359 V364 L369 G370	S359-R367 VanDerWaalsContact CA-CZ 3.46Å; S359-R367 VanDerWaalsContact CA-NH2 3.26Å; S359-R367 PolarHBondContact O-NH1 2.95Å; S359-R367 PolarHBondContact O-NH2 2.9Å; V364-R367 HydrophobicContact CG1-CB 4.16Å; V364-R367 HydrophobicContact CG1-CG 4.41Å; R367-L369 VanDerWaalsContact C-N 3.25Å; R367-L369 PolarHBondContact O-N 3.16Å; R367-G370 PolarHBondContact O-N 3.26Å; R367-G370 VanDerWaalsContact O-N 3.14Å
368	E	87.9	Confident	92.4	Very high	143 Å²	143	61.2 Å²	61.2	67%	0.668	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-66.1	-27.3	177.7	-58.9	71.5	-156.5	0	0	112.3	C366	C366-E368 VanDerWaalsContact C-N 3.29Å; C366-E368 PolarHBondContact O-N 3.15Å; C366-E368 PolarHBondContact SG-OE2 3.41Å
369	L	92.3	Very high	92.5	Very high	27 Å²	27	60.8 Å²	60.8	14%	0.141	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-92.6	-4.5	175.3	-68.4	176	0	0	0	112.9	T270 V284 C366 R367 L371 G405 L406	T270-L369 HydrophobicContact CG2-CD1 3.4Å; V284-L369 HydrophobicContact CG1-CD2 4.36Å; V284-L369 HydrophobicContact CG2-CD1 3.56Å; V284-L369 HydrophobicContact CG2-CD2 4.34Å; C366-L369 HydrophobicContact CB-CB 4.41Å; C366-L369 HydrophobicContact CB-CD1 4.2Å; C366-L369 HydrophobicContact CB-CG 4.44Å; C366-L369 PolarHBondContact O-N 3.34Å; R367-L369 VanDerWaalsContact C-N 3.25Å; R367-L369 PolarHBondContact O-N 3.16Å; L369-L371 PolarHBondContact O-N 2.94Å; L369-G405 CarbonylContact O-C 3.45Å; L369-G405 WeakPolarHBondContact O-CA 3.07Å; L369-L406 HydrophobicContact CB-CD1 4.04Å; L369-L406 HydrophobicContact CB-CG 3.98Å; L369-L406 HydrophobicContact CD1-CD1 4.47Å; L369-L406 PolarHBondContact O-N 3.27Å
370	G	93.9	Very high	92.5	Very high	19 Å²	19	59.7 Å²	59.7	20%	0.196	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-61.7	124.6	-178.6	0	0	0	0	0	111.6	C366 R367	C366-G370 PolarHBondContact O-N 3Å; R367-G370 PolarHBondContact O-N 3.26Å; R367-G370 VanDerWaalsContact O-N 3.14Å
371	L	95	Very high	92.7	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.021	28%	0.279	C	S	.	.			trans	-96	112.5	175.7	-179.2	62.5	0	0	0	109.9	Y356 L369 L379 A392 R394 L406 V407	Y356-L371 VanDerWaalsContact CD1-O 3.26Å; Y356-L371 WeakPolarHBondContact CD1-O 3.42Å; L369-L371 PolarHBondContact O-N 2.94Å; L371-L379 HydrophobicContact CD2-CD2 4.39Å; L371-A392 HydrophobicContact CD2-CB 4.42Å; L371-A392 WeakPolarHBondContact CD2-O 3.5Å; L371-R394 HydrophobicContact CD1-CB 4.22Å; L371-R394 HydrophobicContact CD2-CB 4.23Å; L371-L406 PolarHBondContact N-O 2.82Å; L371-V407 HydrophobicContact CB-CG1 3.79Å; L371-V407 HydrophobicContact CD2-CG1 3.87Å; L371-V407 HydrophobicContact CG-CG1 4.14Å
372	S	95.5	Very high	92.8	Very high	54 Å²	54	54.8 Å²	54.8	38%	0.378	29%	0.286	S	S	.	.			trans	-76.8	146.2	173.2	63.2	0	0	0	0	111.6	Y356 R394	Y356-S372 WeakPolarHBondContact O-CA 3.32Å; S372-R394 PolarHBondContact O-NH1 2.86Å
373	F	95.7	Very high	92.9	Very high	6 Å²	6	50.2 Å²	50.2	3%	0.026	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-154.8	159.9	174.5	59.2	-95.9	0	0	0	111.2	A352 F354 Y356 D377 L379 V407 Y466	A352-F373 HydrophobicContact CB-CD2 3.48Å; A352-F373 VanDerWaalsContact CB-CD2 3.48Å; A352-F373 HydrophobicContact CB-CE2 3.56Å; A352-F373 HydrophobicContact CB-CG 4.49Å; F354-F373 HydrophobicContact CD2-CE2 4.28Å; F354-F373 HydrophobicContact CD2-CZ 4.5Å; F354-F373 HydrophobicContact CE1-CE2 4.16Å; F354-F373 HydrophobicContact CE1-CZ 4.19Å; F354-F373 AromaticContact CE2-CE2 3.94Å; F354-F373 HydrophobicContact CE2-CE2 3.94Å; F354-F373 AromaticContact CE2-CZ 3.73Å; F354-F373 HydrophobicContact CE2-CZ 3.73Å; F354-F373 AromaticContact CZ-CE2 3.89Å; F354-F373 HydrophobicContact CZ-CE2 3.89Å; F354-F373 AromaticContact CZ-CZ 3.55Å; F354-F373 HydrophobicContact CZ-CZ 3.55Å; F354-F373 WeakPolarHBondContact O-CE2 3.4Å; Y356-F373 VanDerWaalsContact CB-CE1 3.46Å; Y356-F373 HydrophobicContact CD1-CD1 4.05Å; Y356-F373 AromaticContact CD1-CE1 3.54Å; Y356-F373 HydrophobicContact CD1-CE1 3.54Å; Y356-F373 HydrophobicContact CD1-CZ 4.16Å; Y356-F373 HydrophobicContact CG-CD1 4.49Å; Y356-F373 AromaticContact CG-CE1 3.81Å; Y356-F373 HydrophobicContact CG-CE1 3.81Å; Y356-F373 AromaticContact CG-CZ 3.95Å; Y356-F373 HydrophobicContact CG-CZ 3.95Å; Y356-F373 PolarHBondContact N-O 3.41Å; Y356-F373 PolarHBondContact O-N 2.89Å; Y356-F373 VanDerWaalsContact O-N 3.08Å; F373-D377 WeakPolarHBondContact CA-OD2 3.44Å; F373-D377 HydrophobicContact CB-CB 4.2Å; F373-L379 HydrophobicContact CB-CD2 4.1Å; F373-L379 HydrophobicContact CD1-CD1 3.89Å; F373-L379 HydrophobicContact CD1-CD2 4.31Å; F373-L379 HydrophobicContact CD2-CD1 4.49Å; F373-L379 HydrophobicContact CE1-CD1 3.99Å; F373-L379 HydrophobicContact CG-CD1 4.15Å; F373-L379 HydrophobicContact CG-CD2 4.28Å; F373-L379 HydrophobicContact CZ-CD1 4.35Å; F373-V407 HydrophobicContact CD1-CG1 3.96Å; F373-V407 HydrophobicContact CE1-CB 3.95Å; F373-V407 HydrophobicContact CE1-CG1 3.73Å; F373-Y466 HydrophobicContact CE2-CE1 4.29Å; F373-Y466 HydrophobicContact CZ-CE1 4.05Å; F373-Y466 WeakPolarHBondContact CZ-OH 3.39Å
374	Q	94.2	Very high	92.9	Very high	136 Å²	136	46.5 Å²	46.5	64%	0.636	25%	0.245	S	C	*	.			trans	-108.3	159.8	175.7	-63.5	-178.3	13.7	0	0	110.8	D355 G376 D377	D355-Q374 WeakPolarHBondContact OD1-CA 3.02Å; Q374-G376 PolarHBondContact O-N 3.11Å; Q374-G376 VanDerWaalsContact O-N 3.15Å; Q374-D377 PolarHBondContact N-OD2 3.3Å; Q374-D377 WeakPolarHBondContact O-CB 3.4Å; Q374-D377 PolarHBondContact O-N 2.67Å; Q374-D377 VanDerWaalsContact O-N 3.09Å
375	K	91.8	Very high	92.8	Very high	80 Å²	80	51.6 Å²	51.6	35%	0.348	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	121	170.3	177.6	177.1	-178.8	-178	0	109.6	F354 D355	F354-K375 PolarHBondContact O-N 3.12Å; D355-K375 WeakPolarHBondContact OD1-CB 3.48Å; D355-K375 PolarHBondContact OD1-N 2.62Å
376	G	90.9	Very high	92.8	Very high	32 Å²	32	49.8 Å²	49.8	33%	0.33	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.5	-18.7	-179.9	0	0	0	0	0	114.1	A352 Q374	A352-G376 PolarHBondContact O-N 3.46Å; Q374-G376 PolarHBondContact O-N 3.11Å; Q374-G376 VanDerWaalsContact O-N 3.15Å
377	D	94.5	Very high	92.8	Very high	49 Å²	49	52 Å²	52	26%	0.262	27%	0.268	S	S	.	.			trans	-63.7	146.8	179.4	-70.9	-13.8	0	0	0	111.7	K351 A352 F373 Q374 R394	K351-D377 WeakPolarHBondContact CA-O 3.42Å; A352-D377 PolarHBondContact N-O 2.91Å; F373-D377 WeakPolarHBondContact CA-OD2 3.44Å; F373-D377 HydrophobicContact CB-CB 4.2Å; Q374-D377 PolarHBondContact N-OD2 3.3Å; Q374-D377 WeakPolarHBondContact O-CB 3.4Å; Q374-D377 PolarHBondContact O-N 2.67Å; Q374-D377 VanDerWaalsContact O-N 3.09Å; D377-R394 HydrophobicContact CB-CG 4.5Å
378	I	95.9	Very high	93	Very high	18 Å²	18	49 Å²	49	9%	0.092	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	127.6	172.6	-57.7	-61.1	0	0	0	108.6	V350 K351 E395 M469 W668	V350-I378 CarbonylContact O-C 3.57Å; V350-I378 WeakPolarHBondContact O-CA 3.38Å; K351-I378 HydrophobicContact CB-CD1 3.79Å; K351-I378 HydrophobicContact CD-CD1 4.43Å; K351-I378 HydrophobicContact CG-CD1 4.06Å; I378-E395 HydrophobicContact CB-CB 3.91Å; I378-E395 HydrophobicContact CG2-CB 4.34Å; I378-E395 WeakPolarHBondContact O-CB 3.1Å; I378-E395 PolarHBondContact O-N 3.41Å; I378-M469 HydrophobicContact CD1-CG 4.23Å; I378-W668 HydrophobicContact CD1-CB 4.3Å; I378-W668 HydrophobicContact CD1-CD2 4.4Å; I378-W668 HydrophobicContact CD1-CG 4.01Å; I378-W668 HydrophobicContact CG1-CD2 4.44Å; I378-W668 HydrophobicContact CG1-CG 4.12Å; I378-W668 HydrophobicContact CG2-CD2 4.36Å; I378-W668 HydrophobicContact CG2-CZ2 4.02Å
379	L	96.5	Very high	93.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.3	177.3	-53	178.1	0	0	0	109.6	H349 V350 L371 F373 V381 A392 Y393 R394 V407 Y466	H349-L379 WeakPolarHBondContact CA-O 3.08Å; V350-L379 HydrophobicContact CG2-CB 3.85Å; V350-L379 PolarHBondContact N-O 2.95Å; V350-L379 PolarHBondContact O-N 3.17Å; L371-L379 HydrophobicContact CD2-CD2 4.39Å; F373-L379 HydrophobicContact CB-CD2 4.1Å; F373-L379 HydrophobicContact CD1-CD1 3.89Å; F373-L379 HydrophobicContact CD1-CD2 4.31Å; F373-L379 HydrophobicContact CD2-CD1 4.49Å; F373-L379 HydrophobicContact CE1-CD1 3.99Å; F373-L379 HydrophobicContact CG-CD1 4.15Å; F373-L379 HydrophobicContact CG-CD2 4.28Å; F373-L379 HydrophobicContact CZ-CD1 4.35Å; L379-V381 PolarHBondContact O-N 3.26Å; L379-A392 HydrophobicContact CB-CB 4.44Å; L379-Y393 CarbonylContact C-O 3.59Å; L379-Y393 WeakPolarHBondContact CA-O 3.33Å; L379-R394 HydrophobicContact CD2-CB 4.08Å; L379-R394 HydrophobicContact CD2-CG 4.08Å; L379-V407 HydrophobicContact CD1-CG1 4.29Å; L379-Y466 HydrophobicContact CD1-CD1 4.48Å; L379-Y466 HydrophobicContact CD1-CE1 3.71Å
380	H	95.1	Very high	93.6	Very high	24 Å²	24	42.7 Å²	42.7	11%	0.111	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	90.7	173.1	-55.7	-36.6	0	0	0	108.6	V347 H349 I382 A392 Y393 E395	V347-H380 HydrophobicContact CG1-CB 4.28Å; H349-H380 AromaticContact CE1-ND1 3.62Å; H349-H380 AromaticContact CG-ND1 3.97Å; H349-H380 AromaticContact ND1-CE1 3.41Å; H349-H380 PolarHBondContact ND1-CE1 3.01Å; H349-H380 AromaticContact ND1-CG 3.95Å; H349-H380 AromaticContact ND1-ND1 2.9Å; H349-H380 PolarHBondContact ND1-ND1 3.45Å; H380-I382 PolarHBondContact O-N 3.35Å; H380-A392 CarbonylContact O-C 3.53Å; H380-A392 WeakPolarHBondContact O-CA 3.31Å; H380-A392 WeakPolarHBondContact O-CB 3.44Å; H380-Y393 PolarHBondContact N-O 2.9Å; H380-Y393 PolarHBondContact O-N 3.43Å; H380-E395 IonicContact CE1-OE2 3.6Å; H380-E395 PolarHBondContact CE1-OE2 3.47Å; H380-E395 IonicContact NE2-OE2 3.55Å; H380-E395 PolarHBondContact NE2-OE2 2.58Å; H380-E395 VanDerWaalsContact NE2-OE2 3.11Å
381	V	95.3	Very high	93.6	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	109.7	179.8	-176.7	0	0	0	0	108.5	V347 I348 V350 L379 Q384 W390 A392	V347-V381 WeakPolarHBondContact CA-O 3.15Å; I348-V381 HydrophobicContact CB-CB 4.49Å; I348-V381 PolarHBondContact N-O 2.71Å; I348-V381 WeakPolarHBondContact O-CB 3.46Å; I348-V381 PolarHBondContact O-N 3.46Å; V350-V381 HydrophobicContact CG1-CG2 4.45Å; V350-V381 HydrophobicContact CG2-CG2 3.79Å; L379-V381 PolarHBondContact O-N 3.26Å; V381-Q384 HydrophobicContact CG1-CG 3.56Å; V381-W390 HydrophobicContact CG1-CB 4.03Å; V381-W390 HydrophobicContact CG1-CD2 4.26Å; V381-W390 HydrophobicContact CG1-CE3 4.07Å; V381-W390 HydrophobicContact CG1-CG 4.29Å; V381-W390 HydrophobicContact CG2-CE3 4.03Å; V381-A392 HydrophobicContact CG2-CB 4.19Å
382	I	92.6	Very high	93.6	Very high	33 Å²	33	41.9 Å²	41.9	17%	0.169	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-24.4	-176.1	59.9	-178.3	0	0	0	112.4	K285 V347 H380 Q391 Y393 A404	K285-I382 HydrophobicContact CB-CD1 3.27Å; K285-I382 HydrophobicContact CB-CG1 4.2Å; K285-I382 HydrophobicContact CG-CD1 3.81Å; K285-I382 HydrophobicContact CG-CG1 4.21Å; V347-I382 HydrophobicContact CG1-CG2 4.29Å; V347-I382 HydrophobicContact CG2-CG2 4.15Å; H380-I382 PolarHBondContact O-N 3.35Å; I382-Q391 HydrophobicContact CD1-CB 4.37Å; I382-Q391 HydrophobicContact CG1-CB 4.07Å; I382-Q391 VanDerWaalsContact CG1-O 3.31Å; I382-Q391 WeakPolarHBondContact CG1-O 3.36Å; I382-Q391 PolarHBondContact N-O 3.17Å; I382-Y393 HydrophobicContact CD1-CD2 4.02Å; I382-Y393 HydrophobicContact CD1-CE2 3.5Å; I382-Y393 HydrophobicContact CG2-CD2 4.08Å; I382-Y393 HydrophobicContact CG2-CE2 4.24Å; I382-A404 HydrophobicContact CD1-CB 3.33Å; I382-A404 HydrophobicContact CG1-CB 4.34Å
383	S	91.8	Very high	93.6	Very high	12 Å²	12	42.1 Å²	42.1	8%	0.084	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	133.1	176	-180	0	0	0	0	111.7	E385 W390 Q391	S383-E385 PolarHBondContact OG-N 2.85Å; S383-W390 WeakPolarHBondContact O-CA 3.44Å; S383-Q391 PolarHBondContact N-O 3.47Å; S383-Q391 PolarHBondContact O-N 3.09Å
384	Q	91.9	Very high	93.5	Very high	82 Å²	82	44.5 Å²	44.5	38%	0.383	22%	0.223	S	C	.	.			trans	-119.3	21.7	173.9	-60.3	-177.3	-41.6	0	0	111.2	V381 D386 W390	V381-Q384 HydrophobicContact CG1-CG 3.56Å; Q384-D386 VanDerWaalsContact C-N 3.27Å; Q384-D386 PolarHBondContact O-N 3.46Å; Q384-W390 HydrophobicContact CG-CD2 4.03Å; Q384-W390 HydrophobicContact CG-CG 4.05Å; Q384-W390 HydrophobicContact CG-CZ2 4.47Å; Q384-W390 VanDerWaalsContact NE2-CH2 3.31Å; Q384-W390 VanDerWaalsContact NE2-CZ2 3.33Å
385	E	88.7	Confident	93.4	Very high	125 Å²	125	42 Å²	42	58%	0.584	21%	0.211	S	C	*	.	S	Bend	trans	-55.7	-42.4	-179.9	-79.5	-176.4	-147.4	0	0	111.9	K339 S383	K339-E385 IonicContact NZ-OE2 3.23Å; K339-E385 PolarHBondContact NZ-OE2 2.97Å; K339-E385 VanDerWaalsContact NZ-OE2 3.08Å; S383-E385 PolarHBondContact OG-N 2.85Å
386	D	90	Very high	93.1	Very high	39 Å²	39	41.4 Å²	41.4	21%	0.209	23%	0.228	C	C	.	.	S	Bend	trans	-89.6	117.3	168.3	-179.6	-18.1	0	0	0	109.4	R282 Q384 N388 W389 W390	R282-D386 IonicContact CZ-OD2 3.63Å; R282-D386 IonicContact NH1-OD2 3.37Å; R282-D386 IonicContact NH2-OD2 2.67Å; R282-D386 PolarHBondContact NH2-OD2 3.15Å; Q384-D386 VanDerWaalsContact C-N 3.27Å; Q384-D386 PolarHBondContact O-N 3.46Å; D386-N388 PolarHBondContact O-N 3.45Å; D386-N388 WeakPolarHBondContact OD1-CA 3.28Å; D386-N388 WeakPolarHBondContact OD1-CB 3.25Å; D386-N388 PolarHBondContact OD1-N 3Å; D386-W389 WeakPolarHBondContact CB-O 3.45Å; D386-W389 CarbonylContact O-C 3.51Å; D386-W389 PolarHBondContact O-N 3.33Å; D386-W389 PolarHBondContact OD1-N 3.19Å; D386-W390 VanDerWaalsContact O-CD1 3.23Å
387	P	90.3	Very high	92.8	Very high	75 Å²	75	41.1 Å²	41.1	49%	0.487	22%	0.219	S	C	.	.	S	Bend	trans	-66.4	-19.4	-178.6	27.6	-35.5	0	0	0	114
388	N	93.6	Very high	91.3	Very high	69 Å²	69	45.8 Å²	45.8	37%	0.369	24%	0.239	S	C	.	.	S	Bend	trans	-96.5	-28	-177.9	-64.6	-2.5	0	0	0	112.8	D386 G409 F412	D386-N388 PolarHBondContact O-N 3.45Å; D386-N388 WeakPolarHBondContact OD1-CA 3.28Å; D386-N388 WeakPolarHBondContact OD1-CB 3.25Å; D386-N388 PolarHBondContact OD1-N 3Å; N388-G409 PolarHBondContact O-N 2.87Å; N388-F412 HydrophobicContact CB-CB 4.24Å; N388-F412 HydrophobicContact CB-CD1 4.49Å; N388-F412 HydrophobicContact CB-CD2 4.44Å; N388-F412 HydrophobicContact CB-CG 4.16Å
389	W	95.8	Very high	89.6	Confident	14 Å²	14	52.8 Å²	52.8	5%	0.053	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	98.9	-176.1	-67.1	104.3	0	0	0	110.9	Y356 D361 Y363 V364 P365 D386 L406 V407 P408 F412	Y356-W389 WeakPolarHBondContact OH-CH2 3.5Å; Y356-W389 VanDerWaalsContact OH-CZ3 3.27Å; Y356-W389 WeakPolarHBondContact OH-CZ3 3.31Å; D361-W389 WeakPolarHBondContact OD2-CH2 3.39Å; Y363-W389 VanDerWaalsContact O-CZ2 3.24Å; Y363-W389 WeakPolarHBondContact O-CZ2 3.31Å; V364-W389 HydrophobicContact CB-CH2 3.89Å; V364-W389 HydrophobicContact CB-CZ2 4.35Å; V364-W389 HydrophobicContact CB-CZ3 4.35Å; V364-W389 HydrophobicContact CG2-CH2 4.11Å; V364-W389 HydrophobicContact CG2-CZ3 4.06Å; P365-W389 VanDerWaalsContact CG-CD1 3.45Å; P365-W389 HydrophobicContact CG-CD2 4.13Å; P365-W389 HydrophobicContact CG-CG 3.82Å; D386-W389 WeakPolarHBondContact CB-O 3.45Å; D386-W389 CarbonylContact O-C 3.51Å; D386-W389 PolarHBondContact O-N 3.33Å; D386-W389 PolarHBondContact OD1-N 3.19Å; W389-L406 HydrophobicContact CB-CD2 4.48Å; W389-L406 HydrophobicContact CE3-CB 4.21Å; W389-V407 CarbonylContact C-O 3.6Å; W389-V407 WeakPolarHBondContact CA-O 3.36Å; W389-P408 HydrophobicContact CH2-CG 4.42Å; W389-P408 HydrophobicContact CZ3-CG 4.04Å; W389-F412 HydrophobicContact CH2-CE1 4.44Å; W389-F412 AromaticContact CZ2-CE1 3.8Å; W389-F412 HydrophobicContact CZ2-CE1 3.8Å
390	W	95.9	Very high	88.1	Confident	25 Å²	25	59 Å²	59	10%	0.095	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	149.4	178	-61.9	-13.6	0	0	0	110.7	V381 S383 Q384 D386 L406 V407 K410 Y466	V381-W390 HydrophobicContact CG1-CB 4.03Å; V381-W390 HydrophobicContact CG1-CD2 4.26Å; V381-W390 HydrophobicContact CG1-CE3 4.07Å; V381-W390 HydrophobicContact CG1-CG 4.29Å; V381-W390 HydrophobicContact CG2-CE3 4.03Å; S383-W390 WeakPolarHBondContact O-CA 3.44Å; Q384-W390 HydrophobicContact CG-CD2 4.03Å; Q384-W390 HydrophobicContact CG-CG 4.05Å; Q384-W390 HydrophobicContact CG-CZ2 4.47Å; Q384-W390 VanDerWaalsContact NE2-CH2 3.31Å; Q384-W390 VanDerWaalsContact NE2-CZ2 3.33Å; D386-W390 VanDerWaalsContact O-CD1 3.23Å; W390-L406 WeakPolarHBondContact O-CA 3.04Å; W390-V407 HydrophobicContact CB-CG2 3.86Å; W390-V407 PolarHBondContact N-O 3.03Å; W390-V407 PolarHBondContact O-N 3.46Å; W390-K410 HydrophobicContact CH2-CB 3.36Å; W390-K410 HydrophobicContact CZ2-CB 3.74Å; W390-K410 VanDerWaalsContact CZ2-N 3.29Å; W390-K410 HydrophobicContact CZ3-CB 4.22Å; W390-Y466 AromaticContact CZ3-CD2 3.99Å; W390-Y466 HydrophobicContact CZ3-CD2 3.99Å; W390-Y466 HydrophobicContact CZ3-CE2 4.28Å
391	Q	95.1	Very high	87	Confident	6 Å²	6	60.8 Å²	60.8	3%	0.028	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	128.7	169.2	-57.2	-170.7	37.7	0	0	108.7	I283 I382 S383 A404 G405 L406	I283-Q391 PolarHBondContact O-NE2 3.5Å; I382-Q391 HydrophobicContact CD1-CB 4.37Å; I382-Q391 HydrophobicContact CG1-CB 4.07Å; I382-Q391 VanDerWaalsContact CG1-O 3.31Å; I382-Q391 WeakPolarHBondContact CG1-O 3.36Å; I382-Q391 PolarHBondContact N-O 3.17Å; S383-Q391 PolarHBondContact N-O 3.47Å; S383-Q391 PolarHBondContact O-N 3.09Å; Q391-A404 HydrophobicContact CB-CB 4.03Å; Q391-G405 WeakPolarHBondContact CA-O 3.43Å; Q391-L406 HydrophobicContact CG-CD2 4.11Å
392	A	95.6	Very high	86.2	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	160.7	-178.2	0	0	0	0	0	112.5	L371 L379 H380 V381 G405 V407	L371-A392 HydrophobicContact CD2-CB 4.42Å; L371-A392 WeakPolarHBondContact CD2-O 3.5Å; L379-A392 HydrophobicContact CB-CB 4.44Å; H380-A392 CarbonylContact O-C 3.53Å; H380-A392 WeakPolarHBondContact O-CA 3.31Å; H380-A392 WeakPolarHBondContact O-CB 3.44Å; V381-A392 HydrophobicContact CG2-CB 4.19Å; A392-G405 PolarHBondContact N-O 2.93Å; A392-G405 PolarHBondContact O-N 2.71Å; A392-V407 HydrophobicContact CB-CG1 4.48Å; A392-V407 HydrophobicContact CB-CG2 4.05Å
393	Y	94.1	Very high	86.1	Confident	58 Å²	58	64.2 Å²	64.2	23%	0.227	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	150	162.1	-62.9	-80.1	0	0	0	109.6	K285 L379 H380 I382 Q401 P402 L403 A404	K285-Y393 PolarHBondContact O-OH 2.76Å; L379-Y393 CarbonylContact C-O 3.59Å; L379-Y393 WeakPolarHBondContact CA-O 3.33Å; H380-Y393 PolarHBondContact N-O 2.9Å; H380-Y393 PolarHBondContact O-N 3.43Å; I382-Y393 HydrophobicContact CD1-CD2 4.02Å; I382-Y393 HydrophobicContact CD1-CE2 3.5Å; I382-Y393 HydrophobicContact CG2-CD2 4.08Å; I382-Y393 HydrophobicContact CG2-CE2 4.24Å; Y393-Q401 WeakPolarHBondContact CE1-O 3.32Å; Y393-P402 PolarHBondContact OH-O 2.85Å; Y393-L403 VanDerWaalsContact CE1-C 3.49Å; Y393-L403 WeakPolarHBondContact CE1-O 3.46Å; Y393-A404 HydrophobicContact CE1-CB 4.18Å; Y393-A404 HydrophobicContact CE2-CB 4.02Å; Y393-A404 PolarHBondContact OH-N 2.64Å
394	R	94.8	Very high	86.2	Confident	56 Å²	56	63.7 Å²	63.7	21%	0.211	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	132.1	169.7	-172.9	176.2	68.8	-161.4	7.3	108.8	L371 S372 D377 L379 G396 D397	L371-R394 HydrophobicContact CD1-CB 4.22Å; L371-R394 HydrophobicContact CD2-CB 4.23Å; S372-R394 PolarHBondContact O-NH1 2.86Å; D377-R394 HydrophobicContact CB-CG 4.5Å; L379-R394 HydrophobicContact CD2-CB 4.08Å; L379-R394 HydrophobicContact CD2-CG 4.08Å; R394-G396 PolarHBondContact O-N 3.46Å; R394-D397 HydrophobicContact CB-CB 4.4Å; R394-D397 IonicContact CZ-OD1 3.69Å; R394-D397 IonicContact CZ-OD2 3.91Å; R394-D397 IonicContact NE-OD1 3.41Å; R394-D397 IonicContact NE-OD2 3.85Å; R394-D397 PolarHBondContact NE-OD2 3.36Å; R394-D397 IonicContact NH2-OD1 2.67Å; R394-D397 PolarHBondContact NH2-OD1 3.1Å; R394-D397 IonicContact NH2-OD2 3.69Å; R394-D397 PolarHBondContact NH2-OD2 3.18Å; R394-D397 PolarHBondContact O-N 2.99Å
395	E	91.2	Very high	86.3	Confident	84 Å²	84	60 Å²	60	39%	0.393	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	131.3	173.4	-178.5	97.7	-143	0	0	109.8	I378 H380 W668	I378-E395 HydrophobicContact CB-CB 3.91Å; I378-E395 HydrophobicContact CG2-CB 4.34Å; I378-E395 WeakPolarHBondContact O-CB 3.1Å; I378-E395 PolarHBondContact O-N 3.41Å; H380-E395 IonicContact CE1-OE2 3.6Å; H380-E395 PolarHBondContact CE1-OE2 3.47Å; H380-E395 IonicContact NE2-OE2 3.55Å; H380-E395 PolarHBondContact NE2-OE2 2.58Å; H380-E395 VanDerWaalsContact NE2-OE2 3.11Å; E395-W668 VanDerWaalsContact OE2-CZ2 3.31Å; E395-W668 WeakPolarHBondContact OE2-CZ2 3.07Å
396	G	86.1	Confident	86.7	Confident	68 Å²	68	54.2 Å²	54.2	70%	0.701	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	-2.3	-178.5	0	0	0	0	0	115.7	R394	R394-G396 PolarHBondContact O-N 3.46Å
397	D	83.6	Confident	87	Confident	26 Å²	26	52.3 Å²	52.3	14%	0.139	29%	0.285	C	S	.	.			trans	-103.1	12.4	175.7	-93.4	17.7	0	0	0	113.5	R394 D399 N400 Q401	R394-D397 HydrophobicContact CB-CB 4.4Å; R394-D397 IonicContact CZ-OD1 3.69Å; R394-D397 IonicContact CZ-OD2 3.91Å; R394-D397 IonicContact NE-OD1 3.41Å; R394-D397 IonicContact NE-OD2 3.85Å; R394-D397 PolarHBondContact NE-OD2 3.36Å; R394-D397 IonicContact NH2-OD1 2.67Å; R394-D397 PolarHBondContact NH2-OD1 3.1Å; R394-D397 IonicContact NH2-OD2 3.69Å; R394-D397 PolarHBondContact NH2-OD2 3.18Å; R394-D397 PolarHBondContact O-N 2.99Å; D397-D399 VanDerWaalsContact C-N 3.26Å; D397-D399 PolarHBondContact O-N 3.49Å; D397-D399 VanDerWaalsContact O-N 3.13Å; D397-N400 PolarHBondContact O-N 2.86Å; D397-N400 VanDerWaalsContact O-N 3.07Å; D397-Q401 PolarHBondContact O-N 2.69Å; D397-Q401 PolarHBondContact OD2-NE2 3.45Å
398	E	64.4	Low	87.3	Confident	147 Å²	147	48.8 Å²	48.8	69%	0.687	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-36.7	-170.1	-61.7	-172.1	166.5	0	0	113.9
399	D	60.4	Low	87.4	Confident	164 Å²	164	45.5 Å²	45.5	88%	0.877	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-16.3	-176.1	-61.9	-36.9	0	0	0	113.9	D397	D397-D399 VanDerWaalsContact C-N 3.26Å; D397-D399 PolarHBondContact O-N 3.49Å; D397-D399 VanDerWaalsContact O-N 3.13Å
400	N	63.4	Low	87.2	Confident	132 Å²	132	48.8 Å²	48.8	71%	0.706	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-14.3	-170.2	-70.9	-35.1	0	0	0	114.1	D397	D397-N400 PolarHBondContact O-N 2.86Å; D397-N400 VanDerWaalsContact O-N 3.07Å
401	Q	72.2	Confident	86.9	Confident	60 Å²	60	50.7 Å²	50.7	28%	0.28	28%	0.277	S	S	.	.			trans	-134.7	92.4	-170.7	-73.6	174.8	11.8	0	0	112.2	Y393 D397 L403	Y393-Q401 WeakPolarHBondContact CE1-O 3.32Å; D397-Q401 PolarHBondContact O-N 2.69Å; D397-Q401 PolarHBondContact OD2-NE2 3.45Å; Q401-L403 PolarHBondContact O-N 3.02Å
402	P	79.9	Confident	86.7	Confident	83 Å²	83	51.9 Å²	51.9	54%	0.539	28%	0.282	S	S	.	.	S	Bend	trans	-68.9	-22.2	174.2	27.9	-34.1	0	0	0	112.7	Y393	Y393-P402 PolarHBondContact OH-O 2.85Å
403	L	90.3	Very high	86.5	Confident	23 Å²	23	52.1 Å²	52.1	12%	0.12	28%	0.283	C	S	.	.	S	Bend	trans	-103.9	141	179.3	-62	179.5	0	0	0	110.1	P266 V284 Y393 Q401	P266-L403 HydrophobicContact CB-CD1 3.9Å; P266-L403 HydrophobicContact CG-CD1 4.1Å; V284-L403 HydrophobicContact CG1-CB 4.05Å; V284-L403 HydrophobicContact CG1-CD2 4.42Å; Y393-L403 VanDerWaalsContact CE1-C 3.49Å; Y393-L403 WeakPolarHBondContact CE1-O 3.46Å; Q401-L403 PolarHBondContact O-N 3.02Å
404	A	93.3	Very high	86.2	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.008	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-67.3	141.5	170.7	0	0	0	0	0	111	V284 K285 I382 Q391 Y393	V284-A404 VanDerWaalsContact CG1-O 3.23Å; V284-A404 WeakPolarHBondContact CG1-O 3.39Å; K285-A404 HydrophobicContact CB-CB 4.15Å; K285-A404 PolarHBondContact O-N 3.01Å; K285-A404 VanDerWaalsContact O-N 3.08Å; I382-A404 HydrophobicContact CD1-CB 3.33Å; I382-A404 HydrophobicContact CG1-CB 4.34Å; Q391-A404 HydrophobicContact CB-CB 4.03Å; Y393-A404 HydrophobicContact CE1-CB 4.18Å; Y393-A404 HydrophobicContact CE2-CB 4.02Å; Y393-A404 PolarHBondContact OH-N 2.64Å
405	G	94.8	Very high	85.8	Confident	6 Å²	6	53.9 Å²	53.9	6%	0.062	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	164.6	175.8	0	0	0	0	0	112.8	L369 Q391 A392	L369-G405 CarbonylContact O-C 3.45Å; L369-G405 WeakPolarHBondContact O-CA 3.07Å; Q391-G405 WeakPolarHBondContact CA-O 3.43Å; A392-G405 PolarHBondContact N-O 2.93Å; A392-G405 PolarHBondContact O-N 2.71Å
406	L	96.3	Very high	85.6	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	127.9	-178.9	-62.7	179.4	0	0	0	110.6	L369 L371 W389 W390 Q391	L369-L406 HydrophobicContact CB-CD1 4.04Å; L369-L406 HydrophobicContact CB-CG 3.98Å; L369-L406 HydrophobicContact CD1-CD1 4.47Å; L369-L406 PolarHBondContact O-N 3.27Å; L371-L406 PolarHBondContact N-O 2.82Å; W389-L406 HydrophobicContact CB-CD2 4.48Å; W389-L406 HydrophobicContact CE3-CB 4.21Å; W390-L406 WeakPolarHBondContact O-CA 3.04Å; Q391-L406 HydrophobicContact CG-CD2 4.11Å
407	V	97	Very high	85.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	149.3	172.9	-59.8	0	0	0	0	110.7	L371 F373 L379 W389 W390 A392 G409	L371-V407 HydrophobicContact CB-CG1 3.79Å; L371-V407 HydrophobicContact CD2-CG1 3.87Å; L371-V407 HydrophobicContact CG-CG1 4.14Å; F373-V407 HydrophobicContact CD1-CG1 3.96Å; F373-V407 HydrophobicContact CE1-CB 3.95Å; F373-V407 HydrophobicContact CE1-CG1 3.73Å; L379-V407 HydrophobicContact CD1-CG1 4.29Å; W389-V407 CarbonylContact C-O 3.6Å; W389-V407 WeakPolarHBondContact CA-O 3.36Å; W390-V407 HydrophobicContact CB-CG2 3.86Å; W390-V407 PolarHBondContact N-O 3.03Å; W390-V407 PolarHBondContact O-N 3.46Å; A392-V407 HydrophobicContact CB-CG1 4.48Å; A392-V407 HydrophobicContact CB-CG2 4.05Å; V407-G409 PolarHBondContact O-N 3.34Å
408	P	96.6	Very high	85.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	131.2	177.8	-23.9	34.3	0	0	0	111.4	Y356 W389 F412 Q413 Y466	Y356-P408 HydrophobicContact CD1-CG 4.28Å; Y356-P408 HydrophobicContact CD2-CG 3.73Å; Y356-P408 HydrophobicContact CE1-CG 4.11Å; Y356-P408 HydrophobicContact CE2-CG 3.54Å; Y356-P408 HydrophobicContact CG-CG 4.11Å; W389-P408 HydrophobicContact CH2-CG 4.42Å; W389-P408 HydrophobicContact CZ3-CG 4.04Å; P408-F412 HydrophobicContact CB-CD1 4.28Å; P408-Q413 HydrophobicContact CB-CB 4.43Å; P408-Y466 VanDerWaalsContact O-CE2 3.24Å; P408-Y466 WeakPolarHBondContact O-CE2 3.16Å; P408-Y466 PolarHBondContact O-OH 3.39Å
409	G	94.3	Very high	86.4	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.264	C	S	.	.			trans	-66.6	150.9	174.1	0	0	0	0	0	111.8	N388 V407 S411 F412 Q413	N388-G409 PolarHBondContact O-N 2.87Å; V407-G409 PolarHBondContact O-N 3.34Å; G409-S411 PolarHBondContact O-N 2.8Å; G409-F412 WeakPolarHBondContact O-CB 3.18Å; G409-F412 PolarHBondContact O-N 2.95Å; G409-F412 VanDerWaalsContact O-N 3.07Å; G409-Q413 PolarHBondContact O-N 3.03Å
410	K	92.1	Very high	87.4	Confident	84 Å²	84	47.6 Å²	47.6	37%	0.365	24%	0.244	S	C	.	.	H	α-helix	trans	-54.1	-49.3	-174.1	179.2	170.7	-175.5	165.9	0	113.8	W390 F412 Q413 Q414 Y466	W390-K410 HydrophobicContact CH2-CB 3.36Å; W390-K410 HydrophobicContact CZ2-CB 3.74Å; W390-K410 VanDerWaalsContact CZ2-N 3.29Å; W390-K410 HydrophobicContact CZ3-CB 4.22Å; K410-F412 VanDerWaalsContact C-N 3.31Å; K410-F412 PolarHBondContact O-N 2.79Å; K410-Q413 PolarHBondContact O-N 2.81Å; K410-Q414 VanDerWaalsContact O-CG 3.29Å; K410-Q414 WeakPolarHBondContact O-CG 3.3Å; K410-Q414 PolarHBondContact O-N 2.93Å; K410-Y466 HydrophobicContact CB-CD2 4.22Å; K410-Y466 PolarHBondContact NZ-O 3.26Å
411	S	88.8	Confident	88	Confident	65 Å²	65	44.9 Å²	44.9	46%	0.455	23%	0.227	S	C	.	.	H	α-helix	trans	-64.7	-37	178.9	46.8	0	0	0	0	112.2	G409 Q414 Q415	G409-S411 PolarHBondContact O-N 2.8Å; S411-Q414 PolarHBondContact O-N 3.15Å; S411-Q415 PolarHBondContact O-N 2.92Å
412	F	90.9	Very high	88	Confident	30 Å²	30	45.7 Å²	45.7	13%	0.132	24%	0.236	C	C	.	.	H	α-helix	trans	-67.1	-43.7	177.7	-176.4	-120.3	0	0	0	111.3	N388 W389 P408 G409 K410 Q414 Q415 R416	N388-F412 HydrophobicContact CB-CB 4.24Å; N388-F412 HydrophobicContact CB-CD1 4.49Å; N388-F412 HydrophobicContact CB-CD2 4.44Å; N388-F412 HydrophobicContact CB-CG 4.16Å; W389-F412 HydrophobicContact CH2-CE1 4.44Å; W389-F412 AromaticContact CZ2-CE1 3.8Å; W389-F412 HydrophobicContact CZ2-CE1 3.8Å; P408-F412 HydrophobicContact CB-CD1 4.28Å; G409-F412 WeakPolarHBondContact O-CB 3.18Å; G409-F412 PolarHBondContact O-N 2.95Å; G409-F412 VanDerWaalsContact O-N 3.07Å; K410-F412 VanDerWaalsContact C-N 3.31Å; K410-F412 PolarHBondContact O-N 2.79Å; F412-Q414 PolarHBondContact O-N 3.43Å; F412-Q415 WeakPolarHBondContact O-CB 3.27Å; F412-Q415 PolarHBondContact O-N 2.88Å; F412-R416 WeakPolarHBondContact O-CG 3.49Å; F412-R416 PolarHBondContact O-N 3.47Å
413	Q	91.8	Very high	87.7	Confident	6 Å²	6	46.2 Å²	46.2	3%	0.028	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-41.9	174.5	-176.7	60.8	16.6	0	0	112.2	F354 P408 G409 K410 Q415 R416 E417 T465	F354-Q413 HydrophobicContact CD1-CG 4.31Å; F354-Q413 HydrophobicContact CD2-CG 4.44Å; F354-Q413 HydrophobicContact CE1-CG 3.8Å; F354-Q413 VanDerWaalsContact CE2-CD 3.45Å; F354-Q413 HydrophobicContact CE2-CG 3.93Å; F354-Q413 HydrophobicContact CZ-CB 4.31Å; F354-Q413 HydrophobicContact CZ-CG 3.57Å; P408-Q413 HydrophobicContact CB-CB 4.43Å; G409-Q413 PolarHBondContact O-N 3.03Å; K410-Q413 PolarHBondContact O-N 2.81Å; Q413-Q415 VanDerWaalsContact C-N 3.27Å; Q413-Q415 PolarHBondContact O-N 2.93Å; Q413-R416 PolarHBondContact O-N 2.88Å; Q413-R416 VanDerWaalsContact O-N 3.16Å; Q413-E417 PolarHBondContact NE2-OE1 2.96Å; Q413-E417 PolarHBondContact O-N 3.34Å; Q413-T465 HydrophobicContact CB-CG2 3.97Å; Q413-T465 HydrophobicContact CG-CG2 3.63Å
414	Q	88.8	Confident	86.3	Confident	42 Å²	42	50.3 Å²	50.3	20%	0.196	25%	0.252	C	S	.	.	H	α-helix	trans	-57.7	-41.8	174.8	-74.8	174.5	-18	0	0	111.9	K410 S411 F412 A418 I463 T465	K410-Q414 VanDerWaalsContact O-CG 3.29Å; K410-Q414 WeakPolarHBondContact O-CG 3.3Å; K410-Q414 PolarHBondContact O-N 2.93Å; S411-Q414 PolarHBondContact O-N 3.15Å; F412-Q414 PolarHBondContact O-N 3.43Å; Q414-A418 WeakPolarHBondContact O-CB 3.31Å; Q414-A418 PolarHBondContact O-N 3.24Å; Q414-I463 HydrophobicContact CG-CG2 4.45Å; Q414-T465 HydrophobicContact CG-CG2 3.74Å
415	Q	86.6	Confident	84.6	Confident	108 Å²	108	57.2 Å²	57.2	51%	0.505	28%	0.284	S	S	.	.	H	α-helix	trans	-65.3	-40.2	177.2	-175.7	177.9	-31.5	0	0	112.2	S411 F412 Q413 M419	S411-Q415 PolarHBondContact O-N 2.92Å; F412-Q415 WeakPolarHBondContact O-CB 3.27Å; F412-Q415 PolarHBondContact O-N 2.88Å; Q413-Q415 VanDerWaalsContact C-N 3.27Å; Q413-Q415 PolarHBondContact O-N 2.93Å; Q415-M419 HydrophobicContact CG-CE 3.79Å; Q415-M419 HydrophobicContact CG-SD 4.36Å; Q415-M419 VanDerWaalsContact NE2-CE 3.31Å; Q415-M419 VanDerWaalsContact O-CG 3.3Å; Q415-M419 WeakPolarHBondContact O-CG 3.36Å; Q415-M419 PolarHBondContact O-N 3.1Å
416	R	86.9	Confident	82.7	Confident	69 Å²	69	63.4 Å²	63.4	26%	0.26	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-47.8	177.3	-70.5	170.7	71.3	160.3	9.5	111.8	D361 F412 Q413 M419 K420	D361-R416 IonicContact OD1-NH2 2.64Å; D361-R416 IonicContact OD2-CZ 3.83Å; D361-R416 VanDerWaalsContact OD2-CZ 3.23Å; D361-R416 IonicContact OD2-NH1 3.79Å; D361-R416 PolarHBondContact OD2-NH1 3.09Å; D361-R416 IonicContact OD2-NH2 3.01Å; D361-R416 PolarHBondContact OD2-NH2 2.88Å; F412-R416 WeakPolarHBondContact O-CG 3.49Å; F412-R416 PolarHBondContact O-N 3.47Å; Q413-R416 PolarHBondContact O-N 2.88Å; Q413-R416 VanDerWaalsContact O-N 3.16Å; R416-M419 PolarHBondContact O-N 2.98Å; R416-K420 PolarHBondContact O-N 3.18Å
417	E	85.1	Confident	80.6	Confident	51 Å²	51	70.9 Å²	70.9	24%	0.238	35%	0.348	C	S	.	.	H	α-helix	trans	-65.5	-43.3	178.7	-71.8	-56.9	141	0	0	111.9	Q413 M419 K420 Q421 I463	Q413-E417 PolarHBondContact NE2-OE1 2.96Å; Q413-E417 PolarHBondContact O-N 3.34Å; E417-M419 VanDerWaalsContact C-N 3.3Å; E417-M419 PolarHBondContact O-N 2.92Å; E417-K420 WeakPolarHBondContact O-CB 3.27Å; E417-K420 PolarHBondContact O-N 3.36Å; E417-K420 VanDerWaalsContact O-N 3.15Å; E417-Q421 WeakPolarHBondContact O-CG 3.32Å; E417-Q421 PolarHBondContact O-N 3.09Å; E417-I463 HydrophobicContact CB-CG2 3.54Å; E417-I463 HydrophobicContact CG-CG2 3.89Å
418	A	83.6	Confident	77.7	Confident	32 Å²	32	77.7 Å²	77.7	26%	0.264	38%	0.38	S	S	.	.	H	α-helix	trans	-60	-40.4	175.8	0	0	0	0	0	112.1	Q414 T422 I463	Q414-A418 WeakPolarHBondContact O-CB 3.31Å; Q414-A418 PolarHBondContact O-N 3.24Å; A418-T422 WeakPolarHBondContact O-CG2 3.43Å; A418-T422 PolarHBondContact O-N 3.13Å; A418-I463 HydrophobicContact CB-CD1 4.13Å
419	M	81.7	Confident	75.1	Confident	100 Å²	100	82.5 Å²	82.5	49%	0.493	41%	0.411	S	S	.	.	H	α-helix	trans	-65.7	-42.2	175	-73.5	179.3	178.6	0	0	112	Q415 R416 E417 Q421 T422 I423	Q415-M419 HydrophobicContact CG-CE 3.79Å; Q415-M419 HydrophobicContact CG-SD 4.36Å; Q415-M419 VanDerWaalsContact NE2-CE 3.31Å; Q415-M419 VanDerWaalsContact O-CG 3.3Å; Q415-M419 WeakPolarHBondContact O-CG 3.36Å; Q415-M419 PolarHBondContact O-N 3.1Å; R416-M419 PolarHBondContact O-N 2.98Å; E417-M419 VanDerWaalsContact C-N 3.3Å; E417-M419 PolarHBondContact O-N 2.92Å; M419-Q421 PolarHBondContact O-N 2.99Å; M419-T422 PolarHBondContact O-N 3.24Å; M419-T422 PolarHBondContact O-OG1 3.28Å; M419-I423 WeakPolarHBondContact O-CG1 3.48Å; M419-I423 PolarHBondContact O-N 3.13Å; M419-I423 VanDerWaalsContact O-N 3.15Å
420	K	81.6	Confident	72.6	Confident	106 Å²	106	91.6 Å²	91.6	46%	0.461	45%	0.454	S	S	.	.	H	α-helix	trans	-59.9	-46.3	177.8	-174.4	-178.8	173.1	-171	0	111.7	R416 E417 T422 I423 E424	R416-K420 PolarHBondContact O-N 3.18Å; E417-K420 WeakPolarHBondContact O-CB 3.27Å; E417-K420 PolarHBondContact O-N 3.36Å; E417-K420 VanDerWaalsContact O-N 3.15Å; K420-T422 PolarHBondContact O-N 3.19Å; K420-I423 PolarHBondContact O-N 3.06Å; K420-I423 VanDerWaalsContact O-N 3.14Å; K420-E424 WeakPolarHBondContact CE-OE1 3.46Å; K420-E424 PolarHBondContact O-N 2.86Å
421	Q	74.9	Confident	70.1	Confident	74 Å²	74	97.1 Å²	97.1	35%	0.346	48%	0.478	S	S	.	.	H	α-helix	trans	-58.7	-44.5	176.6	-71	178	-6.2	0	0	111.8	E417 M419 I423 E424 E425	E417-Q421 WeakPolarHBondContact O-CG 3.32Å; E417-Q421 PolarHBondContact O-N 3.09Å; M419-Q421 PolarHBondContact O-N 2.99Å; Q421-I423 VanDerWaalsContact C-N 3.27Å; Q421-I423 PolarHBondContact O-N 3.13Å; Q421-E424 PolarHBondContact O-N 3.39Å; Q421-E425 WeakPolarHBondContact O-CG 3.45Å; Q421-E425 PolarHBondContact O-N 2.88Å
422	T	73	Confident	67.6	Low	78 Å²	78	99.9 Å²	99.9	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-64.1	-30.2	177.7	59.3	0	0	0	0	113.8	A418 M419 K420 D426	A418-T422 WeakPolarHBondContact O-CG2 3.43Å; A418-T422 PolarHBondContact O-N 3.13Å; M419-T422 PolarHBondContact O-N 3.24Å; M419-T422 PolarHBondContact O-OG1 3.28Å; K420-T422 PolarHBondContact O-N 3.19Å; T422-D426 PolarHBondContact O-N 2.92Å
423	I	73.4	Confident	65	Low	93 Å²	93	101.7 Å²	101.7	48%	0.477	52%	0.524	S	S	.	.	H	α-helix	trans	-79.1	-36.2	178.4	-66.1	165.3	0	0	0	111	M419 K420 Q421 D426 K427	M419-I423 WeakPolarHBondContact O-CG1 3.48Å; M419-I423 PolarHBondContact O-N 3.13Å; M419-I423 VanDerWaalsContact O-N 3.15Å; K420-I423 PolarHBondContact O-N 3.06Å; K420-I423 VanDerWaalsContact O-N 3.14Å; Q421-I423 VanDerWaalsContact C-N 3.27Å; Q421-I423 PolarHBondContact O-N 3.13Å; I423-D426 PolarHBondContact O-N 3.2Å; I423-K427 WeakPolarHBondContact O-CG 3.39Å; I423-K427 PolarHBondContact O-N 3.46Å
424	E	60.9	Low	62.3	Low	109 Å²	109	111.7 Å²	111.7	51%	0.509	57%	0.567	S	S	.	*	H	α-helix	trans	-69.5	-38.6	175.8	-74.3	177.8	-178.4	0	0	111.7	K420 Q421 D426 K427 E428	K420-E424 WeakPolarHBondContact CE-OE1 3.46Å; K420-E424 PolarHBondContact O-N 2.86Å; Q421-E424 PolarHBondContact O-N 3.39Å; E424-D426 VanDerWaalsContact C-N 3.29Å; E424-D426 PolarHBondContact O-N 2.8Å; E424-K427 PolarHBondContact O-N 3.01Å; E424-E428 PolarHBondContact O-N 3.18Å
425	E	57.4	Low	59.8	Low	146 Å²	146	116.9 Å²	116.9	68%	0.682	60%	0.596	S	S	*	*	H	α-helix	trans	-61.1	-36.1	172.3	-74.6	-177.5	172.4	0	0	112.7	Q421 K427	Q421-E425 WeakPolarHBondContact O-CG 3.45Å; Q421-E425 PolarHBondContact O-N 2.88Å; E425-K427 PolarHBondContact O-N 3.25Å
426	D	55.2	Low	57.2	Low	137 Å²	137	123.3 Å²	123.3	73%	0.733	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-12.5	175.6	-86.5	-14.3	0	0	0	112.9	T422 I423 E424	T422-D426 PolarHBondContact O-N 2.92Å; I423-D426 PolarHBondContact O-N 3.2Å; E424-D426 VanDerWaalsContact C-N 3.29Å; E424-D426 PolarHBondContact O-N 2.8Å
427	K	51.2	Low	54.8	Low	158 Å²	158	126.1 Å²	126.1	69%	0.687	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-6.7	179.6	-77.8	179.7	-177.9	176.6	0	114.5	I423 E424 E425 P429	I423-K427 WeakPolarHBondContact O-CG 3.39Å; I423-K427 PolarHBondContact O-N 3.46Å; E424-K427 PolarHBondContact O-N 3.01Å; E425-K427 PolarHBondContact O-N 3.25Å; K427-P429 WeakPolarHBondContact O-CD 3.39Å; K427-P429 VanDerWaalsContact O-N 3.16Å
428	E	37.3	Very low	52.2	Low	144 Å²	144	128.3 Å²	128.3	67%	0.673	67%	0.672	S	S	*	*	S	Bend	trans	-63.8	112.1	171.5	-89.2	-73.5	126.6	0	0	109.6	E424 E430	E424-E428 PolarHBondContact O-N 3.18Å; E428-E430 PolarHBondContact O-N 3.05Å
429	P	42.3	Very low	50.4	Low	101 Å²	101	136.8 Å²	136.8	66%	0.656	70%	0.702	S	S	*	*			trans	-71.8	127.9	179.7	28.9	-30.2	0	0	0	109.2	K427 K431	K427-P429 WeakPolarHBondContact O-CD 3.39Å; K427-P429 VanDerWaalsContact O-N 3.16Å; P429-K431 PolarHBondContact O-N 2.71Å
430	E	41.7	Very low	48.1	Very low	191 Å²	191	141.2 Å²	141.2	89%	0.893	72%	0.719	S	S	*	*			trans	-44.8	108.1	167.1	-76.3	-167.8	152.2	0	0	109.5	E428 S432	E428-E430 PolarHBondContact O-N 3.05Å; E430-S432 PolarHBondContact O-N 3.03Å
431	K	38.4	Very low	45.8	Very low	200 Å²	200	143.1 Å²	143.1	87%	0.87	73%	0.734	S	S	*	*			trans	-58.9	112.4	172	-74.2	-179.5	-179.1	170	0	108	P429 G433	P429-K431 PolarHBondContact O-N 2.71Å; K431-G433 PolarHBondContact O-N 2.99Å
432	S	36.6	Very low	44	Very low	123 Å²	123	149.8 Å²	149.8	86%	0.86	76%	0.762	S	S	*	*			trans	-67.1	127	177.3	56.8	0	0	0	0	110.9	E430	E430-S432 PolarHBondContact O-N 3.03Å
433	G	36.5	Very low	42.2	Very low	68 Å²	68	155.7 Å²	155.7	70%	0.701	78%	0.781	S	S	*	*			trans	114.4	84.2	155	0	0	0	0	0	117.4	K431	K431-G433 PolarHBondContact O-N 2.99Å
434	K	35.4	Very low	40.3	Very low	215 Å²	215	160.7 Å²	160.7	94%	0.935	80%	0.799	S	S	*	*				172.5	134.6	103.5	-92.4	169.1	-177.5	174.3	0	111.5
435	L	37.2	Very low	39.4	Very low	151 Å²	151	166.7 Å²	166.7	79%	0.791	82%	0.817	S	S	*	*			trans	-54.2	137	177.6	-162.8	74.7	0	0	0	112.7
436	W	31.4	Very low	38.4	Very low	243 Å²	243	168.9 Å²	168.9	92%	0.92	83%	0.825	S	S	*	*				-174.9	147	121.1	-97.2	34.9	0	0	0	111.6
437	C	36.3	Very low	37.6	Very low	128 Å²	128	172.1 Å²	172.1	87%	0.865	83%	0.832	S	S	*	*			trans	-67.1	134.9	-162.3	-56.2	0	0	0	0	115.6
438	A	31.3	Very low	36.9	Very low	98 Å²	98	171 Å²	171	81%	0.81	84%	0.838	S	S	*	*			trans	-160.7	105.6	137	0	0	0	0	0	110.6	K440	A438-K440 PolarHBondContact O-N 2.67Å
439	K	44.4	Very low	36.8	Very low	210 Å²	210	171.2 Å²	171.2	91%	0.913	84%	0.843	S	S	*	*			trans	-57.3	120.5	160.3	-78.8	175.1	172.3	172.6	0	108.3
440	K	34.7	Very low	36.8	Very low	193 Å²	193	173 Å²	173	84%	0.839	84%	0.838	S	S	*	*			trans	-162.9	113	144.6	-107.3	163.8	-170.4	-176.4	0	112.3	A438	A438-K440 PolarHBondContact O-N 2.67Å
441	N	31.5	Very low	36.6	Very low	145 Å²	145	170.1 Å²	170.1	78%	0.775	83%	0.828	S	S	*	*			trans	67.1	98.2	152.7	-59.2	-10.5	0	0	0	118.7	K443	N441-K443 PolarHBondContact O-N 3.35Å
442	K	38.2	Very low	36.7	Very low	214 Å²	214	164.4 Å²	164.4	93%	0.93	82%	0.818	S	S	*	*			trans	-49.6	96.8	149.8	-81	176.4	168.6	174.8	0	109.3	K444	K442-K444 PolarHBondContact O-N 3.32Å
443	K	35	Very low	36.8	Very low	203 Å²	203	166 Å²	166	88%	0.883	82%	0.817	S	S	*	*			trans	-67.7	120.6	156.1	-94.8	-178.9	175.9	174.9	0	106.2	N441 R445	N441-K443 PolarHBondContact O-N 3.35Å; K443-R445 PolarHBondContact O-N 3.35Å
444	K	34.3	Very low	36.8	Very low	197 Å²	197	172 Å²	172	86%	0.857	82%	0.824	S	S	*	*			trans	-48	129.2	176.7	-72.4	176.5	173.9	178	0	109.5	K442 K446	K442-K444 PolarHBondContact O-N 3.32Å; K444-K446 PolarHBondContact O-N 2.97Å
445	R	42.3	Very low	37.3	Very low	236 Å²	236	169.1 Å²	169.1	89%	0.891	82%	0.819	S	S	*	*			trans	-47.8	107	164.6	-65.6	170.8	87.3	174.1	6.9	107.6	K443	K443-R445 PolarHBondContact O-N 3.35Å
446	K	34.8	Very low	37.4	Very low	192 Å²	192	169.2 Å²	169.2	84%	0.835	82%	0.82	S	S	*	*			trans	-85.6	111.2	165.1	-106.7	-176.1	173.3	-176.2	0	105.2	K444 V448	K444-K446 PolarHBondContact O-N 2.97Å; K446-V448 PolarHBondContact O-N 3.4Å
447	K	39	Very low	37.6	Very low	205 Å²	205	164.3 Å²	164.3	89%	0.891	81%	0.812	S	S	*	*			trans	-55.1	109.9	158.2	-77.4	-176.7	171.9	-174.7	0	105.8	L449	K447-L449 PolarHBondContact O-N 3.46Å
448	V	36.3	Very low	37.5	Very low	133 Å²	133	167.8 Å²	167.8	81%	0.806	81%	0.808	S	S	*	*			trans	-74.7	91.4	171.7	-179.6	0	0	0	0	105.2	K446 Y450	K446-V448 PolarHBondContact O-N 3.4Å; V448-Y450 PolarHBondContact O-N 3.2Å
449	L	35.3	Very low	38	Very low	150 Å²	150	170.4 Å²	170.4	79%	0.785	81%	0.809	S	S	*	*			trans	-73.8	113.4	163.9	-156.1	78.2	0	0	0	105.3	K447 N451	K447-L449 PolarHBondContact O-N 3.46Å; L449-N451 PolarHBondContact O-N 2.99Å; L449-N451 VanDerWaalsContact O-N 3.08Å
450	Y	41.8	Very low	37.9	Very low	139 Å²	139	167.4 Å²	167.4	55%	0.545	80%	0.803	S	S	.	*			trans	-61.1	111.6	176.9	-171.5	-98.8	0	0	0	108.5	V448	V448-Y450 PolarHBondContact O-N 3.2Å
451	N	37.3	Very low	38.9	Very low	130 Å²	130	165.9 Å²	165.9	70%	0.695	80%	0.799	S	S	*	*			trans	-101.1	111.2	174.1	-112.3	8.2	0	0	0	107	L449 N453	L449-N451 PolarHBondContact O-N 2.99Å; L449-N451 VanDerWaalsContact O-N 3.08Å; N451-N453 PolarHBondContact O-N 3.2Å
452	A	42	Very low	40.6	Very low	80 Å²	80	166.3 Å²	166.3	66%	0.661	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-9.2	-176	0	0	0	0	0	115.2
453	N	38	Very low	42.6	Very low	155 Å²	155	157.5 Å²	157.5	83%	0.829	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	16.9	-165.9	-82.4	10.7	0	0	0	116.7	N451	N451-N453 PolarHBondContact O-N 3.2Å
454	K	37	Very low	45	Very low	194 Å²	194	150.3 Å²	150.3	84%	0.843	73%	0.73	S	S	*	*			trans	-142	99.6	172	-72.8	-170.4	176.7	-177	0	110.9
455	N	44.6	Very low	47.7	Very low	156 Å²	156	141.1 Å²	141.1	83%	0.834	69%	0.69	S	S	*	*			trans	-121.6	67.2	-172.5	-151.5	36.5	0	0	0	110.2
456	D	40.1	Very low	50.1	Low	152 Å²	152	130.4 Å²	130.4	81%	0.813	65%	0.65	S	S	*	*			trans	-147.5	18.5	-173	-134.4	12.5	0	0	0	117
457	D	34.7	Very low	53	Low	141 Å²	141	123.4 Å²	123.4	75%	0.754	62%	0.62	S	S	*	*	S	Bend	trans	-158.2	124.5	168.6	-103.9	-34.4	0	0	0	114.3
458	Y	35.7	Very low	55.6	Low	200 Å²	200	116.9 Å²	116.9	78%	0.784	59%	0.593	S	S	*	*	S	Bend	trans	67.3	111.7	167.9	-76.4	-96.3	0	0	0	118.5	N460	Y458-N460 PolarHBondContact O-N 2.78Å
459	D	40.8	Very low	58.4	Low	154 Å²	154	111 Å²	111	82%	0.824	56%	0.557	S	S	*	*			trans	26	33.7	142.3	-94.2	-5.4	0	0	0	119.2	E461	D459-E461 PolarHBondContact O-N 2.98Å
460	N	43.3	Very low	61.2	Low	146 Å²	146	105.5 Å²	105.5	78%	0.781	53%	0.531	S	S	*	.			trans	-72	121.2	163.7	-76.9	-45.8	0	0	0	106.1	Y458 E462	Y458-N460 PolarHBondContact O-N 2.78Å; N460-E462 PolarHBondContact O-N 3.34Å
461	E	55.7	Low	63.8	Low	161 Å²	161	102.8 Å²	102.8	75%	0.752	53%	0.525	S	S	*	.			trans	-43.3	105.3	170	-74.1	170.5	162	0	0	108.9	D459 I463	D459-E461 PolarHBondContact O-N 2.98Å; E461-I463 PolarHBondContact O-N 3.15Å
462	E	66.9	Low	66.5	Low	154 Å²	154	98.1 Å²	98.1	72%	0.72	50%	0.498	S	S	*	.			trans	-59.3	115.1	175.2	-178.9	176.8	-176.7	0	0	106.8	N460 L464	N460-E462 PolarHBondContact O-N 3.34Å; E462-L464 PolarHBondContact O-N 3.05Å
463	I	79.3	Confident	69.1	Low	29 Å²	29	100.2 Å²	100.2	15%	0.149	49%	0.494	C	S	.	.			trans	-63.5	104.2	179.1	-59.1	177.5	0	0	0	107.6	Q414 E417 A418 E461 T465	Q414-I463 HydrophobicContact CG-CG2 4.45Å; E417-I463 HydrophobicContact CB-CG2 3.54Å; E417-I463 HydrophobicContact CG-CG2 3.89Å; A418-I463 HydrophobicContact CB-CD1 4.13Å; E461-I463 PolarHBondContact O-N 3.15Å; I463-T465 HydrophobicContact CG2-CG2 4.08Å; I463-T465 PolarHBondContact O-N 3.14Å
464	L	85.3	Confident	71.8	Confident	52 Å²	52	93.8 Å²	93.8	27%	0.272	46%	0.459	S	S	.	.			trans	-65.8	115.2	179.9	-67.3	-179.7	0	0	0	109.1	H353 E462	H353-L464 HydrophobicContact CB-CB 3.81Å; E462-L464 PolarHBondContact O-N 3.05Å
465	T	91.4	Very high	74.5	Confident	5 Å²	5	86.7 Å²	86.7	3%	0.031	43%	0.433	C	S	.	.			trans	-127.4	-88.1	180	47.5	0	0	0	0	109.4	H353 F354 Q413 Q414 I463	H353-T465 PolarHBondContact N-O 3.43Å; F354-T465 WeakPolarHBondContact CD1-O 3.27Å; Q413-T465 HydrophobicContact CB-CG2 3.97Å; Q413-T465 HydrophobicContact CG-CG2 3.63Å; Q414-T465 HydrophobicContact CG-CG2 3.74Å; I463-T465 HydrophobicContact CG2-CG2 4.08Å; I463-T465 PolarHBondContact O-N 3.14Å
466	Y	93.9	Very high	76.6	Confident	10 Å²	10	83.4 Å²	83.4	4%	0.039	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	137	178.9	-60.7	-71.8	0	0	0	110.5	V350 K351 A352 F354 F373 L379 W390 P408 K410	V350-Y466 HydrophobicContact CB-CD1 4.43Å; V350-Y466 HydrophobicContact CG2-CD1 3.8Å; V350-Y466 HydrophobicContact CG2-CE1 4.47Å; V350-Y466 HydrophobicContact CG2-CG 4.24Å; K351-Y466 WeakPolarHBondContact O-CA 3.44Å; A352-Y466 HydrophobicContact CB-CD1 4.27Å; A352-Y466 HydrophobicContact CB-CE1 4.09Å; F354-Y466 HydrophobicContact CE1-CD1 4.35Å; F354-Y466 HydrophobicContact CE1-CD2 4.38Å; F354-Y466 AromaticContact CE1-CE1 3.8Å; F354-Y466 HydrophobicContact CE1-CE1 3.8Å; F354-Y466 AromaticContact CE1-CE2 3.85Å; F354-Y466 HydrophobicContact CE1-CE2 3.85Å; F354-Y466 AromaticContact CE1-CZ 3.55Å; F354-Y466 HydrophobicContact CZ-CE1 4.2Å; F354-Y466 HydrophobicContact CZ-CE2 4.03Å; F354-Y466 AromaticContact CZ-CZ 3.61Å; F354-Y466 WeakPolarHBondContact CZ-OH 3.36Å; F373-Y466 HydrophobicContact CE2-CE1 4.29Å; F373-Y466 HydrophobicContact CZ-CE1 4.05Å; F373-Y466 WeakPolarHBondContact CZ-OH 3.39Å; L379-Y466 HydrophobicContact CD1-CD1 4.48Å; L379-Y466 HydrophobicContact CD1-CE1 3.71Å; W390-Y466 AromaticContact CZ3-CD2 3.99Å; W390-Y466 HydrophobicContact CZ3-CD2 3.99Å; W390-Y466 HydrophobicContact CZ3-CE2 4.28Å; P408-Y466 VanDerWaalsContact O-CE2 3.24Å; P408-Y466 WeakPolarHBondContact O-CE2 3.16Å; P408-Y466 PolarHBondContact O-OH 3.39Å; K410-Y466 HydrophobicContact CB-CD2 4.22Å; K410-Y466 PolarHBondContact NZ-O 3.26Å
467	E	93.8	Very high	79.1	Confident	46 Å²	46	81.6 Å²	81.6	22%	0.215	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129	169.6	-176.8	173	-155.9	0	0	109.4	V350 K351 H353 M469 R586 P670	V350-E467 CarbonylContact C-O 3.48Å; V350-E467 VanDerWaalsContact CA-O 3.25Å; V350-E467 WeakPolarHBondContact CA-O 3.32Å; K351-E467 PolarHBondContact N-O 3.08Å; K351-E467 PolarHBondContact O-N 3.47Å; H353-E467 IonicContact CE1-OE2 2.83Å; H353-E467 VanDerWaalsContact NE2-CB 3.28Å; H353-E467 WeakPolarHBondContact NE2-CB 3.4Å; H353-E467 IonicContact NE2-OE2 3.64Å; H353-E467 PolarHBondContact NE2-OE2 2.93Å; H353-E467 VanDerWaalsContact NE2-OE2 3.15Å; E467-M469 HydrophobicContact CB-SD 4.46Å; E467-M469 HydrophobicContact CG-SD 4.04Å; E467-R586 VanDerWaalsContact CD-NH2 3.32Å; E467-R586 IonicContact OE1-CZ 3.81Å; E467-R586 IonicContact OE1-NH2 3.54Å; E467-R586 PolarHBondContact OE1-NH2 2.81Å; E467-R586 IonicContact OE2-NH2 2.93Å; E467-R586 PolarHBondContact OE2-NH2 2.89Å; E467-R586 VanDerWaalsContact OE2-NH2 3.13Å; E467-P670 VanDerWaalsContact OE1-CG 3.27Å; E467-P670 WeakPolarHBondContact OE1-CG 3.47Å
468	E	94.6	Very high	81.9	Confident	67 Å²	67	79.3 Å²	79.3	31%	0.313	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	130.3	178.4	-161	-169.1	159.3	0	0	110.3	I348 P670 S671 R675	I348-E468 HydrophobicContact CG2-CG 3.71Å; E468-P670 WeakPolarHBondContact O-CA 3.41Å; E468-S671 WeakPolarHBondContact CG-OG 3.42Å; E468-S671 PolarHBondContact O-N 2.98Å; E468-S671 PolarHBondContact O-OG 3.47Å; E468-R675 VanDerWaalsContact CD-NH2 3.27Å; E468-R675 IonicContact OE1-CZ 2.7Å; E468-R675 IonicContact OE1-NH1 2.9Å; E468-R675 IonicContact OE1-NH2 2.63Å; E468-R675 PolarHBondContact OE1-NH2 2.72Å; E468-R675 IonicContact OE2-CZ 3.04Å; E468-R675 IonicContact OE2-NH1 3.83Å; E468-R675 PolarHBondContact OE2-NH1 2.65Å; E468-R675 IonicContact OE2-NH2 2.64Å; E468-R675 PolarHBondContact OE2-NH2 3.25Å; E468-R675 VanDerWaalsContact OE2-NH2 3.12Å
469	M	95.4	Very high	84.8	Confident	11 Å²	11	71.2 Å²	71.2	5%	0.054	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	153	-175.2	-53.5	-61	-89.8	0	0	111.4	H349 K351 I378 E467 W668 V669 S671	H349-M469 PolarHBondContact O-N 2.91Å; K351-M469 HydrophobicContact CB-CE 4.26Å; K351-M469 HydrophobicContact CB-CG 3.64Å; K351-M469 HydrophobicContact CB-SD 4.02Å; K351-M469 HydrophobicContact CD-CE 3.97Å; I378-M469 HydrophobicContact CD1-CG 4.23Å; E467-M469 HydrophobicContact CB-SD 4.46Å; E467-M469 HydrophobicContact CG-SD 4.04Å; M469-W668 HydrophobicContact CB-CB 4.39Å; M469-W668 HydrophobicContact CB-CD2 4.41Å; M469-W668 HydrophobicContact CB-CE3 3.69Å; M469-W668 HydrophobicContact CB-CZ3 4.4Å; M469-W668 HydrophobicContact CE-CB 3.97Å; M469-V669 CarbonylContact C-O 3.44Å; M469-V669 VanDerWaalsContact CA-O 3.28Å; M469-V669 WeakPolarHBondContact CA-O 3.42Å; M469-S671 PolarHBondContact N-OG 2.99Å; M469-S671 PolarHBondContact O-OG 3.2Å; M469-S671 VanDerWaalsContact O-OG 3.08Å
470	S	94.8	Very high	87.5	Confident	34 Å²	34	64.1 Å²	64.1	24%	0.238	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	147.1	172.7	-67.4	0	0	0	0	109.4	Y472 V669 S671	S470-Y472 PolarHBondContact O-N 3.02Å; S470-V669 PolarHBondContact N-O 2.75Å; S470-V669 WeakPolarHBondContact O-CG2 3.35Å; S470-V669 PolarHBondContact O-N 3.12Å; S470-S671 PolarHBondContact N-OG 3.16Å; S470-S671 WeakPolarHBondContact OG-CB 3.07Å; S470-S671 PolarHBondContact OG-OG 3.39Å
471	L	94.6	Very high	90.1	Very high	82 Å²	82	57.2 Å²	57.2	43%	0.429	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	128.4	173.3	-73.8	176.3	0	0	0	110.3	P666 W668	L471-P666 HydrophobicContact CB-CB 4.21Å; L471-P666 HydrophobicContact CD1-CG 4.47Å; L471-P666 HydrophobicContact CD2-CB 4.13Å; L471-P666 HydrophobicContact CD2-CG 4.31Å; L471-W668 HydrophobicContact CD1-CH2 4.27Å; L471-W668 HydrophobicContact CD1-CZ2 4.36Å; L471-W668 HydrophobicContact CD2-CD2 3.67Å; L471-W668 HydrophobicContact CD2-CE3 3.97Å; L471-W668 HydrophobicContact CD2-CG 4.17Å; L471-W668 HydrophobicContact CD2-CH2 4.11Å; L471-W668 HydrophobicContact CD2-CZ2 3.83Å; L471-W668 HydrophobicContact CD2-CZ3 4.18Å; L471-W668 HydrophobicContact CG-CD2 4.24Å; L471-W668 HydrophobicContact CG-CE3 4.05Å; L471-W668 HydrophobicContact CG-CH2 3.74Å; L471-W668 HydrophobicContact CG-CZ2 3.94Å; L471-W668 HydrophobicContact CG-CZ3 3.81Å
472	Y	95.6	Very high	92.1	Very high	32 Å²	32	49.5 Å²	49.5	13%	0.125	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.2	174.9	175.1	-104.1	0	0	0	110.8	S470 P475 R480 K591 P666 Q667 V669 L674	S470-Y472 PolarHBondContact O-N 3.02Å; Y472-P475 VanDerWaalsContact OH-CD 3.23Å; Y472-P475 WeakPolarHBondContact OH-CD 3.43Å; Y472-R480 HydrophobicContact CE1-CG 3.97Å; Y472-K591 HydrophobicContact CE1-CD 4.25Å; Y472-K591 HydrophobicContact CE2-CD 3.96Å; Y472-P666 WeakPolarHBondContact O-CA 3.37Å; Y472-Q667 PolarHBondContact N-O 3.49Å; Y472-Q667 PolarHBondContact O-N 3.35Å; Y472-V669 VanDerWaalsContact CB-CG2 3.44Å; Y472-V669 HydrophobicContact CD1-CG1 4.43Å; Y472-V669 HydrophobicContact CG-CG2 4.28Å; Y472-L674 HydrophobicContact CD2-CD2 3.54Å; Y472-L674 HydrophobicContact CE2-CD2 4.18Å; Y472-L674 HydrophobicContact CG-CD2 4.28Å
473	H	95.7	Very high	93.5	Very high	123 Å²	123	42.2 Å²	42.2	57%	0.569	22%	0.221	S	C	*	.	P	Polyproline II helix	trans	-86.1	126.4	171.8	-65.6	87.7	0	0	0	109.6	P475 P666	H473-P475 WeakPolarHBondContact O-CD 3.42Å; H473-P666 WeakPolarHBondContact NE2-CB 3.34Å; H473-P666 WeakPolarHBondContact NE2-CG 3.49Å
474	Q	94.6	Very high	94.3	Very high	21 Å²	21	40.8 Å²	40.8	10%	0.098	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-67.9	119.3	175.4	-179.6	167.2	-92.4	0	0	110.4	K479 R480 L662 D663	Q474-K479 HydrophobicContact CG-CD 4.31Å; Q474-R480 HydrophobicContact CG-CG 4.41Å; Q474-R480 VanDerWaalsContact OE1-CB 3.31Å; Q474-L662 WeakPolarHBondContact CB-O 3.17Å; Q474-D663 PolarHBondContact NE2-OD1 3.45Å
475	P	92.9	Very high	94.7	Very high	45 Å²	45	38.4 Å²	38.4	29%	0.292	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-65.8	143.6	176.3	-20.3	33.1	0	0	0	111.6	Y472 H473 N477 R478	Y472-P475 VanDerWaalsContact OH-CD 3.23Å; Y472-P475 WeakPolarHBondContact OH-CD 3.43Å; H473-P475 WeakPolarHBondContact O-CD 3.42Å; P475-N477 PolarHBondContact O-N 3.31Å; P475-N477 VanDerWaalsContact O-N 3.13Å; P475-R478 HydrophobicContact CB-CB 4.17Å; P475-R478 HydrophobicContact CG-CB 4.29Å; P475-R478 CarbonylContact O-C 3.59Å; P475-R478 PolarHBondContact O-N 2.79Å
476	A	90.4	Very high	94.7	Very high	86 Å²	86	38.9 Å²	38.9	71%	0.711	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-34.1	-179	0	0	0	0	0	113.4	K479	A476-K479 WeakPolarHBondContact O-CE 3.5Å; A476-K479 PolarHBondContact O-NZ 2.81Å
477	N	92.4	Very high	94.3	Very high	114 Å²	114	38.9 Å²	38.9	61%	0.61	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-0.7	-179.4	67.1	-18.8	0	0	0	114.4	P475 G570	P475-N477 PolarHBondContact O-N 3.31Å; P475-N477 VanDerWaalsContact O-N 3.13Å; N477-G570 WeakPolarHBondContact O-CA 3.32Å
478	R	93.8	Very high	93.7	Very high	93 Å²	93	44.4 Å²	44.4	35%	0.351	24%	0.235	S	C	.	.	S	Bend	trans	-135.2	85.4	178.5	-66.7	-169.8	76.6	-154.9	2.1	109.9	P475 I567	P475-R478 HydrophobicContact CB-CB 4.17Å; P475-R478 HydrophobicContact CG-CB 4.29Å; P475-R478 CarbonylContact O-C 3.59Å; P475-R478 PolarHBondContact O-N 2.79Å; R478-I567 HydrophobicContact CB-CG2 4.1Å; R478-I567 HydrophobicContact CG-CG2 4.43Å
479	K	96.6	Very high	92.7	Very high	31 Å²	31	46.4 Å²	46.4	14%	0.135	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-74.1	136.3	178.2	-54.3	-59.2	-177.3	179.9	0	110.7	Q474 A476 I572 D663	Q474-K479 HydrophobicContact CG-CD 4.31Å; A476-K479 WeakPolarHBondContact O-CE 3.5Å; A476-K479 PolarHBondContact O-NZ 2.81Å; K479-I572 HydrophobicContact CB-CB 4.43Å; K479-I572 HydrophobicContact CB-CG1 3.8Å; K479-I572 HydrophobicContact CG-CG1 3.88Å; K479-D663 VanDerWaalsContact NZ-CG 3.33Å; K479-D663 IonicContact NZ-OD1 3.11Å; K479-D663 PolarHBondContact NZ-OD1 2.77Å; K479-D663 IonicContact NZ-OD2 2.69Å; K479-D663 PolarHBondContact NZ-OD2 2.75Å
480	R	97.4	Very high	91.9	Very high	5 Å²	5	46.2 Å²	46.2	2%	0.019	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-66.1	139.6	175.7	-65.7	173.5	68.6	-172.2	-2.4	109.5	Y472 Q474 I482 K591 P592 D640	Y472-R480 HydrophobicContact CE1-CG 3.97Å; Q474-R480 HydrophobicContact CG-CG 4.41Å; Q474-R480 VanDerWaalsContact OE1-CB 3.31Å; R480-I482 PolarHBondContact O-N 3.49Å; R480-K591 WeakPolarHBondContact CB-O 3.4Å; R480-K591 WeakPolarHBondContact CG-O 3.38Å; R480-K591 PolarHBondContact NE-O 3.14Å; R480-P592 PolarHBondContact NH2-O 2.68Å; R480-D640 IonicContact NH2-OD1 3.39Å
481	P	97.5	Very high	91.3	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-62	129.8	171.4	-23.4	34.5	0	0	0	111.2	I483 V563 I567 C573 L575 L590 Y593	P481-I483 HydrophobicContact CB-CD1 4.06Å; P481-V563 HydrophobicContact CB-CG1 4.03Å; P481-V563 HydrophobicContact CG-CG1 3.62Å; P481-I567 HydrophobicContact CG-CD1 3.51Å; P481-I567 HydrophobicContact CG-CG1 3.84Å; P481-C573 CarbonylContact C-O 3.55Å; P481-C573 WeakPolarHBondContact CA-O 3.38Å; P481-C573 HydrophobicContact CB-CB 4.15Å; P481-C573 HydrophobicContact CG-CB 4.47Å; P481-L575 HydrophobicContact CB-CD1 4.41Å; P481-L590 WeakPolarHBondContact CD-O 3.24Å; P481-L590 HydrophobicContact CG-CB 4.45Å; P481-Y593 PolarHBondContact O-N 3.14Å
482	I	97.9	Very high	91	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	115.1	172.4	-57	-57.9	0	0	0	108.2	R480 L484 I572 C573 L574 L575 Y593 I595 I659 L662	R480-I482 PolarHBondContact O-N 3.49Å; I482-L484 HydrophobicContact CG2-CD2 4.15Å; I482-I572 HydrophobicContact CB-CG2 4.34Å; I482-I572 HydrophobicContact CD1-CG2 4.48Å; I482-I572 HydrophobicContact CG1-CG2 3.45Å; I482-I572 VanDerWaalsContact CG1-CG2 3.45Å; I482-C573 PolarHBondContact N-O 3.4Å; I482-L574 HydrophobicContact CB-CD1 3.9Å; I482-L574 HydrophobicContact CG2-CD1 3.87Å; I482-L575 PolarHBondContact O-N 3.23Å; I482-Y593 HydrophobicContact CD1-CD1 4.06Å; I482-Y593 HydrophobicContact CD1-CG 4.42Å; I482-I595 HydrophobicContact CG2-CD1 4.02Å; I482-I659 HydrophobicContact CD1-CG1 3.91Å; I482-I659 HydrophobicContact CD1-CG2 4.4Å; I482-I659 HydrophobicContact CG1-CD1 4.22Å; I482-I659 HydrophobicContact CG1-CG1 3.96Å; I482-I659 HydrophobicContact CG1-CG2 4.33Å; I482-I659 HydrophobicContact CG2-CD1 4.09Å; I482-I659 HydrophobicContact CG2-CG1 4.25Å; I482-L662 HydrophobicContact CD1-CD1 3.63Å
483	I	96.8	Very high	90.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	116.7	-177.3	-52.3	-60	0	0	0	108.4	P481 I485 L575 L577 L585 P592 Y593 I594 I595	P481-I483 HydrophobicContact CB-CD1 4.06Å; I483-I485 HydrophobicContact CG2-CG2 4.2Å; I483-L575 WeakPolarHBondContact CA-O 3.5Å; I483-L575 HydrophobicContact CD1-CB 3.76Å; I483-L575 HydrophobicContact CD1-CD1 3.47Å; I483-L575 VanDerWaalsContact CD1-CD1 3.47Å; I483-L575 HydrophobicContact CD1-CG 4.24Å; I483-L577 HydrophobicContact CD1-CD1 4.27Å; I483-L577 HydrophobicContact CG2-CB 4.14Å; I483-L577 HydrophobicContact CG2-CD1 3.77Å; I483-L577 HydrophobicContact CG2-CG 4.02Å; I483-L585 HydrophobicContact CB-CD2 4.42Å; I483-L585 HydrophobicContact CD1-CD2 4.27Å; I483-L585 HydrophobicContact CG1-CD2 3.74Å; I483-L585 HydrophobicContact CG2-CD2 4.19Å; I483-P592 HydrophobicContact CG1-CB 3.78Å; I483-Y593 PolarHBondContact N-O 3.07Å; I483-I594 HydrophobicContact CB-CG1 4.08Å; I483-I594 HydrophobicContact CG1-CG1 4.4Å; I483-I594 CarbonylContact O-C 3.56Å; I483-I594 WeakPolarHBondContact O-CA 3.49Å; I483-I595 PolarHBondContact O-N 3.45Å
484	L	95.9	Very high	90.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	133.4	171.2	-51.5	-177.1	0	0	0	108.4	I482 Q492 R496 L575 S576 L577 I595 I597 L655	I482-L484 HydrophobicContact CG2-CD2 4.15Å; L484-Q492 HydrophobicContact CB-CG 3.59Å; L484-Q492 HydrophobicContact CD1-CG 4.07Å; L484-Q492 HydrophobicContact CG-CG 4.5Å; L484-Q492 PolarHBondContact O-NE2 3.45Å; L484-R496 HydrophobicContact CD1-CB 4.28Å; L484-L575 PolarHBondContact N-O 3.48Å; L484-S576 WeakPolarHBondContact O-CA 3.49Å; L484-L577 PolarHBondContact O-N 3.32Å; L484-I595 HydrophobicContact CD2-CB 4.1Å; L484-I597 HydrophobicContact CD2-CD1 4.48Å; L484-L655 HydrophobicContact CD2-CD1 4.03Å; L484-L655 HydrophobicContact CD2-CD2 4.41Å
485	I	93.9	Very high	90.4	Very high	1 Å²	1	42 Å²	42	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	159.4	168.8	58.6	168.7	0	0	0	109.2	I483 T579 L582 I594 I595 F596 I597 F639	I483-I485 HydrophobicContact CG2-CG2 4.2Å; I485-T579 HydrophobicContact CD1-CG2 4.49Å; I485-L582 HydrophobicContact CD1-CD1 3.8Å; I485-L582 HydrophobicContact CG2-CD1 4.44Å; I485-L582 HydrophobicContact CG2-CD2 3.88Å; I485-L582 HydrophobicContact CG2-CG 4.44Å; I485-I594 HydrophobicContact CD1-CG2 3.73Å; I485-I594 HydrophobicContact CG1-CG2 3.96Å; I485-I594 HydrophobicContact CG2-CG2 4.32Å; I485-I595 PolarHBondContact N-O 3.37Å; I485-F596 HydrophobicContact CD1-CB 4.32Å; I485-F596 HydrophobicContact CD1-CD2 3.94Å; I485-F596 HydrophobicContact CG1-CB 4.15Å; I485-F596 HydrophobicContact CG1-CD2 3.9Å; I485-I597 PolarHBondContact O-N 2.94Å; I485-F639 HydrophobicContact CD1-CB 4.1Å; I485-F639 HydrophobicContact CD1-CD1 3.96Å; I485-F639 HydrophobicContact CD1-CG 4.49Å
486	G	90.9	Very high	90.4	Very high	16 Å²	16	42.7 Å²	42.7	17%	0.165	23%	0.225	C	C	.	.			trans	157.5	166.7	179.6	0	0	0	0	0	111.6
487	P	86.1	Confident	90.5	Very high	10 Å²	10	42.8 Å²	42.8	7%	0.065	21%	0.211	C	C	.	.			trans	-61.1	160	173.2	-10.7	20.9	0	0	0	111.6	C490 I624 T628 M631	P487-C490 PolarHBondContact O-SG 2.75Å; P487-I624 HydrophobicContact CB-CG2 4.23Å; P487-T628 HydrophobicContact CG-CG2 4.32Å; P487-T628 WeakPolarHBondContact CG-OG1 3.5Å; P487-M631 HydrophobicContact CG-SD 4.14Å
488	Q	79.8	Confident	90.6	Very high	162 Å²	162	40.5 Å²	40.5	76%	0.757	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	146.7	175.6	-64.4	-179.6	-3.7	0	0	110.5	C490	Q488-C490 VanDerWaalsContact C-N 3.27Å; Q488-C490 PolarHBondContact O-N 2.83Å
489	N	74.1	Confident	90.7	Very high	109 Å²	109	36 Å²	36	58%	0.583	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.9	16.7	178.8	-50	-49.2	0	0	0	115.9	G491	N489-G491 VanDerWaalsContact C-N 3.25Å; N489-G491 PolarHBondContact O-N 2.91Å
490	C	79	Confident	90.6	Very high	7 Å²	7	36.8 Å²	36.8	5%	0.047	18%	0.181	C	C	.	.	S	Bend	trans	-86.1	18.8	173.9	-61.3	0	0	0	0	114	P487 Q488 I597 N645	P487-C490 PolarHBondContact O-SG 2.75Å; Q488-C490 VanDerWaalsContact C-N 3.27Å; Q488-C490 PolarHBondContact O-N 2.83Å; C490-I597 HydrophobicContact CB-CG2 4.41Å; C490-I597 WeakPolarHBondContact O-CG2 3.31Å; C490-N645 PolarHBondContact O-ND2 3.25Å
491	G	81.5	Confident	90.4	Very high	9 Å²	9	41 Å²	41	9%	0.093	20%	0.204	C	C	.	.	S	Bend	trans	81.8	8.7	178.8	0	0	0	0	0	115.4	N489 N493 E494 L495	N489-G491 VanDerWaalsContact C-N 3.25Å; N489-G491 PolarHBondContact O-N 2.91Å; G491-N493 PolarHBondContact O-N 3.3Å; G491-E494 WeakPolarHBondContact CA-OE2 3.47Å; G491-E494 PolarHBondContact O-N 2.96Å; G491-L495 VanDerWaalsContact O-CG 3.31Å; G491-L495 WeakPolarHBondContact O-CG 3.28Å; G491-L495 PolarHBondContact O-N 2.82Å
492	Q	88.8	Confident	90.2	Very high	27 Å²	27	46.8 Å²	46.8	13%	0.126	23%	0.229	C	C	.	.	H	α-helix	trans	-62.3	-43.3	-175.8	-167.5	-161.7	56.8	0	0	112.6	L484 R496 S576	L484-Q492 HydrophobicContact CB-CG 3.59Å; L484-Q492 HydrophobicContact CD1-CG 4.07Å; L484-Q492 HydrophobicContact CG-CG 4.5Å; L484-Q492 PolarHBondContact O-NE2 3.45Å; Q492-R496 WeakPolarHBondContact O-CB 3.38Å; Q492-R496 PolarHBondContact O-N 3.24Å; Q492-S576 VanDerWaalsContact OE1-CB 3.24Å; Q492-S576 PolarHBondContact OE1-OG 2.73Å; Q492-S576 VanDerWaalsContact OE1-OG 3.12Å
493	N	88.2	Confident	90	Very high	83 Å²	83	48.3 Å²	48.3	44%	0.444	24%	0.237	S	C	.	.	H	α-helix	trans	-69.5	-37.5	179.8	-85.5	-43.5	0	0	0	111.4	G491 R496 Q497	G491-N493 PolarHBondContact O-N 3.3Å; N493-R496 PolarHBondContact O-N 3.48Å; N493-R496 PolarHBondContact OD1-NH2 2.96Å; N493-Q497 WeakPolarHBondContact O-CB 3.16Å; N493-Q497 VanDerWaalsContact O-CG 3.27Å; N493-Q497 WeakPolarHBondContact O-CG 3.46Å; N493-Q497 PolarHBondContact O-N 2.84Å
494	E	90.3	Very high	89.8	Confident	82 Å²	82	55 Å²	55	38%	0.383	27%	0.266	S	S	.	.	H	α-helix	trans	-63.4	-48.5	178.2	-64.9	75.2	-174	0	0	110	G491 Q497 R498 L648	G491-E494 WeakPolarHBondContact CA-OE2 3.47Å; G491-E494 PolarHBondContact O-N 2.96Å; E494-Q497 PolarHBondContact O-N 3.42Å; E494-R498 VanDerWaalsContact O-CB 3.23Å; E494-R498 WeakPolarHBondContact O-CB 3.31Å; E494-R498 PolarHBondContact O-N 3.33Å; E494-L648 HydrophobicContact CB-CD2 4.15Å
495	L	93.6	Very high	89.7	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-60.3	-45.9	174.2	-70.4	172.7	0	0	0	111.6	G491 R498 L499 I597 L648 A651 L655	G491-L495 VanDerWaalsContact O-CG 3.31Å; G491-L495 WeakPolarHBondContact O-CG 3.28Å; G491-L495 PolarHBondContact O-N 2.82Å; L495-R498 PolarHBondContact O-N 3.38Å; L495-L499 PolarHBondContact O-N 3.21Å; L495-I597 HydrophobicContact CD1-CD1 4.18Å; L495-I597 HydrophobicContact CD1-CG2 4.34Å; L495-L648 HydrophobicContact CG-CD2 4.46Å; L495-A651 HydrophobicContact CD1-CB 4.39Å; L495-A651 HydrophobicContact CD2-CB 4.28Å; L495-L655 HydrophobicContact CB-CD2 4.06Å; L495-L655 HydrophobicContact CD1-CD2 4.39Å
496	R	93.8	Very high	89.7	Confident	61 Å²	61	63.7 Å²	63.7	23%	0.23	31%	0.307	C	S	.	.	H	α-helix	trans	-58.6	-51.7	177.8	-173.8	-177.8	61.3	113.5	-3.9	112	L484 Q492 N493 R498 L499 M500 L574	L484-R496 HydrophobicContact CD1-CB 4.28Å; Q492-R496 WeakPolarHBondContact O-CB 3.38Å; Q492-R496 PolarHBondContact O-N 3.24Å; N493-R496 PolarHBondContact O-N 3.48Å; N493-R496 PolarHBondContact OD1-NH2 2.96Å; R496-R498 VanDerWaalsContact C-N 3.26Å; R496-R498 PolarHBondContact O-N 3.3Å; R496-L499 PolarHBondContact O-N 3.38Å; R496-M500 VanDerWaalsContact O-CG 3.29Å; R496-M500 WeakPolarHBondContact O-CG 3.37Å; R496-M500 PolarHBondContact O-N 2.95Å; R496-L574 HydrophobicContact CB-CD2 4.24Å; R496-L574 HydrophobicContact CG-CD2 3.51Å; R496-L574 HydrophobicContact CG-CG 4.02Å; R496-L574 WeakPolarHBondContact O-CD2 3.49Å
497	Q	93.3	Very high	90	Very high	87 Å²	87	63 Å²	63	41%	0.407	30%	0.3	S	S	.	.	H	α-helix	trans	-63.2	-35.9	179	-71.5	-60.6	-27.6	0	0	111.6	N493 E494 M500 N501	N493-Q497 WeakPolarHBondContact O-CB 3.16Å; N493-Q497 VanDerWaalsContact O-CG 3.27Å; N493-Q497 WeakPolarHBondContact O-CG 3.46Å; N493-Q497 PolarHBondContact O-N 2.84Å; E494-Q497 PolarHBondContact O-N 3.42Å; Q497-M500 PolarHBondContact O-N 3.05Å; Q497-N501 VanDerWaalsContact O-CB 3.3Å; Q497-N501 WeakPolarHBondContact O-CB 3.29Å; Q497-N501 VanDerWaalsContact O-CG 3.28Å; Q497-N501 PolarHBondContact O-N 3.47Å; Q497-N501 PolarHBondContact O-ND2 3.38Å
498	R	94.6	Very high	90.5	Very high	66 Å²	66	63.4 Å²	63.4	25%	0.249	30%	0.304	C	S	.	.	H	α-helix	trans	-65.5	-44.8	178.5	-167.1	172.5	-175.2	167.5	5.2	112.3	E494 L495 R496 N501 K502 D649 Y652	E494-R498 VanDerWaalsContact O-CB 3.23Å; E494-R498 WeakPolarHBondContact O-CB 3.31Å; E494-R498 PolarHBondContact O-N 3.33Å; L495-R498 PolarHBondContact O-N 3.38Å; R496-R498 VanDerWaalsContact C-N 3.26Å; R496-R498 PolarHBondContact O-N 3.3Å; R498-N501 PolarHBondContact O-N 2.88Å; R498-K502 HydrophobicContact CG-CD 4.31Å; R498-K502 WeakPolarHBondContact O-CB 3.48Å; R498-K502 PolarHBondContact O-N 2.79Å; R498-D649 IonicContact CZ-OD1 3.64Å; R498-D649 IonicContact NH1-OD1 3.31Å; R498-D649 PolarHBondContact NH1-OD1 3.48Å; R498-D649 IonicContact NH2-OD1 3.91Å; R498-D649 PolarHBondContact NH2-OD1 2.94Å; R498-Y652 HydrophobicContact CB-CD2 4.02Å; R498-Y652 HydrophobicContact CB-CE2 4.05Å; R498-Y652 HydrophobicContact CG-CD2 3.69Å; R498-Y652 HydrophobicContact CG-CE2 3.62Å; R498-Y652 HydrophobicContact CG-CG 4.4Å
499	L	94.9	Very high	91.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.4	-50.2	174	-75.3	170.8	0	0	0	111.2	L495 R496 N501 K502 E503 F507 L574 Y652 L655 L656 I659	L495-L499 PolarHBondContact O-N 3.21Å; R496-L499 PolarHBondContact O-N 3.38Å; L499-N501 PolarHBondContact O-N 2.98Å; L499-K502 PolarHBondContact O-N 2.96Å; L499-E503 PolarHBondContact O-N 3.04Å; L499-F507 HydrophobicContact CB-CD2 4.37Å; L499-F507 HydrophobicContact CB-CE2 4.41Å; L499-F507 HydrophobicContact CD2-CE2 3.94Å; L499-F507 HydrophobicContact CD2-CZ 3.88Å; L499-L574 HydrophobicContact CB-CD2 3.94Å; L499-L574 HydrophobicContact CD1-CD1 3.84Å; L499-L574 HydrophobicContact CD1-CD2 4.11Å; L499-Y652 HydrophobicContact CD2-CD2 4.32Å; L499-Y652 HydrophobicContact CD2-CE2 3.58Å; L499-Y652 HydrophobicContact CG-CD2 4.37Å; L499-Y652 HydrophobicContact CG-CE2 3.85Å; L499-L655 HydrophobicContact CD1-CD2 3.57Å; L499-L655 HydrophobicContact CD1-CG 4.07Å; L499-L655 HydrophobicContact CG-CD2 4.42Å; L499-L656 HydrophobicContact CD2-CD1 4.01Å; L499-I659 HydrophobicContact CD1-CD1 3.97Å; L499-I659 HydrophobicContact CD2-CD1 4.5Å
500	M	93.6	Very high	92.3	Very high	46 Å²	46	53.3 Å²	53.3	23%	0.227	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-31.6	179.8	-70.1	-65.8	-64.5	0	0	113.1	R496 Q497 K504 F507 L574	R496-M500 VanDerWaalsContact O-CG 3.29Å; R496-M500 WeakPolarHBondContact O-CG 3.37Å; R496-M500 PolarHBondContact O-N 2.95Å; Q497-M500 PolarHBondContact O-N 3.05Å; M500-K504 WeakPolarHBondContact O-CG 3.33Å; M500-F507 HydrophobicContact SD-CB 3.81Å; M500-L574 HydrophobicContact CG-CD2 3.78Å; M500-L574 HydrophobicContact SD-CB 4.31Å; M500-L574 HydrophobicContact SD-CD2 4.05Å
501	N	94.5	Very high	93.1	Very high	93 Å²	93	54.2 Å²	54.2	50%	0.497	27%	0.265	S	S	.	.	H	α-helix	trans	-89.1	-38	-177.8	-75.5	-45.1	0	0	0	113.9	Q497 R498 L499 K504	Q497-N501 VanDerWaalsContact O-CB 3.3Å; Q497-N501 WeakPolarHBondContact O-CB 3.29Å; Q497-N501 VanDerWaalsContact O-CG 3.28Å; Q497-N501 PolarHBondContact O-N 3.47Å; Q497-N501 PolarHBondContact O-ND2 3.38Å; R498-N501 PolarHBondContact O-N 2.88Å; L499-N501 PolarHBondContact O-N 2.98Å; N501-K504 WeakPolarHBondContact O-CE 3.24Å
502	K	93.8	Very high	93.8	Very high	122 Å²	122	55.2 Å²	55.2	53%	0.53	27%	0.269	S	S	.	.	H	α-helix	trans	-77.5	-33.4	-179.7	-77.6	-168.2	171.6	-169.9	0	112.7	R498 L499 Y652	R498-K502 HydrophobicContact CG-CD 4.31Å; R498-K502 WeakPolarHBondContact O-CB 3.48Å; R498-K502 PolarHBondContact O-N 2.79Å; L499-K502 PolarHBondContact O-N 2.96Å; K502-Y652 HydrophobicContact CD-CE1 4.26Å
503	E	92.3	Very high	94.2	Very high	33 Å²	33	54.8 Å²	54.8	15%	0.154	27%	0.268	C	S	.	.			trans	-129.9	58	-172.3	-64.6	-173.2	-159.8	0	0	111.6	L499 D505 R506 F507 L656	L499-E503 PolarHBondContact O-N 3.04Å; E503-D505 PolarHBondContact O-N 2.78Å; E503-R506 HydrophobicContact CB-CB 4.46Å; E503-R506 PolarHBondContact O-N 2.8Å; E503-R506 IonicContact OE1-NH1 2.71Å; E503-R506 VanDerWaalsContact OE2-CD 3.3Å; E503-R506 WeakPolarHBondContact OE2-CD 3.38Å; E503-R506 IonicContact OE2-CZ 3.8Å; E503-R506 IonicContact OE2-NE 3.58Å; E503-R506 IonicContact OE2-NH1 3.56Å; E503-R506 PolarHBondContact OE2-NH1 2.68Å; E503-F507 HydrophobicContact CB-CD2 3.69Å; E503-F507 HydrophobicContact CB-CE2 3.8Å; E503-F507 WeakPolarHBondContact O-CD2 3.17Å; E503-F507 PolarHBondContact O-N 3.17Å; E503-F507 VanDerWaalsContact O-N 3.12Å; E503-F507 WeakPolarHBondContact OE2-CE2 3.38Å; E503-L656 WeakPolarHBondContact OE1-CD1 3.47Å; E503-L656 WeakPolarHBondContact OE1-CD2 3.23Å
504	K	92.8	Very high	94.7	Very high	140 Å²	140	50.9 Å²	50.9	61%	0.609	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-24.5	-174.8	-71.2	175.5	-179.3	-175.2	0	114.7	M500 N501 K571	M500-K504 WeakPolarHBondContact O-CG 3.33Å; N501-K504 WeakPolarHBondContact O-CE 3.24Å; K504-K571 PolarHBondContact O-NZ 3.47Å
505	D	93.8	Very high	95	Very high	117 Å²	117	48.1 Å²	48.1	63%	0.626	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-40.3	178.3	58.2	-39.6	0	0	0	111.3	E503 K571	E503-D505 PolarHBondContact O-N 2.78Å; D505-K571 VanDerWaalsContact O-CE 3.25Å; D505-K571 WeakPolarHBondContact O-CE 3.15Å; D505-K571 PolarHBondContact O-NZ 3.28Å
506	R	95.3	Very high	95.2	Very high	66 Å²	66	49.3 Å²	49.3	25%	0.249	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-40.9	-175.9	-62.5	177.5	63	-163.7	4.7	113.7	E503 I572 N660	E503-R506 HydrophobicContact CB-CB 4.46Å; E503-R506 PolarHBondContact O-N 2.8Å; E503-R506 IonicContact OE1-NH1 2.71Å; E503-R506 VanDerWaalsContact OE2-CD 3.3Å; E503-R506 WeakPolarHBondContact OE2-CD 3.38Å; E503-R506 IonicContact OE2-CZ 3.8Å; E503-R506 IonicContact OE2-NE 3.58Å; E503-R506 IonicContact OE2-NH1 3.56Å; E503-R506 PolarHBondContact OE2-NH1 2.68Å; R506-I572 PolarHBondContact O-N 2.94Å; R506-N660 PolarHBondContact NH1-OD1 2.98Å; R506-N660 PolarHBondContact NH2-OD1 3.08Å
507	F	96.7	Very high	95.3	Very high	3 Å²	3	51.1 Å²	51.1	1%	0.013	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	148	-173.2	-63.3	-83.6	0	0	0	113.2	L499 M500 E503 I572 L574 I659	L499-F507 HydrophobicContact CB-CD2 4.37Å; L499-F507 HydrophobicContact CB-CE2 4.41Å; L499-F507 HydrophobicContact CD2-CE2 3.94Å; L499-F507 HydrophobicContact CD2-CZ 3.88Å; M500-F507 HydrophobicContact SD-CB 3.81Å; E503-F507 HydrophobicContact CB-CD2 3.69Å; E503-F507 HydrophobicContact CB-CE2 3.8Å; E503-F507 WeakPolarHBondContact O-CD2 3.17Å; E503-F507 PolarHBondContact O-N 3.17Å; E503-F507 VanDerWaalsContact O-N 3.12Å; E503-F507 WeakPolarHBondContact OE2-CE2 3.38Å; F507-I572 WeakPolarHBondContact CA-O 3.48Å; F507-I572 HydrophobicContact CD1-CB 3.73Å; F507-I572 HydrophobicContact CD1-CD1 4.44Å; F507-I572 HydrophobicContact CD1-CG2 3.78Å; F507-I572 HydrophobicContact CE1-CB 3.91Å; F507-I572 HydrophobicContact CE1-CD1 3.9Å; F507-I572 HydrophobicContact CE1-CG2 3.68Å; F507-I572 HydrophobicContact CZ-CD1 4.11Å; F507-L574 HydrophobicContact CD1-CB 4.41Å; F507-L574 HydrophobicContact CD1-CD1 4.26Å; F507-L574 HydrophobicContact CE1-CD1 4.41Å; F507-I659 HydrophobicContact CE1-CD1 4.02Å; F507-I659 HydrophobicContact CE1-CG2 4.16Å; F507-I659 HydrophobicContact CZ-CD1 4.07Å; F507-I659 HydrophobicContact CZ-CG2 4.05Å
508	A	96	Very high	95.4	Very high	18 Å²	18	54.1 Å²	54.1	15%	0.149	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	152.7	170.5	0	0	0	0	0	111.3	V566 K571 I572 C573 L574	A508-V566 HydrophobicContact CB-CG1 3.72Å; A508-K571 HydrophobicContact CB-CB 4.15Å; A508-K571 HydrophobicContact CB-CD 3.78Å; A508-I572 PolarHBondContact N-O 3.38Å; A508-C573 WeakPolarHBondContact O-CA 3.31Å; A508-L574 PolarHBondContact O-N 2.95Å
509	S	94.9	Very high	95.5	Very high	57 Å²	57	57.9 Å²	57.9	40%	0.399	28%	0.283	S	S	.	.			trans	-94.1	142.6	171	-177.3	0	0	0	0	109.3
510	A	95.9	Very high	95.4	Very high	2 Å²	2	65.9 Å²	65.9	2%	0.017	33%	0.326	C	S	.	.			trans	-63	139.9	165.9	0	0	0	0	0	109.6	P512 T558 V563 L575	A510-P512 VanDerWaalsContact O-CD 3.26Å; A510-P512 WeakPolarHBondContact O-CD 3.3Å; A510-T558 HydrophobicContact CB-CG2 3.89Å; A510-V563 HydrophobicContact CB-CG2 3.9Å; A510-L575 HydrophobicContact CB-CD2 4.09Å
511	V	96.5	Very high	95.5	Very high	26 Å²	26	72.4 Å²	72.4	16%	0.158	36%	0.356	C	S	.	.			trans	-78.6	114.5	176.9	-175.2	0	0	0	0	108.8	H529 S562	V511-H529 VanDerWaalsContact CG1-CD2 3.45Å; V511-H529 WeakPolarHBondContact CG1-CD2 3.45Å; V511-S562 VanDerWaalsContact O-CB 3.24Å; V511-S562 WeakPolarHBondContact O-CB 3.39Å; V511-S562 PolarHBondContact O-OG 3.34Å
512	P	96.5	Very high	95.5	Very high	29 Å²	29	69.3 Å²	69.3	19%	0.188	34%	0.339	C	S	.	.			trans	-77.9	162.6	-178.1	31.1	-33.4	0	0	0	112	A510 Y528 H529 G557	A510-P512 VanDerWaalsContact O-CD 3.26Å; A510-P512 WeakPolarHBondContact O-CD 3.3Å; P512-Y528 HydrophobicContact CB-CD1 4.22Å; P512-Y528 HydrophobicContact CB-CE1 4.23Å; P512-Y528 HydrophobicContact CG-CD1 3.58Å; P512-Y528 HydrophobicContact CG-CE1 3.47Å; P512-Y528 VanDerWaalsContact CG-CE1 3.47Å; P512-Y528 HydrophobicContact CG-CG 4.48Å; P512-Y528 CarbonylContact O-C 3.48Å; P512-Y528 VanDerWaalsContact O-CA 3.29Å; P512-Y528 WeakPolarHBondContact O-CA 3.29Å; P512-H529 PolarHBondContact O-N 3.35Å; P512-G557 CarbonylContact C-O 3.6Å; P512-G557 WeakPolarHBondContact CA-O 3.48Å; P512-G557 WeakPolarHBondContact CB-O 3.12Å
513	H	97.8	Very high	95.6	Very high	19 Å²	19	66.7 Å²	66.7	9%	0.088	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	148.7	171.3	-65.3	62.8	0	0	0	110.3	H529 V531 F536 F545 Y556 G557 S559	H513-H529 CarbonylContact C-O 3.52Å; H513-H529 VanDerWaalsContact CA-O 3.32Å; H513-H529 WeakPolarHBondContact CA-O 3.36Å; H513-H529 HydrophobicContact CB-CB 4.33Å; H513-H529 WeakPolarHBondContact CD2-CB 3.21Å; H513-H529 AromaticContact CD2-ND1 3.96Å; H513-H529 AromaticContact CE1-CG 3.84Å; H513-H529 AromaticContact CE1-ND1 3.28Å; H513-H529 PolarHBondContact CE1-ND1 3.03Å; H513-H529 VanDerWaalsContact CE1-ND1 3.28Å; H513-H529 AromaticContact NE2-CG 3.67Å; H513-H529 AromaticContact NE2-ND1 3.11Å; H513-H529 PolarHBondContact NE2-ND1 3.04Å; H513-H529 VanDerWaalsContact NE2-ND1 3.11Å; H513-V531 HydrophobicContact CB-CG2 4.46Å; H513-F536 HydrophobicContact CB-CD2 4.08Å; H513-F536 HydrophobicContact CB-CE2 3.7Å; H513-F545 HydrophobicContact CB-CE1 3.83Å; H513-F545 HydrophobicContact CB-CZ 3.88Å; H513-F545 AromaticContact CG-CE1 3.91Å; H513-F545 AromaticContact ND1-CE1 3.96Å; H513-Y556 WeakPolarHBondContact O-CA 3.48Å; H513-G557 PolarHBondContact N-O 3.05Å; H513-G557 PolarHBondContact O-N 3.45Å; H513-G557 VanDerWaalsContact O-N 3.08Å; H513-S559 PolarHBondContact CE1-OG 3.35Å
514	T	97.8	Very high	95.6	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	149.8	171.1	-171.3	0	0	0	0	111.7	R516 Y528 H529 F530 V531 L555 Y556	T514-R516 HydrophobicContact CG2-CB 4.33Å; T514-R516 WeakPolarHBondContact OG1-CB 3.46Å; T514-R516 PolarHBondContact OG1-N 3.45Å; T514-Y528 HydrophobicContact CG2-CD1 3.74Å; T514-Y528 HydrophobicContact CG2-CD2 4.48Å; T514-Y528 HydrophobicContact CG2-CG 3.71Å; T514-H529 PolarHBondContact N-O 3.5Å; T514-F530 HydrophobicContact CG2-CD1 3.5Å; T514-F530 HydrophobicContact CG2-CE1 3.73Å; T514-F530 HydrophobicContact CG2-CG 4.44Å; T514-V531 PolarHBondContact O-N 2.96Å; T514-L555 VanDerWaalsContact CA-O 3.29Å; T514-L555 WeakPolarHBondContact CA-O 3.39Å; T514-L555 PolarHBondContact OG1-O 3.41Å; T514-Y556 VanDerWaalsContact OG1-CD1 3.32Å; T514-Y556 WeakPolarHBondContact OG1-CD1 3.4Å; T514-Y556 WeakPolarHBondContact OG1-CE1 3.5Å
515	T	97.5	Very high	95.4	Very high	24 Å²	24	63.5 Å²	63.5	15%	0.147	34%	0.343	C	S	.	.	S	Bend	trans	-90.4	-8.3	171.7	55.2	0	0	0	0	113.4	V531 R533 F536 L555	T515-V531 WeakPolarHBondContact CA-O 3.44Å; T515-R533 HydrophobicContact CG2-CB 4.11Å; T515-R533 HydrophobicContact CG2-CG 4.48Å; T515-F536 HydrophobicContact CG2-CB 3.63Å; T515-F536 HydrophobicContact CG2-CD2 3.88Å; T515-F536 HydrophobicContact CG2-CG 3.87Å; T515-L555 HydrophobicContact CG2-CB 3.84Å; T515-L555 HydrophobicContact CG2-CD1 4.28Å; T515-L555 HydrophobicContact CG2-CG 4.32Å; T515-L555 PolarHBondContact N-O 3.24Å; T515-L555 PolarHBondContact OG1-N 2.92Å; T515-L555 PolarHBondContact OG1-O 3.16Å
516	R	97.2	Very high	95.2	Very high	27 Å²	27	65.2 Å²	65.2	10%	0.102	34%	0.34	C	S	.	.	S	Bend	trans	-67.5	144	175.8	-165.5	-163.1	69.5	-160.1	-7.5	109.7	T514 E522 F530 N554	T514-R516 HydrophobicContact CG2-CB 4.33Å; T514-R516 WeakPolarHBondContact OG1-CB 3.46Å; T514-R516 PolarHBondContact OG1-N 3.45Å; R516-E522 IonicContact CZ-OE1 3.8Å; R516-E522 IonicContact CZ-OE2 2.73Å; R516-E522 IonicContact NH1-OE1 3.65Å; R516-E522 IonicContact NH2-OE1 2.64Å; R516-E522 PolarHBondContact NH2-OE1 3Å; R516-E522 IonicContact NH2-OE2 2.71Å; R516-E522 PolarHBondContact NH2-OE2 2.77Å; R516-F530 WeakPolarHBondContact O-CD1 3.29Å; R516-N554 WeakPolarHBondContact CA-OD1 3.42Å; R516-N554 HydrophobicContact CB-CB 4.06Å
517	S	94.8	Very high	95	Very high	98 Å²	98	64.4 Å²	64.4	69%	0.685	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-60.5	143.8	168.7	56.2	0	0	0	0	111.6
518	R	96.4	Very high	95	Very high	151 Å²	151	67.2 Å²	67.2	57%	0.57	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-62.4	136.8	174.6	-176	-178.6	75.6	144.2	-3.2	111.1	E522 F530	R518-E522 WeakPolarHBondContact CD-O 3.37Å; R518-E522 HydrophobicContact CG-CB 4.01Å; R518-F530 VanDerWaalsContact CA-CE1 3.48Å; R518-F530 HydrophobicContact CB-CD1 3.88Å; R518-F530 HydrophobicContact CB-CD2 3.9Å; R518-F530 HydrophobicContact CB-CE1 3.83Å; R518-F530 HydrophobicContact CB-CE2 3.84Å; R518-F530 HydrophobicContact CB-CG 3.91Å; R518-F530 HydrophobicContact CB-CZ 3.8Å; R518-F530 HydrophobicContact CG-CD2 4Å; R518-F530 HydrophobicContact CG-CE1 4.18Å; R518-F530 HydrophobicContact CG-CE2 3.53Å; R518-F530 HydrophobicContact CG-CG 4.5Å; R518-F530 HydrophobicContact CG-CZ 3.63Å
519	R	95.8	Very high	95.1	Very high	144 Å²	144	68.9 Å²	68.9	54%	0.543	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-89	160.4	171.9	-60	174.3	177.2	161.2	-2.8	111.1	Q521 E522	R519-Q521 VanDerWaalsContact C-N 3.27Å; R519-Q521 PolarHBondContact O-N 3.25Å; R519-Q521 VanDerWaalsContact O-N 3.17Å; R519-E522 HydrophobicContact CB-CG 4.12Å; R519-E522 WeakPolarHBondContact CB-OE2 3.45Å; R519-E522 PolarHBondContact N-OE2 3.29Å; R519-E522 WeakPolarHBondContact O-CB 3.39Å; R519-E522 PolarHBondContact O-N 3.08Å
520	D	93.8	Very high	95.2	Very high	169 Å²	169	68.6 Å²	68.6	90%	0.904	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-32.9	-173.4	-65.5	-15.3	0	0	0	114.6	E522	D520-E522 VanDerWaalsContact C-N 3.34Å
521	Q	95.3	Very high	95.3	Very high	183 Å²	183	70.5 Å²	70.5	86%	0.855	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.8	179.9	-61	-173.9	6	0	0	113.7	R519	R519-Q521 VanDerWaalsContact C-N 3.27Å; R519-Q521 PolarHBondContact O-N 3.25Å; R519-Q521 VanDerWaalsContact O-N 3.17Å
522	E	95.4	Very high	95.3	Very high	28 Å²	28	72.6 Å²	72.6	13%	0.131	38%	0.375	C	S	.	.			trans	-99.2	143.3	-174.6	-66	173.5	158.4	0	0	112.4	R516 R518 R519 D520 D527 F530	R516-E522 IonicContact CZ-OE1 3.8Å; R516-E522 IonicContact CZ-OE2 2.73Å; R516-E522 IonicContact NH1-OE1 3.65Å; R516-E522 IonicContact NH2-OE1 2.64Å; R516-E522 PolarHBondContact NH2-OE1 3Å; R516-E522 IonicContact NH2-OE2 2.71Å; R516-E522 PolarHBondContact NH2-OE2 2.77Å; R518-E522 WeakPolarHBondContact CD-O 3.37Å; R518-E522 HydrophobicContact CG-CB 4.01Å; R519-E522 HydrophobicContact CB-CG 4.12Å; R519-E522 WeakPolarHBondContact CB-OE2 3.45Å; R519-E522 PolarHBondContact N-OE2 3.29Å; R519-E522 WeakPolarHBondContact O-CB 3.39Å; R519-E522 PolarHBondContact O-N 3.08Å; D520-E522 VanDerWaalsContact C-N 3.34Å; E522-D527 WeakPolarHBondContact CA-OD2 3.43Å; E522-D527 HydrophobicContact CB-CB 4.41Å; E522-F530 HydrophobicContact CB-CZ 4.01Å; E522-F530 WeakPolarHBondContact OE2-CZ 3.47Å
523	V	94.8	Very high	95.4	Very high	67 Å²	67	76.6 Å²	76.6	41%	0.406	39%	0.386	S	S	.	.			trans	-110.5	122	-178.1	-178.2	0	0	0	0	109.2	G525 R526 D527	V523-G525 PolarHBondContact O-N 3.07Å; V523-R526 HydrophobicContact CB-CB 4.15Å; V523-R526 HydrophobicContact CG1-CB 4.18Å; V523-R526 PolarHBondContact O-N 2.87Å; V523-D527 PolarHBondContact N-OD2 3.45Å; V523-D527 PolarHBondContact O-N 2.78Å
524	A	92.9	Very high	95.3	Very high	62 Å²	62	83.4 Å²	83.4	51%	0.512	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-63.6	133.1	175.1	0	0	0	0	0	110.2	R526 F530	A524-R526 VanDerWaalsContact C-N 3.27Å; A524-R526 PolarHBondContact O-N 3.22Å; A524-F530 HydrophobicContact CB-CD2 3.94Å; A524-F530 HydrophobicContact CB-CE2 4.33Å
525	G	87.3	Confident	95.3	Very high	44 Å²	44	85.2 Å²	85.2	45%	0.454	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	-5.7	-177.4	0	0	0	0	0	114.9	V523 Y528	V523-G525 PolarHBondContact O-N 3.07Å; G525-Y528 PolarHBondContact N-O 2.79Å
526	R	90.5	Very high	95.4	Very high	153 Å²	153	84 Å²	84	58%	0.577	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	-53.2	170.3	-173.1	-169.9	71.8	-169.5	-5.5	111.6	V523 A524	V523-R526 HydrophobicContact CB-CB 4.15Å; V523-R526 HydrophobicContact CG1-CB 4.18Å; V523-R526 PolarHBondContact O-N 2.87Å; A524-R526 VanDerWaalsContact C-N 3.27Å; A524-R526 PolarHBondContact O-N 3.22Å
527	D	92.1	Very high	95.3	Very high	49 Å²	49	87 Å²	87	26%	0.262	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-49.3	-174.9	-56.9	-41	0	0	0	109.9	E522 V523	E522-D527 WeakPolarHBondContact CA-OD2 3.43Å; E522-D527 HydrophobicContact CB-CB 4.41Å; V523-D527 PolarHBondContact N-OD2 3.45Å; V523-D527 PolarHBondContact O-N 2.78Å
528	Y	96.8	Very high	95.5	Very high	62 Å²	62	85.1 Å²	85.1	24%	0.243	43%	0.431	C	S	.	.	B	Isolated β-bridge	trans	-147.1	159.3	172.1	-69.1	-91.7	0	0	0	111.7	P512 T514 G525 F530 Y556	P512-Y528 HydrophobicContact CB-CD1 4.22Å; P512-Y528 HydrophobicContact CB-CE1 4.23Å; P512-Y528 HydrophobicContact CG-CD1 3.58Å; P512-Y528 HydrophobicContact CG-CE1 3.47Å; P512-Y528 VanDerWaalsContact CG-CE1 3.47Å; P512-Y528 HydrophobicContact CG-CG 4.48Å; P512-Y528 CarbonylContact O-C 3.48Å; P512-Y528 VanDerWaalsContact O-CA 3.29Å; P512-Y528 WeakPolarHBondContact O-CA 3.29Å; T514-Y528 HydrophobicContact CG2-CD1 3.74Å; T514-Y528 HydrophobicContact CG2-CD2 4.48Å; T514-Y528 HydrophobicContact CG2-CG 3.71Å; G525-Y528 PolarHBondContact N-O 2.79Å; Y528-F530 HydrophobicContact CD2-CE1 4.34Å; Y528-F530 HydrophobicContact CD2-CZ 4.2Å; Y528-F530 HydrophobicContact CG-CE1 4.37Å; Y528-F530 HydrophobicContact CG-CZ 4.4Å; Y528-F530 WeakPolarHBondContact O-CD2 3.5Å; Y528-Y556 HydrophobicContact CD1-CD1 4.41Å; Y528-Y556 AromaticContact CE1-CD1 3.74Å; Y528-Y556 HydrophobicContact CE1-CD1 3.74Å; Y528-Y556 AromaticContact CE1-CE1 3.99Å; Y528-Y556 HydrophobicContact CE1-CE1 3.99Å
529	H	96.9	Very high	95.5	Very high	52 Å²	52	79.5 Å²	79.5	24%	0.241	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	102	157.3	-70.5	-162.1	0	0	0	108.1	V511 P512 H513 T514 V531	V511-H529 VanDerWaalsContact CG1-CD2 3.45Å; V511-H529 WeakPolarHBondContact CG1-CD2 3.45Å; P512-H529 PolarHBondContact O-N 3.35Å; H513-H529 CarbonylContact C-O 3.52Å; H513-H529 VanDerWaalsContact CA-O 3.32Å; H513-H529 WeakPolarHBondContact CA-O 3.36Å; H513-H529 HydrophobicContact CB-CB 4.33Å; H513-H529 WeakPolarHBondContact CD2-CB 3.21Å; H513-H529 AromaticContact CD2-ND1 3.96Å; H513-H529 AromaticContact CE1-CG 3.84Å; H513-H529 AromaticContact CE1-ND1 3.28Å; H513-H529 PolarHBondContact CE1-ND1 3.03Å; H513-H529 VanDerWaalsContact CE1-ND1 3.28Å; H513-H529 AromaticContact NE2-CG 3.67Å; H513-H529 AromaticContact NE2-ND1 3.11Å; H513-H529 PolarHBondContact NE2-ND1 3.04Å; H513-H529 VanDerWaalsContact NE2-ND1 3.11Å; T514-H529 PolarHBondContact N-O 3.5Å; H529-V531 PolarHBondContact O-N 3.16Å
530	F	97.4	Very high	95.4	Very high	52 Å²	52	75.2 Å²	75.2	23%	0.228	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	111.6	180	-59.4	-79.1	0	0	0	109.5	T514 R516 R518 E522 A524 Y528	T514-F530 HydrophobicContact CG2-CD1 3.5Å; T514-F530 HydrophobicContact CG2-CE1 3.73Å; T514-F530 HydrophobicContact CG2-CG 4.44Å; R516-F530 WeakPolarHBondContact O-CD1 3.29Å; R518-F530 VanDerWaalsContact CA-CE1 3.48Å; R518-F530 HydrophobicContact CB-CD1 3.88Å; R518-F530 HydrophobicContact CB-CD2 3.9Å; R518-F530 HydrophobicContact CB-CE1 3.83Å; R518-F530 HydrophobicContact CB-CE2 3.84Å; R518-F530 HydrophobicContact CB-CG 3.91Å; R518-F530 HydrophobicContact CB-CZ 3.8Å; R518-F530 HydrophobicContact CG-CD2 4Å; R518-F530 HydrophobicContact CG-CE1 4.18Å; R518-F530 HydrophobicContact CG-CE2 3.53Å; R518-F530 HydrophobicContact CG-CG 4.5Å; R518-F530 HydrophobicContact CG-CZ 3.63Å; E522-F530 HydrophobicContact CB-CZ 4.01Å; E522-F530 WeakPolarHBondContact OE2-CZ 3.47Å; A524-F530 HydrophobicContact CB-CD2 3.94Å; A524-F530 HydrophobicContact CB-CE2 4.33Å; Y528-F530 HydrophobicContact CD2-CE1 4.34Å; Y528-F530 HydrophobicContact CD2-CZ 4.2Å; Y528-F530 HydrophobicContact CG-CE1 4.37Å; Y528-F530 HydrophobicContact CG-CZ 4.4Å; Y528-F530 WeakPolarHBondContact O-CD2 3.5Å
531	V	97.4	Very high	95.5	Very high	42 Å²	42	71.5 Å²	71.5	26%	0.255	39%	0.393	S	S	.	.			trans	-127.4	162.3	-175.5	-61.5	0	0	0	0	111.2	H513 T514 T515 H529 A535 F536	H513-V531 HydrophobicContact CB-CG2 4.46Å; T514-V531 PolarHBondContact O-N 2.96Å; T515-V531 WeakPolarHBondContact CA-O 3.44Å; H529-V531 PolarHBondContact O-N 3.16Å; V531-A535 HydrophobicContact CB-CB 4.39Å; V531-F536 HydrophobicContact CG2-CB 4.07Å; V531-F536 HydrophobicContact CG2-CD2 3.82Å; V531-F536 HydrophobicContact CG2-CG 4.45Å
532	S	97.6	Very high	95.4	Very high	69 Å²	69	65.9 Å²	65.9	48%	0.483	38%	0.378	S	S	.	.			trans	-72.8	155.9	172.7	72	0	0	0	0	110.7	Q534 A535 F536	S532-Q534 VanDerWaalsContact C-N 3.25Å; S532-Q534 PolarHBondContact O-N 3.18Å; S532-A535 PolarHBondContact O-N 3.46Å; S532-A535 WeakPolarHBondContact OG-CB 3.34Å; S532-A535 PolarHBondContact OG-N 2.75Å; S532-A535 VanDerWaalsContact OG-N 3.15Å; S532-F536 PolarHBondContact O-N 3.15Å
533	R	97.1	Very high	95.3	Very high	114 Å²	114	66.6 Å²	66.6	43%	0.43	39%	0.392	S	S	.	.	H	α-helix	trans	-57.3	-39.6	174.3	-172.9	172.4	-176	145.3	7.3	112.5	T515 F536 E537 L555	T515-R533 HydrophobicContact CG2-CB 4.11Å; T515-R533 HydrophobicContact CG2-CG 4.48Å; R533-F536 PolarHBondContact O-N 3.33Å; R533-E537 HydrophobicContact CG-CG 4.39Å; R533-E537 WeakPolarHBondContact CG-OE1 3.43Å; R533-E537 IonicContact CZ-OE1 2.78Å; R533-E537 IonicContact NE-OE1 3.31Å; R533-E537 PolarHBondContact NE-OE1 2.87Å; R533-E537 IonicContact NH2-OE1 2.69Å; R533-E537 WeakPolarHBondContact O-CB 3.48Å; R533-E537 WeakPolarHBondContact O-CG 3.48Å; R533-E537 PolarHBondContact O-N 3.16Å; R533-L555 HydrophobicContact CG-CD1 4.15Å
534	Q	97.4	Very high	95.3	Very high	161 Å²	161	67.7 Å²	67.7	75%	0.752	39%	0.391	S	S	*	.	H	α-helix	trans	-61.8	-43.8	176.2	-71	177.1	-12.4	0	0	112.4	S532 A538	S532-Q534 VanDerWaalsContact C-N 3.25Å; S532-Q534 PolarHBondContact O-N 3.18Å; Q534-A538 WeakPolarHBondContact O-CB 3.46Å; Q534-A538 PolarHBondContact O-N 2.92Å
535	A	97.3	Very high	95.4	Very high	38 Å²	38	65.1 Å²	65.1	31%	0.314	37%	0.369	S	S	.	.	H	α-helix	trans	-65.3	-42.5	176.8	0	0	0	0	0	111.3	V531 S532 A538 D539	V531-A535 HydrophobicContact CB-CB 4.39Å; S532-A535 PolarHBondContact O-N 3.46Å; S532-A535 WeakPolarHBondContact OG-CB 3.34Å; S532-A535 PolarHBondContact OG-N 2.75Å; S532-A535 VanDerWaalsContact OG-N 3.15Å; A535-A538 PolarHBondContact O-N 3.21Å; A535-D539 PolarHBondContact O-N 2.87Å
536	F	98.2	Very high	95.7	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-60.6	-47.1	177.3	-161	-71.1	0	0	0	111.8	H513 T515 V531 S532 R533 A538 D539 I540 F545 H548 L555 Y556	H513-F536 HydrophobicContact CB-CD2 4.08Å; H513-F536 HydrophobicContact CB-CE2 3.7Å; T515-F536 HydrophobicContact CG2-CB 3.63Å; T515-F536 HydrophobicContact CG2-CD2 3.88Å; T515-F536 HydrophobicContact CG2-CG 3.87Å; V531-F536 HydrophobicContact CG2-CB 4.07Å; V531-F536 HydrophobicContact CG2-CD2 3.82Å; V531-F536 HydrophobicContact CG2-CG 4.45Å; S532-F536 PolarHBondContact O-N 3.15Å; R533-F536 PolarHBondContact O-N 3.33Å; F536-A538 VanDerWaalsContact C-N 3.33Å; F536-A538 PolarHBondContact O-N 3.45Å; F536-D539 PolarHBondContact O-N 3.44Å; F536-I540 HydrophobicContact CD1-CD1 3.68Å; F536-I540 HydrophobicContact CD1-CG1 3.93Å; F536-I540 HydrophobicContact CE1-CD1 3.71Å; F536-I540 HydrophobicContact CE1-CG1 3.9Å; F536-I540 WeakPolarHBondContact O-CG1 3.02Å; F536-I540 PolarHBondContact O-N 2.86Å; F536-F545 AromaticContact CD1-CE2 3.83Å; F536-F545 HydrophobicContact CD1-CE2 3.83Å; F536-F545 HydrophobicContact CD1-CZ 4.21Å; F536-F545 HydrophobicContact CD2-CE2 4.27Å; F536-F545 AromaticContact CD2-CZ 3.86Å; F536-F545 HydrophobicContact CD2-CZ 3.86Å; F536-F545 HydrophobicContact CE1-CD2 4.12Å; F536-F545 AromaticContact CE1-CE2 3.65Å; F536-F545 HydrophobicContact CE1-CE2 3.65Å; F536-F545 AromaticContact CE1-CZ 3.9Å; F536-F545 HydrophobicContact CE1-CZ 3.9Å; F536-F545 HydrophobicContact CE2-CE1 4.03Å; F536-F545 HydrophobicContact CE2-CE2 4.15Å; F536-F545 AromaticContact CE2-CZ 3.55Å; F536-F545 HydrophobicContact CE2-CZ 3.55Å; F536-F545 HydrophobicContact CG-CE2 4.12Å; F536-F545 HydrophobicContact CG-CZ 4.18Å; F536-F545 HydrophobicContact CZ-CD1 4.43Å; F536-F545 HydrophobicContact CZ-CD2 4.4Å; F536-F545 AromaticContact CZ-CE1 3.89Å; F536-F545 HydrophobicContact CZ-CE1 3.89Å; F536-F545 AromaticContact CZ-CE2 3.82Å; F536-F545 HydrophobicContact CZ-CE2 3.82Å; F536-F545 AromaticContact CZ-CZ 3.55Å; F536-F545 HydrophobicContact CZ-CZ 3.55Å; F536-H548 HydrophobicContact CE1-CB 3.97Å; F536-H548 HydrophobicContact CZ-CB 4.12Å; F536-L555 HydrophobicContact CB-CD1 4.41Å; F536-L555 HydrophobicContact CD1-CB 3.88Å; F536-L555 HydrophobicContact CD1-CD1 3.68Å; F536-L555 HydrophobicContact CD1-CG 4.42Å; F536-L555 HydrophobicContact CD2-CB 4.3Å; F536-L555 HydrophobicContact CE1-CB 3.84Å; F536-L555 HydrophobicContact CE1-CD1 4.26Å; F536-L555 HydrophobicContact CE2-CB 4.25Å; F536-L555 HydrophobicContact CG-CB 4.13Å; F536-L555 HydrophobicContact CG-CD1 4.17Å; F536-L555 HydrophobicContact CZ-CB 4.04Å; F536-Y556 VanDerWaalsContact CZ-C 3.49Å
537	E	97	Very high	95.9	Very high	90 Å²	90	57.9 Å²	57.9	42%	0.421	33%	0.33	S	S	.	.	H	α-helix	trans	-65.5	-35.4	178.3	-72.7	173	-174.8	0	0	112.2	R533 I540 A541 L555	R533-E537 HydrophobicContact CG-CG 4.39Å; R533-E537 WeakPolarHBondContact CG-OE1 3.43Å; R533-E537 IonicContact CZ-OE1 2.78Å; R533-E537 IonicContact NE-OE1 3.31Å; R533-E537 PolarHBondContact NE-OE1 2.87Å; R533-E537 IonicContact NH2-OE1 2.69Å; R533-E537 WeakPolarHBondContact O-CB 3.48Å; R533-E537 WeakPolarHBondContact O-CG 3.48Å; R533-E537 PolarHBondContact O-N 3.16Å; E537-I540 PolarHBondContact O-N 2.79Å; E537-A541 PolarHBondContact O-N 2.95Å; E537-L555 HydrophobicContact CG-CD1 4.15Å
538	A	97.4	Very high	96.1	Very high	57 Å²	57	59.4 Å²	59.4	47%	0.471	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-41.2	172.2	0	0	0	0	0	112.1	Q534 A535 F536 A541 A542	Q534-A538 WeakPolarHBondContact O-CB 3.46Å; Q534-A538 PolarHBondContact O-N 2.92Å; A535-A538 PolarHBondContact O-N 3.21Å; F536-A538 VanDerWaalsContact C-N 3.33Å; F536-A538 PolarHBondContact O-N 3.45Å; A538-A541 PolarHBondContact O-N 3.4Å; A538-A542 WeakPolarHBondContact O-CB 3.44Å; A538-A542 PolarHBondContact O-N 3.47Å
539	D	96.4	Very high	95.9	Very high	34 Å²	34	58 Å²	58	18%	0.182	34%	0.34	C	S	.	.	H	α-helix	trans	-70.6	-30.7	177.1	-75	-25.9	0	0	0	112.7	A535 F536 G543 K544 F545	A535-D539 PolarHBondContact O-N 2.87Å; F536-D539 PolarHBondContact O-N 3.44Å; D539-G543 PolarHBondContact O-N 3.26Å; D539-K544 HydrophobicContact CB-CB 4.35Å; D539-K544 HydrophobicContact CB-CD 4.28Å; D539-K544 PolarHBondContact O-N 3.08Å; D539-K544 WeakPolarHBondContact OD1-CD 3.39Å; D539-K544 WeakPolarHBondContact OD1-CE 3.48Å; D539-K544 IonicContact OD1-NZ 2.64Å; D539-K544 PolarHBondContact OD1-NZ 3.21Å; D539-F545 HydrophobicContact CB-CD2 4.15Å; D539-F545 HydrophobicContact CB-CE2 3.57Å; D539-F545 HydrophobicContact CB-CZ 4.33Å
540	I	94.8	Very high	95.9	Very high	54 Å²	54	60.8 Å²	60.8	28%	0.277	35%	0.353	S	S	.	.	H	α-helix	trans	-61.8	-51.2	167.7	-67.8	171.1	0	0	0	109.8	F536 E537 A542 G543 F545	F536-I540 HydrophobicContact CD1-CD1 3.68Å; F536-I540 HydrophobicContact CD1-CG1 3.93Å; F536-I540 HydrophobicContact CE1-CD1 3.71Å; F536-I540 HydrophobicContact CE1-CG1 3.9Å; F536-I540 WeakPolarHBondContact O-CG1 3.02Å; F536-I540 PolarHBondContact O-N 2.86Å; E537-I540 PolarHBondContact O-N 2.79Å; I540-A542 PolarHBondContact O-N 2.99Å; I540-G543 PolarHBondContact O-N 2.9Å; I540-F545 HydrophobicContact CG1-CD2 3.74Å; I540-F545 HydrophobicContact CG1-CE2 4.18Å
541	A	95.1	Very high	95.7	Very high	91 Å²	91	64.1 Å²	64.1	75%	0.752	37%	0.367	S	S	*	.	H	α-helix	trans	-62.3	-30.1	-178.6	0	0	0	0	0	112.6	E537 A538 G543	E537-A541 PolarHBondContact O-N 2.95Å; A538-A541 PolarHBondContact O-N 3.4Å; A541-G543 VanDerWaalsContact C-N 3.28Å; A541-G543 PolarHBondContact O-N 2.56Å
542	A	94.1	Very high	95.6	Very high	65 Å²	65	68.4 Å²	68.4	54%	0.537	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	1.4	174.2	0	0	0	0	0	114.2	A538 I540 K544	A538-A542 WeakPolarHBondContact O-CB 3.44Å; A538-A542 PolarHBondContact O-N 3.47Å; I540-A542 PolarHBondContact O-N 2.99Å; A542-K544 VanDerWaalsContact C-N 3.32Å; A542-K544 HydrophobicContact CB-CG 4.15Å; A542-K544 PolarHBondContact O-N 2.73Å
543	G	92.2	Very high	95.4	Very high	43 Å²	43	73.6 Å²	73.6	44%	0.443	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	23.8	178.3	0	0	0	0	0	114.8	D539 I540 A541	D539-G543 PolarHBondContact O-N 3.26Å; I540-G543 PolarHBondContact O-N 2.9Å; A541-G543 VanDerWaalsContact C-N 3.28Å; A541-G543 PolarHBondContact O-N 2.56Å
544	K	94.4	Very high	95.4	Very high	89 Å²	89	70.1 Å²	70.1	39%	0.387	39%	0.388	S	S	.	.			trans	-81.3	-14.8	-176.3	-64.2	-172.1	-168.4	161.9	0	114.5	D539 A542 S559 I560	D539-K544 HydrophobicContact CB-CB 4.35Å; D539-K544 HydrophobicContact CB-CD 4.28Å; D539-K544 PolarHBondContact O-N 3.08Å; D539-K544 WeakPolarHBondContact OD1-CD 3.39Å; D539-K544 WeakPolarHBondContact OD1-CE 3.48Å; D539-K544 IonicContact OD1-NZ 2.64Å; D539-K544 PolarHBondContact OD1-NZ 3.21Å; A542-K544 VanDerWaalsContact C-N 3.32Å; A542-K544 HydrophobicContact CB-CG 4.15Å; A542-K544 PolarHBondContact O-N 2.73Å; K544-S559 CarbonylContact O-C 3.58Å; K544-S559 WeakPolarHBondContact O-CA 3.26Å; K544-I560 PolarHBondContact O-N 3.37Å
545	F	95.3	Very high	95.4	Very high	9 Å²	9	63 Å²	63	4%	0.039	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.1	-179.3	-75.2	-69.4	0	0	0	111.8	H513 F536 D539 I540 H548	H513-F545 HydrophobicContact CB-CE1 3.83Å; H513-F545 HydrophobicContact CB-CZ 3.88Å; H513-F545 AromaticContact CG-CE1 3.91Å; H513-F545 AromaticContact ND1-CE1 3.96Å; F536-F545 AromaticContact CD1-CE2 3.83Å; F536-F545 HydrophobicContact CD1-CE2 3.83Å; F536-F545 HydrophobicContact CD1-CZ 4.21Å; F536-F545 HydrophobicContact CD2-CE2 4.27Å; F536-F545 AromaticContact CD2-CZ 3.86Å; F536-F545 HydrophobicContact CD2-CZ 3.86Å; F536-F545 HydrophobicContact CE1-CD2 4.12Å; F536-F545 AromaticContact CE1-CE2 3.65Å; F536-F545 HydrophobicContact CE1-CE2 3.65Å; F536-F545 AromaticContact CE1-CZ 3.9Å; F536-F545 HydrophobicContact CE1-CZ 3.9Å; F536-F545 HydrophobicContact CE2-CE1 4.03Å; F536-F545 HydrophobicContact CE2-CE2 4.15Å; F536-F545 AromaticContact CE2-CZ 3.55Å; F536-F545 HydrophobicContact CE2-CZ 3.55Å; F536-F545 HydrophobicContact CG-CE2 4.12Å; F536-F545 HydrophobicContact CG-CZ 4.18Å; F536-F545 HydrophobicContact CZ-CD1 4.43Å; F536-F545 HydrophobicContact CZ-CD2 4.4Å; F536-F545 AromaticContact CZ-CE1 3.89Å; F536-F545 HydrophobicContact CZ-CE1 3.89Å; F536-F545 AromaticContact CZ-CE2 3.82Å; F536-F545 HydrophobicContact CZ-CE2 3.82Å; F536-F545 AromaticContact CZ-CZ 3.55Å; F536-F545 HydrophobicContact CZ-CZ 3.55Å; D539-F545 HydrophobicContact CB-CD2 4.15Å; D539-F545 HydrophobicContact CB-CE2 3.57Å; D539-F545 HydrophobicContact CB-CZ 4.33Å; I540-F545 HydrophobicContact CG1-CD2 3.74Å; I540-F545 HydrophobicContact CG1-CE2 4.18Å; F545-H548 HydrophobicContact CB-CB 4.41Å; F545-H548 HydrophobicContact CG-CB 4.46Å
546	I	94.8	Very high	95.4	Very high	6 Å²	6	63.3 Å²	63.3	3%	0.031	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	-50.1	169.2	-60.7	168.3	0	0	0	109	T558 I560 V563 L577 L585 L590	I546-T558 PolarHBondContact N-O 2.95Å; I546-I560 HydrophobicContact CD1-CG1 4.38Å; I546-I560 HydrophobicContact CG1-CB 4.46Å; I546-I560 HydrophobicContact CG1-CG1 3.62Å; I546-V563 HydrophobicContact CD1-CB 4.32Å; I546-V563 HydrophobicContact CD1-CG2 3.53Å; I546-L577 HydrophobicContact CG2-CD1 3.71Å; I546-L577 HydrophobicContact CG2-CD2 4.36Å; I546-L585 HydrophobicContact CD1-CD1 4.06Å; I546-L585 HydrophobicContact CG2-CB 4.09Å; I546-L585 HydrophobicContact CG2-CD1 4.16Å; I546-L590 HydrophobicContact CD1-CD1 3.87Å
547	E	94.6	Very high	95.3	Very high	38 Å²	38	63.6 Å²	63.6	18%	0.178	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	140.4	177.4	-175.6	168.4	139.7	0	0	109.3	G557 T558 L577 R578 S581	E547-G557 CarbonylContact O-C 3.59Å; E547-G557 WeakPolarHBondContact O-CA 3.23Å; E547-T558 PolarHBondContact O-N 3.22Å; E547-L577 HydrophobicContact CB-CD2 4.03Å; E547-R578 IonicContact OE1-CZ 3.62Å; E547-R578 IonicContact OE1-NE 3.47Å; E547-R578 PolarHBondContact OE1-NE 2.95Å; E547-R578 IonicContact OE1-NH2 2.68Å; E547-R578 PolarHBondContact OE1-NH2 3.36Å; E547-R578 PolarHBondContact OE2-N 2.9Å; E547-R578 IonicContact OE2-NE 2.63Å; E547-S581 WeakPolarHBondContact CB-OG 3.4Å; E547-S581 WeakPolarHBondContact CG-OG 3.42Å; E547-S581 PolarHBondContact OE2-OG 3.27Å
548	H	95.1	Very high	95.3	Very high	82 Å²	82	60.5 Å²	60.5	38%	0.38	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	159	171	60.5	-88.8	0	0	0	110.9	F536 F545 Y556 R578	F536-H548 HydrophobicContact CE1-CB 3.97Å; F536-H548 HydrophobicContact CZ-CB 4.12Å; F545-H548 HydrophobicContact CB-CB 4.41Å; F545-H548 HydrophobicContact CG-CB 4.46Å; H548-Y556 CarbonylContact C-O 3.6Å; H548-Y556 VanDerWaalsContact CA-O 3.24Å; H548-Y556 WeakPolarHBondContact CA-O 3.48Å; H548-R578 PolarHBondContact O-NH2 3.26Å
549	G	94.1	Very high	95.2	Very high	32 Å²	32	58.1 Å²	58.1	33%	0.33	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	166.1	178.5	0	0	0	0	0	112	L555 Y556	G549-L555 WeakPolarHBondContact O-CA 3.47Å; G549-Y556 PolarHBondContact N-O 3.18Å; G549-Y556 PolarHBondContact O-N 3.04Å
550	E	95.4	Very high	95.2	Very high	111 Å²	111	57.7 Å²	57.7	52%	0.519	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.3	177.8	-170.2	169.6	177.5	0	0	110.2	K553 N554 L555	E550-K553 WeakPolarHBondContact OE1-CA 3.46Å; E550-N554 WeakPolarHBondContact CA-O 3.38Å; E550-L555 HydrophobicContact CB-CD2 3.9Å; E550-L555 HydrophobicContact CG-CD2 4.08Å
551	F	93.7	Very high	95.2	Very high	121 Å²	121	59.5 Å²	59.5	53%	0.531	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	130.7	174.9	-179.6	-102.1	0	0	0	109.6	K553 N554 Y556	F551-K553 PolarHBondContact O-N 3.39Å; F551-N554 PolarHBondContact N-O 2.83Å; F551-N554 PolarHBondContact O-N 3.35Å; F551-Y556 HydrophobicContact CB-CD2 4.01Å; F551-Y556 HydrophobicContact CB-CE2 3.91Å; F551-Y556 HydrophobicContact CD1-CE2 4.3Å
552	E	94.6	Very high	95.3	Very high	132 Å²	132	55.2 Å²	55.2	62%	0.617	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	44.5	-176.8	-67.2	179.2	169.6	0	0	113.2	N554	E552-N554 PolarHBondContact O-N 2.93Å; E552-N554 VanDerWaalsContact O-N 3.15Å; E552-N554 PolarHBondContact O-ND2 2.87Å
553	K	95.1	Very high	95.5	Very high	178 Å²	178	52.1 Å²	52.1	77%	0.774	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	9.5	-177.8	-54	179.1	178.8	178.7	0	115.8	E550 F551	E550-K553 WeakPolarHBondContact OE1-CA 3.46Å; F551-K553 PolarHBondContact O-N 3.39Å
554	N	96.9	Very high	95.6	Very high	41 Å²	41	53 Å²	53	22%	0.219	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	138.7	175.7	-63.7	-79.1	0	0	0	109.6	R516 E550 F551 E552 Y556	R516-N554 WeakPolarHBondContact CA-OD1 3.42Å; R516-N554 HydrophobicContact CB-CB 4.06Å; E550-N554 WeakPolarHBondContact CA-O 3.38Å; F551-N554 PolarHBondContact N-O 2.83Å; F551-N554 PolarHBondContact O-N 3.35Å; E552-N554 PolarHBondContact O-N 2.93Å; E552-N554 VanDerWaalsContact O-N 3.15Å; E552-N554 PolarHBondContact O-ND2 2.87Å; N554-Y556 HydrophobicContact CB-CE2 3.83Å; N554-Y556 WeakPolarHBondContact O-CD2 3.35Å; N554-Y556 WeakPolarHBondContact O-CE2 3.42Å
555	L	97.2	Very high	95.7	Very high	13 Å²	13	54.4 Å²	54.4	7%	0.068	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	140.3	172	-54.9	176.5	0	0	0	110.8	T514 T515 R533 F536 E537 G549 E550	T514-L555 VanDerWaalsContact CA-O 3.29Å; T514-L555 WeakPolarHBondContact CA-O 3.39Å; T514-L555 PolarHBondContact OG1-O 3.41Å; T515-L555 HydrophobicContact CG2-CB 3.84Å; T515-L555 HydrophobicContact CG2-CD1 4.28Å; T515-L555 HydrophobicContact CG2-CG 4.32Å; T515-L555 PolarHBondContact N-O 3.24Å; T515-L555 PolarHBondContact OG1-N 2.92Å; T515-L555 PolarHBondContact OG1-O 3.16Å; R533-L555 HydrophobicContact CG-CD1 4.15Å; F536-L555 HydrophobicContact CB-CD1 4.41Å; F536-L555 HydrophobicContact CD1-CB 3.88Å; F536-L555 HydrophobicContact CD1-CD1 3.68Å; F536-L555 HydrophobicContact CD1-CG 4.42Å; F536-L555 HydrophobicContact CD2-CB 4.3Å; F536-L555 HydrophobicContact CE1-CB 3.84Å; F536-L555 HydrophobicContact CE1-CD1 4.26Å; F536-L555 HydrophobicContact CE2-CB 4.25Å; F536-L555 HydrophobicContact CG-CB 4.13Å; F536-L555 HydrophobicContact CG-CD1 4.17Å; F536-L555 HydrophobicContact CZ-CB 4.04Å; E537-L555 HydrophobicContact CG-CD1 4.15Å; G549-L555 WeakPolarHBondContact O-CA 3.47Å; E550-L555 HydrophobicContact CB-CD2 3.9Å; E550-L555 HydrophobicContact CG-CD2 4.08Å
556	Y	97.3	Very high	95.8	Very high	43 Å²	43	54.7 Å²	54.7	17%	0.169	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	144.9	172.8	-62.7	-94	0	0	0	109.2	H513 T514 Y528 F536 H548 G549 F551 N554	H513-Y556 WeakPolarHBondContact O-CA 3.48Å; T514-Y556 VanDerWaalsContact OG1-CD1 3.32Å; T514-Y556 WeakPolarHBondContact OG1-CD1 3.4Å; T514-Y556 WeakPolarHBondContact OG1-CE1 3.5Å; Y528-Y556 HydrophobicContact CD1-CD1 4.41Å; Y528-Y556 AromaticContact CE1-CD1 3.74Å; Y528-Y556 HydrophobicContact CE1-CD1 3.74Å; Y528-Y556 AromaticContact CE1-CE1 3.99Å; Y528-Y556 HydrophobicContact CE1-CE1 3.99Å; F536-Y556 VanDerWaalsContact CZ-C 3.49Å; H548-Y556 CarbonylContact C-O 3.6Å; H548-Y556 VanDerWaalsContact CA-O 3.24Å; H548-Y556 WeakPolarHBondContact CA-O 3.48Å; G549-Y556 PolarHBondContact N-O 3.18Å; G549-Y556 PolarHBondContact O-N 3.04Å; F551-Y556 HydrophobicContact CB-CD2 4.01Å; F551-Y556 HydrophobicContact CB-CE2 3.91Å; F551-Y556 HydrophobicContact CD1-CE2 4.3Å; N554-Y556 HydrophobicContact CB-CE2 3.83Å; N554-Y556 WeakPolarHBondContact O-CD2 3.35Å; N554-Y556 WeakPolarHBondContact O-CE2 3.42Å
557	G	95.9	Very high	95.9	Very high	7 Å²	7	54.6 Å²	54.6	7%	0.072	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	158	176.8	0	0	0	0	0	114	P512 H513 E547	P512-G557 CarbonylContact C-O 3.6Å; P512-G557 WeakPolarHBondContact CA-O 3.48Å; P512-G557 WeakPolarHBondContact CB-O 3.12Å; H513-G557 PolarHBondContact N-O 3.05Å; H513-G557 PolarHBondContact O-N 3.45Å; H513-G557 VanDerWaalsContact O-N 3.08Å; E547-G557 CarbonylContact O-C 3.59Å; E547-G557 WeakPolarHBondContact O-CA 3.23Å
558	T	96.5	Very high	95.9	Very high	25 Å²	25	57.8 Å²	57.8	15%	0.153	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	117.9	178.6	-55.6	0	0	0	0	109.3	A510 I546 E547 V563 L575	A510-T558 HydrophobicContact CB-CG2 3.89Å; I546-T558 PolarHBondContact N-O 2.95Å; E547-T558 PolarHBondContact O-N 3.22Å; T558-V563 HydrophobicContact CG2-CG2 4.07Å; T558-L575 HydrophobicContact CG2-CD2 3.64Å
559	S	96.1	Very high	95.9	Very high	6 Å²	6	57.5 Å²	57.5	4%	0.042	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	154.4	-179.5	80.5	0	0	0	0	111.5	H513 K544 D561 S562 V563	H513-S559 PolarHBondContact CE1-OG 3.35Å; K544-S559 CarbonylContact O-C 3.58Å; K544-S559 WeakPolarHBondContact O-CA 3.26Å; S559-D561 PolarHBondContact O-N 2.99Å; S559-S562 WeakPolarHBondContact O-CB 3.49Å; S559-S562 PolarHBondContact O-N 3.27Å; S559-S562 WeakPolarHBondContact OG-CB 3.31Å; S559-S562 PolarHBondContact OG-N 3.43Å; S559-S562 PolarHBondContact OG-OG 3.35Å; S559-V563 PolarHBondContact O-N 3.06Å
560	I	95.9	Very high	96	Very high	26 Å²	26	57.3 Å²	57.3	13%	0.133	29%	0.29	C	S	.	.	H	α-helix	trans	-58.3	-41.5	172.7	-63	170	0	0	0	109.9	K544 I546 S562 V563 R564 L590	K544-I560 PolarHBondContact O-N 3.37Å; I546-I560 HydrophobicContact CD1-CG1 4.38Å; I546-I560 HydrophobicContact CG1-CB 4.46Å; I546-I560 HydrophobicContact CG1-CG1 3.62Å; I560-S562 PolarHBondContact O-N 3.02Å; I560-V563 PolarHBondContact O-N 2.9Å; I560-R564 VanDerWaalsContact CG2-NH2 3.31Å; I560-R564 PolarHBondContact O-N 3.26Å; I560-L590 HydrophobicContact CG2-CD1 3.98Å; I560-L590 HydrophobicContact CG2-CD2 4.22Å; I560-L590 HydrophobicContact CG2-CG 4.15Å
561	D	95.5	Very high	96	Very high	91 Å²	91	55.4 Å²	55.4	49%	0.487	28%	0.28	S	S	.	.	H	α-helix	trans	-64.4	-38.4	179.9	-65.4	-28.5	0	0	0	112.5	S559 V563 R564 Q565	S559-D561 PolarHBondContact O-N 2.99Å; D561-V563 VanDerWaalsContact C-N 3.27Å; D561-V563 PolarHBondContact O-N 3.03Å; D561-R564 PolarHBondContact O-N 2.97Å; D561-R564 IonicContact OD1-CZ 3.15Å; D561-R564 IonicContact OD1-NH1 3.66Å; D561-R564 PolarHBondContact OD1-NH1 3.31Å; D561-Q565 WeakPolarHBondContact O-CB 3.34Å; D561-Q565 PolarHBondContact O-N 3.33Å
562	S	96.8	Very high	96.2	Very high	2 Å²	2	50 Å²	50	1%	0.014	26%	0.256	C	S	.	.	H	α-helix	trans	-59.4	-38.7	175.7	-60	0	0	0	0	111.6	V511 S559 I560	V511-S562 VanDerWaalsContact O-CB 3.24Å; V511-S562 WeakPolarHBondContact O-CB 3.39Å; V511-S562 PolarHBondContact O-OG 3.34Å; S559-S562 WeakPolarHBondContact O-CB 3.49Å; S559-S562 PolarHBondContact O-N 3.27Å; S559-S562 WeakPolarHBondContact OG-CB 3.31Å; S559-S562 PolarHBondContact OG-N 3.43Å; S559-S562 PolarHBondContact OG-OG 3.35Å; I560-S562 PolarHBondContact O-N 3.02Å
563	V	97.3	Very high	96.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-72.9	-45.1	176.2	-179.5	0	0	0	0	110.3	P481 A510 I546 T558 S559 I560 D561 Q565 V566 I567 C573 L575 L590	P481-V563 HydrophobicContact CB-CG1 4.03Å; P481-V563 HydrophobicContact CG-CG1 3.62Å; A510-V563 HydrophobicContact CB-CG2 3.9Å; I546-V563 HydrophobicContact CD1-CB 4.32Å; I546-V563 HydrophobicContact CD1-CG2 3.53Å; T558-V563 HydrophobicContact CG2-CG2 4.07Å; S559-V563 PolarHBondContact O-N 3.06Å; I560-V563 PolarHBondContact O-N 2.9Å; D561-V563 VanDerWaalsContact C-N 3.27Å; D561-V563 PolarHBondContact O-N 3.03Å; V563-Q565 PolarHBondContact O-N 3.42Å; V563-V566 PolarHBondContact O-N 2.89Å; V563-I567 HydrophobicContact CG1-CD1 4.27Å; V563-I567 WeakPolarHBondContact O-CG1 3.37Å; V563-I567 PolarHBondContact O-N 2.84Å; V563-I567 VanDerWaalsContact O-N 3.08Å; V563-C573 HydrophobicContact CG1-CB 4.24Å; V563-L575 HydrophobicContact CG1-CD1 4.17Å; V563-L575 HydrophobicContact CG2-CD1 3.88Å; V563-L575 HydrophobicContact CG2-CD2 4.03Å; V563-L590 HydrophobicContact CB-CD1 3.96Å; V563-L590 HydrophobicContact CB-CD2 4.4Å; V563-L590 HydrophobicContact CG1-CD1 3.91Å; V563-L590 HydrophobicContact CG1-CD2 4.25Å
564	R	96.2	Very high	96.4	Very high	60 Å²	60	35.3 Å²	35.3	23%	0.226	19%	0.19	C	C	.	.	H	α-helix	trans	-58.1	-37.1	178.3	-165.2	178	-66.2	106	-2.7	112.2	I560 D561 V566 I567 N568 D589 L590	I560-R564 VanDerWaalsContact CG2-NH2 3.31Å; I560-R564 PolarHBondContact O-N 3.26Å; D561-R564 PolarHBondContact O-N 2.97Å; D561-R564 IonicContact OD1-CZ 3.15Å; D561-R564 IonicContact OD1-NH1 3.66Å; D561-R564 PolarHBondContact OD1-NH1 3.31Å; R564-V566 VanDerWaalsContact C-N 3.33Å; R564-V566 PolarHBondContact O-N 2.74Å; R564-I567 PolarHBondContact O-N 3.17Å; R564-N568 WeakPolarHBondContact O-CB 3.32Å; R564-N568 PolarHBondContact O-N 3.32Å; R564-N568 PolarHBondContact O-ND2 3.15Å; R564-D589 IonicContact CZ-OD1 3.85Å; R564-D589 IonicContact NE-OD1 3.98Å; R564-D589 IonicContact NE-OD2 2.62Å; R564-D589 IonicContact NH2-OD1 2.76Å; R564-D589 PolarHBondContact NH2-OD1 3.22Å; R564-D589 IonicContact NH2-OD2 2.95Å; R564-L590 HydrophobicContact CB-CD2 3.98Å; R564-L590 HydrophobicContact CG-CD2 4.5Å
565	Q	96.2	Very high	96.3	Very high	120 Å²	120	34 Å²	34	56%	0.561	18%	0.183	S	C	*	.	H	α-helix	trans	-60.4	-40.7	175.6	-174.7	177.8	-5	0	0	112.4	D561 V563 N568 S569	D561-Q565 WeakPolarHBondContact O-CB 3.34Å; D561-Q565 PolarHBondContact O-N 3.33Å; V563-Q565 PolarHBondContact O-N 3.42Å; Q565-N568 PolarHBondContact O-N 2.67Å; Q565-S569 PolarHBondContact O-N 3.29Å; Q565-S569 VanDerWaalsContact O-N 3.15Å
566	V	96.9	Very high	96.1	Very high	14 Å²	14	35 Å²	35	9%	0.085	19%	0.191	C	C	.	.	H	α-helix	trans	-70.1	-41.1	177.2	179.9	0	0	0	0	111.4	A508 V563 R564 N568 S569 K571 C573	A508-V566 HydrophobicContact CB-CG1 3.72Å; V563-V566 PolarHBondContact O-N 2.89Å; R564-V566 VanDerWaalsContact C-N 3.33Å; R564-V566 PolarHBondContact O-N 2.74Å; V566-N568 VanDerWaalsContact C-N 3.28Å; V566-N568 PolarHBondContact O-N 2.97Å; V566-S569 PolarHBondContact O-N 3.29Å; V566-S569 VanDerWaalsContact O-N 3.14Å; V566-S569 PolarHBondContact O-OG 2.96Å; V566-K571 HydrophobicContact CG1-CB 4.12Å; V566-K571 PolarHBondContact O-N 3.03Å; V566-C573 HydrophobicContact CB-CB 3.88Å; V566-C573 HydrophobicContact CG1-CB 3.58Å
567	I	96.2	Very high	95.8	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-57.2	-46.6	174.1	-61.4	171.9	0	0	0	109.9	R478 P481 V563 R564 S569 G570 L590	R478-I567 HydrophobicContact CB-CG2 4.1Å; R478-I567 HydrophobicContact CG-CG2 4.43Å; P481-I567 HydrophobicContact CG-CD1 3.51Å; P481-I567 HydrophobicContact CG-CG1 3.84Å; V563-I567 HydrophobicContact CG1-CD1 4.27Å; V563-I567 WeakPolarHBondContact O-CG1 3.37Å; V563-I567 PolarHBondContact O-N 2.84Å; V563-I567 VanDerWaalsContact O-N 3.08Å; R564-I567 PolarHBondContact O-N 3.17Å; I567-S569 PolarHBondContact O-N 3.34Å; I567-G570 PolarHBondContact O-N 2.96Å; I567-L590 HydrophobicContact CD1-CB 4.39Å; I567-L590 HydrophobicContact CD1-CD2 3.78Å
568	N	95.9	Very high	95.5	Very high	104 Å²	104	38.2 Å²	38.2	56%	0.556	20%	0.202	S	C	*	.	H	α-helix	trans	-68.7	-18.5	-178.8	-69.7	-12.4	0	0	0	113.3	R564 Q565 V566 G570	R564-N568 WeakPolarHBondContact O-CB 3.32Å; R564-N568 PolarHBondContact O-N 3.32Å; R564-N568 PolarHBondContact O-ND2 3.15Å; Q565-N568 PolarHBondContact O-N 2.67Å; V566-N568 VanDerWaalsContact C-N 3.28Å; V566-N568 PolarHBondContact O-N 2.97Å; N568-G570 PolarHBondContact O-N 3.14Å
569	S	95.4	Very high	95	Very high	76 Å²	76	38.5 Å²	38.5	53%	0.531	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	2.5	172	77.3	0	0	0	0	113.3	Q565 V566 I567 K571	Q565-S569 PolarHBondContact O-N 3.29Å; Q565-S569 VanDerWaalsContact O-N 3.15Å; V566-S569 PolarHBondContact O-N 3.29Å; V566-S569 VanDerWaalsContact O-N 3.14Å; V566-S569 PolarHBondContact O-OG 2.96Å; I567-S569 PolarHBondContact O-N 3.34Å; S569-K571 PolarHBondContact O-N 3.49Å
570	G	94.2	Very high	94.6	Very high	29 Å²	29	44.4 Å²	44.4	30%	0.299	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	10.4	-178.1	0	0	0	0	0	114.7	N477 I567 N568	N477-G570 WeakPolarHBondContact O-CA 3.32Å; I567-G570 PolarHBondContact O-N 2.96Å; N568-G570 PolarHBondContact O-N 3.14Å
571	K	96	Very high	94.3	Very high	71 Å²	71	43.5 Å²	43.5	31%	0.309	23%	0.226	S	C	.	.	S	Bend	trans	-97.3	157	178.8	-70.5	-164.1	173.1	-158.2	0	111.2	K504 D505 A508 V566 S569 C573	K504-K571 PolarHBondContact O-NZ 3.47Å; D505-K571 VanDerWaalsContact O-CE 3.25Å; D505-K571 WeakPolarHBondContact O-CE 3.15Å; D505-K571 PolarHBondContact O-NZ 3.28Å; A508-K571 HydrophobicContact CB-CB 4.15Å; A508-K571 HydrophobicContact CB-CD 3.78Å; V566-K571 HydrophobicContact CG1-CB 4.12Å; V566-K571 PolarHBondContact O-N 3.03Å; S569-K571 PolarHBondContact O-N 3.49Å; K571-C573 PolarHBondContact O-N 3.39Å
572	I	97.6	Very high	94	Very high	7 Å²	7	39.1 Å²	39.1	4%	0.036	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	113.1	174.1	-54	175.5	0	0	0	108.4	K479 I482 R506 F507 A508 L574 I659	K479-I572 HydrophobicContact CB-CB 4.43Å; K479-I572 HydrophobicContact CB-CG1 3.8Å; K479-I572 HydrophobicContact CG-CG1 3.88Å; I482-I572 HydrophobicContact CB-CG2 4.34Å; I482-I572 HydrophobicContact CD1-CG2 4.48Å; I482-I572 HydrophobicContact CG1-CG2 3.45Å; I482-I572 VanDerWaalsContact CG1-CG2 3.45Å; R506-I572 PolarHBondContact O-N 2.94Å; F507-I572 WeakPolarHBondContact CA-O 3.48Å; F507-I572 HydrophobicContact CD1-CB 3.73Å; F507-I572 HydrophobicContact CD1-CD1 4.44Å; F507-I572 HydrophobicContact CD1-CG2 3.78Å; F507-I572 HydrophobicContact CE1-CB 3.91Å; F507-I572 HydrophobicContact CE1-CD1 3.9Å; F507-I572 HydrophobicContact CE1-CG2 3.68Å; F507-I572 HydrophobicContact CZ-CD1 4.11Å; A508-I572 PolarHBondContact N-O 3.38Å; I572-L574 PolarHBondContact O-N 2.93Å; I572-I659 HydrophobicContact CD1-CG2 3.76Å
573	C	97.6	Very high	93.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	121.9	176	-164	0	0	0	0	110.2	P481 I482 A508 V563 V566 K571 L575	P481-C573 CarbonylContact C-O 3.55Å; P481-C573 WeakPolarHBondContact CA-O 3.38Å; P481-C573 HydrophobicContact CB-CB 4.15Å; P481-C573 HydrophobicContact CG-CB 4.47Å; I482-C573 PolarHBondContact N-O 3.4Å; A508-C573 WeakPolarHBondContact O-CA 3.31Å; V563-C573 HydrophobicContact CG1-CB 4.24Å; V566-C573 HydrophobicContact CB-CB 3.88Å; V566-C573 HydrophobicContact CG1-CB 3.58Å; K571-C573 PolarHBondContact O-N 3.39Å; C573-L575 HydrophobicContact CB-CD1 4.35Å; C573-L575 WeakPolarHBondContact SG-CD1 3.39Å
574	L	97.2	Very high	93.2	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	118.4	-177.5	-165.4	76.2	0	0	0	110.5	I482 R496 L499 M500 F507 A508 I572	I482-L574 HydrophobicContact CB-CD1 3.9Å; I482-L574 HydrophobicContact CG2-CD1 3.87Å; R496-L574 HydrophobicContact CB-CD2 4.24Å; R496-L574 HydrophobicContact CG-CD2 3.51Å; R496-L574 HydrophobicContact CG-CG 4.02Å; R496-L574 WeakPolarHBondContact O-CD2 3.49Å; L499-L574 HydrophobicContact CB-CD2 3.94Å; L499-L574 HydrophobicContact CD1-CD1 3.84Å; L499-L574 HydrophobicContact CD1-CD2 4.11Å; M500-L574 HydrophobicContact CG-CD2 3.78Å; M500-L574 HydrophobicContact SD-CB 4.31Å; M500-L574 HydrophobicContact SD-CD2 4.05Å; F507-L574 HydrophobicContact CD1-CB 4.41Å; F507-L574 HydrophobicContact CD1-CD1 4.26Å; F507-L574 HydrophobicContact CE1-CD1 4.41Å; A508-L574 PolarHBondContact O-N 2.95Å; I572-L574 PolarHBondContact O-N 2.93Å
575	L	94.6	Very high	93	Very high	12 Å²	12	44.4 Å²	44.4	6%	0.063	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	147.6	-179.6	-60.3	115.5	0	0	0	112.1	P481 I482 I483 L484 A510 T558 V563 C573 L577	P481-L575 HydrophobicContact CB-CD1 4.41Å; I482-L575 PolarHBondContact O-N 3.23Å; I483-L575 WeakPolarHBondContact CA-O 3.5Å; I483-L575 HydrophobicContact CD1-CB 3.76Å; I483-L575 HydrophobicContact CD1-CD1 3.47Å; I483-L575 VanDerWaalsContact CD1-CD1 3.47Å; I483-L575 HydrophobicContact CD1-CG 4.24Å; L484-L575 PolarHBondContact N-O 3.48Å; A510-L575 HydrophobicContact CB-CD2 4.09Å; T558-L575 HydrophobicContact CG2-CD2 3.64Å; V563-L575 HydrophobicContact CG1-CD1 4.17Å; V563-L575 HydrophobicContact CG2-CD1 3.88Å; V563-L575 HydrophobicContact CG2-CD2 4.03Å; C573-L575 HydrophobicContact CB-CD1 4.35Å; C573-L575 WeakPolarHBondContact SG-CD1 3.39Å; L575-L577 HydrophobicContact CB-CG 4.43Å
576	S	93.3	Very high	92.7	Very high	35 Å²	35	39.9 Å²	39.9	25%	0.245	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.9	165.7	-72.8	0	0	0	0	108.1	L484 Q492	L484-S576 WeakPolarHBondContact O-CA 3.49Å; Q492-S576 VanDerWaalsContact OE1-CB 3.24Å; Q492-S576 PolarHBondContact OE1-OG 2.73Å; Q492-S576 VanDerWaalsContact OE1-OG 3.12Å
577	L	91.3	Very high	92.2	Very high	12 Å²	12	45.6 Å²	45.6	6%	0.063	24%	0.24	C	C	.	.			trans	-124.8	159.9	-179	-62.6	-180	0	0	0	111.4	I483 L484 I546 E547 L575 L585	I483-L577 HydrophobicContact CD1-CD1 4.27Å; I483-L577 HydrophobicContact CG2-CB 4.14Å; I483-L577 HydrophobicContact CG2-CD1 3.77Å; I483-L577 HydrophobicContact CG2-CG 4.02Å; L484-L577 PolarHBondContact O-N 3.32Å; I546-L577 HydrophobicContact CG2-CD1 3.71Å; I546-L577 HydrophobicContact CG2-CD2 4.36Å; E547-L577 HydrophobicContact CB-CD2 4.03Å; L575-L577 HydrophobicContact CB-CG 4.43Å; L577-L585 HydrophobicContact CD1-CD2 4.02Å
578	R	89	Confident	92	Very high	105 Å²	105	46.1 Å²	46.1	40%	0.396	24%	0.244	S	C	.	.			trans	-83.9	154.1	166.4	-67.8	177.9	-72.5	150.2	-3.8	110.4	E547 H548 Q580 S581	E547-R578 IonicContact OE1-CZ 3.62Å; E547-R578 IonicContact OE1-NE 3.47Å; E547-R578 PolarHBondContact OE1-NE 2.95Å; E547-R578 IonicContact OE1-NH2 2.68Å; E547-R578 PolarHBondContact OE1-NH2 3.36Å; E547-R578 PolarHBondContact OE2-N 2.9Å; E547-R578 IonicContact OE2-NE 2.63Å; H548-R578 PolarHBondContact O-NH2 3.26Å; R578-Q580 VanDerWaalsContact C-N 3.26Å; R578-Q580 HydrophobicContact CB-CG 3.93Å; R578-Q580 VanDerWaalsContact NH1-CD 3.31Å; R578-Q580 PolarHBondContact O-N 2.67Å; R578-S581 WeakPolarHBondContact O-CB 3.3Å; R578-S581 PolarHBondContact O-N 2.89Å
579	T	86.8	Confident	91.7	Very high	31 Å²	31	44.8 Å²	44.8	19%	0.19	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-58.6	-34.9	-178.5	41	0	0	0	0	113.6	I485 S581 L582 M631 N635	I485-T579 HydrophobicContact CD1-CG2 4.49Å; T579-S581 PolarHBondContact O-N 2.81Å; T579-S581 VanDerWaalsContact O-N 3.09Å; T579-L582 HydrophobicContact CG2-CD1 4.25Å; T579-L582 VanDerWaalsContact O-CB 3.32Å; T579-L582 WeakPolarHBondContact O-CB 3.4Å; T579-L582 WeakPolarHBondContact O-CG 3.45Å; T579-L582 PolarHBondContact O-N 3.47Å; T579-L582 VanDerWaalsContact O-N 3.09Å; T579-M631 HydrophobicContact CG2-CB 4.45Å; T579-M631 HydrophobicContact CG2-CE 3.31Å; T579-M631 HydrophobicContact CG2-CG 4.21Å; T579-N635 HydrophobicContact CG2-CB 4.28Å
580	Q	86.3	Confident	91.7	Very high	131 Å²	131	41.4 Å²	41.4	61%	0.612	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-55.8	-26.6	175.5	60.9	176.4	73.1	0	0	114.2	R578	R578-Q580 VanDerWaalsContact C-N 3.26Å; R578-Q580 HydrophobicContact CB-CG 3.93Å; R578-Q580 VanDerWaalsContact NH1-CD 3.31Å; R578-Q580 PolarHBondContact O-N 2.67Å
581	S	89.9	Confident	91.8	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.042	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-87	-9.3	-175.5	-49.5	0	0	0	0	112.4	E547 R578 T579 K583 T584 L585	E547-S581 WeakPolarHBondContact CB-OG 3.4Å; E547-S581 WeakPolarHBondContact CG-OG 3.42Å; E547-S581 PolarHBondContact OE2-OG 3.27Å; R578-S581 WeakPolarHBondContact O-CB 3.3Å; R578-S581 PolarHBondContact O-N 2.89Å; T579-S581 PolarHBondContact O-N 2.81Å; T579-S581 VanDerWaalsContact O-N 3.09Å; S581-K583 PolarHBondContact O-N 3.14Å; S581-T584 PolarHBondContact O-N 3.44Å; S581-L585 WeakPolarHBondContact O-CB 3.46Å; S581-L585 PolarHBondContact O-N 3.28Å; S581-L585 VanDerWaalsContact O-N 3.11Å
582	L	90	Very high	91.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.8	-35.7	-175.1	-68.2	177.6	0	0	0	113	I485 T579 L585 R586 I594 N635 Y638	I485-L582 HydrophobicContact CD1-CD1 3.8Å; I485-L582 HydrophobicContact CG2-CD1 4.44Å; I485-L582 HydrophobicContact CG2-CD2 3.88Å; I485-L582 HydrophobicContact CG2-CG 4.44Å; T579-L582 HydrophobicContact CG2-CD1 4.25Å; T579-L582 VanDerWaalsContact O-CB 3.32Å; T579-L582 WeakPolarHBondContact O-CB 3.4Å; T579-L582 WeakPolarHBondContact O-CG 3.45Å; T579-L582 PolarHBondContact O-N 3.47Å; T579-L582 VanDerWaalsContact O-N 3.09Å; L582-L585 HydrophobicContact CD2-CD2 4.34Å; L582-L585 PolarHBondContact O-N 3.3Å; L582-R586 WeakPolarHBondContact O-CB 3.41Å; L582-R586 WeakPolarHBondContact O-CG 3.35Å; L582-R586 PolarHBondContact O-N 3.17Å; L582-I594 HydrophobicContact CD2-CD1 4.01Å; L582-I594 HydrophobicContact CD2-CG1 4.4Å; L582-I594 HydrophobicContact CD2-CG2 4.02Å; L582-N635 HydrophobicContact CD1-CB 4.39Å; L582-Y638 HydrophobicContact CB-CD2 4.28Å; L582-Y638 HydrophobicContact CD1-CD2 4.4Å
583	K	86.9	Confident	91.8	Very high	114 Å²	114	38.2 Å²	38.2	50%	0.496	19%	0.191	S	C	.	.	H	α-helix	trans	-62.7	-50.7	178.7	-169.6	173.3	-176.7	173.9	0	111.1	S581 L585 R586 N587	S581-K583 PolarHBondContact O-N 3.14Å; K583-L585 VanDerWaalsContact C-N 3.28Å; K583-L585 PolarHBondContact O-N 3.41Å; K583-R586 PolarHBondContact O-N 3.17Å; K583-N587 WeakPolarHBondContact O-CB 3.33Å; K583-N587 PolarHBondContact O-N 3.4Å; K583-N587 VanDerWaalsContact O-N 3.08Å; K583-N587 PolarHBondContact O-OD1 3.14Å
584	T	89.7	Confident	91.8	Very high	58 Å²	58	38.2 Å²	38.2	36%	0.356	19%	0.191	S	C	.	.	H	α-helix	trans	-58.9	-41.4	175.7	-51.3	0	0	0	0	111.6	S581	S581-T584 PolarHBondContact O-N 3.44Å
585	L	92.1	Very high	91.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-46.8	178.4	179.1	73.4	0	0	0	112.4	I483 I546 L577 S581 L582 K583 N587 S588 L590 P592 I594	I483-L585 HydrophobicContact CB-CD2 4.42Å; I483-L585 HydrophobicContact CD1-CD2 4.27Å; I483-L585 HydrophobicContact CG1-CD2 3.74Å; I483-L585 HydrophobicContact CG2-CD2 4.19Å; I546-L585 HydrophobicContact CD1-CD1 4.06Å; I546-L585 HydrophobicContact CG2-CB 4.09Å; I546-L585 HydrophobicContact CG2-CD1 4.16Å; L577-L585 HydrophobicContact CD1-CD2 4.02Å; S581-L585 WeakPolarHBondContact O-CB 3.46Å; S581-L585 PolarHBondContact O-N 3.28Å; S581-L585 VanDerWaalsContact O-N 3.11Å; L582-L585 HydrophobicContact CD2-CD2 4.34Å; L582-L585 PolarHBondContact O-N 3.3Å; K583-L585 VanDerWaalsContact C-N 3.28Å; K583-L585 PolarHBondContact O-N 3.41Å; L585-N587 VanDerWaalsContact C-N 3.3Å; L585-N587 PolarHBondContact O-N 2.83Å; L585-S588 WeakPolarHBondContact O-CB 3.33Å; L585-S588 PolarHBondContact O-N 2.74Å; L585-S588 VanDerWaalsContact O-N 3.15Å; L585-S588 PolarHBondContact O-OG 2.95Å; L585-L590 HydrophobicContact CD1-CD1 4.05Å; L585-P592 HydrophobicContact CD1-CB 4.37Å; L585-P592 HydrophobicContact CD1-CG 4.47Å; L585-P592 HydrophobicContact CD2-CB 3.78Å; L585-P592 HydrophobicContact CD2-CG 3.84Å; L585-P592 HydrophobicContact CG-CB 4.13Å; L585-P592 HydrophobicContact CG-CG 3.88Å; L585-I594 HydrophobicContact CD2-CD1 4.3Å; L585-I594 HydrophobicContact CD2-CG1 4.35Å
586	R	89.8	Confident	91.8	Very high	26 Å²	26	37.6 Å²	37.6	10%	0.098	19%	0.187	C	C	.	.	H	α-helix	trans	-69.7	-26	-178.9	-75.9	-176.3	66.8	120.4	-12.3	113.6	E467 L582 K583 S588 I594 Y638 W673	E467-R586 VanDerWaalsContact CD-NH2 3.32Å; E467-R586 IonicContact OE1-CZ 3.81Å; E467-R586 IonicContact OE1-NH2 3.54Å; E467-R586 PolarHBondContact OE1-NH2 2.81Å; E467-R586 IonicContact OE2-NH2 2.93Å; E467-R586 PolarHBondContact OE2-NH2 2.89Å; E467-R586 VanDerWaalsContact OE2-NH2 3.13Å; L582-R586 WeakPolarHBondContact O-CB 3.41Å; L582-R586 WeakPolarHBondContact O-CG 3.35Å; L582-R586 PolarHBondContact O-N 3.17Å; K583-R586 PolarHBondContact O-N 3.17Å; R586-S588 PolarHBondContact O-N 2.78Å; R586-I594 HydrophobicContact CG-CD1 4.18Å; R586-Y638 PolarHBondContact NH1-O 3.23Å; R586-W673 HydrophobicContact CB-CZ2 4.41Å; R586-W673 HydrophobicContact CG-CZ2 4.22Å; R586-W673 PolarHBondContact O-NE1 3.11Å; R586-W673 VanDerWaalsContact O-NE1 3.14Å
587	N	87.7	Confident	91.8	Very high	133 Å²	133	35.9 Å²	35.9	71%	0.711	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-7.8	174	-68.5	-3.5	0	0	0	112.9	K583 L585	K583-N587 WeakPolarHBondContact O-CB 3.33Å; K583-N587 PolarHBondContact O-N 3.4Å; K583-N587 VanDerWaalsContact O-N 3.08Å; K583-N587 PolarHBondContact O-OD1 3.14Å; L585-N587 VanDerWaalsContact C-N 3.3Å; L585-N587 PolarHBondContact O-N 2.83Å
588	S	89.9	Confident	91.8	Very high	17 Å²	17	35.9 Å²	35.9	12%	0.119	18%	0.177	C	C	.	.	S	Bend	trans	-90.5	164	175.9	78.4	0	0	0	0	112.3	L585 R586 L590	L585-S588 WeakPolarHBondContact O-CB 3.33Å; L585-S588 PolarHBondContact O-N 2.74Å; L585-S588 VanDerWaalsContact O-N 3.15Å; L585-S588 PolarHBondContact O-OG 2.95Å; R586-S588 PolarHBondContact O-N 2.78Å; S588-L590 PolarHBondContact O-N 2.7Å; S588-L590 WeakPolarHBondContact OG-CB 3.18Å; S588-L590 WeakPolarHBondContact OG-CD1 3.27Å; S588-L590 VanDerWaalsContact OG-CG 3.27Å; S588-L590 WeakPolarHBondContact OG-CG 3.47Å; S588-L590 PolarHBondContact OG-N 3.03Å
589	D	90.9	Very high	91.8	Very high	75 Å²	75	31.6 Å²	31.6	40%	0.401	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	6.6	176.7	69.4	-35.9	0	0	0	114	R564 K591	R564-D589 IonicContact CZ-OD1 3.85Å; R564-D589 IonicContact NE-OD1 3.98Å; R564-D589 IonicContact NE-OD2 2.62Å; R564-D589 IonicContact NH2-OD1 2.76Å; R564-D589 PolarHBondContact NH2-OD1 3.22Å; R564-D589 IonicContact NH2-OD2 2.95Å; D589-K591 VanDerWaalsContact C-N 3.25Å; D589-K591 PolarHBondContact O-N 2.94Å
590	L	94.8	Very high	91.8	Very high	6 Å²	6	30.6 Å²	30.6	3%	0.031	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-16.7	-172.5	-63.5	178.6	0	0	0	114	P481 I546 I560 V563 R564 I567 L585 S588	P481-L590 WeakPolarHBondContact CD-O 3.24Å; P481-L590 HydrophobicContact CG-CB 4.45Å; I546-L590 HydrophobicContact CD1-CD1 3.87Å; I560-L590 HydrophobicContact CG2-CD1 3.98Å; I560-L590 HydrophobicContact CG2-CD2 4.22Å; I560-L590 HydrophobicContact CG2-CG 4.15Å; V563-L590 HydrophobicContact CB-CD1 3.96Å; V563-L590 HydrophobicContact CB-CD2 4.4Å; V563-L590 HydrophobicContact CG1-CD1 3.91Å; V563-L590 HydrophobicContact CG1-CD2 4.25Å; R564-L590 HydrophobicContact CB-CD2 3.98Å; R564-L590 HydrophobicContact CG-CD2 4.5Å; I567-L590 HydrophobicContact CD1-CB 4.39Å; I567-L590 HydrophobicContact CD1-CD2 3.78Å; L585-L590 HydrophobicContact CD1-CD1 4.05Å; S588-L590 PolarHBondContact O-N 2.7Å; S588-L590 WeakPolarHBondContact OG-CB 3.18Å; S588-L590 WeakPolarHBondContact OG-CD1 3.27Å; S588-L590 VanDerWaalsContact OG-CG 3.27Å; S588-L590 WeakPolarHBondContact OG-CG 3.47Å; S588-L590 PolarHBondContact OG-N 3.03Å
591	K	95.9	Very high	91.7	Very high	34 Å²	34	28 Å²	28	15%	0.148	15%	0.154	C	C	.	.			trans	49.5	54	178.9	-63.5	169.5	169.9	59.7	0	112.7	Y472 R480 D589 W673	Y472-K591 HydrophobicContact CE1-CD 4.25Å; Y472-K591 HydrophobicContact CE2-CD 3.96Å; R480-K591 WeakPolarHBondContact CB-O 3.4Å; R480-K591 WeakPolarHBondContact CG-O 3.38Å; R480-K591 PolarHBondContact NE-O 3.14Å; D589-K591 VanDerWaalsContact C-N 3.25Å; D589-K591 PolarHBondContact O-N 2.94Å; K591-W673 HydrophobicContact CB-CE3 3.88Å; K591-W673 HydrophobicContact CB-CZ3 4.1Å; K591-W673 WeakPolarHBondContact CE-O 3.31Å; K591-W673 HydrophobicContact CG-CB 4.33Å; K591-W673 HydrophobicContact CG-CD2 4.26Å; K591-W673 HydrophobicContact CG-CE3 3.77Å; K591-W673 HydrophobicContact CG-CZ3 4.48Å; K591-W673 PolarHBondContact NZ-O 3.45Å
592	P	96.8	Very high	91.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.166	C	C	.	.			trans	-61.4	155.7	-176	33.3	-42	0	0	0	111.8	R480 I483 L585 I594 W673	R480-P592 PolarHBondContact NH2-O 2.68Å; I483-P592 HydrophobicContact CG1-CB 3.78Å; L585-P592 HydrophobicContact CD1-CB 4.37Å; L585-P592 HydrophobicContact CD1-CG 4.47Å; L585-P592 HydrophobicContact CD2-CB 3.78Å; L585-P592 HydrophobicContact CD2-CG 3.84Å; L585-P592 HydrophobicContact CG-CB 4.13Å; L585-P592 HydrophobicContact CG-CG 3.88Å; P592-I594 HydrophobicContact CB-CD1 4.49Å; P592-I594 HydrophobicContact CB-CG1 4.06Å; P592-I594 HydrophobicContact CG-CD1 4.07Å; P592-I594 HydrophobicContact CG-CG1 4.18Å; P592-W673 HydrophobicContact CG-CH2 3.91Å; P592-W673 HydrophobicContact CG-CZ2 4.38Å
593	Y	97.4	Very high	90.8	Very high	5 Å²	5	38.1 Å²	38.1	2%	0.02	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	111.1	163	-170.5	-99.4	0	0	0	107.8	P481 I482 I483 I595 D640 T641 L662 Q667	P481-Y593 PolarHBondContact O-N 3.14Å; I482-Y593 HydrophobicContact CD1-CD1 4.06Å; I482-Y593 HydrophobicContact CD1-CG 4.42Å; I483-Y593 PolarHBondContact N-O 3.07Å; Y593-I595 HydrophobicContact CD1-CD1 3.85Å; Y593-I595 HydrophobicContact CD1-CG1 3.7Å; Y593-I595 HydrophobicContact CE1-CD1 3.79Å; Y593-I595 HydrophobicContact CE1-CG1 3.66Å; Y593-D640 HydrophobicContact CD2-CB 3.81Å; Y593-D640 HydrophobicContact CE1-CB 4.43Å; Y593-D640 HydrophobicContact CE2-CB 3.48Å; Y593-D640 VanDerWaalsContact CE2-CB 3.48Å; Y593-D640 HydrophobicContact CG-CB 4.45Å; Y593-T641 PolarHBondContact OH-OG1 2.89Å; Y593-L662 HydrophobicContact CD1-CD1 4.06Å; Y593-L662 HydrophobicContact CD1-CD2 4.44Å; Y593-L662 HydrophobicContact CD2-CD1 4.34Å; Y593-L662 HydrophobicContact CD2-CD2 3.72Å; Y593-L662 HydrophobicContact CE1-CD2 4.42Å; Y593-L662 HydrophobicContact CE2-CD2 3.66Å; Y593-L662 HydrophobicContact CG-CD1 3.9Å; Y593-L662 HydrophobicContact CG-CD2 4.1Å; Y593-Q667 HydrophobicContact CE2-CG 4.3Å
594	I	96.7	Very high	90.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120.4	-167.7	-57.9	159.8	0	0	0	108.9	I483 I485 L582 L585 R586 P592 Y638 F639 D640	I483-I594 HydrophobicContact CB-CG1 4.08Å; I483-I594 HydrophobicContact CG1-CG1 4.4Å; I483-I594 CarbonylContact O-C 3.56Å; I483-I594 WeakPolarHBondContact O-CA 3.49Å; I485-I594 HydrophobicContact CD1-CG2 3.73Å; I485-I594 HydrophobicContact CG1-CG2 3.96Å; I485-I594 HydrophobicContact CG2-CG2 4.32Å; L582-I594 HydrophobicContact CD2-CD1 4.01Å; L582-I594 HydrophobicContact CD2-CG1 4.4Å; L582-I594 HydrophobicContact CD2-CG2 4.02Å; L585-I594 HydrophobicContact CD2-CD1 4.3Å; L585-I594 HydrophobicContact CD2-CG1 4.35Å; R586-I594 HydrophobicContact CG-CD1 4.18Å; P592-I594 HydrophobicContact CB-CD1 4.49Å; P592-I594 HydrophobicContact CB-CG1 4.06Å; P592-I594 HydrophobicContact CG-CD1 4.07Å; P592-I594 HydrophobicContact CG-CG1 4.18Å; I594-Y638 VanDerWaalsContact CD1-O 3.28Å; I594-Y638 WeakPolarHBondContact CD1-O 3.44Å; I594-F639 HydrophobicContact CB-CB 4.28Å; I594-F639 HydrophobicContact CG2-CB 3.79Å; I594-D640 PolarHBondContact N-OD2 3.38Å; I594-D640 PolarHBondContact O-N 2.89Å
595	I	96.4	Very high	90	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	120.2	-177.6	-55.2	176	0	0	0	108.9	I482 I483 L484 I485 Y593 I597 T641 I643 L655	I482-I595 HydrophobicContact CG2-CD1 4.02Å; I483-I595 PolarHBondContact O-N 3.45Å; L484-I595 HydrophobicContact CD2-CB 4.1Å; I485-I595 PolarHBondContact N-O 3.37Å; Y593-I595 HydrophobicContact CD1-CD1 3.85Å; Y593-I595 HydrophobicContact CD1-CG1 3.7Å; Y593-I595 HydrophobicContact CE1-CD1 3.79Å; Y593-I595 HydrophobicContact CE1-CG1 3.66Å; I595-I597 HydrophobicContact CG2-CD1 3.92Å; I595-T641 WeakPolarHBondContact CA-O 3.39Å; I595-I643 HydrophobicContact CG2-CD1 3.68Å; I595-I643 HydrophobicContact CG2-CG1 3.87Å; I595-L655 HydrophobicContact CD1-CD1 3.37Å; I595-L655 HydrophobicContact CG2-CD1 4.4Å
596	F	95.4	Very high	89.4	Confident	1 Å²	1	40.5 Å²	40.5	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.9	174.9	-176.7	-106.4	0	0	0	110.9	I485 A598 T628 M631 F639 T641 A642 I643	I485-F596 HydrophobicContact CD1-CB 4.32Å; I485-F596 HydrophobicContact CD1-CD2 3.94Å; I485-F596 HydrophobicContact CG1-CB 4.15Å; I485-F596 HydrophobicContact CG1-CD2 3.9Å; F596-A598 HydrophobicContact CD1-CB 4.02Å; F596-A598 HydrophobicContact CE1-CB 3.7Å; F596-T628 HydrophobicContact CE1-CG2 3.99Å; F596-T628 HydrophobicContact CZ-CG2 3.74Å; F596-M631 HydrophobicContact CE2-CB 4.09Å; F596-M631 HydrophobicContact CE2-CE 4.06Å; F596-M631 HydrophobicContact CZ-CB 4.42Å; F596-F639 HydrophobicContact CB-CB 4.29Å; F596-F639 HydrophobicContact CB-CD1 3.72Å; F596-F639 HydrophobicContact CB-CD2 4.05Å; F596-F639 HydrophobicContact CB-CE1 3.85Å; F596-F639 HydrophobicContact CB-CE2 4.25Å; F596-F639 HydrophobicContact CB-CG 3.78Å; F596-F639 HydrophobicContact CB-CZ 4.14Å; F596-F639 HydrophobicContact CD1-CE1 4.27Å; F596-F639 HydrophobicContact CD1-CZ 4.29Å; F596-F639 HydrophobicContact CD2-CD1 4.24Å; F596-F639 HydrophobicContact CD2-CE1 4.05Å; F596-F639 HydrophobicContact CG-CD1 4.09Å; F596-F639 AromaticContact CG-CE1 3.81Å; F596-F639 HydrophobicContact CG-CE1 3.81Å; F596-F639 HydrophobicContact CG-CZ 4.2Å; F596-T641 PolarHBondContact N-O 3.18Å; F596-A642 HydrophobicContact CB-CB 4.29Å; F596-A642 HydrophobicContact CD1-CB 4.12Å; F596-A642 CarbonylContact O-C 3.4Å; F596-A642 VanDerWaalsContact O-CA 3.28Å; F596-A642 WeakPolarHBondContact O-CA 3.49Å; F596-I643 PolarHBondContact O-N 2.98Å
597	I	94.3	Very high	88.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	101.7	176.6	-52.8	-57.8	0	0	0	108	L484 I485 C490 L495 I595 I643 N645	L484-I597 HydrophobicContact CD2-CD1 4.48Å; I485-I597 PolarHBondContact O-N 2.94Å; C490-I597 HydrophobicContact CB-CG2 4.41Å; C490-I597 WeakPolarHBondContact O-CG2 3.31Å; L495-I597 HydrophobicContact CD1-CD1 4.18Å; L495-I597 HydrophobicContact CD1-CG2 4.34Å; I595-I597 HydrophobicContact CG2-CD1 3.92Å; I597-I643 HydrophobicContact CD1-CB 4.06Å; I597-I643 HydrophobicContact CD1-CD1 4.19Å; I597-I643 HydrophobicContact CD1-CG1 4.49Å; I597-N645 HydrophobicContact CG2-CB 4Å
598	A	92.1	Very high	88.2	Confident	12 Å²	12	37.2 Å²	37.2	10%	0.099	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	142.6	179.6	0	0	0	0	0	111	F596 I643 V644 N645	F596-A598 HydrophobicContact CD1-CB 4.02Å; F596-A598 HydrophobicContact CE1-CB 3.7Å; A598-I643 PolarHBondContact N-O 2.88Å; A598-V644 HydrophobicContact CB-CG2 4.34Å; A598-N645 PolarHBondContact O-N 2.96Å
599	P	88.4	Confident	87.5	Confident	15 Å²	15	37 Å²	37	10%	0.097	19%	0.188	C	C	.	.			trans	-65.8	156.4	167	28.8	-32.2	0	0	0	111.1	L605 I624 T628	P599-L605 HydrophobicContact CB-CD2 4.2Å; P599-I624 HydrophobicContact CB-CG2 4.35Å; P599-I624 HydrophobicContact CG-CG2 4.16Å; P599-T628 VanDerWaalsContact CD-CG2 3.49Å; P599-T628 WeakPolarHBondContact CD-OG1 3.41Å; P599-T628 HydrophobicContact CG-CG2 3.98Å; P599-T628 WeakPolarHBondContact CG-OG1 3.28Å
600	P	86.3	Confident	86.9	Confident	9 Å²	9	35.6 Å²	35.6	6%	0.058	19%	0.187	C	C	.	.			trans	-75.3	-176.8	170.4	36.1	-35.1	0	0	0	110.7	R604 L605 L608 V644 N645 S646	P600-R604 HydrophobicContact CB-CB 4.01Å; P600-R604 HydrophobicContact CB-CG 3.89Å; P600-R604 HydrophobicContact CG-CB 4.16Å; P600-R604 HydrophobicContact CG-CG 4.01Å; P600-L605 HydrophobicContact CG-CB 4.14Å; P600-L608 HydrophobicContact CG-CD1 4.03Å; P600-V644 HydrophobicContact CB-CG1 4.38Å; P600-N645 WeakPolarHBondContact CD-O 3.38Å; P600-S646 WeakPolarHBondContact CB-OG 3.18Å
601	S	84.6	Confident	85.8	Confident	78 Å²	78	43.4 Å²	43.4	55%	0.545	22%	0.221	S	C	.	.			trans	-53.5	152.8	175.3	70.1	0	0	0	0	112.5	E603 R604 L605	S601-E603 PolarHBondContact O-N 3.45Å; S601-E603 VanDerWaalsContact O-N 3.15Å; S601-R604 PolarHBondContact O-N 3.2Å; S601-R604 WeakPolarHBondContact OG-CB 3.38Å; S601-L605 PolarHBondContact O-N 2.92Å
602	Q	81.2	Confident	84.5	Confident	63 Å²	63	46.4 Å²	46.4	29%	0.294	24%	0.235	S	C	.	.	H	α-helix	trans	-51.5	-42.9	-176.3	-163.7	-176	-69.5	0	0	113.4	R606 L621 I625	Q602-R606 WeakPolarHBondContact O-CB 3.29Å; Q602-R606 PolarHBondContact O-N 3.4Å; Q602-L621 HydrophobicContact CG-CB 4.22Å; Q602-I625 HydrophobicContact CB-CD1 3.37Å; Q602-I625 HydrophobicContact CG-CD1 3.55Å
603	E	80.6	Confident	83.2	Confident	154 Å²	154	49.7 Å²	49.7	72%	0.72	27%	0.269	S	S	*	.	H	α-helix	trans	-65.4	-42.2	179.4	-65.9	176.3	176.5	0	0	111.5	S601 R606 A607	S601-E603 PolarHBondContact O-N 3.45Å; S601-E603 VanDerWaalsContact O-N 3.15Å; E603-R606 PolarHBondContact O-N 2.75Å; E603-A607 PolarHBondContact O-N 3.43Å; E603-A607 VanDerWaalsContact O-N 3.09Å
604	R	79.3	Confident	82.2	Confident	111 Å²	111	54 Å²	54	42%	0.419	29%	0.288	S	S	.	.	H	α-helix	trans	-69.9	-42	179.3	-173.1	62.9	177.8	-169.6	-0.5	111.5	P600 S601 R606 A607 L608	P600-R604 HydrophobicContact CB-CB 4.01Å; P600-R604 HydrophobicContact CB-CG 3.89Å; P600-R604 HydrophobicContact CG-CB 4.16Å; P600-R604 HydrophobicContact CG-CG 4.01Å; S601-R604 PolarHBondContact O-N 3.2Å; S601-R604 WeakPolarHBondContact OG-CB 3.38Å; R604-R606 VanDerWaalsContact C-N 3.33Å; R604-R606 PolarHBondContact O-N 2.81Å; R604-A607 PolarHBondContact O-N 3.48Å; R604-L608 HydrophobicContact CG-CD1 4.43Å; R604-L608 WeakPolarHBondContact O-CG 3.41Å; R604-L608 PolarHBondContact O-N 3.01Å
605	L	79.6	Confident	81.2	Confident	8 Å²	8	60.8 Å²	60.8	4%	0.042	32%	0.324	C	S	.	.	H	α-helix	trans	-60.2	-44	176.3	-177.2	61.1	0	0	0	111	P599 P600 S601 A607 L608 L609 L621 I624	P599-L605 HydrophobicContact CB-CD2 4.2Å; P600-L605 HydrophobicContact CG-CB 4.14Å; S601-L605 PolarHBondContact O-N 2.92Å; L605-A607 PolarHBondContact O-N 3.5Å; L605-L608 PolarHBondContact O-N 2.87Å; L605-L609 HydrophobicContact CD1-CD1 3.93Å; L605-L609 HydrophobicContact CD1-CG 4.33Å; L605-L609 HydrophobicContact CG-CD1 3.92Å; L605-L609 WeakPolarHBondContact O-CG 3.14Å; L605-L609 PolarHBondContact O-N 3.14Å; L605-L621 HydrophobicContact CB-CD2 4.36Å; L605-L621 HydrophobicContact CD2-CD2 3.72Å; L605-L621 HydrophobicContact CG-CD2 3.75Å; L605-I624 HydrophobicContact CD2-CB 4.48Å; L605-I624 HydrophobicContact CD2-CD1 4.37Å; L605-I624 HydrophobicContact CD2-CG2 4.01Å
606	R	79.9	Confident	80.2	Confident	103 Å²	103	62.1 Å²	62.1	39%	0.389	33%	0.333	S	S	.	.	H	α-helix	trans	-58.4	-46.1	174	-173.2	-177.1	-68.1	146.4	-3.7	111.8	Q602 E603 R604 A610 L621	Q602-R606 WeakPolarHBondContact O-CB 3.29Å; Q602-R606 PolarHBondContact O-N 3.4Å; E603-R606 PolarHBondContact O-N 2.75Å; R604-R606 VanDerWaalsContact C-N 3.33Å; R604-R606 PolarHBondContact O-N 2.81Å; R606-A610 VanDerWaalsContact O-CB 3.31Å; R606-A610 WeakPolarHBondContact O-CB 3.17Å; R606-A610 PolarHBondContact O-N 2.95Å; R606-L621 HydrophobicContact CB-CD1 3.74Å; R606-L621 HydrophobicContact CG-CD1 3.97Å
607	A	77.8	Confident	79.5	Confident	47 Å²	47	68.5 Å²	68.5	39%	0.388	36%	0.36	S	S	.	.	H	α-helix	trans	-65.4	-37.3	-179.8	0	0	0	0	0	112.8	E603 R604 L605 K611	E603-A607 PolarHBondContact O-N 3.43Å; E603-A607 VanDerWaalsContact O-N 3.09Å; R604-A607 PolarHBondContact O-N 3.48Å; L605-A607 PolarHBondContact O-N 3.5Å; A607-K611 WeakPolarHBondContact O-CG 3.39Å; A607-K611 PolarHBondContact O-N 3.38Å; A607-K611 VanDerWaalsContact O-N 3.17Å
608	L	73.9	Confident	79	Confident	44 Å²	44	71.3 Å²	71.3	23%	0.23	38%	0.379	C	S	.	.	H	α-helix	trans	-67.7	-47.6	176.5	-72	174.1	0	0	0	111.6	P600 R604 L605 A610 K611 E612	P600-L608 HydrophobicContact CG-CD1 4.03Å; R604-L608 HydrophobicContact CG-CD1 4.43Å; R604-L608 WeakPolarHBondContact O-CG 3.41Å; R604-L608 PolarHBondContact O-N 3.01Å; L605-L608 PolarHBondContact O-N 2.87Å; L608-A610 VanDerWaalsContact C-N 3.3Å; L608-A610 PolarHBondContact O-N 3.15Å; L608-K611 WeakPolarHBondContact O-CB 3.01Å; L608-K611 PolarHBondContact O-N 2.74Å; L608-K611 VanDerWaalsContact O-N 3.12Å; L608-E612 PolarHBondContact O-N 2.85Å; L608-E612 VanDerWaalsContact O-N 3.16Å
609	L	75.9	Confident	78.6	Confident	12 Å²	12	76.2 Å²	76.2	6%	0.063	40%	0.4	C	S	.	.	H	α-helix	trans	-63	-40.3	178.7	-69.5	168	0	0	0	110.9	L605 K611 E612 G613 K614 P616 L621	L605-L609 HydrophobicContact CD1-CD1 3.93Å; L605-L609 HydrophobicContact CD1-CG 4.33Å; L605-L609 HydrophobicContact CG-CD1 3.92Å; L605-L609 WeakPolarHBondContact O-CG 3.14Å; L605-L609 PolarHBondContact O-N 3.14Å; L609-K611 VanDerWaalsContact C-N 3.3Å; L609-K611 PolarHBondContact O-N 2.88Å; L609-E612 CarbonylContact O-C 3.6Å; L609-E612 WeakPolarHBondContact O-CA 3.4Å; L609-E612 WeakPolarHBondContact O-CB 3.21Å; L609-E612 PolarHBondContact O-N 2.79Å; L609-G613 PolarHBondContact O-N 3.36Å; L609-K614 CarbonylContact C-O 3.5Å; L609-K614 HydrophobicContact CB-CB 4.24Å; L609-K614 HydrophobicContact CD2-CB 4.44Å; L609-K614 HydrophobicContact CD2-CD 3.94Å; L609-K614 CarbonylContact O-C 3.57Å; L609-K614 WeakPolarHBondContact O-CA 3.33Å; L609-K614 PolarHBondContact O-N 3.46Å; L609-P616 HydrophobicContact CB-CG 3.98Å; L609-P616 HydrophobicContact CD1-CB 4.4Å; L609-P616 HydrophobicContact CD1-CG 3.66Å; L609-P616 HydrophobicContact CG-CG 4.43Å; L609-L621 HydrophobicContact CD1-CD2 3.89Å
610	A	76.8	Confident	78.3	Confident	45 Å²	45	79.5 Å²	79.5	37%	0.372	41%	0.414	S	S	.	.	H	α-helix	trans	-60.3	-37.2	174.9	0	0	0	0	0	112.7	R606 L608 E612 G613 K614	R606-A610 VanDerWaalsContact O-CB 3.31Å; R606-A610 WeakPolarHBondContact O-CB 3.17Å; R606-A610 PolarHBondContact O-N 2.95Å; L608-A610 VanDerWaalsContact C-N 3.3Å; L608-A610 PolarHBondContact O-N 3.15Å; A610-E612 VanDerWaalsContact C-N 3.29Å; A610-E612 PolarHBondContact O-N 3.34Å; A610-G613 PolarHBondContact O-N 2.88Å; A610-G613 VanDerWaalsContact O-N 3.13Å; A610-K614 WeakPolarHBondContact CA-O 3.36Å; A610-K614 PolarHBondContact N-O 2.9Å; A610-K614 VanDerWaalsContact N-O 3.16Å
611	K	71.6	Confident	78	Confident	171 Å²	171	79.1 Å²	79.1	74%	0.743	41%	0.411	S	S	*	.	H	α-helix	trans	-66.6	-29.3	173.9	-77.7	-178	176.5	-172.3	0	113.1	A607 L608 L609 G613	A607-K611 WeakPolarHBondContact O-CG 3.39Å; A607-K611 PolarHBondContact O-N 3.38Å; A607-K611 VanDerWaalsContact O-N 3.17Å; L608-K611 WeakPolarHBondContact O-CB 3.01Å; L608-K611 PolarHBondContact O-N 2.74Å; L608-K611 VanDerWaalsContact O-N 3.12Å; L609-K611 VanDerWaalsContact C-N 3.3Å; L609-K611 PolarHBondContact O-N 2.88Å; K611-G613 PolarHBondContact O-N 2.99Å
612	E	68.9	Low	78	Confident	97 Å²	97	82.6 Å²	82.6	45%	0.453	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	5.2	173.6	-66.6	-174.3	177.2	0	0	113.2	L608 L609 A610 K614	L608-E612 PolarHBondContact O-N 2.85Å; L608-E612 VanDerWaalsContact O-N 3.16Å; L609-E612 CarbonylContact O-C 3.6Å; L609-E612 WeakPolarHBondContact O-CA 3.4Å; L609-E612 WeakPolarHBondContact O-CB 3.21Å; L609-E612 PolarHBondContact O-N 2.79Å; A610-E612 VanDerWaalsContact C-N 3.29Å; A610-E612 PolarHBondContact O-N 3.34Å; E612-K614 PolarHBondContact O-N 2.82Å; E612-K614 IonicContact OE2-NZ 2.75Å; E612-K614 PolarHBondContact OE2-NZ 3.45Å
613	G	71	Confident	78.2	Confident	69 Å²	69	84.5 Å²	84.5	71%	0.711	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	11.2	-175.7	0	0	0	0	0	113.7	L609 A610 K611	L609-G613 PolarHBondContact O-N 3.36Å; A610-G613 PolarHBondContact O-N 2.88Å; A610-G613 VanDerWaalsContact O-N 3.13Å; K611-G613 PolarHBondContact O-N 2.99Å
614	K	75.5	Confident	78.3	Confident	94 Å²	94	78.4 Å²	78.4	41%	0.409	39%	0.393	S	S	.	.			trans	-96.6	119.6	173.5	-63.2	172.4	-172.5	152.8	0	108.6	L609 A610 E612 P616	L609-K614 CarbonylContact C-O 3.5Å; L609-K614 HydrophobicContact CB-CB 4.24Å; L609-K614 HydrophobicContact CD2-CB 4.44Å; L609-K614 HydrophobicContact CD2-CD 3.94Å; L609-K614 CarbonylContact O-C 3.57Å; L609-K614 WeakPolarHBondContact O-CA 3.33Å; L609-K614 PolarHBondContact O-N 3.46Å; A610-K614 WeakPolarHBondContact CA-O 3.36Å; A610-K614 PolarHBondContact N-O 2.9Å; A610-K614 VanDerWaalsContact N-O 3.16Å; E612-K614 PolarHBondContact O-N 2.82Å; E612-K614 IonicContact OE2-NZ 2.75Å; E612-K614 PolarHBondContact OE2-NZ 3.45Å; K614-P616 WeakPolarHBondContact O-CD 3.32Å
615	N	75.4	Confident	78.6	Confident	143 Å²	143	75.9 Å²	75.9	77%	0.765	39%	0.387	S	S	*	.			trans	-106.2	79	171.4	-82.1	-23.8	0	0	0	109.4
616	P	74.7	Confident	78.9	Confident	28 Å²	28	79 Å²	79	18%	0.182	40%	0.402	C	S	.	.			trans	-64.3	148.2	178	31.4	-39.3	0	0	0	110.5	L609 K614 E620 L621	L609-P616 HydrophobicContact CB-CG 3.98Å; L609-P616 HydrophobicContact CD1-CB 4.4Å; L609-P616 HydrophobicContact CD1-CG 3.66Å; L609-P616 HydrophobicContact CG-CG 4.43Å; K614-P616 WeakPolarHBondContact O-CD 3.32Å; P616-E620 VanDerWaalsContact CA-OE2 3.32Å; P616-E620 WeakPolarHBondContact CA-OE2 3.3Å; P616-E620 HydrophobicContact CB-CB 4.44Å; P616-E620 WeakPolarHBondContact CB-OE2 3.41Å; P616-L621 HydrophobicContact CB-CD2 4.42Å; P616-L621 HydrophobicContact CB-CG 4.38Å; P616-L621 HydrophobicContact CG-CD1 4.33Å; P616-L621 HydrophobicContact CG-CD2 3.86Å; P616-L621 HydrophobicContact CG-CG 4.06Å
617	K	82	Confident	79.2	Confident	135 Å²	135	78.8 Å²	78.8	59%	0.587	40%	0.404	S	S	*	.			trans	-68.1	150.2	175.7	-66.2	178.3	-176.9	171.2	0	110.2	E619 E620 L621	K617-E619 PolarHBondContact O-N 3.09Å; K617-E619 VanDerWaalsContact O-N 3.13Å; K617-E620 HydrophobicContact CB-CG 4.24Å; K617-E620 PolarHBondContact N-OE2 2.86Å; K617-E620 WeakPolarHBondContact O-CB 3.46Å; K617-E620 PolarHBondContact O-N 3.17Å; K617-L621 PolarHBondContact O-N 3.38Å
618	P	82.6	Confident	79.6	Confident	59 Å²	59	77.1 Å²	77.1	38%	0.383	39%	0.389	S	S	.	.	H	α-helix	trans	-52.7	-33.2	175	-26.6	35.3	0	0	0	113.8	L621 R622	P618-L621 PolarHBondContact O-N 2.89Å; P618-R622 PolarHBondContact O-N 2.86Å; P618-R622 VanDerWaalsContact O-N 3.13Å
619	E	84	Confident	80.2	Confident	116 Å²	116	81.8 Å²	81.8	54%	0.542	40%	0.403	S	S	.	.	H	α-helix	trans	-65.8	-41.8	177.6	-64.9	69	-148.6	0	0	112	K617 L621 R622 E623	K617-E619 PolarHBondContact O-N 3.09Å; K617-E619 VanDerWaalsContact O-N 3.13Å; E619-L621 VanDerWaalsContact C-N 3.33Å; E619-L621 PolarHBondContact O-N 3.36Å; E619-R622 PolarHBondContact O-N 2.76Å; E619-E623 WeakPolarHBondContact O-CB 3.5Å; E619-E623 PolarHBondContact O-N 3.13Å
620	E	82.2	Confident	80.7	Confident	84 Å²	84	85.7 Å²	85.7	39%	0.393	42%	0.421	S	S	.	.	H	α-helix	trans	-65	-38.7	177.6	-66.1	165.8	-167.2	0	0	111.1	P616 K617 E623 I624	P616-E620 VanDerWaalsContact CA-OE2 3.32Å; P616-E620 WeakPolarHBondContact CA-OE2 3.3Å; P616-E620 HydrophobicContact CB-CB 4.44Å; P616-E620 WeakPolarHBondContact CB-OE2 3.41Å; K617-E620 HydrophobicContact CB-CG 4.24Å; K617-E620 PolarHBondContact N-OE2 2.86Å; K617-E620 WeakPolarHBondContact O-CB 3.46Å; K617-E620 PolarHBondContact O-N 3.17Å; E620-E623 PolarHBondContact O-N 2.79Å; E620-I624 VanDerWaalsContact O-CG1 3.31Å; E620-I624 WeakPolarHBondContact O-CG1 3.3Å; E620-I624 PolarHBondContact O-N 3.48Å
621	L	81.3	Confident	81.3	Confident	0 Å²	0	84.8 Å²	84.8	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-65.1	-40.9	175.9	-67.5	171.1	0	0	0	111.9	Q602 L605 R606 L609 P616 K617 P618 E619 I624 I625	Q602-L621 HydrophobicContact CG-CB 4.22Å; L605-L621 HydrophobicContact CB-CD2 4.36Å; L605-L621 HydrophobicContact CD2-CD2 3.72Å; L605-L621 HydrophobicContact CG-CD2 3.75Å; R606-L621 HydrophobicContact CB-CD1 3.74Å; R606-L621 HydrophobicContact CG-CD1 3.97Å; L609-L621 HydrophobicContact CD1-CD2 3.89Å; P616-L621 HydrophobicContact CB-CD2 4.42Å; P616-L621 HydrophobicContact CB-CG 4.38Å; P616-L621 HydrophobicContact CG-CD1 4.33Å; P616-L621 HydrophobicContact CG-CD2 3.86Å; P616-L621 HydrophobicContact CG-CG 4.06Å; K617-L621 PolarHBondContact O-N 3.38Å; P618-L621 PolarHBondContact O-N 2.89Å; E619-L621 VanDerWaalsContact C-N 3.33Å; E619-L621 PolarHBondContact O-N 3.36Å; L621-I624 PolarHBondContact O-N 3.3Å; L621-I625 WeakPolarHBondContact O-CG1 3.23Å; L621-I625 PolarHBondContact O-N 2.68Å
622	R	83.9	Confident	82	Confident	152 Å²	152	81.2 Å²	81.2	57%	0.574	40%	0.395	S	S	*	.	H	α-helix	trans	-64.8	-42.3	174.8	-75.2	179.3	180	157.2	-0.6	111.3	P618 E619 I624 I625 E626	P618-R622 PolarHBondContact O-N 2.86Å; P618-R622 VanDerWaalsContact O-N 3.13Å; E619-R622 PolarHBondContact O-N 2.76Å; R622-I624 VanDerWaalsContact C-N 3.32Å; R622-I624 PolarHBondContact O-N 2.74Å; R622-I625 PolarHBondContact O-N 3.36Å; R622-E626 WeakPolarHBondContact O-CB 3.12Å; R622-E626 PolarHBondContact O-N 3.42Å
623	E	84.8	Confident	82.7	Confident	102 Å²	102	82.7 Å²	82.7	48%	0.477	40%	0.403	S	S	.	.	H	α-helix	trans	-61.2	-40.2	177.6	-168.9	-173.7	159.8	0	0	111.9	E619 E620 K627	E619-E623 WeakPolarHBondContact O-CB 3.5Å; E619-E623 PolarHBondContact O-N 3.13Å; E620-E623 PolarHBondContact O-N 2.79Å; E623-K627 HydrophobicContact CG-CD 4.16Å; E623-K627 VanDerWaalsContact O-CB 3.27Å; E623-K627 WeakPolarHBondContact O-CB 3.46Å; E623-K627 VanDerWaalsContact O-CG 3.27Å; E623-K627 WeakPolarHBondContact O-CG 3.46Å; E623-K627 PolarHBondContact O-N 3.42Å; E623-K627 WeakPolarHBondContact OE1-CE 3.42Å; E623-K627 IonicContact OE1-NZ 2.91Å; E623-K627 PolarHBondContact OE1-NZ 3.44Å
624	I	82.9	Confident	83.4	Confident	26 Å²	26	84.3 Å²	84.3	13%	0.133	40%	0.395	C	S	.	.	H	α-helix	trans	-62.3	-45.8	175.5	-69.2	164.2	0	0	0	111	P487 P599 L605 E620 L621 R622 T628	P487-I624 HydrophobicContact CB-CG2 4.23Å; P599-I624 HydrophobicContact CB-CG2 4.35Å; P599-I624 HydrophobicContact CG-CG2 4.16Å; L605-I624 HydrophobicContact CD2-CB 4.48Å; L605-I624 HydrophobicContact CD2-CD1 4.37Å; L605-I624 HydrophobicContact CD2-CG2 4.01Å; E620-I624 VanDerWaalsContact O-CG1 3.31Å; E620-I624 WeakPolarHBondContact O-CG1 3.3Å; E620-I624 PolarHBondContact O-N 3.48Å; L621-I624 PolarHBondContact O-N 3.3Å; R622-I624 VanDerWaalsContact C-N 3.32Å; R622-I624 PolarHBondContact O-N 2.74Å; I624-T628 WeakPolarHBondContact O-CB 3.18Å; I624-T628 PolarHBondContact O-N 3.4Å; I624-T628 PolarHBondContact O-OG1 2.93Å
625	I	85.1	Confident	83.9	Confident	58 Å²	58	81.4 Å²	81.4	30%	0.297	38%	0.384	S	S	.	.	H	α-helix	trans	-66.9	-43.8	-179.2	-66.8	169.5	0	0	0	110.8	Q602 L621 R622 T628 R629	Q602-I625 HydrophobicContact CB-CD1 3.37Å; Q602-I625 HydrophobicContact CG-CD1 3.55Å; L621-I625 WeakPolarHBondContact O-CG1 3.23Å; L621-I625 PolarHBondContact O-N 2.68Å; R622-I625 PolarHBondContact O-N 3.36Å; I625-T628 VanDerWaalsContact O-CB 3.3Å; I625-T628 WeakPolarHBondContact O-CB 3.27Å; I625-T628 PolarHBondContact O-N 3.24Å; I625-T628 VanDerWaalsContact O-N 3.17Å; I625-R629 PolarHBondContact O-N 3.24Å
626	E	86.6	Confident	84.4	Confident	75 Å²	75	75.1 Å²	75.1	35%	0.35	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-47.1	177.7	-169	58.1	-139.3	0	0	110.9	R622 T628 R629 E630	R622-E626 WeakPolarHBondContact O-CB 3.12Å; R622-E626 PolarHBondContact O-N 3.42Å; E626-T628 VanDerWaalsContact C-N 3.26Å; E626-T628 PolarHBondContact O-N 3.05Å; E626-R629 WeakPolarHBondContact O-CB 3.35Å; E626-R629 PolarHBondContact O-N 3Å; E626-R629 VanDerWaalsContact O-N 3.1Å; E626-R629 IonicContact OE1-CZ 3.27Å; E626-R629 VanDerWaalsContact OE1-CZ 3.31Å; E626-R629 IonicContact OE1-NE 2.8Å; E626-R629 PolarHBondContact OE1-NE 3.29Å; E626-R629 VanDerWaalsContact OE1-NE 3.14Å; E626-R629 IonicContact OE1-NH2 3.8Å; E626-R629 PolarHBondContact OE1-NH2 3.26Å; E626-R629 IonicContact OE2-CZ 3.78Å; E626-R629 IonicContact OE2-NE 2.82Å; E626-R629 IonicContact OE2-NH2 2.88Å; E626-E630 WeakPolarHBondContact O-CG 3.38Å; E626-E630 PolarHBondContact O-N 2.95Å
627	K	85.3	Confident	85	Confident	97 Å²	97	74.7 Å²	74.7	42%	0.422	35%	0.348	S	S	.	.	H	α-helix	trans	-59.2	-37.2	174	-77.9	176.2	171.2	171.2	0	112.6	E623 M631	E623-K627 HydrophobicContact CG-CD 4.16Å; E623-K627 VanDerWaalsContact O-CB 3.27Å; E623-K627 WeakPolarHBondContact O-CB 3.46Å; E623-K627 VanDerWaalsContact O-CG 3.27Å; E623-K627 WeakPolarHBondContact O-CG 3.46Å; E623-K627 PolarHBondContact O-N 3.42Å; E623-K627 WeakPolarHBondContact OE1-CE 3.42Å; E623-K627 IonicContact OE1-NZ 2.91Å; E623-K627 PolarHBondContact OE1-NZ 3.44Å; K627-M631 WeakPolarHBondContact O-CB 3.36Å; K627-M631 WeakPolarHBondContact O-CG 3.31Å; K627-M631 PolarHBondContact O-N 3.49Å
628	T	86.5	Confident	85.4	Confident	13 Å²	13	70.1 Å²	70.1	8%	0.08	33%	0.327	C	S	.	.	H	α-helix	trans	-60.7	-49	175.3	-53.9	0	0	0	0	110.3	P487 F596 P599 I624 I625 E626 M631 E632	P487-T628 HydrophobicContact CG-CG2 4.32Å; P487-T628 WeakPolarHBondContact CG-OG1 3.5Å; F596-T628 HydrophobicContact CE1-CG2 3.99Å; F596-T628 HydrophobicContact CZ-CG2 3.74Å; P599-T628 VanDerWaalsContact CD-CG2 3.49Å; P599-T628 WeakPolarHBondContact CD-OG1 3.41Å; P599-T628 HydrophobicContact CG-CG2 3.98Å; P599-T628 WeakPolarHBondContact CG-OG1 3.28Å; I624-T628 WeakPolarHBondContact O-CB 3.18Å; I624-T628 PolarHBondContact O-N 3.4Å; I624-T628 PolarHBondContact O-OG1 2.93Å; I625-T628 VanDerWaalsContact O-CB 3.3Å; I625-T628 WeakPolarHBondContact O-CB 3.27Å; I625-T628 PolarHBondContact O-N 3.24Å; I625-T628 VanDerWaalsContact O-N 3.17Å; E626-T628 VanDerWaalsContact C-N 3.26Å; E626-T628 PolarHBondContact O-N 3.05Å; T628-M631 WeakPolarHBondContact O-CB 3.47Å; T628-M631 PolarHBondContact O-N 3.39Å; T628-E632 PolarHBondContact O-N 3.03Å
629	R	87.5	Confident	85.7	Confident	141 Å²	141	68.5 Å²	68.5	53%	0.532	31%	0.314	S	S	.	.	H	α-helix	trans	-61.6	-46.4	179.7	-171.7	178.8	75	139.8	3.8	111.4	I625 E626 M631 E632 Q633	I625-R629 PolarHBondContact O-N 3.24Å; E626-R629 WeakPolarHBondContact O-CB 3.35Å; E626-R629 PolarHBondContact O-N 3Å; E626-R629 VanDerWaalsContact O-N 3.1Å; E626-R629 IonicContact OE1-CZ 3.27Å; E626-R629 VanDerWaalsContact OE1-CZ 3.31Å; E626-R629 IonicContact OE1-NE 2.8Å; E626-R629 PolarHBondContact OE1-NE 3.29Å; E626-R629 VanDerWaalsContact OE1-NE 3.14Å; E626-R629 IonicContact OE1-NH2 3.8Å; E626-R629 PolarHBondContact OE1-NH2 3.26Å; E626-R629 IonicContact OE2-CZ 3.78Å; E626-R629 IonicContact OE2-NE 2.82Å; E626-R629 IonicContact OE2-NH2 2.88Å; R629-M631 VanDerWaalsContact C-N 3.32Å; R629-M631 PolarHBondContact O-N 2.83Å; R629-E632 PolarHBondContact O-N 3.47Å; R629-Q633 VanDerWaalsContact O-CB 3.32Å; R629-Q633 WeakPolarHBondContact O-CB 3.42Å; R629-Q633 PolarHBondContact O-N 3.46Å
630	E	87.1	Confident	86.2	Confident	94 Å²	94	65 Å²	65	44%	0.439	30%	0.3	S	S	.	.	H	α-helix	trans	-59.7	-41.9	175.5	-71.4	176.2	174.9	0	0	111.9	E626 Q633 N634	E626-E630 WeakPolarHBondContact O-CG 3.38Å; E626-E630 PolarHBondContact O-N 2.95Å; E630-Q633 PolarHBondContact O-N 2.95Å; E630-N634 VanDerWaalsContact O-CB 3.27Å; E630-N634 WeakPolarHBondContact O-CB 3.4Å; E630-N634 VanDerWaalsContact O-CG 3.24Å; E630-N634 PolarHBondContact O-N 3.19Å; E630-N634 PolarHBondContact O-ND2 2.94Å
631	M	87.6	Confident	86.7	Confident	26 Å²	26	62.8 Å²	62.8	13%	0.128	29%	0.292	C	S	.	.	H	α-helix	trans	-64.5	-44.5	178.1	-74.5	170.8	76.6	0	0	112.1	P487 T579 F596 K627 T628 R629 N635	P487-M631 HydrophobicContact CG-SD 4.14Å; T579-M631 HydrophobicContact CG2-CB 4.45Å; T579-M631 HydrophobicContact CG2-CE 3.31Å; T579-M631 HydrophobicContact CG2-CG 4.21Å; F596-M631 HydrophobicContact CE2-CB 4.09Å; F596-M631 HydrophobicContact CE2-CE 4.06Å; F596-M631 HydrophobicContact CZ-CB 4.42Å; K627-M631 WeakPolarHBondContact O-CB 3.36Å; K627-M631 WeakPolarHBondContact O-CG 3.31Å; K627-M631 PolarHBondContact O-N 3.49Å; T628-M631 WeakPolarHBondContact O-CB 3.47Å; T628-M631 PolarHBondContact O-N 3.39Å; R629-M631 VanDerWaalsContact C-N 3.32Å; R629-M631 PolarHBondContact O-N 2.83Å; M631-N635 WeakPolarHBondContact O-CA 3.47Å; M631-N635 WeakPolarHBondContact O-CB 3.49Å; M631-N635 PolarHBondContact O-N 3.37Å
632	E	86.4	Confident	87.3	Confident	96 Å²	96	65 Å²	65	45%	0.449	31%	0.31	S	S	.	.	H	α-helix	trans	-67	-39.1	177.6	-178.4	167.1	-151.6	0	0	111.8	T628 R629 G636 F639	T628-E632 PolarHBondContact O-N 3.03Å; R629-E632 PolarHBondContact O-N 3.47Å; E632-G636 WeakPolarHBondContact O-CA 3.41Å; E632-G636 PolarHBondContact O-N 3.16Å; E632-F639 HydrophobicContact CG-CZ 4.26Å
633	Q	84.6	Confident	87.8	Confident	129 Å²	129	58.3 Å²	58.3	60%	0.603	29%	0.285	S	S	*	.	H	α-helix	trans	-66.5	-47.3	177.2	-172.6	161.9	9.1	0	0	111.8	R629 E630	R629-Q633 VanDerWaalsContact O-CB 3.32Å; R629-Q633 WeakPolarHBondContact O-CB 3.42Å; R629-Q633 PolarHBondContact O-N 3.46Å; E630-Q633 PolarHBondContact O-N 2.95Å
634	N	84.7	Confident	88.2	Confident	103 Å²	103	57.7 Å²	57.7	55%	0.551	29%	0.288	S	S	*	.	H	α-helix	trans	-86.5	-26.8	-171.9	-63.7	-17.1	0	0	0	114	E630 H637	E630-N634 VanDerWaalsContact O-CB 3.27Å; E630-N634 WeakPolarHBondContact O-CB 3.4Å; E630-N634 VanDerWaalsContact O-CG 3.24Å; E630-N634 PolarHBondContact O-N 3.19Å; E630-N634 PolarHBondContact O-ND2 2.94Å; N634-H637 PolarHBondContact O-CE1 2.89Å
635	N	86.9	Confident	88.6	Confident	33 Å²	33	56.9 Å²	56.9	18%	0.176	29%	0.285	C	S	.	.	H	α-helix	trans	-128.3	9.1	-174.4	-55.6	-80	0	0	0	112.9	T579 L582 M631 H637 Y638	T579-N635 HydrophobicContact CG2-CB 4.28Å; L582-N635 HydrophobicContact CD1-CB 4.39Å; M631-N635 WeakPolarHBondContact O-CA 3.47Å; M631-N635 WeakPolarHBondContact O-CB 3.49Å; M631-N635 PolarHBondContact O-N 3.37Å; N635-H637 PolarHBondContact O-N 3.01Å; N635-Y638 HydrophobicContact CB-CD2 4.12Å; N635-Y638 WeakPolarHBondContact O-CB 3.48Å; N635-Y638 PolarHBondContact O-N 3.35Å
636	G	85.6	Confident	88.7	Confident	10 Å²	10	56.4 Å²	56.4	10%	0.103	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-53.8	-40.3	-178.7	0	0	0	0	0	114	E632 Y638 F639	E632-G636 WeakPolarHBondContact O-CA 3.41Å; E632-G636 PolarHBondContact O-N 3.16Å; G636-Y638 PolarHBondContact O-N 2.87Å; G636-Y638 VanDerWaalsContact O-N 3.16Å; G636-F639 PolarHBondContact O-N 2.82Å
637	H	87.3	Confident	88.7	Confident	19 Å²	19	55.3 Å²	55.3	9%	0.088	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-66	-15.9	-180	61.2	-64.3	0	0	0	113.5	H353 N634 N635	H353-H637 VanDerWaalsContact CE1-CB 3.5Å; H353-H637 WeakPolarHBondContact CE1-CB 3.27Å; H353-H637 WeakPolarHBondContact ND1-CB 3.3Å; N634-H637 PolarHBondContact O-CE1 2.89Å; N635-H637 PolarHBondContact O-N 3.01Å
638	Y	89.6	Confident	88.9	Confident	40 Å²	40	53.5 Å²	53.5	16%	0.157	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-87.7	-22.3	-177.9	-68.5	-42.2	0	0	0	115.1	L582 R586 I594 N635 G636	L582-Y638 HydrophobicContact CB-CD2 4.28Å; L582-Y638 HydrophobicContact CD1-CD2 4.4Å; R586-Y638 PolarHBondContact NH1-O 3.23Å; I594-Y638 VanDerWaalsContact CD1-O 3.28Å; I594-Y638 WeakPolarHBondContact CD1-O 3.44Å; N635-Y638 HydrophobicContact CB-CD2 4.12Å; N635-Y638 WeakPolarHBondContact O-CB 3.48Å; N635-Y638 PolarHBondContact O-N 3.35Å; G636-Y638 PolarHBondContact O-N 2.87Å; G636-Y638 VanDerWaalsContact O-N 3.16Å
639	F	90.8	Very high	89.2	Confident	24 Å²	24	57 Å²	57	11%	0.105	30%	0.295	C	S	.	.			trans	-95.2	149	-178.4	57.7	-111.5	0	0	0	112.9	I485 I594 F596 E632 G636 A642	I485-F639 HydrophobicContact CD1-CB 4.1Å; I485-F639 HydrophobicContact CD1-CD1 3.96Å; I485-F639 HydrophobicContact CD1-CG 4.49Å; I594-F639 HydrophobicContact CB-CB 4.28Å; I594-F639 HydrophobicContact CG2-CB 3.79Å; F596-F639 HydrophobicContact CB-CB 4.29Å; F596-F639 HydrophobicContact CB-CD1 3.72Å; F596-F639 HydrophobicContact CB-CD2 4.05Å; F596-F639 HydrophobicContact CB-CE1 3.85Å; F596-F639 HydrophobicContact CB-CE2 4.25Å; F596-F639 HydrophobicContact CB-CG 3.78Å; F596-F639 HydrophobicContact CB-CZ 4.14Å; F596-F639 HydrophobicContact CD1-CE1 4.27Å; F596-F639 HydrophobicContact CD1-CZ 4.29Å; F596-F639 HydrophobicContact CD2-CD1 4.24Å; F596-F639 HydrophobicContact CD2-CE1 4.05Å; F596-F639 HydrophobicContact CG-CD1 4.09Å; F596-F639 AromaticContact CG-CE1 3.81Å; F596-F639 HydrophobicContact CG-CE1 3.81Å; F596-F639 HydrophobicContact CG-CZ 4.2Å; E632-F639 HydrophobicContact CG-CZ 4.26Å; G636-F639 PolarHBondContact O-N 2.82Å; F639-A642 HydrophobicContact CE2-CB 4.28Å
640	D	93.2	Very high	89.5	Confident	44 Å²	44	58 Å²	58	24%	0.235	30%	0.304	C	S	.	.	S	Bend	trans	-83.2	-35.3	-178.7	-58	-104.2	0	0	0	111.3	R480 Y593 I594	R480-D640 IonicContact NH2-OD1 3.39Å; Y593-D640 HydrophobicContact CD2-CB 3.81Å; Y593-D640 HydrophobicContact CE1-CB 4.43Å; Y593-D640 HydrophobicContact CE2-CB 3.48Å; Y593-D640 VanDerWaalsContact CE2-CB 3.48Å; Y593-D640 HydrophobicContact CG-CB 4.45Å; I594-D640 PolarHBondContact N-OD2 3.38Å; I594-D640 PolarHBondContact O-N 2.89Å
641	T	93.1	Very high	89.9	Confident	37 Å²	37	53.7 Å²	53.7	23%	0.227	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	151.3	-177	-50.1	0	0	0	0	111.3	Y593 I595 F596 L658	Y593-T641 PolarHBondContact OH-OG1 2.89Å; I595-T641 WeakPolarHBondContact CA-O 3.39Å; F596-T641 PolarHBondContact N-O 3.18Å; T641-L658 HydrophobicContact CG2-CD1 3.77Å; T641-L658 HydrophobicContact CG2-CD2 4.19Å
642	A	93.3	Very high	90.3	Very high	47 Å²	47	52.7 Å²	52.7	39%	0.388	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	139.4	170.9	0	0	0	0	0	111.6	F596 F639	F596-A642 HydrophobicContact CB-CB 4.29Å; F596-A642 HydrophobicContact CD1-CB 4.12Å; F596-A642 CarbonylContact O-C 3.4Å; F596-A642 VanDerWaalsContact O-CA 3.28Å; F596-A642 WeakPolarHBondContact O-CA 3.49Å; F639-A642 HydrophobicContact CE2-CB 4.28Å
643	I	95	Very high	90.8	Very high	10 Å²	10	53.4 Å²	53.4	5%	0.051	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.2	173.9	-57.6	177.2	0	0	0	108.4	I595 F596 I597 A598 N645 A651 E654 L655 L658	I595-I643 HydrophobicContact CG2-CD1 3.68Å; I595-I643 HydrophobicContact CG2-CG1 3.87Å; F596-I643 PolarHBondContact O-N 2.98Å; I597-I643 HydrophobicContact CD1-CB 4.06Å; I597-I643 HydrophobicContact CD1-CD1 4.19Å; I597-I643 HydrophobicContact CD1-CG1 4.49Å; A598-I643 PolarHBondContact N-O 2.88Å; I643-N645 PolarHBondContact O-N 3.39Å; I643-A651 HydrophobicContact CG2-CB 4.09Å; I643-E654 HydrophobicContact CD1-CG 4.45Å; I643-E654 HydrophobicContact CG1-CG 4.44Å; I643-L655 HydrophobicContact CD1-CB 3.87Å; I643-L655 HydrophobicContact CD1-CD1 4.08Å; I643-L658 HydrophobicContact CD1-CD1 3.77Å; I643-L658 HydrophobicContact CG1-CD1 3.95Å
644	V	93.3	Very high	91.4	Very high	89 Å²	89	50.5 Å²	50.5	54%	0.539	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	107.7	173.6	-176.4	0	0	0	0	109.7	A598 P600 S646	A598-V644 HydrophobicContact CB-CG2 4.34Å; P600-V644 HydrophobicContact CB-CG1 4.38Å; V644-S646 VanDerWaalsContact C-N 3.35Å; V644-S646 PolarHBondContact O-N 2.96Å
645	N	90.6	Very high	91.9	Very high	10 Å²	10	45.6 Å²	45.6	5%	0.053	24%	0.243	C	C	.	.			trans	-81.3	77.5	-177.1	-173.5	14.3	0	0	0	112.4	C490 I597 A598 P600 I643 D647 A651	C490-N645 PolarHBondContact O-ND2 3.25Å; I597-N645 HydrophobicContact CG2-CB 4Å; A598-N645 PolarHBondContact O-N 2.96Å; P600-N645 WeakPolarHBondContact CD-O 3.38Å; I643-N645 PolarHBondContact O-N 3.39Å; N645-D647 PolarHBondContact OD1-O 3.34Å; N645-A651 HydrophobicContact CB-CB 4.26Å; N645-A651 WeakPolarHBondContact OD1-CB 3.22Å
646	S	87.3	Confident	92.4	Very high	47 Å²	47	45 Å²	45	33%	0.329	24%	0.239	S	C	.	.	S	Bend	trans	-84.8	-20.3	174	-62.5	0	0	0	0	114.2	P600 V644	P600-S646 WeakPolarHBondContact CB-OG 3.18Å; V644-S646 VanDerWaalsContact C-N 3.35Å; V644-S646 PolarHBondContact O-N 2.96Å
647	D	88.3	Confident	92.9	Very high	53 Å²	53	50.2 Å²	50.2	28%	0.283	26%	0.256	S	S	.	.	S	Bend	trans	-157.2	127.4	-177.3	176.9	-95.8	0	0	0	108.6	N645 D649 K650 A651	N645-D647 PolarHBondContact OD1-O 3.34Å; D647-D649 VanDerWaalsContact C-N 3.28Å; D647-D649 PolarHBondContact O-N 3.44Å; D647-D649 WeakPolarHBondContact OD1-CA 3.43Å; D647-D649 WeakPolarHBondContact OD1-CB 3.12Å; D647-D649 PolarHBondContact OD1-N 3.44Å; D647-K650 HydrophobicContact CB-CB 4.22Å; D647-K650 HydrophobicContact CB-CD 4.28Å; D647-K650 HydrophobicContact CB-CG 4.26Å; D647-K650 PolarHBondContact O-N 2.95Å; D647-K650 PolarHBondContact OD1-N 3.48Å; D647-A651 WeakPolarHBondContact O-CB 3.5Å; D647-A651 PolarHBondContact O-N 2.94Å
648	L	88.4	Confident	93.4	Very high	59 Å²	59	49.7 Å²	49.7	31%	0.309	25%	0.254	S	S	.	.	H	α-helix	trans	-65.9	-29.1	-173.2	-76.4	172.3	0	0	0	113.2	E494 L495 Y652	E494-L648 HydrophobicContact CB-CD2 4.15Å; L495-L648 HydrophobicContact CG-CD2 4.46Å; L648-Y652 WeakPolarHBondContact O-CB 3.4Å; L648-Y652 PolarHBondContact O-N 3.32Å; L648-Y652 VanDerWaalsContact O-N 3.11Å
649	D	92.3	Very high	93.7	Very high	85 Å²	85	47.9 Å²	47.9	46%	0.455	25%	0.247	S	C	.	.	H	α-helix	trans	-74	-47.6	177.9	-70.9	-44.6	0	0	0	110.6	R498 D647 Y652 Q653	R498-D649 IonicContact CZ-OD1 3.64Å; R498-D649 IonicContact NH1-OD1 3.31Å; R498-D649 PolarHBondContact NH1-OD1 3.48Å; R498-D649 IonicContact NH2-OD1 3.91Å; R498-D649 PolarHBondContact NH2-OD1 2.94Å; D647-D649 VanDerWaalsContact C-N 3.28Å; D647-D649 PolarHBondContact O-N 3.44Å; D647-D649 WeakPolarHBondContact OD1-CA 3.43Å; D647-D649 WeakPolarHBondContact OD1-CB 3.12Å; D647-D649 PolarHBondContact OD1-N 3.44Å; D649-Y652 PolarHBondContact O-N 2.65Å; D649-Q653 WeakPolarHBondContact O-CG 3.34Å; D649-Q653 PolarHBondContact O-N 3.47Å
650	K	94.4	Very high	94	Very high	163 Å²	163	49.6 Å²	49.6	71%	0.709	26%	0.257	S	S	*	.	H	α-helix	trans	-62.4	-46.4	176.8	-67.5	-175.8	179.3	-171.7	0	112.1	D647 Y652 Q653 E654	D647-K650 HydrophobicContact CB-CB 4.22Å; D647-K650 HydrophobicContact CB-CD 4.28Å; D647-K650 HydrophobicContact CB-CG 4.26Å; D647-K650 PolarHBondContact O-N 2.95Å; D647-K650 PolarHBondContact OD1-N 3.48Å; K650-Y652 VanDerWaalsContact C-N 3.29Å; K650-Y652 PolarHBondContact O-N 3.29Å; K650-Q653 PolarHBondContact O-N 3.22Å; K650-E654 PolarHBondContact O-N 3.05Å
651	A	94.8	Very high	94.1	Very high	4 Å²	4	50.5 Å²	50.5	3%	0.033	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-36.9	177.6	0	0	0	0	0	111.8	L495 I643 N645 D647 L655	L495-A651 HydrophobicContact CD1-CB 4.39Å; L495-A651 HydrophobicContact CD2-CB 4.28Å; I643-A651 HydrophobicContact CG2-CB 4.09Å; N645-A651 HydrophobicContact CB-CB 4.26Å; N645-A651 WeakPolarHBondContact OD1-CB 3.22Å; D647-A651 WeakPolarHBondContact O-CB 3.5Å; D647-A651 PolarHBondContact O-N 2.94Å; A651-L655 WeakPolarHBondContact O-CB 3.24Å; A651-L655 PolarHBondContact O-N 3.49Å
652	Y	95.9	Very high	94.3	Very high	5 Å²	5	49 Å²	49	2%	0.02	25%	0.249	C	C	.	.	H	α-helix	trans	-64.9	-44.4	174.3	174.8	-91.4	0	0	0	112.5	R498 L499 K502 L648 D649 K650 L655 L656	R498-Y652 HydrophobicContact CB-CD2 4.02Å; R498-Y652 HydrophobicContact CB-CE2 4.05Å; R498-Y652 HydrophobicContact CG-CD2 3.69Å; R498-Y652 HydrophobicContact CG-CE2 3.62Å; R498-Y652 HydrophobicContact CG-CG 4.4Å; L499-Y652 HydrophobicContact CD2-CD2 4.32Å; L499-Y652 HydrophobicContact CD2-CE2 3.58Å; L499-Y652 HydrophobicContact CG-CD2 4.37Å; L499-Y652 HydrophobicContact CG-CE2 3.85Å; K502-Y652 HydrophobicContact CD-CE1 4.26Å; L648-Y652 WeakPolarHBondContact O-CB 3.4Å; L648-Y652 PolarHBondContact O-N 3.32Å; L648-Y652 VanDerWaalsContact O-N 3.11Å; D649-Y652 PolarHBondContact O-N 2.65Å; K650-Y652 VanDerWaalsContact C-N 3.29Å; K650-Y652 PolarHBondContact O-N 3.29Å; Y652-L655 PolarHBondContact O-N 2.98Å; Y652-L656 HydrophobicContact CE1-CD2 4.26Å; Y652-L656 WeakPolarHBondContact O-CB 3.45Å; Y652-L656 PolarHBondContact O-N 2.9Å
653	Q	96.6	Very high	94.3	Very high	111 Å²	111	50.1 Å²	50.1	52%	0.519	25%	0.249	S	C	.	.	H	α-helix	trans	-64	-43.1	178.2	-67.6	-58.2	-34	0	0	111.3	D649 K650 L656 R657	D649-Q653 WeakPolarHBondContact O-CG 3.34Å; D649-Q653 PolarHBondContact O-N 3.47Å; K650-Q653 PolarHBondContact O-N 3.22Å; Q653-L656 PolarHBondContact O-N 3.31Å; Q653-R657 WeakPolarHBondContact O-CB 3.45Å; Q653-R657 PolarHBondContact O-N 3.42Å
654	E	96.9	Very high	94.3	Very high	68 Å²	68	55 Å²	55	32%	0.318	28%	0.279	S	S	.	.	H	α-helix	trans	-65.4	-43	177.1	-177.4	55.5	-160.4	0	0	111.8	I643 K650 L656 R657 L658	I643-E654 HydrophobicContact CD1-CG 4.45Å; I643-E654 HydrophobicContact CG1-CG 4.44Å; K650-E654 PolarHBondContact O-N 3.05Å; E654-L656 VanDerWaalsContact C-N 3.32Å; E654-L656 PolarHBondContact O-N 3.41Å; E654-R657 WeakPolarHBondContact O-CB 3.4Å; E654-R657 PolarHBondContact O-N 3Å; E654-R657 IonicContact OE1-CZ 3.6Å; E654-R657 IonicContact OE1-NE 3.94Å; E654-R657 PolarHBondContact OE1-NE 3.04Å; E654-R657 IonicContact OE1-NH2 3.22Å; E654-R657 PolarHBondContact OE1-NH2 3.12Å; E654-R657 IonicContact OE2-CZ 2.65Å; E654-R657 IonicContact OE2-NE 3.88Å; E654-R657 PolarHBondContact OE2-NE 3.29Å; E654-R657 IonicContact OE2-NH2 3.15Å; E654-L658 HydrophobicContact CG-CD1 4.31Å; E654-L658 WeakPolarHBondContact O-CG 3.37Å; E654-L658 PolarHBondContact O-N 3.14Å
655	L	96.9	Very high	94.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.1	-45.2	174.3	177.9	58.3	0	0	0	111.4	L484 L495 L499 I595 I643 A651 Y652 L658 I659	L484-L655 HydrophobicContact CD2-CD1 4.03Å; L484-L655 HydrophobicContact CD2-CD2 4.41Å; L495-L655 HydrophobicContact CB-CD2 4.06Å; L495-L655 HydrophobicContact CD1-CD2 4.39Å; L499-L655 HydrophobicContact CD1-CD2 3.57Å; L499-L655 HydrophobicContact CD1-CG 4.07Å; L499-L655 HydrophobicContact CG-CD2 4.42Å; I595-L655 HydrophobicContact CD1-CD1 3.37Å; I595-L655 HydrophobicContact CG2-CD1 4.4Å; I643-L655 HydrophobicContact CD1-CB 3.87Å; I643-L655 HydrophobicContact CD1-CD1 4.08Å; A651-L655 WeakPolarHBondContact O-CB 3.24Å; A651-L655 PolarHBondContact O-N 3.49Å; Y652-L655 PolarHBondContact O-N 2.98Å; L655-L658 PolarHBondContact O-N 2.94Å; L655-I659 HydrophobicContact CD1-CD1 3.9Å; L655-I659 HydrophobicContact CD1-CG1 4.33Å; L655-I659 HydrophobicContact CG-CD1 3.94Å; L655-I659 WeakPolarHBondContact O-CD1 3.29Å; L655-I659 WeakPolarHBondContact O-CG1 3.33Å; L655-I659 PolarHBondContact O-N 3.06Å
656	L	96.6	Very high	94.5	Very high	19 Å²	19	56.5 Å²	56.5	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-66.3	-40.5	178.4	-170.5	65.9	0	0	0	111.7	L499 E503 Y652 Q653 E654 I659 N660	L499-L656 HydrophobicContact CD2-CD1 4.01Å; E503-L656 WeakPolarHBondContact OE1-CD1 3.47Å; E503-L656 WeakPolarHBondContact OE1-CD2 3.23Å; Y652-L656 HydrophobicContact CE1-CD2 4.26Å; Y652-L656 WeakPolarHBondContact O-CB 3.45Å; Y652-L656 PolarHBondContact O-N 2.9Å; Q653-L656 PolarHBondContact O-N 3.31Å; E654-L656 VanDerWaalsContact C-N 3.32Å; E654-L656 PolarHBondContact O-N 3.41Å; L656-I659 PolarHBondContact O-N 3.11Å; L656-N660 WeakPolarHBondContact O-CB 3.13Å; L656-N660 PolarHBondContact O-N 3.08Å; L656-N660 PolarHBondContact O-ND2 2.67Å; L656-N660 PolarHBondContact O-OD1 3.1Å
657	R	97.1	Very high	94.9	Very high	120 Å²	120	56 Å²	56	45%	0.453	28%	0.276	S	S	.	.	H	α-helix	trans	-58.2	-49	175.3	-169.7	-165.6	71.5	78.9	1.7	110.9	Q653 E654 I659 N660 K661	Q653-R657 WeakPolarHBondContact O-CB 3.45Å; Q653-R657 PolarHBondContact O-N 3.42Å; E654-R657 WeakPolarHBondContact O-CB 3.4Å; E654-R657 PolarHBondContact O-N 3Å; E654-R657 IonicContact OE1-CZ 3.6Å; E654-R657 IonicContact OE1-NE 3.94Å; E654-R657 PolarHBondContact OE1-NE 3.04Å; E654-R657 IonicContact OE1-NH2 3.22Å; E654-R657 PolarHBondContact OE1-NH2 3.12Å; E654-R657 IonicContact OE2-CZ 2.65Å; E654-R657 IonicContact OE2-NE 3.88Å; E654-R657 PolarHBondContact OE2-NE 3.29Å; E654-R657 IonicContact OE2-NH2 3.15Å; R657-I659 PolarHBondContact O-N 3.23Å; R657-N660 PolarHBondContact O-N 2.93Å; R657-K661 WeakPolarHBondContact O-CB 3.4Å; R657-K661 PolarHBondContact O-N 2.87Å
658	L	97.1	Very high	95.3	Very high	9 Å²	9	55.9 Å²	55.9	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-61.1	-43.6	177.6	-70.8	168.9	0	0	0	112.1	T641 I643 E654 L655 K661	T641-L658 HydrophobicContact CG2-CD1 3.77Å; T641-L658 HydrophobicContact CG2-CD2 4.19Å; I643-L658 HydrophobicContact CD1-CD1 3.77Å; I643-L658 HydrophobicContact CG1-CD1 3.95Å; E654-L658 HydrophobicContact CG-CD1 4.31Å; E654-L658 WeakPolarHBondContact O-CG 3.37Å; E654-L658 PolarHBondContact O-N 3.14Å; L655-L658 PolarHBondContact O-N 2.94Å; L658-K661 WeakPolarHBondContact O-CB 3.45Å; L658-K661 PolarHBondContact O-N 2.98Å
659	I	96.8	Very high	95.6	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-64.6	-42.7	177.9	-65.6	165.6	0	0	0	111.1	I482 L499 F507 I572 L655 L656 R657 K661 L662	I482-I659 HydrophobicContact CD1-CG1 3.91Å; I482-I659 HydrophobicContact CD1-CG2 4.4Å; I482-I659 HydrophobicContact CG1-CD1 4.22Å; I482-I659 HydrophobicContact CG1-CG1 3.96Å; I482-I659 HydrophobicContact CG1-CG2 4.33Å; I482-I659 HydrophobicContact CG2-CD1 4.09Å; I482-I659 HydrophobicContact CG2-CG1 4.25Å; L499-I659 HydrophobicContact CD1-CD1 3.97Å; L499-I659 HydrophobicContact CD2-CD1 4.5Å; F507-I659 HydrophobicContact CE1-CD1 4.02Å; F507-I659 HydrophobicContact CE1-CG2 4.16Å; F507-I659 HydrophobicContact CZ-CD1 4.07Å; F507-I659 HydrophobicContact CZ-CG2 4.05Å; I572-I659 HydrophobicContact CD1-CG2 3.76Å; L655-I659 HydrophobicContact CD1-CD1 3.9Å; L655-I659 HydrophobicContact CD1-CG1 4.33Å; L655-I659 HydrophobicContact CG-CD1 3.94Å; L655-I659 WeakPolarHBondContact O-CD1 3.29Å; L655-I659 WeakPolarHBondContact O-CG1 3.33Å; L655-I659 PolarHBondContact O-N 3.06Å; L656-I659 PolarHBondContact O-N 3.11Å; R657-I659 PolarHBondContact O-N 3.23Å; I659-K661 VanDerWaalsContact C-N 3.31Å; I659-K661 PolarHBondContact O-N 3.32Å; I659-L662 WeakPolarHBondContact O-CB 3.37Å; I659-L662 PolarHBondContact O-N 2.65Å
660	N	95.9	Very high	95.7	Very high	60 Å²	60	49.3 Å²	49.3	32%	0.321	24%	0.237	S	C	.	.	H	α-helix	trans	-65.9	-36.1	178.5	-68.2	-15.2	0	0	0	111.8	R506 L656 R657 L662 D663	R506-N660 PolarHBondContact NH1-OD1 2.98Å; R506-N660 PolarHBondContact NH2-OD1 3.08Å; L656-N660 WeakPolarHBondContact O-CB 3.13Å; L656-N660 PolarHBondContact O-N 3.08Å; L656-N660 PolarHBondContact O-ND2 2.67Å; L656-N660 PolarHBondContact O-OD1 3.1Å; R657-N660 PolarHBondContact O-N 2.93Å; N660-L662 PolarHBondContact O-N 3.39Å; N660-D663 WeakPolarHBondContact O-CB 3.41Å; N660-D663 PolarHBondContact O-N 2.81Å
661	K	96.4	Very high	95.6	Very high	63 Å²	63	41.6 Å²	41.6	27%	0.274	20%	0.204	S	C	.	.	H	α-helix	trans	-56.5	-31.6	177.9	-165	-179.9	-175.7	-163.5	0	112.4	R657 L658 I659 D663 T664 E665	R657-K661 WeakPolarHBondContact O-CB 3.4Å; R657-K661 PolarHBondContact O-N 2.87Å; L658-K661 WeakPolarHBondContact O-CB 3.45Å; L658-K661 PolarHBondContact O-N 2.98Å; I659-K661 VanDerWaalsContact C-N 3.31Å; I659-K661 PolarHBondContact O-N 3.32Å; K661-D663 PolarHBondContact O-N 2.88Å; K661-T664 PolarHBondContact O-N 3.09Å; K661-T664 PolarHBondContact O-OG1 2.82Å; K661-E665 WeakPolarHBondContact CE-OE1 3.4Å; K661-E665 WeakPolarHBondContact CE-OE2 3.34Å; K661-E665 HydrophobicContact CG-CB 4.21Å; K661-E665 HydrophobicContact CG-CG 4.34Å; K661-E665 IonicContact NZ-OE1 3.14Å; K661-E665 IonicContact NZ-OE2 3.72Å; K661-E665 PolarHBondContact NZ-OE2 3.39Å; K661-E665 PolarHBondContact O-N 3.49Å
662	L	96.1	Very high	95.4	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.026	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23	177.6	-57.7	-178.9	0	0	0	113.9	Q474 I482 Y593 I659 N660 Q667	Q474-L662 WeakPolarHBondContact CB-O 3.17Å; I482-L662 HydrophobicContact CD1-CD1 3.63Å; Y593-L662 HydrophobicContact CD1-CD1 4.06Å; Y593-L662 HydrophobicContact CD1-CD2 4.44Å; Y593-L662 HydrophobicContact CD2-CD1 4.34Å; Y593-L662 HydrophobicContact CD2-CD2 3.72Å; Y593-L662 HydrophobicContact CE1-CD2 4.42Å; Y593-L662 HydrophobicContact CE2-CD2 3.66Å; Y593-L662 HydrophobicContact CG-CD1 3.9Å; Y593-L662 HydrophobicContact CG-CD2 4.1Å; I659-L662 WeakPolarHBondContact O-CB 3.37Å; I659-L662 PolarHBondContact O-N 2.65Å; N660-L662 PolarHBondContact O-N 3.39Å; L662-Q667 HydrophobicContact CD2-CG 3.46Å; L662-Q667 VanDerWaalsContact CD2-CG 3.46Å
663	D	93.6	Very high	95.3	Very high	71 Å²	71	47.4 Å²	47.4	38%	0.38	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-23.1	179.4	-76.2	-27.2	0	0	0	113	Q474 K479 N660 K661	Q474-D663 PolarHBondContact NE2-OD1 3.45Å; K479-D663 VanDerWaalsContact NZ-CG 3.33Å; K479-D663 IonicContact NZ-OD1 3.11Å; K479-D663 PolarHBondContact NZ-OD1 2.77Å; K479-D663 IonicContact NZ-OD2 2.69Å; K479-D663 PolarHBondContact NZ-OD2 2.75Å; N660-D663 WeakPolarHBondContact O-CB 3.41Å; N660-D663 PolarHBondContact O-N 2.81Å; K661-D663 PolarHBondContact O-N 2.88Å
664	T	94.1	Very high	95	Very high	112 Å²	112	45.8 Å²	45.8	69%	0.687	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-33.8	-174.9	53.4	0	0	0	0	112.9	K661	K661-T664 PolarHBondContact O-N 3.09Å; K661-T664 PolarHBondContact O-OG1 2.82Å
665	E	94.8	Very high	94.3	Very high	91 Å²	91	53.1 Å²	53.1	43%	0.425	26%	0.255	S	S	.	.	S	Bend	trans	-115.8	130.1	-173.6	-67.9	-178.6	-131.3	0	0	111.6	K661 Q667	K661-E665 WeakPolarHBondContact CE-OE1 3.4Å; K661-E665 WeakPolarHBondContact CE-OE2 3.34Å; K661-E665 HydrophobicContact CG-CB 4.21Å; K661-E665 HydrophobicContact CG-CG 4.34Å; K661-E665 IonicContact NZ-OE1 3.14Å; K661-E665 IonicContact NZ-OE2 3.72Å; K661-E665 PolarHBondContact NZ-OE2 3.39Å; K661-E665 PolarHBondContact O-N 3.49Å; E665-Q667 PolarHBondContact O-NE2 3.14Å; E665-Q667 VanDerWaalsContact O-NE2 3.11Å
666	P	94.9	Very high	94.2	Very high	40 Å²	40	55.8 Å²	55.8	26%	0.26	27%	0.268	S	S	.	.			trans	-61.7	152	171.7	27.1	-33	0	0	0	111	L471 Y472 H473	L471-P666 HydrophobicContact CB-CB 4.21Å; L471-P666 HydrophobicContact CD1-CG 4.47Å; L471-P666 HydrophobicContact CD2-CB 4.13Å; L471-P666 HydrophobicContact CD2-CG 4.31Å; Y472-P666 WeakPolarHBondContact O-CA 3.37Å; H473-P666 WeakPolarHBondContact NE2-CB 3.34Å; H473-P666 WeakPolarHBondContact NE2-CG 3.49Å
667	Q	95.9	Very high	94.1	Very high	35 Å²	35	57.7 Å²	57.7	16%	0.164	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	146.8	177.2	-58.4	-56.7	-59	0	0	110.5	Y472 Y593 L662 E665 V669	Y472-Q667 PolarHBondContact N-O 3.49Å; Y472-Q667 PolarHBondContact O-N 3.35Å; Y593-Q667 HydrophobicContact CE2-CG 4.3Å; L662-Q667 HydrophobicContact CD2-CG 3.46Å; L662-Q667 VanDerWaalsContact CD2-CG 3.46Å; E665-Q667 PolarHBondContact O-NE2 3.14Å; E665-Q667 VanDerWaalsContact O-NE2 3.11Å; Q667-V669 PolarHBondContact O-N 2.95Å
668	W	94.9	Very high	93.9	Very high	52 Å²	52	54.2 Å²	54.2	20%	0.197	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	119.6	169.5	-68.2	111.3	0	0	0	110.2	H349 I378 E395 M469 L471	H349-W668 HydrophobicContact CB-CE3 4.36Å; H349-W668 HydrophobicContact CB-CH2 3.76Å; H349-W668 HydrophobicContact CB-CZ3 3.49Å; H349-W668 VanDerWaalsContact CB-CZ3 3.49Å; H349-W668 AromaticContact CG-CH2 3.5Å; H349-W668 AromaticContact CG-CZ3 3.63Å; H349-W668 AromaticContact ND1-CH2 3.36Å; H349-W668 WeakPolarHBondContact ND1-CH2 3.29Å; H349-W668 AromaticContact ND1-CZ3 4Å; I378-W668 HydrophobicContact CD1-CB 4.3Å; I378-W668 HydrophobicContact CD1-CD2 4.4Å; I378-W668 HydrophobicContact CD1-CG 4.01Å; I378-W668 HydrophobicContact CG1-CD2 4.44Å; I378-W668 HydrophobicContact CG1-CG 4.12Å; I378-W668 HydrophobicContact CG2-CD2 4.36Å; I378-W668 HydrophobicContact CG2-CZ2 4.02Å; E395-W668 VanDerWaalsContact OE2-CZ2 3.31Å; E395-W668 WeakPolarHBondContact OE2-CZ2 3.07Å; M469-W668 HydrophobicContact CB-CB 4.39Å; M469-W668 HydrophobicContact CB-CD2 4.41Å; M469-W668 HydrophobicContact CB-CE3 3.69Å; M469-W668 HydrophobicContact CB-CZ3 4.4Å; M469-W668 HydrophobicContact CE-CB 3.97Å; L471-W668 HydrophobicContact CD1-CH2 4.27Å; L471-W668 HydrophobicContact CD1-CZ2 4.36Å; L471-W668 HydrophobicContact CD2-CD2 3.67Å; L471-W668 HydrophobicContact CD2-CE3 3.97Å; L471-W668 HydrophobicContact CD2-CG 4.17Å; L471-W668 HydrophobicContact CD2-CH2 4.11Å; L471-W668 HydrophobicContact CD2-CZ2 3.83Å; L471-W668 HydrophobicContact CD2-CZ3 4.18Å; L471-W668 HydrophobicContact CG-CD2 4.24Å; L471-W668 HydrophobicContact CG-CE3 4.05Å; L471-W668 HydrophobicContact CG-CH2 3.74Å; L471-W668 HydrophobicContact CG-CZ2 3.94Å; L471-W668 HydrophobicContact CG-CZ3 3.81Å
669	V	95.2	Very high	93.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	156.6	173	-60.5	0	0	0	0	109.9	M469 S470 Y472 Q667 S671 W673 L674	M469-V669 CarbonylContact C-O 3.44Å; M469-V669 VanDerWaalsContact CA-O 3.28Å; M469-V669 WeakPolarHBondContact CA-O 3.42Å; S470-V669 PolarHBondContact N-O 2.75Å; S470-V669 WeakPolarHBondContact O-CG2 3.35Å; S470-V669 PolarHBondContact O-N 3.12Å; Y472-V669 VanDerWaalsContact CB-CG2 3.44Å; Y472-V669 HydrophobicContact CD1-CG1 4.43Å; Y472-V669 HydrophobicContact CG-CG2 4.28Å; Q667-V669 PolarHBondContact O-N 2.95Å; V669-S671 PolarHBondContact O-N 3.07Å; V669-W673 HydrophobicContact CB-CD2 4.46Å; V669-W673 HydrophobicContact CB-CE3 3.64Å; V669-W673 HydrophobicContact CB-CZ3 4Å; V669-W673 HydrophobicContact CG1-CE3 3.96Å; V669-W673 HydrophobicContact CG1-CZ3 3.93Å; V669-W673 HydrophobicContact CG2-CE3 4.31Å; V669-L674 HydrophobicContact CG2-CD1 4.26Å; V669-L674 HydrophobicContact CG2-CD2 4.36Å; V669-L674 HydrophobicContact CG2-CG 4.23Å
670	P	93.9	Very high	93.6	Very high	5 Å²	5	60.3 Å²	60.3	3%	0.032	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.3	130.1	173.5	-26.9	35.7	0	0	0	111.4	E467 E468 T672 W673	E467-P670 VanDerWaalsContact OE1-CG 3.27Å; E467-P670 WeakPolarHBondContact OE1-CG 3.47Å; E468-P670 WeakPolarHBondContact O-CA 3.41Å; P670-T672 PolarHBondContact O-N 3.34Å; P670-T672 VanDerWaalsContact O-N 3.1Å; P670-W673 HydrophobicContact CB-CD2 4.49Å; P670-W673 HydrophobicContact CB-CG 4.35Å; P670-W673 HydrophobicContact CG-CD2 4.3Å; P670-W673 HydrophobicContact CG-CZ2 4.18Å; P670-W673 VanDerWaalsContact O-CB 3.32Å; P670-W673 WeakPolarHBondContact O-CB 3.32Å; P670-W673 PolarHBondContact O-N 3.1Å
671	S	92.6	Very high	93.4	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.014	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-58	-28.2	-178.6	-62.9	0	0	0	0	112.4	E468 M469 S470 V669 W673 L674 R675	E468-S671 WeakPolarHBondContact CG-OG 3.42Å; E468-S671 PolarHBondContact O-N 2.98Å; E468-S671 PolarHBondContact O-OG 3.47Å; M469-S671 PolarHBondContact N-OG 2.99Å; M469-S671 PolarHBondContact O-OG 3.2Å; M469-S671 VanDerWaalsContact O-OG 3.08Å; S470-S671 PolarHBondContact N-OG 3.16Å; S470-S671 WeakPolarHBondContact OG-CB 3.07Å; S470-S671 PolarHBondContact OG-OG 3.39Å; V669-S671 PolarHBondContact O-N 3.07Å; S671-W673 PolarHBondContact O-N 2.6Å; S671-L674 PolarHBondContact O-N 2.85Å; S671-R675 PolarHBondContact O-N 3.47Å
672	T	91.4	Very high	93.2	Very high	103 Å²	103	60.1 Å²	60.1	63%	0.632	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-60.2	-20.9	174.2	53.6	0	0	0	0	113.7	P670 L674	P670-T672 PolarHBondContact O-N 3.34Å; P670-T672 VanDerWaalsContact O-N 3.1Å; T672-L674 VanDerWaalsContact C-N 3.31Å
673	W	92.9	Very high	93	Very high	28 Å²	28	64.4 Å²	64.4	11%	0.106	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-77	-18.2	176.3	-68.2	3.7	0	0	0	113.4	R586 K591 P592 V669 P670 S671	R586-W673 HydrophobicContact CB-CZ2 4.41Å; R586-W673 HydrophobicContact CG-CZ2 4.22Å; R586-W673 PolarHBondContact O-NE1 3.11Å; R586-W673 VanDerWaalsContact O-NE1 3.14Å; K591-W673 HydrophobicContact CB-CE3 3.88Å; K591-W673 HydrophobicContact CB-CZ3 4.1Å; K591-W673 WeakPolarHBondContact CE-O 3.31Å; K591-W673 HydrophobicContact CG-CB 4.33Å; K591-W673 HydrophobicContact CG-CD2 4.26Å; K591-W673 HydrophobicContact CG-CE3 3.77Å; K591-W673 HydrophobicContact CG-CZ3 4.48Å; K591-W673 PolarHBondContact NZ-O 3.45Å; P592-W673 HydrophobicContact CG-CH2 3.91Å; P592-W673 HydrophobicContact CG-CZ2 4.38Å; V669-W673 HydrophobicContact CB-CD2 4.46Å; V669-W673 HydrophobicContact CB-CE3 3.64Å; V669-W673 HydrophobicContact CB-CZ3 4Å; V669-W673 HydrophobicContact CG1-CE3 3.96Å; V669-W673 HydrophobicContact CG1-CZ3 3.93Å; V669-W673 HydrophobicContact CG2-CE3 4.31Å; P670-W673 HydrophobicContact CB-CD2 4.49Å; P670-W673 HydrophobicContact CB-CG 4.35Å; P670-W673 HydrophobicContact CG-CD2 4.3Å; P670-W673 HydrophobicContact CG-CZ2 4.18Å; P670-W673 VanDerWaalsContact O-CB 3.32Å; P670-W673 WeakPolarHBondContact O-CB 3.32Å; P670-W673 PolarHBondContact O-N 3.1Å; S671-W673 PolarHBondContact O-N 2.6Å
674	L	90.4	Very high	92.9	Very high	76 Å²	76	63.8 Å²	63.8	40%	0.398	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-10.2	-176.1	-53.2	-174	0	0	0	113.4	Y472 V669 S671 T672	Y472-L674 HydrophobicContact CD2-CD2 3.54Å; Y472-L674 HydrophobicContact CE2-CD2 4.18Å; Y472-L674 HydrophobicContact CG-CD2 4.28Å; V669-L674 HydrophobicContact CG2-CD1 4.26Å; V669-L674 HydrophobicContact CG2-CD2 4.36Å; V669-L674 HydrophobicContact CG2-CG 4.23Å; S671-L674 PolarHBondContact O-N 2.85Å; T672-L674 VanDerWaalsContact C-N 3.31Å
675	R	83.9	Confident	92.8	Very high	222 Å²	222	59.5 Å²	59.5	84%	0.838	28%	0.279	S	S	*	.			trans	-84.8	0	178.6	-74.3	-178.7	175.2	151.1	4.7	113.2	E468 S671	E468-R675 VanDerWaalsContact CD-NH2 3.27Å; E468-R675 IonicContact OE1-CZ 2.7Å; E468-R675 IonicContact OE1-NH1 2.9Å; E468-R675 IonicContact OE1-NH2 2.63Å; E468-R675 PolarHBondContact OE1-NH2 2.72Å; E468-R675 IonicContact OE2-CZ 3.04Å; E468-R675 IonicContact OE2-NH1 3.83Å; E468-R675 PolarHBondContact OE2-NH1 2.65Å; E468-R675 IonicContact OE2-NH2 2.64Å; E468-R675 PolarHBondContact OE2-NH2 3.25Å; E468-R675 VanDerWaalsContact OE2-NH2 3.12Å; S671-R675 PolarHBondContact O-N 3.47Å

Retrieved 675 of 675 residues in 1754 ms (Link to these results)

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