A0A096NGV9_PAPAN Loading...

Translation initiation factor IF-2, mitochondrial

One of the essential components for the initiation of protein synthesis. Protects formylmethionyl-tRNA from spontaneous hydrolysis and promotes its binding to the 30S ribosomal subunits. Also involved in the hydrolysis of GTP during the formation of the 70S ribosomal complex.

AlphaFold DB , UniProt , Accession A0A096NGV9, Species PAPAN (Papio anubis, Olive baboon), Gene MTIF2, Length 727 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.3	Very low	43.6	Very low	227 Å²	227	141.4 Å²	141.4	100%	1.118	69%	0.693	S	S	*	*				0	7.3	0	-146.7	158.8	152.4	0	0	114.3
2	N	42.3	Very low	43.5	Very low	130 Å²	130	139.3 Å²	139.3	70%	0.695	69%	0.686	S	S	*	*			trans	-111.6	7.4	-173.7	-81.6	-11.7	0	0	0	117.3
3	Q	42.3	Very low	43.6	Very low	177 Å²	177	141.3 Å²	141.3	83%	0.827	68%	0.681	S	S	*	*	S	Bend	trans	-102.5	-9.8	175.9	-88.8	-177.2	-15.2	0	0	114.9
4	K	42	Very low	43.4	Very low	184 Å²	184	141.8 Å²	141.8	80%	0.8	68%	0.679	S	S	*	*	S	Bend	trans	-87.7	-22.4	175.1	-76.9	-174.3	176.5	-179.4	0	113.4
5	L	40.1	Very low	43.3	Very low	109 Å²	109	141.9 Å²	141.9	57%	0.571	68%	0.678	S	S	*	*	H	α-helix	trans	-73.9	-39.1	178.5	-95.6	147.6	0	0	0	112.8	K7 L8 E9	L5-K7 VanDerWaalsContact C-N 3.31Å; L5-K7 PolarHBondContact O-N 3.32Å; L5-L8 PolarHBondContact O-N 2.85Å; L5-E9 PolarHBondContact O-N 3.37Å
6	L	42.1	Very low	43.2	Very low	114 Å²	114	138.3 Å²	138.3	60%	0.597	67%	0.668	S	S	*	*	H	α-helix	trans	-66.1	-27.3	178.6	-101.2	97.6	0	0	0	114.3	N10	L6-N10 PolarHBondContact O-N 3.34Å
7	K	46.1	Very low	43.3	Very low	161 Å²	161	135.4 Å²	135.4	70%	0.7	66%	0.655	S	S	*	*	H	α-helix	trans	-77.5	-25.5	177.9	-80.7	-174.7	174.8	-178.4	0	112.8	L5 L11	L5-K7 VanDerWaalsContact C-N 3.31Å; L5-K7 PolarHBondContact O-N 3.32Å; K7-L11 PolarHBondContact O-N 3.29Å
8	L	43.5	Very low	43.1	Very low	114 Å²	114	136.9 Å²	136.9	60%	0.597	66%	0.655	S	S	*	*	H	α-helix	trans	-80.8	-36.6	178.4	-107	135.1	0	0	0	112.2	L5 L11 L12	L5-L8 PolarHBondContact O-N 2.85Å; L8-L11 PolarHBondContact O-N 3.03Å; L8-L12 PolarHBondContact O-N 2.98Å; L8-L12 VanDerWaalsContact O-N 3.14Å
9	E	44.3	Very low	42.8	Very low	116 Å²	116	140.2 Å²	140.2	54%	0.542	66%	0.66	S	S	.	*	H	α-helix	trans	-67	-34.9	174.5	-75.8	-173.2	146.1	0	0	112.9	L5 L12 R13	L5-E9 PolarHBondContact O-N 3.37Å; E9-L12 PolarHBondContact O-N 3.47Å; E9-R13 WeakPolarHBondContact O-CG 3.45Å; E9-R13 PolarHBondContact O-N 3.47Å; E9-R13 VanDerWaalsContact O-N 3.09Å
10	N	44.1	Very low	42.8	Very low	95 Å²	95	139.5 Å²	139.5	51%	0.508	66%	0.656	S	S	.	*	H	α-helix	trans	-72.8	-30.4	177.6	-78.3	-18.4	0	0	0	113.5	L6 F14	L6-N10 PolarHBondContact O-N 3.34Å; N10-F14 PolarHBondContact O-N 3.37Å
11	L	45	Very low	42.7	Very low	128 Å²	128	137.8 Å²	137.8	67%	0.67	65%	0.651	S	S	*	*	H	α-helix	trans	-74.2	-35.9	173.7	-90.1	157.9	0	0	0	112.3	K7 L8 F14 H15	K7-L11 PolarHBondContact O-N 3.29Å; L8-L11 PolarHBondContact O-N 3.03Å; L11-F14 PolarHBondContact O-N 2.86Å; L11-H15 PolarHBondContact O-N 3.14Å
12	L	43.1	Very low	42.2	Very low	116 Å²	116	134.1 Å²	134.1	61%	0.607	63%	0.631	S	S	*	*	H	α-helix	trans	-68.6	-36	175.2	-88.3	154.3	0	0	0	112.5	L8 E9 T16	L8-L12 PolarHBondContact O-N 2.98Å; L8-L12 VanDerWaalsContact O-N 3.14Å; E9-L12 PolarHBondContact O-N 3.47Å; L12-T16 PolarHBondContact O-N 3.13Å; L12-T16 PolarHBondContact O-OG1 3.33Å
13	R	44.5	Very low	42	Very low	166 Å²	166	131.6 Å²	131.6	63%	0.626	62%	0.623	S	S	*	*	H	α-helix	trans	-67.6	-38	173.3	-74.8	-176.7	-178.2	-167	2.5	113	E9 H15 T16 I17	E9-R13 WeakPolarHBondContact O-CG 3.45Å; E9-R13 PolarHBondContact O-N 3.47Å; E9-R13 VanDerWaalsContact O-N 3.09Å; R13-H15 VanDerWaalsContact C-N 3.34Å; R13-H15 PolarHBondContact O-N 3.25Å; R13-T16 WeakPolarHBondContact CA-OG1 3.26Å; R13-T16 PolarHBondContact O-N 2.96Å; R13-T16 PolarHBondContact O-OG1 2.98Å; R13-I17 WeakPolarHBondContact O-CD1 3.41Å; R13-I17 VanDerWaalsContact O-CG1 3.25Å; R13-I17 WeakPolarHBondContact O-CG1 3.49Å; R13-I17 PolarHBondContact O-N 3.46Å; R13-I17 VanDerWaalsContact O-N 3.13Å
14	F	41.1	Very low	41.7	Very low	148 Å²	148	128.5 Å²	128.5	65%	0.649	61%	0.612	S	S	*	*	H	α-helix	trans	-65.2	-36.6	176.3	-109.7	-88.7	0	0	0	112.9	N10 L11 Y18	N10-F14 PolarHBondContact O-N 3.37Å; L11-F14 PolarHBondContact O-N 2.86Å; F14-Y18 PolarHBondContact O-N 3.45Å
15	H	41.4	Very low	41.3	Very low	143 Å²	143	125.2 Å²	125.2	66%	0.662	61%	0.61	S	S	*	*	H	α-helix	trans	-75.6	-27.2	-180	-141.6	38.2	0	0	0	113.1	L11 R13 R19	L11-H15 PolarHBondContact O-N 3.14Å; R13-H15 VanDerWaalsContact C-N 3.34Å; R13-H15 PolarHBondContact O-N 3.25Å; H15-R19 PolarHBondContact O-N 3.19Å
16	T	42.2	Very low	41.3	Very low	85 Å²	85	128.7 Å²	128.7	52%	0.521	62%	0.624	S	S	.	*	H	α-helix	trans	-75.2	-35.7	172.9	16.3	0	0	0	0	112.3	L12 R13 R19 Q20	L12-T16 PolarHBondContact O-N 3.13Å; L12-T16 PolarHBondContact O-OG1 3.33Å; R13-T16 WeakPolarHBondContact CA-OG1 3.26Å; R13-T16 PolarHBondContact O-N 2.96Å; R13-T16 PolarHBondContact O-OG1 2.98Å; T16-R19 PolarHBondContact O-N 3.3Å; T16-Q20 PolarHBondContact O-N 3.02Å; T16-Q20 VanDerWaalsContact O-N 3.08Å
17	I	44.3	Very low	40.9	Very low	88 Å²	88	133.8 Å²	133.8	45%	0.451	64%	0.635	S	S	.	*	H	α-helix	trans	-67.2	-37.9	175.7	-68.2	165.7	0	0	0	111.4	R13 Q20 L21	R13-I17 WeakPolarHBondContact O-CD1 3.41Å; R13-I17 VanDerWaalsContact O-CG1 3.25Å; R13-I17 WeakPolarHBondContact O-CG1 3.49Å; R13-I17 PolarHBondContact O-N 3.46Å; R13-I17 VanDerWaalsContact O-N 3.13Å; I17-Q20 PolarHBondContact O-N 2.75Å; I17-L21 HydrophobicContact CG2-CD1 3.78Å; I17-L21 WeakPolarHBondContact O-CB 3.27Å; I17-L21 PolarHBondContact O-N 3.21Å
18	Y	39.3	Very low	40.2	Very low	163 Å²	163	137.2 Å²	137.2	64%	0.639	64%	0.644	S	S	*	*	H	α-helix	trans	-69.4	-35.4	177.8	-131.8	-93.9	0	0	0	113	F14 H22	F14-Y18 PolarHBondContact O-N 3.45Å; Y18-H22 PolarHBondContact O-N 3.11Å
19	R	38.6	Very low	39.6	Very low	199 Å²	199	136.7 Å²	136.7	75%	0.751	66%	0.656	S	S	*	*	H	α-helix	trans	-70.8	-33.1	173	-96.2	-175.7	178.1	-179.5	-0.6	112.9	H15 T16 S23	H15-R19 PolarHBondContact O-N 3.19Å; T16-R19 PolarHBondContact O-N 3.3Å; R19-S23 PolarHBondContact O-N 3.35Å
20	Q	41.5	Very low	39.2	Very low	127 Å²	127	138.9 Å²	138.9	59%	0.593	67%	0.67	S	S	*	*	H	α-helix	trans	-72.9	-37.9	174.6	-80.7	-176.9	-29.5	0	0	112.5	T16 I17 S23 L24	T16-Q20 PolarHBondContact O-N 3.02Å; T16-Q20 VanDerWaalsContact O-N 3.08Å; I17-Q20 PolarHBondContact O-N 2.75Å; Q20-S23 PolarHBondContact O-N 2.89Å; Q20-S23 PolarHBondContact O-OG 3.04Å; Q20-L24 PolarHBondContact O-N 3.04Å
21	L	40.8	Very low	38.4	Very low	104 Å²	104	146.3 Å²	146.3	55%	0.545	69%	0.691	S	S	.	*	H	α-helix	trans	-67.5	-34.9	176.6	-81.7	159.3	0	0	0	113.4	I17 S23 L24 C25	I17-L21 HydrophobicContact CG2-CD1 3.78Å; I17-L21 WeakPolarHBondContact O-CB 3.27Å; I17-L21 PolarHBondContact O-N 3.21Å; L21-S23 VanDerWaalsContact C-N 3.3Å; L21-S23 PolarHBondContact O-N 3.44Å; L21-L24 PolarHBondContact O-N 3.38Å; L21-C25 PolarHBondContact O-N 2.93Å
22	H	38.5	Very low	37.6	Very low	150 Å²	150	149.1 Å²	149.1	69%	0.694	70%	0.701	S	S	*	*	H	α-helix	trans	-71.4	-23.6	174.6	-122.1	-82.3	0	0	0	113.5	Y18	Y18-H22 PolarHBondContact O-N 3.11Å
23	S	36.8	Very low	36.7	Very low	77 Å²	77	155.8 Å²	155.8	54%	0.538	72%	0.718	S	S	.	*	H	α-helix	trans	-87.8	-11.7	174.7	72.6	0	0	0	0	114.1	R19 Q20 L21	R19-S23 PolarHBondContact O-N 3.35Å; Q20-S23 PolarHBondContact O-N 2.89Å; Q20-S23 PolarHBondContact O-OG 3.04Å; L21-S23 VanDerWaalsContact C-N 3.3Å; L21-S23 PolarHBondContact O-N 3.44Å
24	L	35.9	Very low	35.8	Very low	112 Å²	112	152.8 Å²	152.8	59%	0.586	72%	0.722	S	S	*	*	H	α-helix	trans	-103.3	-15.3	-179.9	-79.9	162.9	0	0	0	113.8	Q20 L21	Q20-L24 PolarHBondContact O-N 3.04Å; L21-L24 PolarHBondContact O-N 3.38Å
25	C	34.3	Very low	35	Very low	114 Å²	114	155 Å²	155	77%	0.77	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-10.2	172.2	-101.7	0	0	0	0	114.7	L21	L21-C25 PolarHBondContact O-N 2.93Å
26	Q	39.8	Very low	34.2	Very low	182 Å²	182	152 Å²	152	85%	0.85	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	12.1	171.5	-97.8	-177	-13.1	0	0	114.3
27	R	33.8	Very low	33.3	Very low	221 Å²	221	157.5 Å²	157.5	83%	0.834	76%	0.76	S	S	*	*	S	Bend	trans	-136.2	26.2	173.6	-80.1	-170.1	-178.5	-176.5	1	114.8
28	R	30.9	Very low	32.3	Very low	234 Å²	234	158.4 Å²	158.4	88%	0.883	77%	0.774	S	S	*	*	S	Bend	trans	-137.2	66	169.2	-98.5	-175.9	175	177.3	-1.4	111.5
29	A	31.1	Very low	31.7	Very low	102 Å²	102	155.4 Å²	155.4	84%	0.843	78%	0.777	S	S	*	*	S	Bend	trans	-144.2	25.2	156.5	0	0	0	0	0	111.4
30	L	35.3	Very low	31.1	Very low	162 Å²	162	150.2 Å²	150.2	85%	0.848	78%	0.776	S	S	*	*	S	Bend	trans	-149.6	79.7	172.3	-89.7	165.6	0	0	0	107.3
31	R	28.6	Very low	30.4	Very low	251 Å²	251	154.7 Å²	154.7	95%	0.947	79%	0.789	S	S	*	*			trans	168.7	75.6	158.3	-97.4	172.8	-174.5	-165.4	1.9	109.5
32	Q	27.2	Very low	30.6	Very low	188 Å²	188	154.6 Å²	154.6	88%	0.879	80%	0.795	S	S	*	*			trans	-158.1	79.2	150.7	-120.1	179.8	-4.8	0	0	107.3
33	W	25.3	Very low	30	Very low	255 Å²	255	153.7 Å²	153.7	97%	0.966	80%	0.799	S	S	*	*			trans	-174.9	93.7	155.2	-97.8	6.1	0	0	0	108.3
34	S	24.4	Very low	29.3	Very low	103 Å²	103	160.5 Å²	160.5	72%	0.72	81%	0.813	S	S	*	*			trans	169.3	105.3	135.8	59.2	0	0	0	0	109.3
35	H	25.2	Very low	28.7	Very low	194 Å²	194	160.4 Å²	160.4	90%	0.898	82%	0.818	S	S	*	*				-165.6	125.1	123	-94.5	-57.7	0	0	0	109.1
36	G	24.2	Very low	28.3	Very low	81 Å²	81	158.9 Å²	158.9	84%	0.835	81%	0.814	S	S	*	*			trans	167.8	61.3	-178.9	0	0	0	0	0	108.2
37	F	23.8	Very low	27.6	Very low	200 Å²	200	157.9 Å²	157.9	88%	0.877	81%	0.809	S	S	*	*			trans	-99.1	130.4	169.7	-102.8	-80.1	0	0	0	108.9
38	S	23.1	Very low	27.1	Very low	108 Å²	108	155.5 Å²	155.5	76%	0.755	81%	0.812	S	S	*	*			trans	-148.4	100.7	149.9	-157.2	0	0	0	0	105.5
39	S	26.1	Very low	26.8	Very low	100 Å²	100	153.8 Å²	153.8	70%	0.699	81%	0.807	S	S	*	*				58.3	124.9	105	73.8	0	0	0	0	113.7
40	A	25.5	Very low	26.3	Very low	89 Å²	89	152.3 Å²	152.3	74%	0.736	80%	0.795	S	S	*	*			cis	-163.5	144.4	26.3	0	0	0	0	0	112.4
41	Y	28.4	Very low	25.8	Very low	222 Å²	222	156 Å²	156	87%	0.871	80%	0.797	S	S	*	*			trans	3.8	173.5	147.8	-62.6	-75.8	0	0	0	123.3
42	P	44.8	Very low	26.1	Very low	102 Å²	102	148.2 Å²	148.2	66%	0.662	78%	0.779	S	S	*	*			cis	-141.6	-173.7	-46.3	39.9	-22.3	0	0	0	112.8
43	V	25	Very low	26	Very low	130 Å²	130	150 Å²	150	79%	0.788	78%	0.778	S	S	*	*			trans	169.2	104.5	140.1	156.6	0	0	0	0	106.7
44	W	23	Very low	26.4	Very low	220 Å²	220	142.4 Å²	142.4	83%	0.833	76%	0.761	S	S	*	*				52.6	131.7	93.8	-87.9	56	0	0	0	113.2
45	T	23.3	Very low	26.6	Very low	110 Å²	110	144.3 Å²	144.3	68%	0.675	77%	0.769	S	S	*	*			cis	-179.3	155.5	5.3	17.1	0	0	0	0	106.5
46	A	25.6	Very low	26.7	Very low	83 Å²	83	143.4 Å²	143.4	69%	0.686	77%	0.765	S	S	*	*			trans	142.1	97.4	144.1	0	0	0	0	0	110.5
47	Q	23.9	Very low	27	Very low	161 Å²	161	147.8 Å²	147.8	75%	0.752	77%	0.766	S	S	*	*				66.3	116	100.5	-85.2	163.3	-45	0	0	112.4
48	L	24.3	Very low	27.4	Very low	171 Å²	171	145.9 Å²	145.9	90%	0.895	76%	0.764	S	S	*	*				-149.9	150.5	80.1	-85.1	158.2	0	0	0	115
49	Y	24.1	Very low	27.7	Very low	198 Å²	198	147.9 Å²	147.9	78%	0.776	76%	0.764	S	S	*	*			trans	-53.5	133	175.4	-82.1	-103.1	0	0	0	114.2
50	A	21.7	Very low	28	Very low	71 Å²	71	146.3 Å²	146.3	59%	0.587	76%	0.764	S	S	*	*				83.1	101	89	0	0	0	0	0	113.9
51	W	24.4	Very low	28.3	Very low	240 Å²	240	145.1 Å²	145.1	91%	0.909	75%	0.754	S	S	*	*				101.1	160.6	98.7	-94.5	37.8	0	0	0	112
52	P	34.3	Very low	28.5	Very low	86 Å²	86	138 Å²	138	56%	0.558	74%	0.741	S	S	*	*			cis	-145	179.8	-25.6	31.9	-7.9	0	0	0	115.6
53	W	26.3	Very low	27.8	Very low	227 Å²	227	139.3 Å²	139.3	86%	0.86	74%	0.742	S	S	*	*			trans	83.3	148.5	163	-58.9	73.7	0	0	0	120.2
54	P	32.4	Very low	28.1	Very low	95 Å²	95	137.2 Å²	137.2	62%	0.617	73%	0.733	S	S	*	*			cis	-137.1	148.7	-43.5	35.7	-19.2	0	0	0	113.3	E56	P54-E56 PolarHBondContact O-N 3.39Å; P54-E56 VanDerWaalsContact O-N 3.11Å
55	T	28.6	Very low	28.6	Very low	143 Å²	143	133.9 Å²	133.9	88%	0.877	73%	0.727	S	S	*	*			trans	-57.4	100.4	149.6	31.8	0	0	0	0	110.6
56	E	27.2	Very low	28.9	Very low	174 Å²	174	138.2 Å²	138.2	81%	0.813	73%	0.732	S	S	*	*			trans	-152.7	116.4	147.7	-85.1	-153.5	155.8	0	0	108.4	P54	P54-E56 PolarHBondContact O-N 3.39Å; P54-E56 VanDerWaalsContact O-N 3.11Å
57	M	31.3	Very low	29.1	Very low	173 Å²	173	145 Å²	145	85%	0.852	74%	0.74	S	S	*	*	S	Bend	trans	167.4	15.5	150.6	-90.5	-114.8	96	0	0	113.5
58	L	31	Very low	29.4	Very low	160 Å²	160	146.3 Å²	146.3	84%	0.838	74%	0.744	S	S	*	*	S	Bend	trans	-131.5	24.1	170.5	-78.6	170.1	0	0	0	114.5
59	I	31.5	Very low	29.6	Very low	150 Å²	150	145.3 Å²	145.3	77%	0.769	74%	0.738	S	S	*	*	S	Bend	trans	-111.6	-2.3	164.3	-62.5	177.6	0	0	0	111.5
60	G	31.4	Very low	30	Very low	67 Å²	67	142 Å²	142	69%	0.691	74%	0.739	S	S	*	*	S	Bend	trans	-92.7	-16.9	179.1	0	0	0	0	0	116.9
61	A	32.2	Very low	30.3	Very low	64 Å²	64	145.2 Å²	145.2	53%	0.529	75%	0.751	S	S	.	*	S	Bend	trans	-109.7	-22.5	-171	0	0	0	0	0	114.9
62	A	32.4	Very low	30.5	Very low	72 Å²	72	143.7 Å²	143.7	60%	0.595	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-8.5	-178.7	0	0	0	0	0	114.1
63	L	29.7	Very low	30.3	Very low	131 Å²	131	149 Å²	149	69%	0.686	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	4.7	179.5	-79.9	167.8	0	0	0	114.6
64	S	32.2	Very low	30.5	Very low	85 Å²	85	146.8 Å²	146.8	59%	0.594	76%	0.764	S	S	*	*	S	Bend	trans	-98.9	-18.2	169.5	79.8	0	0	0	0	113.7
65	Q	33.5	Very low	30.3	Very low	151 Å²	151	151.3 Å²	151.3	71%	0.706	78%	0.777	S	S	*	*	S	Bend	trans	-100.3	-16.2	-178.4	-73.2	-175.1	-20	0	0	114.9
66	Y	28.7	Very low	30.2	Very low	200 Å²	200	155.5 Å²	155.5	78%	0.784	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	4.4	175.1	-101.6	-88.1	0	0	0	114.9
67	R	29.1	Very low	30.2	Very low	225 Å²	225	153.2 Å²	153.2	85%	0.849	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	9.4	176.9	-137.9	174.7	-173.1	168.9	1.2	114.5
68	F	30.2	Very low	30.1	Very low	189 Å²	189	156.6 Å²	156.6	83%	0.829	78%	0.781	S	S	*	*	S	Bend	trans	-122.3	2.3	179.8	-125.6	-90.5	0	0	0	115.4
69	L	30.2	Very low	30	Very low	150 Å²	150	158.7 Å²	158.7	79%	0.785	78%	0.783	S	S	*	*	S	Bend	trans	-125	4.2	-173.7	-88.6	162.1	0	0	0	116.8
70	V	31.2	Very low	29.9	Very low	129 Å²	129	156.6 Å²	156.6	78%	0.782	78%	0.782	S	S	*	*			trans	-138.7	71.9	171.4	-170.1	0	0	0	0	111.5
71	T	29.4	Very low	29.9	Very low	138 Å²	138	162.7 Å²	162.7	85%	0.847	79%	0.792	S	S	*	*			trans	-140.3	49	151	46.1	0	0	0	0	109.9	K73	T71-K73 PolarHBondContact O-N 3.34Å
72	K	28.6	Very low	30.1	Very low	209 Å²	209	167.3 Å²	167.3	91%	0.909	81%	0.807	S	S	*	*			trans	-91.4	90.7	160	-100.9	-177.7	175.7	176.4	0	108.5
73	K	29.9	Very low	30.1	Very low	198 Å²	198	168.9 Å²	168.9	86%	0.861	81%	0.814	S	S	*	*			trans	-74.2	119.2	166.7	-146.6	176	-174.2	179.4	0	107	T71 E75	T71-K73 PolarHBondContact O-N 3.34Å; K73-E75 PolarHBondContact O-N 2.82Å
74	E	29.1	Very low	30.7	Very low	180 Å²	180	167.7 Å²	167.7	84%	0.841	82%	0.817	S	S	*	*			trans	-60.4	112.6	169.6	-75.7	177.9	129.9	0	0	109.7
75	E	28.3	Very low	30.9	Very low	189 Å²	189	170.7 Å²	170.7	88%	0.883	83%	0.831	S	S	*	*			trans	-97.3	114.8	161.2	-75.8	-169.2	155.1	0	0	109.3	K73	K73-E75 PolarHBondContact O-N 2.82Å
76	R	27.1	Very low	31.4	Very low	232 Å²	232	173.2 Å²	173.2	88%	0.875	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-82.9	154.3	160.1	-86	-174.7	-178.3	-177.5	1.2	109.6
77	P	28.2	Very low	32.4	Very low	126 Å²	126	169.3 Å²	169.3	82%	0.818	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-78	125.8	-146	30.8	-33.5	0	0	0	112.1
78	R	28.5	Very low	34	Very low	244 Å²	244	165 Å²	165	92%	0.921	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-84.1	130.7	165.5	-82.7	-177.6	172	-179.8	-2.2	109.7
79	K	29	Very low	36.1	Very low	203 Å²	203	160.1 Å²	160.1	88%	0.883	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-49.6	137	172.7	-72	174.4	174.4	178.5	0	111	Q81	K79-Q81 PolarHBondContact O-N 2.95Å
80	S	29	Very low	38.4	Very low	107 Å²	107	157 Å²	157	75%	0.748	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-55.9	123.4	169.5	50.9	0	0	0	0	112
81	Q	32.2	Very low	40.7	Very low	194 Å²	194	151 Å²	151	91%	0.907	76%	0.759	S	S	*	*			trans	-117.5	124.3	148.2	-79.6	-169.1	-21.1	0	0	108.1	K79	K79-Q81 PolarHBondContact O-N 2.95Å
82	L	36	Very low	43	Very low	161 Å²	161	149.2 Å²	149.2	84%	0.843	74%	0.74	S	S	*	*			trans	-63.9	141.6	179.7	-88	76.8	0	0	0	112.1
83	S	32.3	Very low	45.4	Very low	105 Å²	105	139.2 Å²	139.2	73%	0.734	70%	0.697	S	S	*	*				-175.8	93.3	127.6	41.5	0	0	0	0	107.8
84	S	41.9	Very low	47.7	Very low	107 Å²	107	133 Å²	133	75%	0.748	67%	0.668	S	S	*	*				66	78.3	97.6	70.3	0	0	0	0	115.7
85	T	35.9	Very low	49.9	Very low	147 Å²	147	130.6 Å²	130.6	90%	0.902	66%	0.66	S	S	*	*			trans	-145.8	94.7	132.1	-37	0	0	0	0	107.7	S87	T85-S87 PolarHBondContact O-N 2.98Å; T85-S87 VanDerWaalsContact O-N 3.16Å
86	K	44.5	Very low	52	Low	205 Å²	205	122.9 Å²	122.9	89%	0.891	63%	0.631	S	S	*	*			trans	-66.5	112.1	178.9	-75.5	-178.4	177.6	179	0	108.6	K88	K86-K88 PolarHBondContact O-N 3.38Å
87	S	50.6	Low	54.5	Low	118 Å²	118	111.9 Å²	111.9	83%	0.825	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-63.3	125.7	163.6	49.2	0	0	0	0	108.2	T85 K89	T85-S87 PolarHBondContact O-N 2.98Å; T85-S87 VanDerWaalsContact O-N 3.16Å; S87-K89 PolarHBondContact O-N 3.35Å
88	K	61.8	Low	57.2	Low	133 Å²	133	106.6 Å²	106.6	58%	0.578	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-61.8	125.3	177.8	-68.9	-174.9	175.8	-174.8	0	109	K86 G146 K148	K86-K88 PolarHBondContact O-N 3.38Å; K88-G146 WeakPolarHBondContact CD-O 3.48Å; K88-G146 WeakPolarHBondContact CG-O 3.48Å; K88-K148 HydrophobicContact CB-CD 4.45Å; K88-K148 HydrophobicContact CB-CG 4.07Å; K88-K148 HydrophobicContact CD-CG 4.41Å
89	K	74.1	Confident	59.6	Low	88 Å²	88	95 Å²	95	38%	0.383	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-59.4	134.3	176.5	-161.4	177.2	-177.7	-173.1	0	109.2	S87 E107 M147 K148	S87-K89 PolarHBondContact O-N 3.35Å; K89-E107 IonicContact NZ-OE1 2.86Å; K89-E107 PolarHBondContact NZ-OE1 3.24Å; K89-E107 IonicContact NZ-OE2 2.89Å; K89-E107 PolarHBondContact NZ-OE2 3.44Å; K89-M147 HydrophobicContact CB-CG 4.31Å; K89-M147 CarbonylContact O-C 3.41Å; K89-M147 WeakPolarHBondContact O-CA 3.49Å; K89-M147 WeakPolarHBondContact O-CB 3.31Å; K89-K148 PolarHBondContact O-N 3Å
90	V	78.3	Confident	62.1	Low	84 Å²	84	88.2 Å²	88.2	51%	0.509	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.8	179.1	-177.4	0	0	0	0	108.4	K148 K150	V90-K148 CarbonylContact C-O 3.55Å; V90-K148 VanDerWaalsContact CA-O 3.28Å; V90-K148 WeakPolarHBondContact CA-O 3.44Å; V90-K148 HydrophobicContact CG2-CB 4.07Å; V90-K150 HydrophobicContact CG1-CB 3.88Å
91	V	79.9	Confident	64.6	Low	4 Å²	4	86.7 Å²	86.7	2%	0.024	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129.6	177.2	-178.2	0	0	0	0	108.5	V93 A105 M106 I142 M147 K148 K150	V91-V93 HydrophobicContact CG1-CG2 4.02Å; V91-A105 HydrophobicContact CG1-CB 3.97Å; V91-M106 HydrophobicContact CG1-CG 4.21Å; V91-M106 HydrophobicContact CG2-CG 4.26Å; V91-I142 HydrophobicContact CG1-CD1 4.4Å; V91-M147 HydrophobicContact CG2-CB 4.03Å; V91-M147 HydrophobicContact CG2-CG 4.32Å; V91-M147 HydrophobicContact CG2-SD 3.38Å; V91-M147 WeakPolarHBondContact CG2-SD 3.42Å; V91-K148 PolarHBondContact N-O 3.24Å; V91-K150 PolarHBondContact O-N 3.35Å
92	E	78.6	Confident	67	Low	99 Å²	99	77.4 Å²	77.4	46%	0.463	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	128.1	174.3	-61.2	-163	151.3	0	0	109.7	K150	E92-K150 VanDerWaalsContact CA-O 3.31Å; E92-K150 WeakPolarHBondContact CA-O 3.46Å; E92-K150 HydrophobicContact CG-CD 4.35Å; E92-K150 IonicContact OE1-NZ 2.64Å; E92-K150 PolarHBondContact OE1-NZ 3.46Å
93	V	78.9	Confident	69.3	Low	0 Å²	0	69.9 Å²	69.9	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	147.9	-176.2	-165.1	0	0	0	0	111.1	V91 M97 I138 I142 L149 K150 W151 S152	V91-V93 HydrophobicContact CG1-CG2 4.02Å; V93-M97 HydrophobicContact CG1-CB 4.33Å; V93-M97 HydrophobicContact CG1-SD 3.6Å; V93-I138 HydrophobicContact CB-CG2 4.23Å; V93-I138 HydrophobicContact CG1-CD1 4.18Å; V93-I138 HydrophobicContact CG1-CG2 3.36Å; V93-I138 HydrophobicContact CG2-CG2 4.24Å; V93-I142 HydrophobicContact CG2-CD1 3.34Å; V93-L149 HydrophobicContact CG2-CD1 4.26Å; V93-L149 HydrophobicContact CG2-CG 4.15Å; V93-K150 PolarHBondContact N-O 3.13Å; V93-W151 CarbonylContact O-C 3.55Å; V93-W151 VanDerWaalsContact O-CA 3.3Å; V93-W151 WeakPolarHBondContact O-CA 3.22Å; V93-S152 PolarHBondContact O-N 2.77Å
94	W	78.1	Confident	71.8	Confident	66 Å²	66	73.2 Å²	73.2	25%	0.25	38%	0.378	C	S	.	.			trans	-123.1	166.4	173	56.8	88.5	0	0	0	110.8	M97 E101 S152 L154	W94-M97 HydrophobicContact CE3-CE 4.19Å; W94-M97 HydrophobicContact CH2-CE 3.49Å; W94-M97 VanDerWaalsContact CH2-CE 3.49Å; W94-M97 HydrophobicContact CZ2-CE 3.83Å; W94-M97 HydrophobicContact CZ2-CG 4.22Å; W94-M97 HydrophobicContact CZ3-CE 3.66Å; W94-E101 HydrophobicContact CZ2-CB 4.38Å; W94-E101 WeakPolarHBondContact CZ2-OE2 3.32Å; W94-S152 WeakPolarHBondContact CB-O 3.38Å; W94-L154 HydrophobicContact CB-CD1 4.19Å; W94-L154 HydrophobicContact CD2-CD1 3.92Å; W94-L154 HydrophobicContact CG-CD1 3.53Å
95	I	75.1	Confident	73.7	Confident	131 Å²	131	69.9 Å²	69.9	67%	0.672	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	130	-177.6	-58.2	169	0	0	0	108.5	W151	I95-W151 HydrophobicContact CG1-CE3 4.2Å; I95-W151 HydrophobicContact CG1-CH2 4.35Å; I95-W151 HydrophobicContact CG1-CZ3 3.67Å
96	G	72.4	Confident	75.7	Confident	26 Å²	26	63 Å²	63	27%	0.268	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	28.8	-178.3	0	0	0	0	0	114.4	H132	G96-H132 PolarHBondContact O-ND1 2.9Å
97	M	79.6	Confident	77.5	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.005	31%	0.305	C	S	.	.			trans	-65.2	137.4	173.8	-163.4	175.9	-145.3	0	0	110.6	V93 W94 E101 L102 A105 L133 I138	V93-M97 HydrophobicContact CG1-CB 4.33Å; V93-M97 HydrophobicContact CG1-SD 3.6Å; W94-M97 HydrophobicContact CE3-CE 4.19Å; W94-M97 HydrophobicContact CH2-CE 3.49Å; W94-M97 VanDerWaalsContact CH2-CE 3.49Å; W94-M97 HydrophobicContact CZ2-CE 3.83Å; W94-M97 HydrophobicContact CZ2-CG 4.22Å; W94-M97 HydrophobicContact CZ3-CE 3.66Å; M97-E101 HydrophobicContact CE-CB 4.04Å; M97-E101 WeakPolarHBondContact CE-O 3.48Å; M97-E101 HydrophobicContact CG-CB 3.6Å; M97-L102 HydrophobicContact CG-CB 4.14Å; M97-L102 VanDerWaalsContact SD-CA 3.52Å; M97-L102 HydrophobicContact SD-CB 3.72Å; M97-L102 HydrophobicContact SD-CD1 3.6Å; M97-L102 VanDerWaalsContact SD-CD1 3.6Å; M97-L102 HydrophobicContact SD-CG 4.27Å; M97-A105 HydrophobicContact CE-CB 3.53Å; M97-L133 PolarHBondContact O-N 2.87Å; M97-I138 HydrophobicContact CB-CD1 3.92Å
98	T	83.5	Confident	79	Confident	15 Å²	15	57.8 Å²	57.8	9%	0.092	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-75.6	161.9	173.7	67.9	0	0	0	0	111.4	E100 E101 L102 D130 S131	T98-E100 VanDerWaalsContact C-N 3.26Å; T98-E100 PolarHBondContact O-N 3.34Å; T98-E101 PolarHBondContact N-OE2 3.03Å; T98-E101 PolarHBondContact O-N 2.61Å; T98-E101 WeakPolarHBondContact OG1-CB 3.34Å; T98-E101 VanDerWaalsContact OG1-CG 3.22Å; T98-E101 WeakPolarHBondContact OG1-CG 3.36Å; T98-E101 PolarHBondContact OG1-N 2.91Å; T98-L102 WeakPolarHBondContact O-CB 3.22Å; T98-L102 PolarHBondContact O-N 3.15Å; T98-D130 WeakPolarHBondContact CG2-O 3.45Å; T98-S131 WeakPolarHBondContact CA-O 3.35Å
99	V	80.9	Confident	80	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.6	-41.8	176.1	-177.4	0	0	0	0	110.5	A103 I113 Y114 A129 S131 L133	V99-A103 WeakPolarHBondContact O-CB 3.37Å; V99-A103 PolarHBondContact O-N 3.41Å; V99-I113 HydrophobicContact CG1-CB 4.15Å; V99-I113 HydrophobicContact CG1-CD1 4.35Å; V99-I113 HydrophobicContact CG1-CG2 3.93Å; V99-I113 WeakPolarHBondContact O-CD1 3.33Å; V99-Y114 HydrophobicContact CG1-CE1 4.38Å; V99-Y114 HydrophobicContact CG1-CE2 4.48Å; V99-A129 WeakPolarHBondContact CB-O 3.25Å; V99-A129 PolarHBondContact N-O 2.93Å; V99-S131 PolarHBondContact N-O 3.1Å; V99-L133 HydrophobicContact CG2-CD1 3.94Å; V99-L133 HydrophobicContact CG2-CD2 4.22Å; V99-L133 HydrophobicContact CG2-CG 3.94Å
100	E	81.3	Confident	80.3	Confident	62 Å²	62	55 Å²	55	29%	0.29	28%	0.276	S	S	.	.	H	α-helix	trans	-64	-46	175.9	-68.7	-155.2	169.3	0	0	113.5	T98 L102 A103 R104 T110 A129	T98-E100 VanDerWaalsContact C-N 3.26Å; T98-E100 PolarHBondContact O-N 3.34Å; E100-L102 VanDerWaalsContact C-N 3.3Å; E100-L102 PolarHBondContact O-N 2.86Å; E100-A103 WeakPolarHBondContact O-CB 3.38Å; E100-A103 PolarHBondContact O-N 2.96Å; E100-R104 WeakPolarHBondContact O-CG 3.48Å; E100-R104 PolarHBondContact O-N 2.96Å; E100-R104 IonicContact OE2-CZ 3.5Å; E100-R104 IonicContact OE2-NH2 2.79Å; E100-R104 PolarHBondContact OE2-NH2 2.96Å; E100-T110 HydrophobicContact CG-CG2 4.25Å; E100-A129 HydrophobicContact CG-CB 3.71Å; E100-A129 PolarHBondContact N-O 3.44Å
101	E	81	Confident	80.3	Confident	74 Å²	74	55.8 Å²	55.8	35%	0.346	28%	0.278	S	S	.	.	H	α-helix	trans	-62.2	-41.9	179.8	-74.9	174.9	168.2	0	0	110.8	W94 M97 T98 R104 A105	W94-E101 HydrophobicContact CZ2-CB 4.38Å; W94-E101 WeakPolarHBondContact CZ2-OE2 3.32Å; M97-E101 HydrophobicContact CE-CB 4.04Å; M97-E101 WeakPolarHBondContact CE-O 3.48Å; M97-E101 HydrophobicContact CG-CB 3.6Å; T98-E101 PolarHBondContact N-OE2 3.03Å; T98-E101 PolarHBondContact O-N 2.61Å; T98-E101 WeakPolarHBondContact OG1-CB 3.34Å; T98-E101 VanDerWaalsContact OG1-CG 3.22Å; T98-E101 WeakPolarHBondContact OG1-CG 3.36Å; T98-E101 PolarHBondContact OG1-N 2.91Å; E101-R104 PolarHBondContact O-N 3.04Å; E101-A105 WeakPolarHBondContact O-CB 3.24Å; E101-A105 PolarHBondContact O-N 3.09Å
102	L	83.1	Confident	80.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-40.7	176.6	-174.9	63.7	0	0	0	111.4	M97 T98 E100 A105 M106 I113 L133 I138 V141 I142	M97-L102 HydrophobicContact CG-CB 4.14Å; M97-L102 VanDerWaalsContact SD-CA 3.52Å; M97-L102 HydrophobicContact SD-CB 3.72Å; M97-L102 HydrophobicContact SD-CD1 3.6Å; M97-L102 VanDerWaalsContact SD-CD1 3.6Å; M97-L102 HydrophobicContact SD-CG 4.27Å; T98-L102 WeakPolarHBondContact O-CB 3.22Å; T98-L102 PolarHBondContact O-N 3.15Å; E100-L102 VanDerWaalsContact C-N 3.3Å; E100-L102 PolarHBondContact O-N 2.86Å; L102-A105 PolarHBondContact O-N 3.49Å; L102-M106 HydrophobicContact CD1-CG 4.39Å; L102-M106 HydrophobicContact CD1-SD 4.05Å; L102-M106 HydrophobicContact CG-SD 3.96Å; L102-M106 WeakPolarHBondContact O-CB 3.27Å; L102-M106 VanDerWaalsContact O-CG 3.25Å; L102-M106 WeakPolarHBondContact O-CG 3.45Å; L102-M106 PolarHBondContact O-N 3.04Å; L102-I113 HydrophobicContact CB-CD1 3.84Å; L102-I113 HydrophobicContact CD2-CD1 4Å; L102-I113 HydrophobicContact CD2-CG2 4.48Å; L102-I113 HydrophobicContact CG-CD1 3.79Å; L102-L133 HydrophobicContact CD2-CD1 3.72Å; L102-I138 HydrophobicContact CD1-CG2 4.32Å; L102-I138 HydrophobicContact CD2-CG1 4.33Å; L102-V141 HydrophobicContact CD2-CB 4.45Å; L102-V141 HydrophobicContact CD2-CG1 4.26Å; L102-I142 HydrophobicContact CD1-CD1 4Å; L102-I142 HydrophobicContact CD1-CG1 4.35Å
103	A	83.9	Confident	80.3	Confident	3 Å²	3	54.1 Å²	54.1	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-61.6	-47.1	176.8	0	0	0	0	0	111	V99 E100 M106 E107 K108 T110 I113	V99-A103 WeakPolarHBondContact O-CB 3.37Å; V99-A103 PolarHBondContact O-N 3.41Å; E100-A103 WeakPolarHBondContact O-CB 3.38Å; E100-A103 PolarHBondContact O-N 2.96Å; A103-M106 PolarHBondContact O-N 3.24Å; A103-E107 PolarHBondContact O-N 3.5Å; A103-K108 CarbonylContact C-O 3.59Å; A103-K108 WeakPolarHBondContact CB-O 3.5Å; A103-K108 PolarHBondContact O-N 3.08Å; A103-K108 VanDerWaalsContact O-O 3.08Å; A103-T110 HydrophobicContact CB-CG2 3.94Å; A103-I113 VanDerWaalsContact CA-CD1 3.46Å; A103-I113 HydrophobicContact CB-CD1 3.64Å; A103-I113 HydrophobicContact CB-CG1 4.48Å
104	R	83.8	Confident	80.4	Confident	175 Å²	175	56.4 Å²	56.4	66%	0.66	28%	0.276	S	S	*	.	H	α-helix	trans	-61.5	-45	175.7	-69.3	177.7	-157.3	176.7	8.5	111.5	E100 E101 M106 E107	E100-R104 WeakPolarHBondContact O-CG 3.48Å; E100-R104 PolarHBondContact O-N 2.96Å; E100-R104 IonicContact OE2-CZ 3.5Å; E100-R104 IonicContact OE2-NH2 2.79Å; E100-R104 PolarHBondContact OE2-NH2 2.96Å; E101-R104 PolarHBondContact O-N 3.04Å; R104-M106 VanDerWaalsContact C-N 3.27Å; R104-M106 PolarHBondContact O-N 3.26Å; R104-E107 PolarHBondContact O-N 2.65Å; R104-E107 VanDerWaalsContact O-N 3.11Å
105	A	81.9	Confident	80.4	Confident	37 Å²	37	59.1 Å²	59.1	31%	0.306	29%	0.291	S	S	.	.	H	α-helix	trans	-65.2	-30.6	178.9	0	0	0	0	0	112.9	V91 M97 E101 L102	V91-A105 HydrophobicContact CG1-CB 3.97Å; M97-A105 HydrophobicContact CE-CB 3.53Å; E101-A105 WeakPolarHBondContact O-CB 3.24Å; E101-A105 PolarHBondContact O-N 3.09Å; L102-A105 PolarHBondContact O-N 3.49Å
106	M	79	Confident	80.3	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-84.5	-8.6	175.6	-67.8	178.3	66.9	0	0	113.7	V91 L102 A103 R104 K108 Y112 V141 I142 A145 M147	V91-M106 HydrophobicContact CG1-CG 4.21Å; V91-M106 HydrophobicContact CG2-CG 4.26Å; L102-M106 HydrophobicContact CD1-CG 4.39Å; L102-M106 HydrophobicContact CD1-SD 4.05Å; L102-M106 HydrophobicContact CG-SD 3.96Å; L102-M106 WeakPolarHBondContact O-CB 3.27Å; L102-M106 VanDerWaalsContact O-CG 3.25Å; L102-M106 WeakPolarHBondContact O-CG 3.45Å; L102-M106 PolarHBondContact O-N 3.04Å; A103-M106 PolarHBondContact O-N 3.24Å; R104-M106 VanDerWaalsContact C-N 3.27Å; R104-M106 PolarHBondContact O-N 3.26Å; M106-K108 VanDerWaalsContact C-N 3.29Å; M106-K108 HydrophobicContact CB-CB 4.48Å; M106-K108 HydrophobicContact CB-CG 4.43Å; M106-Y112 HydrophobicContact CE-CE1 4.26Å; M106-V141 HydrophobicContact CE-CG1 4.06Å; M106-V141 HydrophobicContact SD-CG1 3.9Å; M106-I142 HydrophobicContact SD-CG1 4.07Å; M106-A145 HydrophobicContact CE-CB 3.26Å; M106-M147 HydrophobicContact CB-SD 4.46Å; M106-M147 HydrophobicContact CE-CE 4.44Å; M106-M147 HydrophobicContact CE-SD 4.3Å; M106-M147 HydrophobicContact CG-SD 4.38Å
107	E	80.8	Confident	80.4	Confident	150 Å²	150	52 Å²	52	70%	0.701	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	43.6	-167.6	-66.4	168.1	-141.3	0	0	112.4	K89 A103 R104	K89-E107 IonicContact NZ-OE1 2.86Å; K89-E107 PolarHBondContact NZ-OE1 3.24Å; K89-E107 IonicContact NZ-OE2 2.89Å; K89-E107 PolarHBondContact NZ-OE2 3.44Å; A103-E107 PolarHBondContact O-N 3.5Å; R104-E107 PolarHBondContact O-N 2.65Å; R104-E107 VanDerWaalsContact O-N 3.11Å
108	K	82.3	Confident	80	Confident	64 Å²	64	57.1 Å²	57.1	28%	0.278	28%	0.277	S	S	.	.	S	Bend	trans	-128.4	164.2	177.1	-66.5	-167.7	178.5	-173.5	0	110.8	A103 M106 Y112	A103-K108 CarbonylContact C-O 3.59Å; A103-K108 WeakPolarHBondContact CB-O 3.5Å; A103-K108 PolarHBondContact O-N 3.08Å; A103-K108 VanDerWaalsContact O-O 3.08Å; M106-K108 VanDerWaalsContact C-N 3.29Å; M106-K108 HydrophobicContact CB-CB 4.48Å; M106-K108 HydrophobicContact CB-CG 4.43Å; K108-Y112 HydrophobicContact CB-CD1 4.23Å; K108-Y112 HydrophobicContact CB-CG 4.34Å; K108-Y112 HydrophobicContact CD-CD1 3.22Å; K108-Y112 HydrophobicContact CD-CD2 4.11Å; K108-Y112 HydrophobicContact CD-CE1 3.4Å; K108-Y112 VanDerWaalsContact CD-CE1 3.4Å; K108-Y112 HydrophobicContact CD-CE2 4.26Å; K108-Y112 HydrophobicContact CD-CG 3.6Å; K108-Y112 HydrophobicContact CG-CD1 4.35Å; K108-Y112 PolarHBondContact NZ-OH 2.97Å
109	N	83.8	Confident	79.1	Confident	119 Å²	119	63.3 Å²	63.3	64%	0.636	31%	0.309	S	S	*	.			trans	-72.7	153.9	173.5	-67.1	-10.7	0	0	0	110.5	D111 Y112	N109-D111 PolarHBondContact O-N 3.15Å; N109-Y112 WeakPolarHBondContact O-CB 3.3Å; N109-Y112 PolarHBondContact O-N 2.94Å
110	T	80.1	Confident	78.2	Confident	44 Å²	44	64.4 Å²	64.4	27%	0.27	32%	0.316	S	S	.	.	H	α-helix	trans	-55.9	-36.5	173.9	44.5	0	0	0	0	111.9	E100 A103 Y112 I113 Y114	E100-T110 HydrophobicContact CG-CG2 4.25Å; A103-T110 HydrophobicContact CB-CG2 3.94Å; T110-Y112 PolarHBondContact O-N 3.18Å; T110-I113 WeakPolarHBondContact O-CB 3.47Å; T110-I113 PolarHBondContact O-N 3.16Å; T110-Y114 VanDerWaalsContact O-CD2 3.27Å; T110-Y114 WeakPolarHBondContact O-CD2 3.34Å; T110-Y114 PolarHBondContact O-N 3.06Å; T110-Y114 VanDerWaalsContact O-N 3.16Å
111	D	78.9	Confident	77.1	Confident	100 Å²	100	66.5 Å²	66.5	54%	0.535	34%	0.344	S	S	.	.	H	α-helix	trans	-52.7	-37.7	174.4	-56.3	-28.7	0	0	0	113	N109 I113 Y114 E115	N109-D111 PolarHBondContact O-N 3.15Å; D111-I113 VanDerWaalsContact C-N 3.28Å; D111-I113 PolarHBondContact O-N 3.04Å; D111-Y114 PolarHBondContact O-N 2.84Å; D111-E115 WeakPolarHBondContact O-CG 3.3Å; D111-E115 PolarHBondContact O-N 3.04Å
112	Y	79.5	Confident	76.4	Confident	67 Å²	67	64.7 Å²	64.7	26%	0.263	34%	0.336	S	S	.	.	H	α-helix	trans	-67.7	-30.9	179.2	-177.9	-93	0	0	0	112.3	M106 K108 N109 T110 A116 A145	M106-Y112 HydrophobicContact CE-CE1 4.26Å; K108-Y112 HydrophobicContact CB-CD1 4.23Å; K108-Y112 HydrophobicContact CB-CG 4.34Å; K108-Y112 HydrophobicContact CD-CD1 3.22Å; K108-Y112 HydrophobicContact CD-CD2 4.11Å; K108-Y112 HydrophobicContact CD-CE1 3.4Å; K108-Y112 VanDerWaalsContact CD-CE1 3.4Å; K108-Y112 HydrophobicContact CD-CE2 4.26Å; K108-Y112 HydrophobicContact CD-CG 3.6Å; K108-Y112 HydrophobicContact CG-CD1 4.35Å; K108-Y112 PolarHBondContact NZ-OH 2.97Å; N109-Y112 WeakPolarHBondContact O-CB 3.3Å; N109-Y112 PolarHBondContact O-N 2.94Å; T110-Y112 PolarHBondContact O-N 3.18Å; Y112-A116 WeakPolarHBondContact O-CB 3.44Å; Y112-A116 PolarHBondContact O-N 2.8Å; Y112-A145 HydrophobicContact CE1-CB 4.05Å
113	I	79.1	Confident	75.5	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-74	-43.7	177	-62.2	-176.5	0	0	0	109.6	V99 L102 A103 T110 D111 E115 A116 L117 L133 V141	V99-I113 HydrophobicContact CG1-CB 4.15Å; V99-I113 HydrophobicContact CG1-CD1 4.35Å; V99-I113 HydrophobicContact CG1-CG2 3.93Å; V99-I113 WeakPolarHBondContact O-CD1 3.33Å; L102-I113 HydrophobicContact CB-CD1 3.84Å; L102-I113 HydrophobicContact CD2-CD1 4Å; L102-I113 HydrophobicContact CD2-CG2 4.48Å; L102-I113 HydrophobicContact CG-CD1 3.79Å; A103-I113 VanDerWaalsContact CA-CD1 3.46Å; A103-I113 HydrophobicContact CB-CD1 3.64Å; A103-I113 HydrophobicContact CB-CG1 4.48Å; T110-I113 WeakPolarHBondContact O-CB 3.47Å; T110-I113 PolarHBondContact O-N 3.16Å; D111-I113 VanDerWaalsContact C-N 3.28Å; D111-I113 PolarHBondContact O-N 3.04Å; I113-E115 VanDerWaalsContact C-N 3.32Å; I113-E115 PolarHBondContact O-N 3.25Å; I113-A116 PolarHBondContact O-N 3.27Å; I113-A116 VanDerWaalsContact O-N 3.15Å; I113-L117 HydrophobicContact CG2-CD1 3.88Å; I113-L117 HydrophobicContact CG2-CG 4.47Å; I113-L117 VanDerWaalsContact O-CG 3.3Å; I113-L117 WeakPolarHBondContact O-CG 3.28Å; I113-L117 PolarHBondContact O-N 2.88Å; I113-L133 HydrophobicContact CG2-CD1 4.4Å; I113-V141 HydrophobicContact CG1-CG1 4.21Å; I113-V141 HydrophobicContact CG2-CG1 4.25Å; I113-V141 HydrophobicContact CG2-CG2 4.25Å
114	Y	79.9	Confident	74.4	Confident	48 Å²	48	71.6 Å²	71.6	19%	0.188	37%	0.372	C	S	.	.	H	α-helix	trans	-58.1	-45.4	172.9	-65.3	-60.1	0	0	0	111.1	V99 T110 D111 A116 L117 L118 I124 L127 A129	V99-Y114 HydrophobicContact CG1-CE1 4.38Å; V99-Y114 HydrophobicContact CG1-CE2 4.48Å; T110-Y114 VanDerWaalsContact O-CD2 3.27Å; T110-Y114 WeakPolarHBondContact O-CD2 3.34Å; T110-Y114 PolarHBondContact O-N 3.06Å; T110-Y114 VanDerWaalsContact O-N 3.16Å; D111-Y114 PolarHBondContact O-N 2.84Å; Y114-A116 VanDerWaalsContact C-N 3.32Å; Y114-A116 PolarHBondContact O-N 3.06Å; Y114-L117 CarbonylContact O-C 3.57Å; Y114-L117 WeakPolarHBondContact O-CA 3.41Å; Y114-L117 PolarHBondContact O-N 2.79Å; Y114-L118 WeakPolarHBondContact O-CG 3.25Å; Y114-L118 PolarHBondContact O-N 3.23Å; Y114-I124 HydrophobicContact CD1-CG2 4.4Å; Y114-L127 HydrophobicContact CE1-CB 4.26Å; Y114-L127 PolarHBondContact OH-O 3.21Å; Y114-A129 PolarHBondContact OH-N 3.4Å
115	E	77.4	Confident	73.1	Confident	123 Å²	123	71 Å²	71	58%	0.575	38%	0.382	S	S	*	.	H	α-helix	trans	-58.7	-40.4	174.6	-77.5	-178.3	178	0	0	113.2	D111 I113 L117 L118	D111-E115 WeakPolarHBondContact O-CG 3.3Å; D111-E115 PolarHBondContact O-N 3.04Å; I113-E115 VanDerWaalsContact C-N 3.32Å; I113-E115 PolarHBondContact O-N 3.25Å; E115-L117 PolarHBondContact O-N 2.92Å; E115-L118 HydrophobicContact CB-CD1 4.5Å; E115-L118 HydrophobicContact CG-CD1 4.35Å; E115-L118 PolarHBondContact O-N 2.75Å
116	A	74.4	Confident	72	Confident	8 Å²	8	73.2 Å²	73.2	7%	0.066	40%	0.396	C	S	.	.	H	α-helix	trans	-67.8	-25.9	177.6	0	0	0	0	0	112.6	Y112 I113 Y114 V141 K144	Y112-A116 WeakPolarHBondContact O-CB 3.44Å; Y112-A116 PolarHBondContact O-N 2.8Å; I113-A116 PolarHBondContact O-N 3.27Å; I113-A116 VanDerWaalsContact O-N 3.15Å; Y114-A116 VanDerWaalsContact C-N 3.32Å; Y114-A116 PolarHBondContact O-N 3.06Å; A116-V141 HydrophobicContact CB-CB 4.42Å; A116-V141 HydrophobicContact CB-CG1 4.12Å; A116-V141 HydrophobicContact CB-CG2 4.08Å; A116-K144 HydrophobicContact CB-CD 4.38Å; A116-K144 WeakPolarHBondContact O-CD 3.39Å; A116-K144 PolarHBondContact O-NZ 3.31Å
117	L	74.6	Confident	71.2	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.005	40%	0.403	C	S	.	.	H	α-helix	trans	-91	-15	178.1	-65.1	171	0	0	0	113.4	I113 Y114 E115 N119 T120 I122 L133 W137 V141	I113-L117 HydrophobicContact CG2-CD1 3.88Å; I113-L117 HydrophobicContact CG2-CG 4.47Å; I113-L117 VanDerWaalsContact O-CG 3.3Å; I113-L117 WeakPolarHBondContact O-CG 3.28Å; I113-L117 PolarHBondContact O-N 2.88Å; Y114-L117 CarbonylContact O-C 3.57Å; Y114-L117 WeakPolarHBondContact O-CA 3.41Å; Y114-L117 PolarHBondContact O-N 2.79Å; E115-L117 PolarHBondContact O-N 2.92Å; L117-N119 PolarHBondContact O-N 3.39Å; L117-T120 PolarHBondContact O-N 2.91Å; L117-T120 PolarHBondContact O-OG1 2.87Å; L117-I122 HydrophobicContact CD2-CD1 4.13Å; L117-L133 HydrophobicContact CD1-CD2 4.12Å; L117-W137 HydrophobicContact CD2-CB 4.11Å; L117-V141 HydrophobicContact CD1-CG2 4.46Å; L117-V141 HydrophobicContact CD2-CG2 3.64Å; L117-V141 HydrophobicContact CG-CG2 3.84Å
118	L	70.4	Confident	70.5	Confident	108 Å²	108	74.8 Å²	74.8	57%	0.565	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-26.6	178.5	-80	169.9	0	0	0	115.5	Y114 E115 I124	Y114-L118 WeakPolarHBondContact O-CG 3.25Å; Y114-L118 PolarHBondContact O-N 3.23Å; E115-L118 HydrophobicContact CB-CD1 4.5Å; E115-L118 HydrophobicContact CG-CD1 4.35Å; E115-L118 PolarHBondContact O-N 2.75Å; L118-I124 VanDerWaalsContact CA-CD1 3.41Å; L118-I124 HydrophobicContact CB-CD1 4.31Å; L118-I124 HydrophobicContact CD2-CD1 3.63Å; L118-I124 HydrophobicContact CG-CD1 4.11Å
119	N	64.1	Low	69.6	Low	144 Å²	144	73.1 Å²	73.1	77%	0.77	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	11.6	-178.9	-68.6	-35.5	0	0	0	113.6	L117	L117-N119 PolarHBondContact O-N 3.39Å
120	T	63.5	Low	68.9	Low	23 Å²	23	72.8 Å²	72.8	14%	0.141	40%	0.4	C	S	.	.	S	Bend	trans	-104.7	166.4	177.5	65.2	0	0	0	0	111.5	L117 I122 W137 E140	L117-T120 PolarHBondContact O-N 2.91Å; L117-T120 PolarHBondContact O-OG1 2.87Å; T120-I122 PolarHBondContact O-N 2.79Å; T120-W137 HydrophobicContact CG2-CE3 4.1Å; T120-W137 HydrophobicContact CG2-CZ3 3.75Å; T120-E140 VanDerWaalsContact CG2-CD 3.49Å; T120-E140 VanDerWaalsContact CG2-OE1 3.25Å; T120-E140 WeakPolarHBondContact CG2-OE1 3.5Å; T120-E140 VanDerWaalsContact CG2-OE2 3.28Å; T120-E140 WeakPolarHBondContact CG2-OE2 3.49Å
121	A	58.5	Low	68.6	Low	106 Å²	106	72 Å²	72	88%	0.876	40%	0.397	S	S	*	.	S	Bend	trans	-77.1	23.1	-176.9	0	0	0	0	0	114
122	I	65.3	Low	68.6	Low	36 Å²	36	73.7 Å²	73.7	19%	0.185	40%	0.401	C	S	.	.	S	Bend	trans	-94.5	140	-179.2	-53.4	172.5	0	0	0	109.5	L117 T120 I124 L127 W137	L117-I122 HydrophobicContact CD2-CD1 4.13Å; T120-I122 PolarHBondContact O-N 2.79Å; I122-I124 PolarHBondContact O-N 3.34Å; I122-L127 HydrophobicContact CG2-CD1 3.7Å; I122-L127 HydrophobicContact CG2-CG 4.31Å; I122-W137 HydrophobicContact CD1-CB 4.44Å; I122-W137 HydrophobicContact CD1-CD2 3.33Å; I122-W137 HydrophobicContact CD1-CE3 3.81Å; I122-W137 HydrophobicContact CD1-CG 3.61Å; I122-W137 HydrophobicContact CD1-CH2 4.21Å; I122-W137 HydrophobicContact CD1-CZ2 3.78Å; I122-W137 HydrophobicContact CD1-CZ3 4.24Å; I122-W137 HydrophobicContact CG1-CD2 4.04Å; I122-W137 HydrophobicContact CG1-CE3 4.35Å; I122-W137 HydrophobicContact CG1-CH2 3.85Å; I122-W137 HydrophobicContact CG1-CZ2 3.48Å; I122-W137 VanDerWaalsContact CG1-CZ2 3.48Å; I122-W137 HydrophobicContact CG1-CZ3 4.29Å
123	D	63.3	Low	68.4	Low	111 Å²	111	70.7 Å²	70.7	59%	0.594	39%	0.389	S	S	*	.			trans	-78	96.3	170.9	-160.8	1.4	0	0	0	110	D125 S126	D123-D125 PolarHBondContact O-N 3.19Å; D123-S126 PolarHBondContact O-N 2.83Å; D123-S126 PolarHBondContact O-OG 3.41Å
124	I	60.7	Low	68.3	Low	38 Å²	38	76 Å²	76	20%	0.195	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-66.9	-25	-170.4	-68.1	161.4	0	0	0	111.9	Y114 L118 I122 S126 L127	Y114-I124 HydrophobicContact CD1-CG2 4.4Å; L118-I124 VanDerWaalsContact CA-CD1 3.41Å; L118-I124 HydrophobicContact CB-CD1 4.31Å; L118-I124 HydrophobicContact CD2-CD1 3.63Å; L118-I124 HydrophobicContact CG-CD1 4.11Å; I122-I124 PolarHBondContact O-N 3.34Å; I124-S126 PolarHBondContact O-N 2.89Å; I124-S126 VanDerWaalsContact O-N 3.11Å; I124-L127 PolarHBondContact O-N 2.88Å
125	D	57.1	Low	68.1	Low	161 Å²	161	77.2 Å²	77.2	86%	0.861	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-68.9	-7.4	178.8	-67.8	-19.9	0	0	0	112.8	D123	D123-D125 PolarHBondContact O-N 3.19Å
126	S	60	Low	68.1	Low	85 Å²	85	75.9 Å²	75.9	59%	0.594	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-105.5	-5.4	177.5	70.3	0	0	0	0	115.3	D123 I124	D123-S126 PolarHBondContact O-N 2.83Å; D123-S126 PolarHBondContact O-OG 3.41Å; I124-S126 PolarHBondContact O-N 2.89Å; I124-S126 VanDerWaalsContact O-N 3.11Å
127	L	62	Low	68.3	Low	32 Å²	32	78.3 Å²	78.3	17%	0.168	43%	0.433	C	S	.	.			trans	-94.4	104.8	-177.6	-74.5	169.3	0	0	0	111.2	Y114 I122 I124 S131	Y114-L127 HydrophobicContact CE1-CB 4.26Å; Y114-L127 PolarHBondContact OH-O 3.21Å; I122-L127 HydrophobicContact CG2-CD1 3.7Å; I122-L127 HydrophobicContact CG2-CG 4.31Å; I124-L127 PolarHBondContact O-N 2.88Å; L127-S131 VanDerWaalsContact CD2-OG 3.24Å; L127-S131 WeakPolarHBondContact CD2-OG 3.28Å
128	E	65.8	Low	68.5	Low	152 Å²	152	78.3 Å²	78.3	71%	0.71	43%	0.433	S	S	*	.			trans	-80.3	161.7	166.8	-64.4	-176.9	172.6	0	0	111.1	D130 S131	E128-D130 PolarHBondContact O-N 3.39Å; E128-D130 VanDerWaalsContact O-N 3.09Å; E128-S131 VanDerWaalsContact O-CB 3.3Å; E128-S131 WeakPolarHBondContact O-CB 3.39Å; E128-S131 PolarHBondContact O-N 2.83Å; E128-S131 PolarHBondContact O-OG 3.33Å
129	A	62.2	Low	69	Low	30 Å²	30	77.6 Å²	77.6	25%	0.248	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.2	-175.1	0	0	0	0	0	113.9	V99 E100 Y114	V99-A129 WeakPolarHBondContact CB-O 3.25Å; V99-A129 PolarHBondContact N-O 2.93Å; E100-A129 HydrophobicContact CG-CB 3.71Å; E100-A129 PolarHBondContact N-O 3.44Å; Y114-A129 PolarHBondContact OH-N 3.4Å
130	D	69.1	Low	69.7	Low	111 Å²	111	73.1 Å²	73.1	59%	0.594	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-0.6	179.3	-64.8	-27.2	0	0	0	113.6	T98 E128	T98-D130 WeakPolarHBondContact CG2-O 3.45Å; E128-D130 PolarHBondContact O-N 3.39Å; E128-D130 VanDerWaalsContact O-N 3.09Å
131	S	75.5	Confident	70.6	Confident	29 Å²	29	72.1 Å²	72.1	20%	0.203	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-67.9	137.1	178.1	63.1	0	0	0	0	111.5	T98 V99 L127 E128	T98-S131 WeakPolarHBondContact CA-O 3.35Å; V99-S131 PolarHBondContact N-O 3.1Å; L127-S131 VanDerWaalsContact CD2-OG 3.24Å; L127-S131 WeakPolarHBondContact CD2-OG 3.28Å; E128-S131 VanDerWaalsContact O-CB 3.3Å; E128-S131 WeakPolarHBondContact O-CB 3.39Å; E128-S131 PolarHBondContact O-N 2.83Å; E128-S131 PolarHBondContact O-OG 3.33Å
132	H	78.6	Confident	71.6	Confident	134 Å²	134	67.2 Å²	67.2	62%	0.62	35%	0.352	S	S	*	.	B	Isolated β-bridge	trans	-76.8	128.3	178.3	-66.7	-68.7	0	0	0	110.5	G96	G96-H132 PolarHBondContact O-ND1 2.9Å
133	L	74.9	Confident	72.3	Confident	4 Å²	4	72.3 Å²	72.3	2%	0.021	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-89.2	134.7	176.1	-70.1	170.5	0	0	0	111.1	M97 V99 L102 I113 L117 W137 I138	M97-L133 PolarHBondContact O-N 2.87Å; V99-L133 HydrophobicContact CG2-CD1 3.94Å; V99-L133 HydrophobicContact CG2-CD2 4.22Å; V99-L133 HydrophobicContact CG2-CG 3.94Å; L102-L133 HydrophobicContact CD2-CD1 3.72Å; I113-L133 HydrophobicContact CG2-CD1 4.4Å; L117-L133 HydrophobicContact CD1-CD2 4.12Å; L133-W137 HydrophobicContact CD2-CB 4.45Å; L133-I138 HydrophobicContact CB-CD1 4.15Å; L133-I138 HydrophobicContact CB-CG1 3.75Å; L133-I138 WeakPolarHBondContact O-CD1 3.47Å
134	D	75.9	Confident	73.1	Confident	112 Å²	112	71.1 Å²	71.1	60%	0.599	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-65.9	155.3	170.8	-70.3	-38.3	0	0	0	112.1	V136 W137 I138	D134-V136 PolarHBondContact O-N 2.96Å; D134-V136 VanDerWaalsContact O-N 3.1Å; D134-W137 PolarHBondContact O-N 3.49Å; D134-I138 PolarHBondContact O-N 3.14Å
135	E	76.3	Confident	74	Confident	74 Å²	74	70.3 Å²	70.3	35%	0.346	37%	0.366	S	S	.	.	H	α-helix	trans	-54.1	-34.1	-178.4	170.2	169.7	-172.4	0	0	113.5	K139 W151	E135-K139 HydrophobicContact CG-CD 4.33Å; E135-K139 WeakPolarHBondContact O-CG 3.36Å; E135-K139 PolarHBondContact O-N 2.96Å; E135-K139 WeakPolarHBondContact OE1-CE 3.44Å; E135-K139 IonicContact OE1-NZ 3.77Å; E135-K139 PolarHBondContact OE1-NZ 3.37Å; E135-W151 HydrophobicContact CB-CH2 4.16Å; E135-W151 HydrophobicContact CG-CH2 3.61Å; E135-W151 HydrophobicContact CG-CZ2 3.6Å; E135-W151 VanDerWaalsContact OE1-CZ2 3.29Å; E135-W151 WeakPolarHBondContact OE1-CZ2 3.43Å
136	V	78.8	Confident	74.9	Confident	95 Å²	95	64.3 Å²	64.3	58%	0.576	34%	0.342	S	S	*	.	H	α-helix	trans	-64.2	-44.1	-179.4	-177.5	0	0	0	0	110.5	D134 K139 E140	D134-V136 PolarHBondContact O-N 2.96Å; D134-V136 VanDerWaalsContact O-N 3.1Å; V136-K139 PolarHBondContact O-N 2.74Å; V136-E140 PolarHBondContact O-N 3.18Å
137	W	78.1	Confident	75.9	Confident	59 Å²	59	61.7 Å²	61.7	22%	0.223	32%	0.321	C	S	.	.	H	α-helix	trans	-74.6	-40.6	-175.6	-52.9	128.4	0	0	0	112.3	L117 T120 I122 L133 D134 K139 E140 V141	L117-W137 HydrophobicContact CD2-CB 4.11Å; T120-W137 HydrophobicContact CG2-CE3 4.1Å; T120-W137 HydrophobicContact CG2-CZ3 3.75Å; I122-W137 HydrophobicContact CD1-CB 4.44Å; I122-W137 HydrophobicContact CD1-CD2 3.33Å; I122-W137 HydrophobicContact CD1-CE3 3.81Å; I122-W137 HydrophobicContact CD1-CG 3.61Å; I122-W137 HydrophobicContact CD1-CH2 4.21Å; I122-W137 HydrophobicContact CD1-CZ2 3.78Å; I122-W137 HydrophobicContact CD1-CZ3 4.24Å; I122-W137 HydrophobicContact CG1-CD2 4.04Å; I122-W137 HydrophobicContact CG1-CE3 4.35Å; I122-W137 HydrophobicContact CG1-CH2 3.85Å; I122-W137 HydrophobicContact CG1-CZ2 3.48Å; I122-W137 VanDerWaalsContact CG1-CZ2 3.48Å; I122-W137 HydrophobicContact CG1-CZ3 4.29Å; L133-W137 HydrophobicContact CD2-CB 4.45Å; D134-W137 PolarHBondContact O-N 3.49Å; W137-K139 VanDerWaalsContact C-N 3.3Å; W137-K139 PolarHBondContact O-N 3.42Å; W137-E140 PolarHBondContact O-N 3.25Å; W137-E140 VanDerWaalsContact O-N 3.13Å; W137-V141 WeakPolarHBondContact O-CG2 3.2Å; W137-V141 PolarHBondContact O-N 3.18Å
138	I	78.7	Confident	76.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-56.4	-46.1	173.8	-68.9	175.7	0	0	0	110.8	V93 M97 L102 L133 D134 E140 I142 L149	V93-I138 HydrophobicContact CB-CG2 4.23Å; V93-I138 HydrophobicContact CG1-CD1 4.18Å; V93-I138 HydrophobicContact CG1-CG2 3.36Å; V93-I138 HydrophobicContact CG2-CG2 4.24Å; M97-I138 HydrophobicContact CB-CD1 3.92Å; L102-I138 HydrophobicContact CD1-CG2 4.32Å; L102-I138 HydrophobicContact CD2-CG1 4.33Å; L133-I138 HydrophobicContact CB-CD1 4.15Å; L133-I138 HydrophobicContact CB-CG1 3.75Å; L133-I138 WeakPolarHBondContact O-CD1 3.47Å; D134-I138 PolarHBondContact O-N 3.14Å; I138-E140 VanDerWaalsContact C-N 3.33Å; I138-E140 PolarHBondContact O-N 2.94Å; I138-I142 HydrophobicContact CG2-CD1 3.94Å; I138-I142 WeakPolarHBondContact O-CB 3.2Å; I138-I142 WeakPolarHBondContact O-CG1 3.4Å; I138-I142 PolarHBondContact O-N 3.4Å; I138-I142 VanDerWaalsContact O-N 3.17Å; I138-L149 HydrophobicContact CG2-CD1 4.26Å
139	K	80.1	Confident	77.3	Confident	93 Å²	93	61.5 Å²	61.5	40%	0.404	32%	0.318	S	S	.	.	H	α-helix	trans	-61	-43.2	176.9	-77.8	175.8	-171.3	171.6	0	111.5	E135 V136 W137 M143 L149	E135-K139 HydrophobicContact CG-CD 4.33Å; E135-K139 WeakPolarHBondContact O-CG 3.36Å; E135-K139 PolarHBondContact O-N 2.96Å; E135-K139 WeakPolarHBondContact OE1-CE 3.44Å; E135-K139 IonicContact OE1-NZ 3.77Å; E135-K139 PolarHBondContact OE1-NZ 3.37Å; V136-K139 PolarHBondContact O-N 2.74Å; W137-K139 VanDerWaalsContact C-N 3.3Å; W137-K139 PolarHBondContact O-N 3.42Å; K139-M143 VanDerWaalsContact O-CB 3.28Å; K139-M143 WeakPolarHBondContact O-CB 3.31Å; K139-M143 PolarHBondContact O-N 2.96Å; K139-L149 HydrophobicContact CG-CD1 3.91Å
140	E	79.2	Confident	78.1	Confident	51 Å²	51	65.4 Å²	65.4	24%	0.238	33%	0.33	C	S	.	.	H	α-helix	trans	-67.4	-45.2	-176.8	-162.9	-179.2	156.4	0	0	112.3	T120 V136 W137 I138 I142 M143 K144	T120-E140 VanDerWaalsContact CG2-CD 3.49Å; T120-E140 VanDerWaalsContact CG2-OE1 3.25Å; T120-E140 WeakPolarHBondContact CG2-OE1 3.5Å; T120-E140 VanDerWaalsContact CG2-OE2 3.28Å; T120-E140 WeakPolarHBondContact CG2-OE2 3.49Å; V136-E140 PolarHBondContact O-N 3.18Å; W137-E140 PolarHBondContact O-N 3.25Å; W137-E140 VanDerWaalsContact O-N 3.13Å; I138-E140 VanDerWaalsContact C-N 3.33Å; I138-E140 PolarHBondContact O-N 2.94Å; E140-I142 VanDerWaalsContact C-N 3.33Å; E140-I142 PolarHBondContact O-N 2.98Å; E140-M143 PolarHBondContact O-N 3.05Å; E140-K144 PolarHBondContact O-N 3.25Å; E140-K144 VanDerWaalsContact OE1-CE 3.25Å; E140-K144 WeakPolarHBondContact OE1-CE 3.31Å; E140-K144 IonicContact OE1-NZ 3.3Å; E140-K144 PolarHBondContact OE1-NZ 3.45Å
141	V	81.7	Confident	78.5	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.006	32%	0.32	C	S	.	.	H	α-helix	trans	-59.9	-44	177.2	173.1	0	0	0	0	110.9	L102 M106 I113 A116 L117 W137 K144 A145	L102-V141 HydrophobicContact CD2-CB 4.45Å; L102-V141 HydrophobicContact CD2-CG1 4.26Å; M106-V141 HydrophobicContact CE-CG1 4.06Å; M106-V141 HydrophobicContact SD-CG1 3.9Å; I113-V141 HydrophobicContact CG1-CG1 4.21Å; I113-V141 HydrophobicContact CG2-CG1 4.25Å; I113-V141 HydrophobicContact CG2-CG2 4.25Å; A116-V141 HydrophobicContact CB-CB 4.42Å; A116-V141 HydrophobicContact CB-CG1 4.12Å; A116-V141 HydrophobicContact CB-CG2 4.08Å; L117-V141 HydrophobicContact CD1-CG2 4.46Å; L117-V141 HydrophobicContact CD2-CG2 3.64Å; L117-V141 HydrophobicContact CG-CG2 3.84Å; W137-V141 WeakPolarHBondContact O-CG2 3.2Å; W137-V141 PolarHBondContact O-N 3.18Å; V141-K144 PolarHBondContact O-N 3.02Å; V141-A145 WeakPolarHBondContact O-CB 3.25Å; V141-A145 PolarHBondContact O-N 2.95Å
142	I	81.1	Confident	78.3	Confident	3 Å²	3	65.2 Å²	65.2	2%	0.015	32%	0.322	C	S	.	.	H	α-helix	trans	-68.5	-37.5	178.9	-71.3	170.6	0	0	0	111.6	V91 V93 L102 M106 I138 E140 A145 G146 M147 L149	V91-I142 HydrophobicContact CG1-CD1 4.4Å; V93-I142 HydrophobicContact CG2-CD1 3.34Å; L102-I142 HydrophobicContact CD1-CD1 4Å; L102-I142 HydrophobicContact CD1-CG1 4.35Å; M106-I142 HydrophobicContact SD-CG1 4.07Å; I138-I142 HydrophobicContact CG2-CD1 3.94Å; I138-I142 WeakPolarHBondContact O-CB 3.2Å; I138-I142 WeakPolarHBondContact O-CG1 3.4Å; I138-I142 PolarHBondContact O-N 3.4Å; I138-I142 VanDerWaalsContact O-N 3.17Å; E140-I142 VanDerWaalsContact C-N 3.33Å; E140-I142 PolarHBondContact O-N 2.98Å; I142-A145 PolarHBondContact O-N 3.1Å; I142-G146 PolarHBondContact O-N 3.33Å; I142-M147 HydrophobicContact CG2-CB 4Å; I142-M147 PolarHBondContact O-N 2.95Å; I142-M147 VanDerWaalsContact O-N 3.09Å; I142-L149 HydrophobicContact CD1-CD1 3.76Å; I142-L149 HydrophobicContact CD1-CG 4.29Å; I142-L149 HydrophobicContact CG2-CB 4.14Å
143	M	79.9	Confident	77.6	Confident	144 Å²	144	68.4 Å²	68.4	71%	0.709	33%	0.334	S	S	*	.	H	α-helix	trans	-66.7	-44.7	176.2	-169	175.1	70.4	0	0	111.5	K139 E140 A145 G146	K139-M143 VanDerWaalsContact O-CB 3.28Å; K139-M143 WeakPolarHBondContact O-CB 3.31Å; K139-M143 PolarHBondContact O-N 2.96Å; E140-M143 PolarHBondContact O-N 3.05Å; M143-A145 VanDerWaalsContact C-N 3.28Å; M143-A145 PolarHBondContact O-N 3.2Å; M143-G146 PolarHBondContact O-N 3.32Å
144	K	80.3	Confident	76.6	Confident	86 Å²	86	73.2 Å²	73.2	37%	0.374	36%	0.359	S	S	.	.	H	α-helix	trans	-61.5	-36.4	173.7	-77.6	-177	-175.3	160.4	0	112	A116 E140 V141 G146	A116-K144 HydrophobicContact CB-CD 4.38Å; A116-K144 WeakPolarHBondContact O-CD 3.39Å; A116-K144 PolarHBondContact O-NZ 3.31Å; E140-K144 PolarHBondContact O-N 3.25Å; E140-K144 VanDerWaalsContact OE1-CE 3.25Å; E140-K144 WeakPolarHBondContact OE1-CE 3.31Å; E140-K144 IonicContact OE1-NZ 3.3Å; E140-K144 PolarHBondContact OE1-NZ 3.45Å; V141-K144 PolarHBondContact O-N 3.02Å; K144-G146 PolarHBondContact O-N 3.27Å
145	A	77.9	Confident	75.5	Confident	21 Å²	21	77.2 Å²	77.2	17%	0.174	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-6.4	174.7	0	0	0	0	0	114.2	M106 Y112 V141 I142 M143 M147	M106-A145 HydrophobicContact CE-CB 3.26Å; Y112-A145 HydrophobicContact CE1-CB 4.05Å; V141-A145 WeakPolarHBondContact O-CB 3.25Å; V141-A145 PolarHBondContact O-N 2.95Å; I142-A145 PolarHBondContact O-N 3.1Å; M143-A145 VanDerWaalsContact C-N 3.28Å; M143-A145 PolarHBondContact O-N 3.2Å; A145-M147 VanDerWaalsContact C-N 3.28Å; A145-M147 HydrophobicContact CB-CE 4.35Å; A145-M147 HydrophobicContact CB-CG 4.25Å; A145-M147 PolarHBondContact O-N 3.06Å
146	G	76.3	Confident	74.3	Confident	35 Å²	35	81.4 Å²	81.4	36%	0.361	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	19.2	179.2	0	0	0	0	0	114.3	K88 I142 M143 K144	K88-G146 WeakPolarHBondContact CD-O 3.48Å; K88-G146 WeakPolarHBondContact CG-O 3.48Å; I142-G146 PolarHBondContact O-N 3.33Å; M143-G146 PolarHBondContact O-N 3.32Å; K144-G146 PolarHBondContact O-N 3.27Å
147	M	82.5	Confident	73.3	Confident	29 Å²	29	84.2 Å²	84.2	14%	0.143	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-96.3	159.9	-178.3	-62.4	-174.5	-166.5	0	0	111.2	K89 V91 M106 I142 A145	K89-M147 HydrophobicContact CB-CG 4.31Å; K89-M147 CarbonylContact O-C 3.41Å; K89-M147 WeakPolarHBondContact O-CA 3.49Å; K89-M147 WeakPolarHBondContact O-CB 3.31Å; V91-M147 HydrophobicContact CG2-CB 4.03Å; V91-M147 HydrophobicContact CG2-CG 4.32Å; V91-M147 HydrophobicContact CG2-SD 3.38Å; V91-M147 WeakPolarHBondContact CG2-SD 3.42Å; M106-M147 HydrophobicContact CB-SD 4.46Å; M106-M147 HydrophobicContact CE-CE 4.44Å; M106-M147 HydrophobicContact CE-SD 4.3Å; M106-M147 HydrophobicContact CG-SD 4.38Å; I142-M147 HydrophobicContact CG2-CB 4Å; I142-M147 PolarHBondContact O-N 2.95Å; I142-M147 VanDerWaalsContact O-N 3.09Å; A145-M147 VanDerWaalsContact C-N 3.28Å; A145-M147 HydrophobicContact CB-CE 4.35Å; A145-M147 HydrophobicContact CB-CG 4.25Å; A145-M147 PolarHBondContact O-N 3.06Å
148	K	76.6	Confident	72.6	Confident	128 Å²	128	90.9 Å²	90.9	56%	0.557	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	131.7	175.7	-80.5	-174.8	176.9	-175	0	109.9	K88 K89 V90 V91	K88-K148 HydrophobicContact CB-CD 4.45Å; K88-K148 HydrophobicContact CB-CG 4.07Å; K88-K148 HydrophobicContact CD-CG 4.41Å; K89-K148 PolarHBondContact O-N 3Å; V90-K148 CarbonylContact C-O 3.55Å; V90-K148 VanDerWaalsContact CA-O 3.28Å; V90-K148 WeakPolarHBondContact CA-O 3.44Å; V90-K148 HydrophobicContact CG2-CB 4.07Å; V91-K148 PolarHBondContact N-O 3.24Å
149	L	79.3	Confident	72.4	Confident	53 Å²	53	97.1 Å²	97.1	28%	0.277	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	135.6	179.5	-168.6	148	0	0	0	111.3	V93 I138 K139 I142 W151	V93-L149 HydrophobicContact CG2-CD1 4.26Å; V93-L149 HydrophobicContact CG2-CG 4.15Å; I138-L149 HydrophobicContact CG2-CD1 4.26Å; K139-L149 HydrophobicContact CG-CD1 3.91Å; I142-L149 HydrophobicContact CD1-CD1 3.76Å; I142-L149 HydrophobicContact CD1-CG 4.29Å; I142-L149 HydrophobicContact CG2-CB 4.14Å; L149-W151 VanDerWaalsContact CD2-CD1 3.49Å; L149-W151 HydrophobicContact CD2-CD2 3.94Å; L149-W151 HydrophobicContact CD2-CG 3.9Å; L149-W151 HydrophobicContact CD2-CZ2 4.1Å; L149-W151 VanDerWaalsContact CD2-NE1 3.25Å
150	K	80.1	Confident	72.2	Confident	111 Å²	111	98.2 Å²	98.2	48%	0.483	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	119.6	169.3	-177.4	-176.3	169.6	-153.3	0	109.5	V90 V91 E92 V93 S152	V90-K150 HydrophobicContact CG1-CB 3.88Å; V91-K150 PolarHBondContact O-N 3.35Å; E92-K150 VanDerWaalsContact CA-O 3.31Å; E92-K150 WeakPolarHBondContact CA-O 3.46Å; E92-K150 HydrophobicContact CG-CD 4.35Å; E92-K150 IonicContact OE1-NZ 2.64Å; E92-K150 PolarHBondContact OE1-NZ 3.46Å; V93-K150 PolarHBondContact N-O 3.13Å; K150-S152 PolarHBondContact O-N 3.18Å
151	W	76.8	Confident	72.3	Confident	101 Å²	101	104 Å²	104	38%	0.383	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	125	176.9	-70.5	102.9	0	0	0	111.2	V93 I95 E135 L149	V93-W151 CarbonylContact O-C 3.55Å; V93-W151 VanDerWaalsContact O-CA 3.3Å; V93-W151 WeakPolarHBondContact O-CA 3.22Å; I95-W151 HydrophobicContact CG1-CE3 4.2Å; I95-W151 HydrophobicContact CG1-CH2 4.35Å; I95-W151 HydrophobicContact CG1-CZ3 3.67Å; E135-W151 HydrophobicContact CB-CH2 4.16Å; E135-W151 HydrophobicContact CG-CH2 3.61Å; E135-W151 HydrophobicContact CG-CZ2 3.6Å; E135-W151 VanDerWaalsContact OE1-CZ2 3.29Å; E135-W151 WeakPolarHBondContact OE1-CZ2 3.43Å; L149-W151 VanDerWaalsContact CD2-CD1 3.49Å; L149-W151 HydrophobicContact CD2-CD2 3.94Å; L149-W151 HydrophobicContact CD2-CG 3.9Å; L149-W151 HydrophobicContact CD2-CZ2 4.1Å; L149-W151 VanDerWaalsContact CD2-NE1 3.25Å
152	S	71.9	Confident	72.7	Confident	35 Å²	35	109.1 Å²	109.1	25%	0.245	53%	0.527	C	S	.	.			trans	-109.3	137.8	169.1	60.3	0	0	0	0	109.6	V93 W94 K150	V93-S152 PolarHBondContact O-N 2.77Å; W94-S152 WeakPolarHBondContact CB-O 3.38Å; K150-S152 PolarHBondContact O-N 3.18Å
153	K	62.5	Low	73	Confident	201 Å²	201	113 Å²	113	87%	0.874	54%	0.544	S	S	*	.			trans	-72.7	130.4	166.3	-69.5	-174.6	178.5	-176.4	0	106.9	K155	K153-K155 PolarHBondContact O-N 3.48Å; K153-K155 VanDerWaalsContact O-N 3.08Å
154	L	54	Low	73.5	Confident	106 Å²	106	108.1 Å²	108.1	56%	0.555	52%	0.521	S	S	*	.			trans	-45.9	120.6	173.8	-148.1	88.3	0	0	0	107.8	W94 Q156	W94-L154 HydrophobicContact CB-CD1 4.19Å; W94-L154 HydrophobicContact CD2-CD1 3.92Å; W94-L154 HydrophobicContact CG-CD1 3.53Å; L154-Q156 PolarHBondContact O-N 3.38Å
155	K	53.6	Low	73.9	Confident	196 Å²	196	104.6 Å²	104.6	85%	0.852	51%	0.508	S	S	*	.			trans	-66.6	90.4	164.1	-79.9	-178.4	179.9	175.8	0	104.7	K153 D157	K153-K155 PolarHBondContact O-N 3.48Å; K153-K155 VanDerWaalsContact O-N 3.08Å; K155-D157 PolarHBondContact O-N 3.22Å; K155-D157 VanDerWaalsContact O-N 3.16Å
156	Q	51.5	Low	74.6	Confident	161 Å²	161	109 Å²	109	75%	0.752	53%	0.533	S	S	*	.			trans	-52.3	125.6	161.7	-72.2	178	-17.2	0	0	105.7	L154 K158	L154-Q156 PolarHBondContact O-N 3.38Å; Q156-K158 VanDerWaalsContact C-N 3.34Å; Q156-K158 PolarHBondContact O-N 2.95Å
157	D	56.7	Low	75.3	Confident	154 Å²	154	114 Å²	114	82%	0.824	54%	0.541	S	S	*	.			trans	-53.8	106.7	170.8	-77.6	-36.8	0	0	0	106.5	K155 V159	K155-D157 PolarHBondContact O-N 3.22Å; K155-D157 VanDerWaalsContact O-N 3.16Å; D157-V159 VanDerWaalsContact C-N 3.25Å; D157-V159 PolarHBondContact O-N 2.94Å
158	K	63.6	Low	75.6	Confident	199 Å²	199	119.5 Å²	119.5	87%	0.865	56%	0.56	S	S	*	*			trans	-68.1	95	179	-82.9	-176.1	177.2	179.8	0	105.9	Q156 K160	Q156-K158 VanDerWaalsContact C-N 3.34Å; Q156-K158 PolarHBondContact O-N 2.95Å; K158-K160 PolarHBondContact O-N 3.23Å
159	V	74.3	Confident	76.3	Confident	131 Å²	131	118.9 Å²	118.9	79%	0.794	57%	0.568	S	S	*	*			trans	-54.5	112.6	164.7	-177.9	0	0	0	0	105.8	D157 K161	D157-V159 VanDerWaalsContact C-N 3.25Å; D157-V159 PolarHBondContact O-N 2.94Å; V159-K161 PolarHBondContact O-N 3.42Å
160	K	76.4	Confident	76.6	Confident	116 Å²	116	124.8 Å²	124.8	50%	0.504	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-60.8	126.6	176.5	-71.8	-176.6	179	177.3	0	106.9	K158 W446 Y449	K158-K160 PolarHBondContact O-N 3.23Å; K160-W446 HydrophobicContact CB-CZ3 3.66Å; K160-W446 HydrophobicContact CD-CZ3 4.46Å; K160-Y449 HydrophobicContact CD-CD1 4.05Å; K160-Y449 HydrophobicContact CD-CE1 3.79Å; K160-Y449 HydrophobicContact CD-CE2 4.44Å; K160-Y449 HydrophobicContact CD-CG 4.48Å; K160-Y449 VanDerWaalsContact NZ-CE2 3.32Å
161	K	82.4	Confident	76.9	Confident	173 Å²	173	120.6 Å²	120.6	75%	0.752	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-67.9	137.2	177.3	-64.4	-175.7	177.9	-173.8	0	108.9	V159 K163	V159-K161 PolarHBondContact O-N 3.42Å; K161-K163 PolarHBondContact O-N 3.46Å
162	N	89	Confident	77.5	Confident	109 Å²	109	121.5 Å²	121.5	58%	0.583	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-62.7	122.8	170.3	-172.5	-20.7	0	0	0	108.5	D164 W446	N162-D164 WeakPolarHBondContact OD1-CB 3.32Å; N162-D164 PolarHBondContact OD1-N 3.17Å; N162-W446 HydrophobicContact CB-CH2 4.36Å; N162-W446 HydrophobicContact CB-CZ2 3.86Å; N162-W446 PolarHBondContact OD1-NE1 2.93Å
163	K	87.4	Confident	78.2	Confident	85 Å²	85	125.2 Å²	125.2	37%	0.37	62%	0.616	S	S	.	*			trans	-122.4	14.6	-174.7	-80.7	-177.5	169	-152.6	0	111.5	K161 R439 E442 V443	K161-K163 PolarHBondContact O-N 3.46Å; K163-R439 PolarHBondContact O-NH1 2.95Å; K163-R439 PolarHBondContact O-NH2 2.78Å; K163-E442 HydrophobicContact CD-CB 4.46Å; K163-E442 WeakPolarHBondContact CD-OE2 3.49Å; K163-E442 IonicContact NZ-OE1 2.72Å; K163-E442 PolarHBondContact NZ-OE1 3.35Å; K163-E442 IonicContact NZ-OE2 3Å; K163-E442 PolarHBondContact NZ-OE2 3.34Å; K163-V443 WeakPolarHBondContact O-CG2 3.44Å
164	D	91.1	Very high	79.5	Confident	40 Å²	40	120.5 Å²	120.5	21%	0.214	62%	0.615	C	S	.	*			trans	-64.1	157.8	-176.7	-160	5.8	0	0	0	112.7	N162 R439 V443 R447	N162-D164 WeakPolarHBondContact OD1-CB 3.32Å; N162-D164 PolarHBondContact OD1-N 3.17Å; D164-R439 PolarHBondContact O-NH2 2.96Å; D164-V443 VanDerWaalsContact OD1-CG1 3.27Å; D164-V443 WeakPolarHBondContact OD1-CG1 3.47Å; D164-R447 IonicContact OD1-CZ 2.77Å; D164-R447 VanDerWaalsContact OD1-CZ 3.3Å; D164-R447 IonicContact OD1-NE 3.03Å; D164-R447 PolarHBondContact OD1-NE 3.32Å; D164-R447 IonicContact OD1-NH2 3.27Å; D164-R447 PolarHBondContact OD1-NH2 3.48Å; D164-R447 IonicContact OD2-NE 2.87Å; D164-R447 IonicContact OD2-NH2 3.44Å
165	A	89	Confident	81.2	Confident	13 Å²	13	119 Å²	119	11%	0.107	61%	0.607	C	S	.	*			trans	-83.9	122	164.9	0	0	0	0	0	108.1	L432 V434 V443 R447	A165-L432 HydrophobicContact CB-CB 4.31Å; A165-L432 HydrophobicContact CB-CD1 3.87Å; A165-L432 VanDerWaalsContact O-CD1 3.27Å; A165-L432 WeakPolarHBondContact O-CD1 3.38Å; A165-V434 HydrophobicContact CB-CG1 4.16Å; A165-V443 HydrophobicContact CB-CG1 4.12Å; A165-V443 HydrophobicContact CB-CG2 4.15Å; A165-R447 PolarHBondContact O-NH2 2.83Å
166	V	92.1	Very high	83	Confident	114 Å²	114	112.1 Å²	112.1	69%	0.691	58%	0.58	S	S	*	*			trans	-111.4	143.8	-178.2	-175.9	0	0	0	0	109.3	R168	V166-R168 PolarHBondContact O-N 2.86Å
167	R	90.6	Very high	84.9	Confident	140 Å²	140	107.1 Å²	107.1	53%	0.528	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-50.6	132.5	171.5	-164.6	180	-171.9	-166.9	-2.1	110.4	E356	R167-E356 VanDerWaalsContact CG-OE2 3.31Å; R167-E356 WeakPolarHBondContact CG-OE2 3.4Å; R167-E356 IonicContact CZ-OE1 3.78Å; R167-E356 VanDerWaalsContact CZ-OE1 3.28Å; R167-E356 IonicContact NE-OE1 3.46Å; R167-E356 PolarHBondContact NE-OE1 3.32Å; R167-E356 IonicContact NE-OE2 2.9Å; R167-E356 IonicContact NH2-OE1 2.71Å; R167-E356 PolarHBondContact NH2-OE1 3.4Å
168	R	89.1	Confident	86.5	Confident	144 Å²	144	105.4 Å²	105.4	54%	0.543	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-68	148.4	177.9	-75.4	-167.4	175.6	-172.1	6.6	110.5	V166 P354 R378	V166-R168 PolarHBondContact O-N 2.86Å; R168-P354 VanDerWaalsContact NE-CG 3.34Å; R168-R378 PolarHBondContact O-NH1 2.7Å
169	P	90	Very high	87.9	Confident	114 Å²	114	98.1 Å²	98.1	74%	0.74	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-56.2	165.5	169.6	27.3	-35.3	0	0	0	110.6	A171 R378	P169-A171 PolarHBondContact O-N 3.42Å; P169-R378 PolarHBondContact O-NH1 3.38Å
170	Q	85.8	Confident	88.7	Confident	177 Å²	177	93.6 Å²	93.6	83%	0.827	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-55	136.4	177.6	-163.5	127.1	13.2	0	0	110.3
171	A	86.4	Confident	89.6	Confident	23 Å²	23	88.4 Å²	88.4	19%	0.19	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-65.8	151.5	179.8	0	0	0	0	0	110.9	P169 L176 D350	P169-A171 PolarHBondContact O-N 3.42Å; A171-L176 HydrophobicContact CB-CD2 4.02Å; A171-D350 HydrophobicContact CB-CB 3.94Å
172	D	89.9	Confident	90.2	Very high	121 Å²	121	80.2 Å²	80.2	65%	0.647	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-60.1	139	175	-66.7	-41.4	0	0	0	110.3	A174 L175	D172-A174 PolarHBondContact O-N 3.21Å; D172-L175 PolarHBondContact O-N 3.09Å
173	P	87.6	Confident	90.6	Very high	112 Å²	112	75 Å²	75	73%	0.727	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-20.5	-175.1	23.2	-33.7	0	0	0	113.6
174	A	89.2	Confident	91	Very high	103 Å²	103	71 Å²	71	85%	0.851	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-23.6	177.2	0	0	0	0	0	114.1	D172	D172-A174 PolarHBondContact O-N 3.21Å
175	L	89.6	Confident	91.2	Very high	74 Å²	74	69 Å²	69	39%	0.387	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-10.4	-178.8	-167.4	64.2	0	0	0	112.4	D172 T177 D350 N352	D172-L175 PolarHBondContact O-N 3.09Å; L175-T177 PolarHBondContact O-N 3.01Å; L175-D350 HydrophobicContact CD2-CB 4.47Å; L175-D350 VanDerWaalsContact CD2-CG 3.45Å; L175-D350 VanDerWaalsContact CD2-OD1 3.25Å; L175-D350 WeakPolarHBondContact CD2-OD1 3.39Å; L175-D350 WeakPolarHBondContact CD2-OD2 3.45Å; L175-D350 WeakPolarHBondContact CG-OD1 3.41Å; L175-N352 HydrophobicContact CD1-CB 4.42Å
176	L	90.6	Very high	91.4	Very high	52 Å²	52	68.4 Å²	68.4	27%	0.272	38%	0.38	S	S	.	.			trans	-70.1	120.2	-178.8	-74.1	-177.5	0	0	0	111.2	A171 K348	A171-L176 HydrophobicContact CB-CD2 4.02Å; L176-K348 HydrophobicContact CB-CB 3.92Å; L176-K348 HydrophobicContact CB-CD 4.05Å; L176-K348 HydrophobicContact CB-CG 4.17Å; L176-K348 HydrophobicContact CD1-CB 4.18Å; L176-K348 HydrophobicContact CD1-CD 4.09Å; L176-K348 HydrophobicContact CD2-CB 4.13Å; L176-K348 HydrophobicContact CG-CB 4.3Å
177	T	91.9	Very high	91.5	Very high	56 Å²	56	63 Å²	63	34%	0.344	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	148.9	174.6	57.6	0	0	0	0	110.7	L175 K348 A349 P351	L175-T177 PolarHBondContact O-N 3.01Å; T177-K348 CarbonylContact O-C 3.58Å; T177-K348 VanDerWaalsContact O-CA 3.22Å; T177-K348 WeakPolarHBondContact O-CA 3.28Å; T177-A349 PolarHBondContact N-O 3.42Å; T177-A349 PolarHBondContact O-N 2.98Å; T177-A349 PolarHBondContact OG1-O 2.94Å; T177-P351 HydrophobicContact CG2-CG 4.03Å; T177-P351 WeakPolarHBondContact OG1-CD 3.41Å
178	P	91.4	Very high	91.5	Very high	118 Å²	118	58.6 Å²	58.6	77%	0.766	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	137.8	175.2	27.1	-34.1	0	0	0	110.1	L347	P178-L347 WeakPolarHBondContact CA-O 3.27Å
179	R	91.7	Very high	91.5	Very high	46 Å²	46	53.4 Å²	53.4	17%	0.174	32%	0.317	C	S	.	.			trans	-122.2	159.4	179.6	75.6	-177.6	177.3	85.5	-10.2	112.1	D253 L347 K348 A349 S413	R179-D253 IonicContact CZ-OD1 2.66Å; R179-D253 IonicContact CZ-OD2 3.48Å; R179-D253 IonicContact NH1-OD1 3.34Å; R179-D253 PolarHBondContact NH1-OD1 2.9Å; R179-D253 IonicContact NH1-OD2 3.86Å; R179-D253 PolarHBondContact NH1-OD2 3.23Å; R179-D253 IonicContact NH2-OD1 3.44Å; R179-D253 PolarHBondContact NH2-OD1 3.46Å; R179-D253 IonicContact NH2-OD2 3.5Å; R179-D253 PolarHBondContact NH2-OD2 3.45Å; R179-L347 HydrophobicContact CG-CB 3.97Å; R179-L347 PolarHBondContact N-O 3.38Å; R179-K348 PolarHBondContact NE-O 2.85Å; R179-A349 HydrophobicContact CB-CB 4.13Å; R179-A349 HydrophobicContact CG-CB 4.38Å; R179-S413 PolarHBondContact NH1-OG 2.89Å
180	S	91.4	Very high	91.4	Very high	35 Å²	35	53.5 Å²	53.5	25%	0.245	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-66.1	142.2	173.2	-76.6	0	0	0	0	111.8	K229 S413	S180-K229 WeakPolarHBondContact CB-O 3.12Å; S180-K229 PolarHBondContact OG-O 2.77Å; S180-S413 WeakPolarHBondContact O-CB 3.37Å; S180-S413 PolarHBondContact O-OG 2.88Å
181	P	95.3	Very high	91.7	Very high	8 Å²	8	45.1 Å²	45.1	5%	0.052	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-71.3	141.9	173.7	28.1	-33.3	0	0	0	111.5	V183 I230 T231 I254 A342 L347	P181-V183 HydrophobicContact CB-CG2 4.23Å; P181-I230 HydrophobicContact CG-CG1 4.1Å; P181-I230 HydrophobicContact CG-CG2 4.35Å; P181-T231 PolarHBondContact O-N 2.98Å; P181-I254 HydrophobicContact CB-CD1 4.43Å; P181-A342 HydrophobicContact CB-CB 3.81Å; P181-A342 HydrophobicContact CG-CB 3.89Å; P181-L347 HydrophobicContact CB-CD1 3.7Å
182	I	95.8	Very high	91.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.1	168.8	-46.5	162.1	0	0	0	107.9	T231 L233 T252 D253 I254 I375	I182-T231 CarbonylContact C-O 3.5Å; I182-T231 WeakPolarHBondContact CA-O 3.34Å; I182-T231 HydrophobicContact CG2-CG2 4.17Å; I182-L233 HydrophobicContact CG2-CD1 4.31Å; I182-L233 HydrophobicContact CG2-CG 4.24Å; I182-T252 HydrophobicContact CB-CG2 4.19Å; I182-T252 HydrophobicContact CG2-CG2 3.59Å; I182-T252 WeakPolarHBondContact O-CB 3.38Å; I182-D253 PolarHBondContact N-OD2 2.81Å; I182-D253 PolarHBondContact O-N 2.84Å; I182-I254 PolarHBondContact O-N 3.2Å; I182-I375 HydrophobicContact CD1-CG2 3.66Å; I182-I375 HydrophobicContact CG1-CG2 4.34Å; I182-I375 HydrophobicContact CG2-CD1 3.74Å
183	V	96.1	Very high	91.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	118.4	-167.5	-176	0	0	0	0	110.4	P181 I230 T231 F232 L233 I254 I256 T338	P181-V183 HydrophobicContact CB-CG2 4.23Å; V183-I230 HydrophobicContact CB-CG2 4.11Å; V183-I230 HydrophobicContact CG2-CG2 3.49Å; V183-I230 VanDerWaalsContact CG2-CG2 3.49Å; V183-T231 PolarHBondContact N-O 3.32Å; V183-F232 HydrophobicContact CB-CD1 3.84Å; V183-F232 HydrophobicContact CB-CE1 3.96Å; V183-F232 HydrophobicContact CG1-CD1 3.95Å; V183-F232 HydrophobicContact CG1-CE1 3.81Å; V183-F232 CarbonylContact O-C 3.55Å; V183-F232 VanDerWaalsContact O-CA 3.24Å; V183-F232 WeakPolarHBondContact O-CA 3.41Å; V183-L233 PolarHBondContact O-N 2.74Å; V183-I254 VanDerWaalsContact CA-O 3.27Å; V183-I254 WeakPolarHBondContact CA-O 3.42Å; V183-I254 HydrophobicContact CG2-CB 4.33Å; V183-I256 HydrophobicContact CG1-CB 4.47Å; V183-I256 HydrophobicContact CG1-CD1 3.57Å; V183-I256 HydrophobicContact CG1-CG1 3.59Å; V183-T338 HydrophobicContact CG1-CG2 4.31Å; V183-T338 HydrophobicContact CG2-CG2 3.69Å
184	T	95.7	Very high	92	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	135.7	173.7	-61.5	0	0	0	0	110.5	M186 L233 T235 G248 T252 I254 V255 I256	T184-M186 HydrophobicContact CG2-CE 3.61Å; T184-M186 HydrophobicContact CG2-CG 3.72Å; T184-L233 HydrophobicContact CG2-CB 4.29Å; T184-T235 HydrophobicContact CG2-CG2 3.45Å; T184-T235 VanDerWaalsContact CG2-CG2 3.45Å; T184-G248 PolarHBondContact OG1-O 2.83Å; T184-G248 VanDerWaalsContact OG1-O 3.11Å; T184-T252 WeakPolarHBondContact OG1-CB 3.25Å; T184-T252 WeakPolarHBondContact OG1-CG2 3.39Å; T184-T252 PolarHBondContact OG1-OG1 2.82Å; T184-T252 VanDerWaalsContact OG1-OG1 3.06Å; T184-I254 PolarHBondContact N-O 3.46Å; T184-V255 CarbonylContact O-C 3.59Å; T184-V255 WeakPolarHBondContact O-CA 3.34Å; T184-I256 PolarHBondContact O-N 2.77Å
185	I	95.2	Very high	92	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	120.1	169.2	-53.5	-152	0	0	0	109.4	K193 L196 L197 F232 L233 T235 I256 V258	I185-K193 HydrophobicContact CG2-CB 3.95Å; I185-K193 HydrophobicContact CG2-CD 4.35Å; I185-K193 HydrophobicContact CG2-CG 3.96Å; I185-L196 HydrophobicContact CD1-CD2 3.76Å; I185-L197 HydrophobicContact CD1-CD1 4.23Å; I185-L197 HydrophobicContact CD1-CD2 3.18Å; I185-L197 HydrophobicContact CD1-CG 3.74Å; I185-L197 HydrophobicContact CG1-CD1 4.48Å; I185-L197 HydrophobicContact CG1-CD2 4.04Å; I185-L197 HydrophobicContact CG1-CG 4.49Å; I185-F232 HydrophobicContact CD1-CD1 4.12Å; I185-F232 HydrophobicContact CD1-CE1 4.38Å; I185-F232 HydrophobicContact CG1-CD1 4.13Å; I185-L233 PolarHBondContact N-O 2.78Å; I185-T235 PolarHBondContact O-OG1 2.74Å; I185-I256 WeakPolarHBondContact CA-O 3.42Å; I185-I256 HydrophobicContact CG1-CB 4.38Å; I185-V258 HydrophobicContact CG2-CG2 3.41Å; I185-V258 VanDerWaalsContact CG2-CG2 3.41Å
186	M	94.7	Very high	92	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	160.9	-179.2	-62.6	-163.6	176.9	0	0	111.7	T184 R245 A249 V255 I256 V258	T184-M186 HydrophobicContact CG2-CE 3.61Å; T184-M186 HydrophobicContact CG2-CG 3.72Å; M186-R245 WeakPolarHBondContact CE-O 3.27Å; M186-A249 HydrophobicContact CE-CB 3.79Å; M186-V255 HydrophobicContact CB-CG1 4.07Å; M186-V255 HydrophobicContact CE-CG2 4.47Å; M186-V255 HydrophobicContact CG-CG1 3.84Å; M186-V255 HydrophobicContact SD-CG1 3.96Å; M186-I256 PolarHBondContact N-O 2.87Å; M186-V258 PolarHBondContact O-N 2.86Å
187	G	92.6	Very high	91.9	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.2	174.4	177.9	0	0	0	0	0	113.1	K193	G187-K193 PolarHBondContact O-NZ 2.89Å
188	H	92.3	Very high	91.7	Very high	46 Å²	46	24.7 Å²	24.7	21%	0.213	14%	0.144	C	C	.	.			trans	-64.5	159.2	-179.3	-170	62.7	0	0	0	113.2	H191 K193 M266 Q268	H188-H191 VanDerWaalsContact CB-CE1 3.42Å; H188-H191 WeakPolarHBondContact CB-CE1 3.28Å; H188-H191 AromaticContact CD2-CD2 3.9Å; H188-H191 AromaticContact CD2-NE2 3.61Å; H188-H191 AromaticContact CG-NE2 3.91Å; H188-H191 WeakPolarHBondContact O-CB 3.34Å; H188-H191 PolarHBondContact O-N 2.96Å; H188-K193 PolarHBondContact O-NZ 3.33Å; H188-M266 HydrophobicContact CB-CB 4.17Å; H188-Q268 HydrophobicContact CB-CB 4.27Å; H188-Q268 PolarHBondContact CE1-OE1 2.95Å; H188-Q268 VanDerWaalsContact ND1-CD 3.27Å; H188-Q268 PolarHBondContact ND1-OE1 2.84Å
189	V	88.9	Confident	91.6	Very high	35 Å²	35	23.4 Å²	23.4	21%	0.212	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	144.4	170.4	177.6	0	0	0	0	109.8	H191 H238	V189-H191 PolarHBondContact O-CD2 2.82Å; V189-H191 PolarHBondContact O-N 3.26Å; V189-H238 HydrophobicContact CG2-CB 4.11Å
190	D	87.6	Confident	91.3	Very high	117 Å²	117	22.9 Å²	22.9	63%	0.626	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	12.4	179.7	-58	-26.4	0	0	0	117.3	G192 K289	D190-G192 PolarHBondContact O-N 3.19Å; D190-K289 WeakPolarHBondContact O-CE 3.4Å; D190-K289 PolarHBondContact O-NZ 3.1Å; D190-K289 VanDerWaalsContact O-NZ 3.11Å
191	H	93.1	Very high	90.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-77.3	0.8	168.6	-74	-161.4	0	0	0	113.6	H188 V189 V258 V259 A260 D263 N288	H188-H191 VanDerWaalsContact CB-CE1 3.42Å; H188-H191 WeakPolarHBondContact CB-CE1 3.28Å; H188-H191 AromaticContact CD2-CD2 3.9Å; H188-H191 AromaticContact CD2-NE2 3.61Å; H188-H191 AromaticContact CG-NE2 3.91Å; H188-H191 WeakPolarHBondContact O-CB 3.34Å; H188-H191 PolarHBondContact O-N 2.96Å; V189-H191 PolarHBondContact O-CD2 2.82Å; V189-H191 PolarHBondContact O-N 3.26Å; H191-V258 HydrophobicContact CB-CG1 4.23Å; H191-V258 PolarHBondContact ND1-O 2.9Å; H191-V258 VanDerWaalsContact ND1-O 3.12Å; H191-V258 VanDerWaalsContact O-CG1 3.31Å; H191-V258 WeakPolarHBondContact O-CG1 3.41Å; H191-V259 WeakPolarHBondContact ND1-CA 3.16Å; H191-A260 HydrophobicContact CB-CB 4.33Å; H191-A260 PolarHBondContact ND1-N 3.1Å; H191-D263 IonicContact CD2-OD2 2.64Å; H191-D263 IonicContact NE2-OD2 2.74Å; H191-N288 PolarHBondContact O-ND2 2.86Å
192	G	89.3	Confident	90.2	Very high	16 Å²	16	33.8 Å²	33.8	17%	0.165	17%	0.168	C	C	.	.			trans	80.7	29.7	173.1	0	0	0	0	0	115.6	D190 T195 L196	D190-G192 PolarHBondContact O-N 3.19Å; G192-T195 PolarHBondContact O-N 3.43Å; G192-L196 WeakPolarHBondContact O-CB 3.35Å; G192-L196 PolarHBondContact O-N 2.76Å
193	K	91	Very high	89.5	Confident	11 Å²	11	36.2 Å²	36.2	5%	0.048	18%	0.183	C	C	.	.	H	α-helix	trans	-56.1	-57.1	175.6	-61.9	-177.5	-67	-79.4	0	112	I185 G187 H188 T195 L196 L197 T235 V258	I185-K193 HydrophobicContact CG2-CB 3.95Å; I185-K193 HydrophobicContact CG2-CD 4.35Å; I185-K193 HydrophobicContact CG2-CG 3.96Å; G187-K193 PolarHBondContact O-NZ 2.89Å; H188-K193 PolarHBondContact O-NZ 3.33Å; K193-T195 VanDerWaalsContact C-N 3.28Å; K193-T195 PolarHBondContact O-N 3.37Å; K193-L196 WeakPolarHBondContact O-CB 3.46Å; K193-L196 PolarHBondContact O-N 3.37Å; K193-L196 VanDerWaalsContact O-N 3.16Å; K193-L197 WeakPolarHBondContact O-CG 3.5Å; K193-L197 PolarHBondContact O-N 2.91Å; K193-L197 VanDerWaalsContact O-N 3.11Å; K193-T235 WeakPolarHBondContact CE-O 3.31Å; K193-V258 HydrophobicContact CG-CB 4.15Å; K193-V258 HydrophobicContact CG-CG2 4.28Å
194	T	88.8	Confident	88.6	Confident	22 Å²	22	43.2 Å²	43.2	14%	0.135	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-37.8	179.7	-32.8	0	0	0	0	111.4	L197 D198 A206 T214	T194-L197 PolarHBondContact O-N 2.79Å; T194-D198 WeakPolarHBondContact O-CB 3.48Å; T194-D198 PolarHBondContact O-N 2.9Å; T194-A206 HydrophobicContact CG2-CB 3.93Å; T194-T214 PolarHBondContact OG1-OG1 3.26Å
195	T	90.1	Very high	87.8	Confident	48 Å²	48	45.4 Å²	45.4	29%	0.294	23%	0.229	S	C	.	.	H	α-helix	trans	-65.1	-41	176.4	-44.3	0	0	0	0	112.4	G192 K193 L197 D198 Q199 A325 L326	G192-T195 PolarHBondContact O-N 3.43Å; K193-T195 VanDerWaalsContact C-N 3.28Å; K193-T195 PolarHBondContact O-N 3.37Å; T195-L197 VanDerWaalsContact C-N 3.28Å; T195-L197 PolarHBondContact O-N 3.35Å; T195-D198 PolarHBondContact O-N 3.32Å; T195-Q199 PolarHBondContact O-N 3.05Å; T195-Q199 VanDerWaalsContact O-N 3.09Å; T195-A325 HydrophobicContact CG2-CB 4.06Å; T195-L326 HydrophobicContact CG2-CD2 4.13Å
196	L	89.4	Confident	86.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60	-44.2	174.8	-173.6	164	0	0	0	109.9	I185 G192 K193 Q199 L200 V258 A325 L331 L334	I185-L196 HydrophobicContact CD1-CD2 3.76Å; G192-L196 WeakPolarHBondContact O-CB 3.35Å; G192-L196 PolarHBondContact O-N 2.76Å; K193-L196 WeakPolarHBondContact O-CB 3.46Å; K193-L196 PolarHBondContact O-N 3.37Å; K193-L196 VanDerWaalsContact O-N 3.16Å; L196-Q199 PolarHBondContact O-N 3.39Å; L196-L200 HydrophobicContact CD2-CD1 3.51Å; L196-L200 HydrophobicContact CD2-CG 4.12Å; L196-L200 WeakPolarHBondContact O-CG 3.24Å; L196-L200 PolarHBondContact O-N 3.42Å; L196-V258 HydrophobicContact CD1-CG2 4.2Å; L196-A325 HydrophobicContact CB-CB 4.19Å; L196-L331 HydrophobicContact CD2-CD2 4.43Å; L196-L331 HydrophobicContact CG-CD2 3.98Å; L196-L334 HydrophobicContact CD1-CD2 3.96Å; L196-L334 HydrophobicContact CD2-CD2 4.43Å
197	L	87.7	Confident	85.7	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-68	-40.4	179	-67.1	177.4	0	0	0	113.4	I185 K193 T194 T195 Q199 L200 R201 F220 F232 D234	I185-L197 HydrophobicContact CD1-CD1 4.23Å; I185-L197 HydrophobicContact CD1-CD2 3.18Å; I185-L197 HydrophobicContact CD1-CG 3.74Å; I185-L197 HydrophobicContact CG1-CD1 4.48Å; I185-L197 HydrophobicContact CG1-CD2 4.04Å; I185-L197 HydrophobicContact CG1-CG 4.49Å; K193-L197 WeakPolarHBondContact O-CG 3.5Å; K193-L197 PolarHBondContact O-N 2.91Å; K193-L197 VanDerWaalsContact O-N 3.11Å; T194-L197 PolarHBondContact O-N 2.79Å; T195-L197 VanDerWaalsContact C-N 3.28Å; T195-L197 PolarHBondContact O-N 3.35Å; L197-Q199 VanDerWaalsContact C-N 3.26Å; L197-Q199 PolarHBondContact O-N 3.13Å; L197-L200 HydrophobicContact CD2-CD1 4.29Å; L197-L200 PolarHBondContact O-N 3.49Å; L197-R201 VanDerWaalsContact O-CB 3.31Å; L197-R201 WeakPolarHBondContact O-CB 3.43Å; L197-R201 WeakPolarHBondContact O-CD 3.47Å; L197-R201 WeakPolarHBondContact O-CG 3.34Å; L197-R201 PolarHBondContact O-N 2.87Å; L197-F220 HydrophobicContact CB-CE2 4.4Å; L197-F220 HydrophobicContact CB-CZ 3.88Å; L197-F220 HydrophobicContact CD1-CE1 3.81Å; L197-F220 HydrophobicContact CD1-CZ 3.45Å; L197-F220 VanDerWaalsContact CD1-CZ 3.45Å; L197-F220 HydrophobicContact CD2-CE1 4.42Å; L197-F220 HydrophobicContact CD2-CE2 3.74Å; L197-F220 HydrophobicContact CD2-CZ 3.28Å; L197-F220 HydrophobicContact CG-CE1 4.47Å; L197-F220 HydrophobicContact CG-CE2 4.44Å; L197-F220 HydrophobicContact CG-CZ 3.67Å; L197-F232 HydrophobicContact CD2-CB 4.24Å; L197-F232 HydrophobicContact CD2-CD1 4.24Å; L197-F232 HydrophobicContact CD2-CG 4.19Å; L197-D234 HydrophobicContact CD1-CB 3.49Å; L197-D234 VanDerWaalsContact CD1-CB 3.49Å
198	D	87.9	Confident	84.9	Confident	13 Å²	13	58.4 Å²	58.4	7%	0.07	31%	0.311	C	S	.	.	H	α-helix	trans	-57.4	-42.7	173.8	-91.2	-19.4	0	0	0	112	T194 T195 R201 K202 T203 V205 A206	T194-D198 WeakPolarHBondContact O-CB 3.48Å; T194-D198 PolarHBondContact O-N 2.9Å; T195-D198 PolarHBondContact O-N 3.32Å; D198-R201 PolarHBondContact O-N 3.44Å; D198-K202 WeakPolarHBondContact O-CA 3.39Å; D198-K202 PolarHBondContact O-N 3.39Å; D198-T203 CarbonylContact C-O 3.56Å; D198-T203 VanDerWaalsContact CB-O 3.22Å; D198-T203 WeakPolarHBondContact CB-O 3.41Å; D198-T203 PolarHBondContact O-N 2.67Å; D198-T203 PolarHBondContact OD1-OG1 3.35Å; D198-V205 WeakPolarHBondContact OD1-CB 3.46Å; D198-V205 PolarHBondContact OD1-N 3.03Å; D198-V205 PolarHBondContact OD2-N 3.43Å; D198-A206 WeakPolarHBondContact OD2-CB 3.42Å; D198-A206 PolarHBondContact OD2-N 3.06Å
199	Q	88.4	Confident	84.2	Confident	92 Å²	92	58.3 Å²	58.3	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-68.8	-38.4	178.5	-164.8	64.5	6.1	0	0	112.2	T195 L196 L197 R201 K202 L331	T195-Q199 PolarHBondContact O-N 3.05Å; T195-Q199 VanDerWaalsContact O-N 3.09Å; L196-Q199 PolarHBondContact O-N 3.39Å; L197-Q199 VanDerWaalsContact C-N 3.26Å; L197-Q199 PolarHBondContact O-N 3.13Å; Q199-R201 VanDerWaalsContact C-N 3.35Å; Q199-K202 PolarHBondContact O-N 3.03Å; Q199-L331 HydrophobicContact CB-CD1 3.8Å; Q199-L331 HydrophobicContact CG-CD1 3.28Å
200	L	85.2	Confident	83.3	Confident	34 Å²	34	59.9 Å²	59.9	18%	0.178	32%	0.32	C	S	.	.	H	α-helix	trans	-65.7	-37.2	173.8	-73.3	177.5	0	0	0	112.4	L196 L197 F232 L331	L196-L200 HydrophobicContact CD2-CD1 3.51Å; L196-L200 HydrophobicContact CD2-CG 4.12Å; L196-L200 WeakPolarHBondContact O-CG 3.24Å; L196-L200 PolarHBondContact O-N 3.42Å; L197-L200 HydrophobicContact CD2-CD1 4.29Å; L197-L200 PolarHBondContact O-N 3.49Å; L200-F232 HydrophobicContact CD1-CE1 4.4Å; L200-F232 HydrophobicContact CD1-CE2 4.08Å; L200-F232 HydrophobicContact CD1-CZ 3.88Å; L200-L331 HydrophobicContact CD2-CB 4.42Å
201	R	81.9	Confident	82.2	Confident	77 Å²	77	56.8 Å²	56.8	29%	0.291	32%	0.316	S	S	.	.	H	α-helix	trans	-83.7	-15.3	-179.3	-67	168.1	70.5	-170.3	-0.5	113.5	L197 D198 Q199 T203 F220 V222	L197-R201 VanDerWaalsContact O-CB 3.31Å; L197-R201 WeakPolarHBondContact O-CB 3.43Å; L197-R201 WeakPolarHBondContact O-CD 3.47Å; L197-R201 WeakPolarHBondContact O-CG 3.34Å; L197-R201 PolarHBondContact O-N 2.87Å; D198-R201 PolarHBondContact O-N 3.44Å; Q199-R201 VanDerWaalsContact C-N 3.35Å; R201-T203 HydrophobicContact CB-CG2 4.06Å; R201-T203 VanDerWaalsContact CB-OG1 3.29Å; R201-T203 WeakPolarHBondContact CB-OG1 3.34Å; R201-T203 PolarHBondContact O-N 3.38Å; R201-F220 VanDerWaalsContact CD-CD2 3.44Å; R201-F220 HydrophobicContact CG-CD2 3.65Å; R201-F220 HydrophobicContact CG-CE2 3.8Å; R201-F220 HydrophobicContact CG-CG 4.46Å; R201-V222 HydrophobicContact CG-CG2 4.16Å
202	K	83	Confident	81.3	Confident	195 Å²	195	59.1 Å²	59.1	85%	0.848	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	38.5	-166.4	-54.9	177.4	-179.2	175.1	0	111.8	D198 Q199	D198-K202 WeakPolarHBondContact O-CA 3.39Å; D198-K202 PolarHBondContact O-N 3.39Å; Q199-K202 PolarHBondContact O-N 3.03Å
203	T	80.9	Confident	80.8	Confident	52 Å²	52	59.9 Å²	59.9	32%	0.319	34%	0.34	S	S	.	.			trans	-118.6	171.8	176.6	57.2	0	0	0	0	110.6	D198 R201	D198-T203 CarbonylContact C-O 3.56Å; D198-T203 VanDerWaalsContact CB-O 3.22Å; D198-T203 WeakPolarHBondContact CB-O 3.41Å; D198-T203 PolarHBondContact O-N 2.67Å; D198-T203 PolarHBondContact OD1-OG1 3.35Å; R201-T203 HydrophobicContact CB-CG2 4.06Å; R201-T203 VanDerWaalsContact CB-OG1 3.29Å; R201-T203 WeakPolarHBondContact CB-OG1 3.34Å; R201-T203 PolarHBondContact O-N 3.38Å
204	Q	76.8	Confident	80.4	Confident	146 Å²	146	60.2 Å²	60.2	68%	0.682	34%	0.343	S	S	*	.			trans	-131.5	67.3	175.8	-68	-171.8	-15.1	0	0	110.3
205	V	78.2	Confident	80	Confident	47 Å²	47	59.8 Å²	59.8	29%	0.285	34%	0.34	S	S	.	.			trans	-76.3	-39.5	177.8	-178.7	0	0	0	0	110.9	D198 A207 M208 E209	D198-V205 WeakPolarHBondContact OD1-CB 3.46Å; D198-V205 PolarHBondContact OD1-N 3.03Å; D198-V205 PolarHBondContact OD2-N 3.43Å; V205-A207 PolarHBondContact O-N 2.73Å; V205-A207 VanDerWaalsContact O-N 3.15Å; V205-M208 WeakPolarHBondContact O-CA 3.47Å; V205-M208 PolarHBondContact O-N 2.64Å; V205-E209 HydrophobicContact CG1-CG 4.19Å; V205-E209 PolarHBondContact O-N 3.32Å
206	A	70.9	Confident	79.7	Confident	29 Å²	29	60.2 Å²	60.2	24%	0.24	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-33.2	-179	0	0	0	0	0	112.9	T194 D198 M208	T194-A206 HydrophobicContact CG2-CB 3.93Å; D198-A206 WeakPolarHBondContact OD2-CB 3.42Å; D198-A206 PolarHBondContact OD2-N 3.06Å; A206-M208 VanDerWaalsContact C-N 3.35Å
207	A	75.6	Confident	79.5	Confident	86 Å²	86	60.4 Å²	60.4	71%	0.711	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-21.3	176.4	0	0	0	0	0	113.6	V205	V205-A207 PolarHBondContact O-N 2.73Å; V205-A207 VanDerWaalsContact O-N 3.15Å
208	M	76.8	Confident	79.4	Confident	159 Å²	159	61.8 Å²	61.8	78%	0.783	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-18.3	179.9	-64.3	-172.3	-173.4	0	0	112.9	V205 A206	V205-M208 WeakPolarHBondContact O-CA 3.47Å; V205-M208 PolarHBondContact O-N 2.64Å; A206-M208 VanDerWaalsContact C-N 3.35Å
209	E	76.1	Confident	79.5	Confident	44 Å²	44	61.8 Å²	61.8	21%	0.206	36%	0.355	C	S	.	.	S	Bend	trans	-64.6	133.2	179.4	-75.7	-174.5	160.5	0	0	112.2	V205 G211 G212 T214	V205-E209 HydrophobicContact CG1-CG 4.19Å; V205-E209 PolarHBondContact O-N 3.32Å; E209-G211 PolarHBondContact O-N 3.11Å; E209-G212 PolarHBondContact O-N 3.37Å; E209-G212 VanDerWaalsContact O-N 3.12Å; E209-T214 PolarHBondContact OE1-OG1 3.5Å; E209-T214 WeakPolarHBondContact OE2-CA 3.24Å; E209-T214 PolarHBondContact OE2-N 2.88Å; E209-T214 VanDerWaalsContact OE2-N 3.1Å; E209-T214 PolarHBondContact OE2-OG1 2.71Å
210	V	70.8	Confident	79.5	Confident	67 Å²	67	57.6 Å²	57.6	41%	0.406	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-70.8	119.7	-179	-178.8	0	0	0	0	109.4	G212 Q215 K597	V210-G212 VanDerWaalsContact C-N 3.29Å; V210-Q215 PolarHBondContact O-NE2 2.79Å; V210-K597 HydrophobicContact CB-CB 4.46Å; V210-K597 HydrophobicContact CB-CD 4.48Å; V210-K597 HydrophobicContact CG1-CB 3.73Å; V210-K597 HydrophobicContact CG1-CD 3.85Å; V210-K597 HydrophobicContact CG1-CG 4.47Å; V210-K597 HydrophobicContact CG2-CD 4.18Å
211	G	64.6	Low	79.7	Confident	53 Å²	53	58.3 Å²	58.3	55%	0.546	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	81.4	5.7	-177	0	0	0	0	0	114.1	E209 I213	E209-G211 PolarHBondContact O-N 3.11Å; G211-I213 PolarHBondContact O-N 3.47Å
212	G	74.3	Confident	80	Confident	48 Å²	48	55.1 Å²	55.1	50%	0.495	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	65.8	22.5	179.6	0	0	0	0	0	113.9	E209 V210	E209-G212 PolarHBondContact O-N 3.37Å; E209-G212 VanDerWaalsContact O-N 3.12Å; V210-G212 VanDerWaalsContact C-N 3.29Å
213	I	79	Confident	80.2	Confident	33 Å²	33	49.8 Å²	49.8	17%	0.169	32%	0.316	C	S	.	.			trans	-126	137.5	-178.9	56.8	164.7	0	0	0	111.3	G211 Q215 I598 Y600	G211-I213 PolarHBondContact O-N 3.47Å; I213-Q215 HydrophobicContact CD1-CG 3.81Å; I213-Q215 HydrophobicContact CG1-CG 3.93Å; I213-I598 HydrophobicContact CD1-CG2 4.09Å; I213-Y600 HydrophobicContact CD1-CE2 4.12Å
214	T	81.7	Confident	80.3	Confident	17 Å²	17	48 Å²	48	10%	0.104	30%	0.304	C	S	.	.			trans	-78.3	120.3	172.8	-51	0	0	0	0	109.3	T194 E209 H216 P236	T194-T214 PolarHBondContact OG1-OG1 3.26Å; E209-T214 PolarHBondContact OE1-OG1 3.5Å; E209-T214 WeakPolarHBondContact OE2-CA 3.24Å; E209-T214 PolarHBondContact OE2-N 2.88Å; E209-T214 VanDerWaalsContact OE2-N 3.1Å; E209-T214 PolarHBondContact OE2-OG1 2.71Å; T214-H216 WeakPolarHBondContact CG2-O 3.35Å; T214-P236 VanDerWaalsContact O-CB 3.24Å; T214-P236 WeakPolarHBondContact O-CB 3.5Å; T214-P236 WeakPolarHBondContact O-CG 3.45Å
215	Q	81.9	Confident	80.5	Confident	14 Å²	14	46.4 Å²	46.4	7%	0.065	31%	0.306	C	S	.	.			trans	-117.7	-4.6	-175.4	-64.4	178.3	77.5	0	0	113.1	V210 I213 F241 K597	V210-Q215 PolarHBondContact O-NE2 2.79Å; I213-Q215 HydrophobicContact CD1-CG 3.81Å; I213-Q215 HydrophobicContact CG1-CG 3.93Å; Q215-F241 HydrophobicContact CB-CZ 4.32Å; Q215-F241 HydrophobicContact CG-CZ 4.39Å; Q215-K597 PolarHBondContact NE2-O 3.14Å; Q215-K597 PolarHBondContact OE1-O 2.64Å
216	H	83.1	Confident	80.6	Confident	57 Å²	57	48.1 Å²	48.1	26%	0.264	32%	0.321	S	S	.	.	S	Bend	trans	-125.4	151.3	-179.7	-55.7	-59.8	0	0	0	110.4	T214 G218 E361 D523 V524	T214-H216 WeakPolarHBondContact CG2-O 3.35Å; H216-G218 PolarHBondContact O-N 3.45Å; H216-E361 WeakPolarHBondContact CA-OE1 3.24Å; H216-D523 IonicContact CE1-OD1 3.27Å; H216-D523 PolarHBondContact CE1-OD1 3.1Å; H216-D523 IonicContact CE1-OD2 2.76Å; H216-D523 PolarHBondContact CE1-OD2 3.4Å; H216-D523 IonicContact ND1-OD2 3.8Å; H216-D523 IonicContact NE2-OD2 2.78Å; H216-D523 PolarHBondContact NE2-OD2 2.86Å; H216-V524 WeakPolarHBondContact ND1-CG2 3.38Å
217	I	85.8	Confident	81.2	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.021	34%	0.336	C	S	.	.			trans	-81.5	110.2	169.5	-52.1	178.8	0	0	0	108.6	D234 M244 I360 E361	I217-D234 WeakPolarHBondContact CA-O 3.46Å; I217-D234 WeakPolarHBondContact CG2-O 3.27Å; I217-M244 HydrophobicContact CD1-CB 3.62Å; I217-M244 HydrophobicContact CD1-CG 3.93Å; I217-M244 HydrophobicContact CD1-SD 4.45Å; I217-M244 HydrophobicContact CG1-CB 3.91Å; I217-M244 HydrophobicContact CG1-CG 4.07Å; I217-M244 HydrophobicContact CG1-SD 3.94Å; I217-I360 HydrophobicContact CB-CG2 3.82Å; I217-I360 HydrophobicContact CD1-CG2 4.43Å; I217-I360 HydrophobicContact CG2-CG2 3.4Å; I217-I360 VanDerWaalsContact CG2-CG2 3.4Å; I217-E361 HydrophobicContact CB-CG 4.25Å; I217-E361 PolarHBondContact N-OE1 3.28Å
218	G	84.8	Confident	81.5	Confident	31 Å²	31	48.3 Å²	48.3	32%	0.32	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	131.6	175.2	0	0	0	0	0	111.2	H216 L233 D234	H216-G218 PolarHBondContact O-N 3.45Å; G218-L233 WeakPolarHBondContact O-CA 3.38Å; G218-D234 PolarHBondContact N-O 2.97Å; G218-D234 PolarHBondContact O-N 2.9Å
219	A	90.1	Very high	82.1	Confident	12 Å²	12	46 Å²	46	10%	0.099	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	134.5	168.7	0	0	0	0	0	110.1	F232 L233 I360 P415	A219-F232 WeakPolarHBondContact CA-O 3.45Å; A219-L233 HydrophobicContact CB-CD2 3.34Å; A219-I360 HydrophobicContact CB-CD1 3.5Å; A219-P415 HydrophobicContact CB-CB 3.56Å; A219-P415 HydrophobicContact CB-CG 4.29Å
220	F	87.9	Confident	82.9	Confident	5 Å²	5	43.9 Å²	43.9	2%	0.022	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	153.8	178.5	52.2	-83.2	0	0	0	113	L197 R201 V222 T231 F232 D234 E402	L197-F220 HydrophobicContact CB-CE2 4.4Å; L197-F220 HydrophobicContact CB-CZ 3.88Å; L197-F220 HydrophobicContact CD1-CE1 3.81Å; L197-F220 HydrophobicContact CD1-CZ 3.45Å; L197-F220 VanDerWaalsContact CD1-CZ 3.45Å; L197-F220 HydrophobicContact CD2-CE1 4.42Å; L197-F220 HydrophobicContact CD2-CE2 3.74Å; L197-F220 HydrophobicContact CD2-CZ 3.28Å; L197-F220 HydrophobicContact CG-CE1 4.47Å; L197-F220 HydrophobicContact CG-CE2 4.44Å; L197-F220 HydrophobicContact CG-CZ 3.67Å; R201-F220 VanDerWaalsContact CD-CD2 3.44Å; R201-F220 HydrophobicContact CG-CD2 3.65Å; R201-F220 HydrophobicContact CG-CE2 3.8Å; R201-F220 HydrophobicContact CG-CG 4.46Å; F220-V222 HydrophobicContact CD2-CG2 3.78Å; F220-V222 HydrophobicContact CE2-CG2 3.88Å; F220-T231 CarbonylContact O-C 3.54Å; F220-T231 WeakPolarHBondContact O-CA 3.38Å; F220-F232 HydrophobicContact CD2-CB 4Å; F220-F232 HydrophobicContact CE1-CB 3.97Å; F220-F232 HydrophobicContact CE2-CB 3.28Å; F220-F232 AromaticContact CE2-CD2 3.92Å; F220-F232 HydrophobicContact CE2-CD2 3.92Å; F220-F232 AromaticContact CE2-CG 3.89Å; F220-F232 HydrophobicContact CE2-CG 3.89Å; F220-F232 HydrophobicContact CZ-CB 3.2Å; F220-F232 HydrophobicContact CZ-CG 4.12Å; F220-F232 PolarHBondContact N-O 2.88Å; F220-F232 PolarHBondContact O-N 2.72Å; F220-D234 HydrophobicContact CE1-CB 4.24Å; F220-E402 WeakPolarHBondContact CA-OE2 3.42Å
221	L	89	Confident	84	Confident	49 Å²	49	40.7 Å²	40.7	26%	0.257	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	117.6	-177.7	-169.2	69.7	0	0	0	111.3	K229 T231 E402	L221-K229 HydrophobicContact CD1-CB 4.15Å; L221-K229 HydrophobicContact CD2-CD 4.44Å; L221-T231 WeakPolarHBondContact CD1-OG1 3.47Å; L221-E402 PolarHBondContact N-OE1 3.36Å; L221-E402 PolarHBondContact N-OE2 2.98Å
222	V	87.9	Confident	85.4	Confident	10 Å²	10	38.3 Å²	38.3	6%	0.061	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.4	174.9	179.5	0	0	0	0	109.5	R201 F220 K229 I230 F232	R201-V222 HydrophobicContact CG-CG2 4.16Å; F220-V222 HydrophobicContact CD2-CG2 3.78Å; F220-V222 HydrophobicContact CE2-CG2 3.88Å; V222-K229 WeakPolarHBondContact O-CA 3.4Å; V222-I230 PolarHBondContact N-O 2.78Å; V222-I230 PolarHBondContact O-N 3.25Å; V222-F232 HydrophobicContact CB-CD2 3.94Å; V222-F232 HydrophobicContact CB-CE2 3.85Å; V222-F232 HydrophobicContact CG1-CE2 4.43Å; V222-F232 HydrophobicContact CG2-CD2 3.58Å; V222-F232 HydrophobicContact CG2-CE2 3.86Å
223	S	87.3	Confident	86.3	Confident	82 Å²	82	36.1 Å²	36.1	57%	0.573	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	119	171.1	-166.3	0	0	0	0	109.3	E228	S223-E228 WeakPolarHBondContact CA-O 3.38Å
224	L	83.7	Confident	86.9	Confident	16 Å²	16	35 Å²	35	8%	0.084	22%	0.219	C	C	.	.			trans	-75.6	157	175.2	-64.8	179.4	0	0	0	111.2	S226 G227 E228 I230 A335 V339	L224-S226 WeakPolarHBondContact CB-OG 3.35Å; L224-S226 PolarHBondContact O-N 2.68Å; L224-G227 PolarHBondContact O-N 2.77Å; L224-E228 HydrophobicContact CD1-CB 4.43Å; L224-E228 PolarHBondContact N-O 2.84Å; L224-I230 HydrophobicContact CD1-CD1 3.73Å; L224-I230 HydrophobicContact CD1-CG1 4.42Å; L224-I230 HydrophobicContact CG-CD1 4.29Å; L224-A335 HydrophobicContact CD1-CB 3.94Å; L224-A335 HydrophobicContact CD2-CB 3.66Å; L224-A335 HydrophobicContact CG-CB 4.48Å; L224-V339 HydrophobicContact CD1-CG2 3.76Å
225	P	81.4	Confident	87.3	Confident	111 Å²	111	34.3 Å²	34.3	72%	0.721	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-25.2	171.8	-25.3	35.5	0	0	0	114	G227 M332	P225-G227 PolarHBondContact O-N 3.03Å; P225-M332 HydrophobicContact CB-CE 4.46Å; P225-M332 HydrophobicContact CG-CE 3.81Å; P225-M332 HydrophobicContact CG-SD 4.38Å
226	S	79.8	Confident	87.6	Confident	84 Å²	84	33.6 Å²	33.6	59%	0.587	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-13.7	173.2	52.9	0	0	0	0	113.5	L224	L224-S226 WeakPolarHBondContact CB-OG 3.35Å; L224-S226 PolarHBondContact O-N 2.68Å
227	G	83.3	Confident	87.5	Confident	54 Å²	54	31.2 Å²	31.2	56%	0.557	20%	0.202	S	C	*	.	S	Bend	trans	94.3	-6.9	-176.4	0	0	0	0	0	113.8	L224 P225	L224-G227 PolarHBondContact O-N 2.77Å; P225-G227 PolarHBondContact O-N 3.03Å
228	E	83.2	Confident	87.4	Confident	65 Å²	65	31.9 Å²	31.9	30%	0.304	21%	0.205	S	C	.	.			trans	-74.7	150.9	176	-69.2	-172.2	-148	0	0	112.6	S223 L224 V339	S223-E228 WeakPolarHBondContact CA-O 3.38Å; L224-E228 HydrophobicContact CD1-CB 4.43Å; L224-E228 PolarHBondContact N-O 2.84Å; E228-V339 VanDerWaalsContact CD-CG1 3.44Å; E228-V339 VanDerWaalsContact OE1-CG1 3.24Å; E228-V339 WeakPolarHBondContact OE1-CG1 3.31Å; E228-V339 WeakPolarHBondContact OE2-CG1 3.49Å; E228-V339 WeakPolarHBondContact OE2-CG2 3.46Å
229	K	89.6	Confident	87.3	Confident	109 Å²	109	31.4 Å²	31.4	47%	0.474	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129	-179.2	-63.4	178	-178.7	178.8	0	109	S180 L221 V222	S180-K229 WeakPolarHBondContact CB-O 3.12Å; S180-K229 PolarHBondContact OG-O 2.77Å; L221-K229 HydrophobicContact CD1-CB 4.15Å; L221-K229 HydrophobicContact CD2-CD 4.44Å; V222-K229 WeakPolarHBondContact O-CA 3.4Å
230	I	92.4	Very high	86.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.1	178.6	-55.7	179.7	0	0	0	107.9	P181 V183 V222 L224 F232 V339	P181-I230 HydrophobicContact CG-CG1 4.1Å; P181-I230 HydrophobicContact CG-CG2 4.35Å; V183-I230 HydrophobicContact CB-CG2 4.11Å; V183-I230 HydrophobicContact CG2-CG2 3.49Å; V183-I230 VanDerWaalsContact CG2-CG2 3.49Å; V222-I230 PolarHBondContact N-O 2.78Å; V222-I230 PolarHBondContact O-N 3.25Å; L224-I230 HydrophobicContact CD1-CD1 3.73Å; L224-I230 HydrophobicContact CD1-CG1 4.42Å; L224-I230 HydrophobicContact CG-CD1 4.29Å; I230-F232 HydrophobicContact CB-CD2 4.31Å; I230-F232 HydrophobicContact CB-CE2 3.81Å; I230-F232 HydrophobicContact CB-CZ 4.23Å; I230-F232 HydrophobicContact CD1-CZ 4.41Å; I230-F232 HydrophobicContact CG2-CD1 4.4Å; I230-F232 HydrophobicContact CG2-CD2 3.93Å; I230-F232 HydrophobicContact CG2-CE1 4.06Å; I230-F232 HydrophobicContact CG2-CE2 3.56Å; I230-F232 HydrophobicContact CG2-CG 4.34Å; I230-F232 HydrophobicContact CG2-CZ 3.64Å; I230-V339 HydrophobicContact CD1-CG2 4.06Å
231	T	93.6	Very high	86.9	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116.7	172.8	-62.3	0	0	0	0	108.1	P181 I182 V183 F220 L221 S413 P415	P181-T231 PolarHBondContact O-N 2.98Å; I182-T231 CarbonylContact C-O 3.5Å; I182-T231 WeakPolarHBondContact CA-O 3.34Å; I182-T231 HydrophobicContact CG2-CG2 4.17Å; V183-T231 PolarHBondContact N-O 3.32Å; F220-T231 CarbonylContact O-C 3.54Å; F220-T231 WeakPolarHBondContact O-CA 3.38Å; L221-T231 WeakPolarHBondContact CD1-OG1 3.47Å; T231-S413 WeakPolarHBondContact CB-O 3.35Å; T231-S413 PolarHBondContact OG1-O 2.81Å; T231-P415 HydrophobicContact CG2-CB 4.4Å; T231-P415 HydrophobicContact CG2-CG 3.99Å
232	F	93.7	Very high	86.9	Confident	4 Å²	4	30.8 Å²	30.8	2%	0.018	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	141.8	178.7	-74.5	-79.5	0	0	0	111.2	V183 I185 L197 L200 A219 F220 V222 I230 I256	V183-F232 HydrophobicContact CB-CD1 3.84Å; V183-F232 HydrophobicContact CB-CE1 3.96Å; V183-F232 HydrophobicContact CG1-CD1 3.95Å; V183-F232 HydrophobicContact CG1-CE1 3.81Å; V183-F232 CarbonylContact O-C 3.55Å; V183-F232 VanDerWaalsContact O-CA 3.24Å; V183-F232 WeakPolarHBondContact O-CA 3.41Å; I185-F232 HydrophobicContact CD1-CD1 4.12Å; I185-F232 HydrophobicContact CD1-CE1 4.38Å; I185-F232 HydrophobicContact CG1-CD1 4.13Å; L197-F232 HydrophobicContact CD2-CB 4.24Å; L197-F232 HydrophobicContact CD2-CD1 4.24Å; L197-F232 HydrophobicContact CD2-CG 4.19Å; L200-F232 HydrophobicContact CD1-CE1 4.4Å; L200-F232 HydrophobicContact CD1-CE2 4.08Å; L200-F232 HydrophobicContact CD1-CZ 3.88Å; A219-F232 WeakPolarHBondContact CA-O 3.45Å; F220-F232 HydrophobicContact CD2-CB 4Å; F220-F232 HydrophobicContact CE1-CB 3.97Å; F220-F232 HydrophobicContact CE2-CB 3.28Å; F220-F232 AromaticContact CE2-CD2 3.92Å; F220-F232 HydrophobicContact CE2-CD2 3.92Å; F220-F232 AromaticContact CE2-CG 3.89Å; F220-F232 HydrophobicContact CE2-CG 3.89Å; F220-F232 HydrophobicContact CZ-CB 3.2Å; F220-F232 HydrophobicContact CZ-CG 4.12Å; F220-F232 PolarHBondContact N-O 2.88Å; F220-F232 PolarHBondContact O-N 2.72Å; V222-F232 HydrophobicContact CB-CD2 3.94Å; V222-F232 HydrophobicContact CB-CE2 3.85Å; V222-F232 HydrophobicContact CG1-CE2 4.43Å; V222-F232 HydrophobicContact CG2-CD2 3.58Å; V222-F232 HydrophobicContact CG2-CE2 3.86Å; I230-F232 HydrophobicContact CB-CD2 4.31Å; I230-F232 HydrophobicContact CB-CE2 3.81Å; I230-F232 HydrophobicContact CB-CZ 4.23Å; I230-F232 HydrophobicContact CD1-CZ 4.41Å; I230-F232 HydrophobicContact CG2-CD1 4.4Å; I230-F232 HydrophobicContact CG2-CD2 3.93Å; I230-F232 HydrophobicContact CG2-CE1 4.06Å; I230-F232 HydrophobicContact CG2-CE2 3.56Å; I230-F232 HydrophobicContact CG2-CG 4.34Å; I230-F232 HydrophobicContact CG2-CZ 3.64Å; F232-I256 HydrophobicContact CE1-CD1 3.88Å
233	L	93.3	Very high	87	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	120.1	169.3	-57.6	-173.6	0	0	0	109.7	I182 V183 T184 I185 G218 A219 V251 T252 I360 I375	I182-L233 HydrophobicContact CG2-CD1 4.31Å; I182-L233 HydrophobicContact CG2-CG 4.24Å; V183-L233 PolarHBondContact O-N 2.74Å; T184-L233 HydrophobicContact CG2-CB 4.29Å; I185-L233 PolarHBondContact N-O 2.78Å; G218-L233 WeakPolarHBondContact O-CA 3.38Å; A219-L233 HydrophobicContact CB-CD2 3.34Å; L233-V251 HydrophobicContact CD1-CB 4.48Å; L233-V251 HydrophobicContact CD1-CG1 4.28Å; L233-T252 HydrophobicContact CD1-CG2 3.5Å; L233-T252 HydrophobicContact CG-CG2 4.1Å; L233-I360 HydrophobicContact CD2-CD1 4.02Å; L233-I375 HydrophobicContact CD1-CD1 3.86Å; L233-I375 HydrophobicContact CD2-CD1 3.69Å; L233-I375 HydrophobicContact CG-CD1 4.18Å
234	D	92.3	Very high	87.2	Confident	10 Å²	10	27.7 Å²	27.7	5%	0.053	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	125.2	170.6	-160.4	-1.9	0	0	0	109.4	L197 I217 G218 F220	L197-D234 HydrophobicContact CD1-CB 3.49Å; L197-D234 VanDerWaalsContact CD1-CB 3.49Å; I217-D234 WeakPolarHBondContact CA-O 3.46Å; I217-D234 WeakPolarHBondContact CG2-O 3.27Å; G218-D234 PolarHBondContact N-O 2.97Å; G218-D234 PolarHBondContact O-N 2.9Å; F220-D234 HydrophobicContact CE1-CB 4.24Å
235	T	90.1	Very high	87.6	Confident	1 Å²	1	27 Å²	27	1%	0.006	17%	0.174	C	C	.	.			trans	-115.6	136.8	177.9	60	0	0	0	0	111.6	T184 I185 K193 G237	T184-T235 HydrophobicContact CG2-CG2 3.45Å; T184-T235 VanDerWaalsContact CG2-CG2 3.45Å; I185-T235 PolarHBondContact O-OG1 2.74Å; K193-T235 WeakPolarHBondContact CE-O 3.31Å; T235-G237 PolarHBondContact O-N 2.71Å
236	P	88.2	Confident	88.1	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	15%	0.153	C	C	.	.			trans	-57.5	134.8	173.1	-29.5	38.3	0	0	0	112.8	T214 F241 M244 R245	T214-P236 VanDerWaalsContact O-CB 3.24Å; T214-P236 WeakPolarHBondContact O-CB 3.5Å; T214-P236 WeakPolarHBondContact O-CG 3.45Å; P236-F241 HydrophobicContact CB-CB 3.7Å; P236-F241 HydrophobicContact CB-CD2 3.51Å; P236-F241 HydrophobicContact CB-CE2 4.27Å; P236-F241 HydrophobicContact CB-CG 3.68Å; P236-F241 HydrophobicContact CG-CB 4.3Å; P236-F241 HydrophobicContact CG-CD2 4.32Å; P236-F241 HydrophobicContact CG-CG 4.19Å; P236-M244 HydrophobicContact CG-SD 3.78Å; P236-R245 PolarHBondContact O-NH1 3.49Å; P236-R245 VanDerWaalsContact O-NH1 3.14Å
237	G	80.6	Confident	88.7	Confident	7 Å²	7	20.4 Å²	20.4	7%	0.072	13%	0.129	C	C	.	.			trans	-76.9	-23.4	-180	0	0	0	0	0	114.4	T235 R245 Q268	T235-G237 PolarHBondContact O-N 2.71Å; G237-R245 PolarHBondContact O-NH1 2.95Å; G237-Q268 PolarHBondContact O-NE2 3.05Å; G237-Q268 PolarHBondContact O-OE1 3.49Å
238	H	82.9	Confident	89.1	Confident	18 Å²	18	17.9 Å²	17.9	8%	0.083	10%	0.104	C	C	.	.	S	Bend	trans	-72.7	147.1	-168.6	-175.7	-88.5	0	0	0	113.5	V189 A240 F241 R245 Y600 F727	V189-H238 HydrophobicContact CG2-CB 4.11Å; H238-A240 VanDerWaalsContact C-N 3.29Å; H238-A240 VanDerWaalsContact ND1-CB 3.3Å; H238-A240 WeakPolarHBondContact ND1-CB 3.18Å; H238-A240 PolarHBondContact ND1-N 3.07Å; H238-A240 PolarHBondContact O-N 2.92Å; H238-F241 HydrophobicContact CB-CD2 3.95Å; H238-F241 HydrophobicContact CB-CE2 4.32Å; H238-F241 PolarHBondContact O-N 3.24Å; H238-R245 PolarHBondContact O-NH1 3.17Å; H238-Y600 WeakPolarHBondContact CB-OH 3.46Å; H238-Y600 AromaticContact CD2-CE1 3.36Å; H238-Y600 WeakPolarHBondContact CD2-CE1 3.42Å; H238-Y600 AromaticContact CD2-CZ 3.23Å; H238-Y600 PolarHBondContact CD2-OH 3.02Å; H238-Y600 AromaticContact CE1-CD1 3.98Å; H238-Y600 AromaticContact CE1-CE1 3.15Å; H238-Y600 WeakPolarHBondContact CE1-CE1 3.41Å; H238-Y600 AromaticContact CE1-CZ 3.89Å; H238-Y600 AromaticContact CG-CE1 3.58Å; H238-Y600 AromaticContact CG-CZ 3.55Å; H238-Y600 AromaticContact ND1-CE1 3.45Å; H238-Y600 WeakPolarHBondContact ND1-CE1 3.49Å; H238-Y600 AromaticContact ND1-CZ 3.93Å; H238-Y600 AromaticContact NE2-CD1 3.89Å; H238-Y600 AromaticContact NE2-CE1 3.07Å; H238-Y600 WeakPolarHBondContact NE2-CE1 3.37Å; H238-Y600 AromaticContact NE2-CZ 3.47Å; H238-F727 AromaticContact CE1-CD2 3.19Å; H238-F727 WeakPolarHBondContact CE1-CD2 3.38Å; H238-F727 AromaticContact CE1-CE2 3.88Å; H238-F727 AromaticContact CE1-CG 3.4Å; H238-F727 VanDerWaalsContact CE1-CG 3.4Å; H238-F727 WeakPolarHBondContact CE1-CG 3.45Å; H238-F727 AromaticContact NE2-CD2 3.46Å; H238-F727 WeakPolarHBondContact NE2-CD2 3.33Å; H238-F727 AromaticContact NE2-CG 3.97Å
239	A	82.3	Confident	89.6	Confident	21 Å²	21	14.9 Å²	14.9	17%	0.174	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-55.1	-40.5	-175	0	0	0	0	0	113.3	F241 S242 F727	A239-F241 PolarHBondContact O-N 3.15Å; A239-S242 PolarHBondContact O-N 2.98Å; A239-S242 VanDerWaalsContact O-N 3.08Å; A239-F727 HydrophobicContact CB-CB 3.77Å
240	A	82.6	Confident	89.7	Confident	12 Å²	12	16.1 Å²	16.1	10%	0.099	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-52.3	-25.7	175.3	0	0	0	0	0	115	H238 I534 I599 F727	H238-A240 VanDerWaalsContact C-N 3.29Å; H238-A240 VanDerWaalsContact ND1-CB 3.3Å; H238-A240 WeakPolarHBondContact ND1-CB 3.18Å; H238-A240 PolarHBondContact ND1-N 3.07Å; H238-A240 PolarHBondContact O-N 2.92Å; A240-I534 HydrophobicContact CB-CD1 3.73Å; A240-I534 HydrophobicContact CB-CG1 4.22Å; A240-I599 HydrophobicContact CB-CD1 4.26Å; A240-F727 HydrophobicContact CB-CD1 4.5Å
241	F	88.5	Confident	89.7	Confident	1 Å²	1	16.5 Å²	16.5	0%	0.004	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-99.4	29.1	-178.6	-58.4	-69.8	0	0	0	112.9	Q215 P236 H238 A239 A243 M244 R245 A530 I599	Q215-F241 HydrophobicContact CB-CZ 4.32Å; Q215-F241 HydrophobicContact CG-CZ 4.39Å; P236-F241 HydrophobicContact CB-CB 3.7Å; P236-F241 HydrophobicContact CB-CD2 3.51Å; P236-F241 HydrophobicContact CB-CE2 4.27Å; P236-F241 HydrophobicContact CB-CG 3.68Å; P236-F241 HydrophobicContact CG-CB 4.3Å; P236-F241 HydrophobicContact CG-CD2 4.32Å; P236-F241 HydrophobicContact CG-CG 4.19Å; H238-F241 HydrophobicContact CB-CD2 3.95Å; H238-F241 HydrophobicContact CB-CE2 4.32Å; H238-F241 PolarHBondContact O-N 3.24Å; A239-F241 PolarHBondContact O-N 3.15Å; F241-A243 VanDerWaalsContact C-N 3.3Å; F241-A243 PolarHBondContact O-N 2.56Å; F241-M244 HydrophobicContact CB-CB 4.25Å; F241-M244 HydrophobicContact CB-CG 4.37Å; F241-M244 HydrophobicContact CB-SD 4.06Å; F241-M244 HydrophobicContact CD1-CE 3.55Å; F241-M244 HydrophobicContact CD1-CG 4.41Å; F241-M244 HydrophobicContact CD1-SD 3.53Å; F241-M244 VanDerWaalsContact CD1-SD 3.53Å; F241-M244 HydrophobicContact CE1-CE 3.85Å; F241-M244 HydrophobicContact CE1-SD 4.29Å; F241-M244 HydrophobicContact CG-SD 4.06Å; F241-M244 WeakPolarHBondContact O-CB 3.28Å; F241-M244 PolarHBondContact O-N 3.25Å; F241-M244 VanDerWaalsContact O-N 3.14Å; F241-R245 PolarHBondContact O-N 3.15Å; F241-R245 VanDerWaalsContact O-N 3.16Å; F241-A530 HydrophobicContact CD1-CB 3.56Å; F241-A530 HydrophobicContact CE1-CB 3.66Å; F241-I599 HydrophobicContact CE1-CD1 4.03Å; F241-I599 HydrophobicContact CE2-CG2 4.16Å; F241-I599 HydrophobicContact CZ-CB 4.4Å; F241-I599 HydrophobicContact CZ-CD1 3.81Å; F241-I599 HydrophobicContact CZ-CG2 4.1Å
242	S	89.3	Confident	89.8	Confident	40 Å²	40	16.9 Å²	16.9	28%	0.28	10%	0.102	S	C	.	.	H	α-helix	trans	-58.5	-40.3	178.2	-168.8	0	0	0	0	112.5	A239 M244 R245 A246 H275	A239-S242 PolarHBondContact O-N 2.98Å; A239-S242 VanDerWaalsContact O-N 3.08Å; S242-M244 VanDerWaalsContact C-N 3.29Å; S242-M244 PolarHBondContact O-N 3.3Å; S242-R245 PolarHBondContact O-N 3.01Å; S242-R245 VanDerWaalsContact O-N 3.11Å; S242-A246 PolarHBondContact O-N 3.27Å; S242-H275 PolarHBondContact OG-NE2 3.41Å; S242-H275 VanDerWaalsContact OG-NE2 3.12Å
243	A	89.1	Confident	89.9	Confident	25 Å²	25	17.8 Å²	17.8	21%	0.207	11%	0.107	C	C	.	.	H	α-helix	trans	-59.7	-38.4	175.9	0	0	0	0	0	112.6	F241 A246 R247	F241-A243 VanDerWaalsContact C-N 3.3Å; F241-A243 PolarHBondContact O-N 2.56Å; A243-A246 PolarHBondContact O-N 3.47Å; A243-R247 PolarHBondContact O-N 3.19Å
244	M	90.8	Very high	90	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-65.6	-40.4	175	-69.4	-173.8	-176.8	0	0	112.2	I217 P236 F241 S242 R247 G248 G526	I217-M244 HydrophobicContact CD1-CB 3.62Å; I217-M244 HydrophobicContact CD1-CG 3.93Å; I217-M244 HydrophobicContact CD1-SD 4.45Å; I217-M244 HydrophobicContact CG1-CB 3.91Å; I217-M244 HydrophobicContact CG1-CG 4.07Å; I217-M244 HydrophobicContact CG1-SD 3.94Å; P236-M244 HydrophobicContact CG-SD 3.78Å; F241-M244 HydrophobicContact CB-CB 4.25Å; F241-M244 HydrophobicContact CB-CG 4.37Å; F241-M244 HydrophobicContact CB-SD 4.06Å; F241-M244 HydrophobicContact CD1-CE 3.55Å; F241-M244 HydrophobicContact CD1-CG 4.41Å; F241-M244 HydrophobicContact CD1-SD 3.53Å; F241-M244 VanDerWaalsContact CD1-SD 3.53Å; F241-M244 HydrophobicContact CE1-CE 3.85Å; F241-M244 HydrophobicContact CE1-SD 4.29Å; F241-M244 HydrophobicContact CG-SD 4.06Å; F241-M244 WeakPolarHBondContact O-CB 3.28Å; F241-M244 PolarHBondContact O-N 3.25Å; F241-M244 VanDerWaalsContact O-N 3.14Å; S242-M244 VanDerWaalsContact C-N 3.29Å; S242-M244 PolarHBondContact O-N 3.3Å; M244-R247 PolarHBondContact O-N 2.86Å; M244-G248 PolarHBondContact O-N 3.45Å; M244-G526 VanDerWaalsContact CE-O 3.25Å; M244-G526 WeakPolarHBondContact CE-O 3.38Å
245	R	93.1	Very high	90.3	Very high	1 Å²	1	17.2 Å²	17.2	0%	0.004	10%	0.104	C	C	.	.	H	α-helix	trans	-64.5	-44	175.5	-71.4	-167.6	-67.3	-75.2	2.5	111.6	M186 P236 G237 H238 F241 S242 R247 G248 A249 E271	M186-R245 WeakPolarHBondContact CE-O 3.27Å; P236-R245 PolarHBondContact O-NH1 3.49Å; P236-R245 VanDerWaalsContact O-NH1 3.14Å; G237-R245 PolarHBondContact O-NH1 2.95Å; H238-R245 PolarHBondContact O-NH1 3.17Å; F241-R245 PolarHBondContact O-N 3.15Å; F241-R245 VanDerWaalsContact O-N 3.16Å; S242-R245 PolarHBondContact O-N 3.01Å; S242-R245 VanDerWaalsContact O-N 3.11Å; R245-R247 VanDerWaalsContact C-N 3.32Å; R245-R247 PolarHBondContact O-N 3.43Å; R245-G248 PolarHBondContact O-N 2.96Å; R245-A249 PolarHBondContact O-N 2.96Å; R245-E271 IonicContact CZ-OE2 3.89Å; R245-E271 IonicContact NH2-OE2 2.85Å; R245-E271 PolarHBondContact NH2-OE2 3.12Å
246	A	91.9	Very high	90.6	Very high	33 Å²	33	17.2 Å²	17.2	27%	0.273	10%	0.104	S	C	.	.	H	α-helix	trans	-58.1	-45.4	175.7	0	0	0	0	0	111.3	S242 A243 G248 A249 Q250	S242-A246 PolarHBondContact O-N 3.27Å; A243-A246 PolarHBondContact O-N 3.47Å; A246-G248 PolarHBondContact O-N 3.23Å; A246-A249 PolarHBondContact O-N 3.45Å; A246-Q250 WeakPolarHBondContact O-CG 3.45Å; A246-Q250 PolarHBondContact O-N 3.09Å; A246-Q250 VanDerWaalsContact O-N 3.16Å
247	R	91.3	Very high	91	Very high	23 Å²	23	17.3 Å²	17.3	9%	0.087	10%	0.104	C	C	.	.	H	α-helix	trans	-60.6	-44.3	174.9	-173	-175.7	-60.4	140.3	7.5	112.2	A243 M244 R245 A249 Q250 V251 I360 A427 E529	A243-R247 PolarHBondContact O-N 3.19Å; M244-R247 PolarHBondContact O-N 2.86Å; R245-R247 VanDerWaalsContact C-N 3.32Å; R245-R247 PolarHBondContact O-N 3.43Å; R247-A249 VanDerWaalsContact C-N 3.35Å; R247-A249 PolarHBondContact O-N 2.9Å; R247-Q250 PolarHBondContact O-N 2.73Å; R247-V251 WeakPolarHBondContact O-CG2 3.28Å; R247-V251 PolarHBondContact O-N 3.49Å; R247-I360 PolarHBondContact NH1-O 2.86Å; R247-A427 VanDerWaalsContact CZ-C 3.42Å; R247-A427 VanDerWaalsContact NE-C 3.27Å; R247-A427 PolarHBondContact NE-O 3.33Å; R247-A427 PolarHBondContact NH2-O 3.26Å; R247-A427 VanDerWaalsContact NH2-O 3.07Å; R247-E529 IonicContact CZ-OE2 2.64Å; R247-E529 IonicContact NH2-OE1 2.86Å; R247-E529 IonicContact NH2-OE2 2.79Å; R247-E529 PolarHBondContact NH2-OE2 3.46Å
248	G	92.1	Very high	91.7	Very high	2 Å²	2	17 Å²	17	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-56.2	-48.2	175.3	0	0	0	0	0	111.8	T184 M244 R245 A246 Q250 V251 T252	T184-G248 PolarHBondContact OG1-O 2.83Å; T184-G248 VanDerWaalsContact OG1-O 3.11Å; M244-G248 PolarHBondContact O-N 3.45Å; R245-G248 PolarHBondContact O-N 2.96Å; A246-G248 PolarHBondContact O-N 3.23Å; G248-Q250 PolarHBondContact O-N 3.28Å; G248-V251 PolarHBondContact O-N 2.86Å; G248-T252 WeakPolarHBondContact O-CG2 3.27Å; G248-T252 PolarHBondContact O-N 2.96Å; G248-T252 PolarHBondContact O-OG1 3.18Å
249	A	93.4	Very high	92.4	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.008	10%	0.097	C	C	.	.	H	α-helix	trans	-58.1	-45.8	178.4	0	0	0	0	0	112.6	M186 R245 A246 R247 V251 T252 H275 A279 V281	M186-A249 HydrophobicContact CE-CB 3.79Å; R245-A249 PolarHBondContact O-N 2.96Å; A246-A249 PolarHBondContact O-N 3.45Å; R247-A249 VanDerWaalsContact C-N 3.35Å; R247-A249 PolarHBondContact O-N 2.9Å; A249-V251 VanDerWaalsContact C-N 3.27Å; A249-V251 PolarHBondContact O-N 3.37Å; A249-T252 PolarHBondContact O-N 2.97Å; A249-T252 PolarHBondContact O-OG1 2.81Å; A249-H275 HydrophobicContact CB-CB 4.28Å; A249-A279 HydrophobicContact CB-CB 3.81Å; A249-V281 WeakPolarHBondContact O-CG2 3.2Å
250	Q	92.1	Very high	93	Very high	135 Å²	135	15.1 Å²	15.1	63%	0.631	9%	0.089	S	C	*	.	H	α-helix	trans	-66.1	-26.9	-176.3	-66.9	-64	-33	0	0	114	A246 R247 G248	A246-Q250 WeakPolarHBondContact O-CG 3.45Å; A246-Q250 PolarHBondContact O-N 3.09Å; A246-Q250 VanDerWaalsContact O-N 3.16Å; R247-Q250 PolarHBondContact O-N 2.73Å; G248-Q250 PolarHBondContact O-N 3.28Å
251	V	93.1	Very high	93.7	Very high	8 Å²	8	14.7 Å²	14.7	5%	0.048	9%	0.085	C	C	.	.	H	α-helix	trans	-88.8	-16.8	-175.8	175.7	0	0	0	0	112.2	L233 R247 G248 A249 T358 I375 Q377	L233-V251 HydrophobicContact CD1-CB 4.48Å; L233-V251 HydrophobicContact CD1-CG1 4.28Å; R247-V251 WeakPolarHBondContact O-CG2 3.28Å; R247-V251 PolarHBondContact O-N 3.49Å; G248-V251 PolarHBondContact O-N 2.86Å; A249-V251 VanDerWaalsContact C-N 3.27Å; A249-V251 PolarHBondContact O-N 3.37Å; V251-T358 HydrophobicContact CG2-CG2 3.71Å; V251-I375 HydrophobicContact CG1-CB 4.34Å; V251-I375 HydrophobicContact CG1-CD1 3.45Å; V251-I375 VanDerWaalsContact CG1-CD1 3.45Å; V251-I375 HydrophobicContact CG1-CG1 4.16Å; V251-Q377 PolarHBondContact O-NE2 3.16Å
252	T	95.1	Very high	94	Very high	8 Å²	8	16 Å²	16	5%	0.049	9%	0.092	C	C	.	.			trans	-105.5	152.9	-168.3	53.6	0	0	0	0	115.7	I182 T184 L233 G248 A249 V281	I182-T252 HydrophobicContact CB-CG2 4.19Å; I182-T252 HydrophobicContact CG2-CG2 3.59Å; I182-T252 WeakPolarHBondContact O-CB 3.38Å; T184-T252 WeakPolarHBondContact OG1-CB 3.25Å; T184-T252 WeakPolarHBondContact OG1-CG2 3.39Å; T184-T252 PolarHBondContact OG1-OG1 2.82Å; T184-T252 VanDerWaalsContact OG1-OG1 3.06Å; L233-T252 HydrophobicContact CD1-CG2 3.5Å; L233-T252 HydrophobicContact CG-CG2 4.1Å; G248-T252 WeakPolarHBondContact O-CG2 3.27Å; G248-T252 PolarHBondContact O-N 2.96Å; G248-T252 PolarHBondContact O-OG1 3.18Å; A249-T252 PolarHBondContact O-N 2.97Å; A249-T252 PolarHBondContact O-OG1 2.81Å; T252-V281 WeakPolarHBondContact O-CG2 3.38Å
253	D	95.9	Very high	94.2	Very high	23 Å²	23	16.7 Å²	16.7	12%	0.123	9%	0.093	C	C	.	.	S	Bend	trans	-87.6	-30.7	179.5	-54.4	-51.4	0	0	0	111.6	R179 I182 V281 P282 L347	R179-D253 IonicContact CZ-OD1 2.66Å; R179-D253 IonicContact CZ-OD2 3.48Å; R179-D253 IonicContact NH1-OD1 3.34Å; R179-D253 PolarHBondContact NH1-OD1 2.9Å; R179-D253 IonicContact NH1-OD2 3.86Å; R179-D253 PolarHBondContact NH1-OD2 3.23Å; R179-D253 IonicContact NH2-OD1 3.44Å; R179-D253 PolarHBondContact NH2-OD1 3.46Å; R179-D253 IonicContact NH2-OD2 3.5Å; R179-D253 PolarHBondContact NH2-OD2 3.45Å; I182-D253 PolarHBondContact N-OD2 2.81Å; I182-D253 PolarHBondContact O-N 2.84Å; D253-V281 VanDerWaalsContact C-CG1 3.49Å; D253-V281 WeakPolarHBondContact O-CG1 3.42Å; D253-P282 WeakPolarHBondContact O-CD 3.28Å; D253-P282 WeakPolarHBondContact O-CG 3.42Å; D253-L347 HydrophobicContact CB-CD1 3.83Å; D253-L347 HydrophobicContact CB-CD2 4.05Å
254	I	96.4	Very high	94.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	141	-177.6	-58.1	170.2	0	0	0	108.6	P181 I182 V183 T184 P282 V284 T338 L341 A342 L345	P181-I254 HydrophobicContact CB-CD1 4.43Å; I182-I254 PolarHBondContact O-N 3.2Å; V183-I254 VanDerWaalsContact CA-O 3.27Å; V183-I254 WeakPolarHBondContact CA-O 3.42Å; V183-I254 HydrophobicContact CG2-CB 4.33Å; T184-I254 PolarHBondContact N-O 3.46Å; I254-P282 HydrophobicContact CG1-CG 4.49Å; I254-V284 HydrophobicContact CG2-CG2 3.88Å; I254-T338 HydrophobicContact CD1-CG2 4.05Å; I254-T338 WeakPolarHBondContact CD1-O 3.48Å; I254-T338 HydrophobicContact CG2-CG2 4.47Å; I254-L341 HydrophobicContact CD1-CB 4.13Å; I254-L341 HydrophobicContact CD1-CD2 4.02Å; I254-L341 HydrophobicContact CD1-CG 4Å; I254-L341 HydrophobicContact CG1-CD2 4.01Å; I254-L341 HydrophobicContact CG1-CG 4.31Å; I254-L341 HydrophobicContact CG2-CD2 3.75Å; I254-A342 HydrophobicContact CD1-CB 3.97Å; I254-L345 HydrophobicContact CD1-CD1 4.32Å; I254-L345 HydrophobicContact CG1-CD1 3.94Å
255	V	96.9	Very high	94.6	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.006	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.6	171	174.4	0	0	0	0	109.9	T184 M186 A276 V281 P282 I283 V284	T184-V255 CarbonylContact O-C 3.59Å; T184-V255 WeakPolarHBondContact O-CA 3.34Å; M186-V255 HydrophobicContact CB-CG1 4.07Å; M186-V255 HydrophobicContact CE-CG2 4.47Å; M186-V255 HydrophobicContact CG-CG1 3.84Å; M186-V255 HydrophobicContact SD-CG1 3.96Å; V255-A276 HydrophobicContact CB-CB 4.39Å; V255-A276 HydrophobicContact CG1-CB 4.48Å; V255-A276 HydrophobicContact CG2-CB 4.21Å; V255-V281 HydrophobicContact CG2-CB 4.29Å; V255-V281 HydrophobicContact CG2-CG1 3.84Å; V255-P282 PolarHBondContact N-O 3.31Å; V255-I283 CarbonylContact O-C 3.53Å; V255-I283 WeakPolarHBondContact O-CA 3.18Å; V255-V284 PolarHBondContact O-N 2.85Å
256	I	96.8	Very high	94.7	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	112.5	166.5	-63.9	175.1	0	0	0	108.2	V183 T184 I185 M186 F232 V258 V284 A286 L334	V183-I256 HydrophobicContact CG1-CB 4.47Å; V183-I256 HydrophobicContact CG1-CD1 3.57Å; V183-I256 HydrophobicContact CG1-CG1 3.59Å; T184-I256 PolarHBondContact O-N 2.77Å; I185-I256 WeakPolarHBondContact CA-O 3.42Å; I185-I256 HydrophobicContact CG1-CB 4.38Å; M186-I256 PolarHBondContact N-O 2.87Å; F232-I256 HydrophobicContact CE1-CD1 3.88Å; I256-V258 HydrophobicContact CG2-CG2 4.1Å; I256-V284 CarbonylContact C-O 3.59Å; I256-V284 WeakPolarHBondContact CA-O 3.3Å; I256-V284 HydrophobicContact CG1-CB 4.39Å; I256-A286 HydrophobicContact CG2-CB 3.77Å; I256-L334 HydrophobicContact CD1-CD2 4.44Å; I256-L334 HydrophobicContact CD1-CG 4.45Å; I256-L334 HydrophobicContact CG2-CD1 4.43Å; I256-L334 HydrophobicContact CG2-CD2 4.44Å
257	L	96.7	Very high	94.6	Very high	2 Å²	2	25 Å²	25	1%	0.01	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	112.3	175	-175.2	67.4	0	0	0	109.7	V259 T269 I273 I283 V284 L285 A286 L304	L257-V259 HydrophobicContact CD2-CG2 4.25Å; L257-V259 HydrophobicContact CG-CG2 4.02Å; L257-T269 HydrophobicContact CD1-CG2 3.99Å; L257-T269 HydrophobicContact CD2-CG2 4.11Å; L257-T269 HydrophobicContact CG-CG2 4.27Å; L257-I273 HydrophobicContact CD1-CG1 4.47Å; L257-I273 HydrophobicContact CD2-CD1 4Å; L257-I273 HydrophobicContact CD2-CG1 3.62Å; L257-I283 HydrophobicContact CB-CG2 3.7Å; L257-I283 HydrophobicContact CD2-CG2 4.47Å; L257-V284 PolarHBondContact N-O 2.84Å; L257-L285 HydrophobicContact CD2-CD1 4.26Å; L257-L285 HydrophobicContact CG-CD1 4.46Å; L257-A286 PolarHBondContact O-N 3.48Å; L257-L304 HydrophobicContact CD2-CD2 4.36Å
258	V	96.3	Very high	94.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115.8	179.9	-172.8	0	0	0	0	110.1	I185 M186 H191 K193 L196 I256 A286 N288	I185-V258 HydrophobicContact CG2-CG2 3.41Å; I185-V258 VanDerWaalsContact CG2-CG2 3.41Å; M186-V258 PolarHBondContact O-N 2.86Å; H191-V258 HydrophobicContact CB-CG1 4.23Å; H191-V258 PolarHBondContact ND1-O 2.9Å; H191-V258 VanDerWaalsContact ND1-O 3.12Å; H191-V258 VanDerWaalsContact O-CG1 3.31Å; H191-V258 WeakPolarHBondContact O-CG1 3.41Å; K193-V258 HydrophobicContact CG-CB 4.15Å; K193-V258 HydrophobicContact CG-CG2 4.28Å; L196-V258 HydrophobicContact CD1-CG2 4.2Å; I256-V258 HydrophobicContact CG2-CG2 4.1Å; V258-A286 WeakPolarHBondContact CA-O 3.3Å; V258-A286 HydrophobicContact CG2-CB 4.35Å; V258-N288 HydrophobicContact CG1-CB 3.85Å
259	V	96.6	Very high	94.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126	178.3	-171.3	0	0	0	0	109.2	H191 L257 G264 T269 L285 A286 I287 N288 V300	H191-V259 WeakPolarHBondContact ND1-CA 3.16Å; L257-V259 HydrophobicContact CD2-CG2 4.25Å; L257-V259 HydrophobicContact CG-CG2 4.02Å; V259-G264 VanDerWaalsContact CG1-O 3.23Å; V259-G264 WeakPolarHBondContact CG1-O 3.42Å; V259-T269 HydrophobicContact CG2-CG2 3.68Å; V259-L285 HydrophobicContact CB-CD1 4.35Å; V259-L285 HydrophobicContact CG2-CD1 3.79Å; V259-A286 PolarHBondContact N-O 3.41Å; V259-I287 CarbonylContact O-C 3.55Å; V259-I287 VanDerWaalsContact O-CA 3.29Å; V259-I287 WeakPolarHBondContact O-CA 3.44Å; V259-N288 PolarHBondContact O-N 3.14Å; V259-V300 HydrophobicContact CB-CG1 3.92Å; V259-V300 HydrophobicContact CG1-CG1 3.59Å; V259-V300 HydrophobicContact CG1-CG2 4.38Å
260	A	96.2	Very high	94.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	136.9	178.6	0	0	0	0	0	110.8	H191 D262 D263 G264 K289	H191-A260 HydrophobicContact CB-CB 4.33Å; H191-A260 PolarHBondContact ND1-N 3.1Å; A260-D262 VanDerWaalsContact C-N 3.28Å; A260-D262 WeakPolarHBondContact CB-OD1 3.3Å; A260-D262 PolarHBondContact O-N 2.83Å; A260-D263 HydrophobicContact CB-CB 4.25Å; A260-D263 PolarHBondContact O-N 2.76Å; A260-G264 PolarHBondContact O-N 2.62Å; A260-K289 HydrophobicContact CB-CD 3.9Å; A260-K289 HydrophobicContact CB-CG 4.16Å
261	A	95.9	Very high	94.8	Very high	3 Å²	3	22.3 Å²	22.3	3%	0.025	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-21.5	-176.3	0	0	0	0	0	114	I287 N288 A295 D296	A261-I287 HydrophobicContact CB-CG2 3.8Å; A261-N288 VanDerWaalsContact CB-O 3.3Å; A261-N288 WeakPolarHBondContact CB-O 3.29Å; A261-N288 PolarHBondContact N-O 3.44Å; A261-A295 HydrophobicContact CB-CB 3.69Å; A261-D296 PolarHBondContact O-N 2.93Å; A261-D296 VanDerWaalsContact O-N 3.07Å
262	D	94.3	Very high	94.8	Very high	28 Å²	28	21.9 Å²	21.9	15%	0.15	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-42.4	175.4	53	-16.6	0	0	0	112	A260 K289 K292	A260-D262 VanDerWaalsContact C-N 3.28Å; A260-D262 WeakPolarHBondContact CB-OD1 3.3Å; A260-D262 PolarHBondContact O-N 2.83Å; D262-K289 WeakPolarHBondContact OD1-CD 3.31Å; D262-K289 IonicContact OD1-NZ 2.64Å; D262-K289 PolarHBondContact OD1-NZ 2.99Å; D262-K289 WeakPolarHBondContact OD2-CD 3.41Å; D262-K289 IonicContact OD2-NZ 2.87Å; D262-K289 PolarHBondContact OD2-NZ 2.85Å; D262-K292 HydrophobicContact CB-CD 4.32Å; D262-K292 WeakPolarHBondContact OD2-CD 3.05Å; D262-K292 WeakPolarHBondContact OD2-CE 3.49Å; D262-K292 IonicContact OD2-NZ 3.66Å; D262-K292 PolarHBondContact OD2-NZ 2.95Å
263	D	93.9	Very high	94.8	Very high	55 Å²	55	21.8 Å²	21.8	29%	0.294	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-48.5	-174.7	-62.4	-41.5	0	0	0	112.5	H191 A260 M266 K289	H191-D263 IonicContact CD2-OD2 2.64Å; H191-D263 IonicContact NE2-OD2 2.74Å; A260-D263 HydrophobicContact CB-CB 4.25Å; A260-D263 PolarHBondContact O-N 2.76Å; D263-M266 HydrophobicContact CB-CE 3.93Å; D263-K289 IonicContact OD2-NZ 3.45Å; D263-K289 PolarHBondContact OD2-NZ 2.64Å
264	G	94.3	Very high	94.8	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.01	12%	0.124	C	C	.	.			trans	88.3	-158.6	-172.8	0	0	0	0	0	114.4	V259 A260 M266 E303	V259-G264 VanDerWaalsContact CG1-O 3.23Å; V259-G264 WeakPolarHBondContact CG1-O 3.42Å; A260-G264 PolarHBondContact O-N 2.62Å; G264-M266 PolarHBondContact O-N 3.35Å; G264-E303 WeakPolarHBondContact CA-OE2 3.4Å
265	V	95.1	Very high	94.7	Very high	21 Å²	21	26.7 Å²	26.7	13%	0.127	13%	0.131	C	C	.	.	S	Bend	trans	-79.6	116.5	-177.8	-177.5	0	0	0	0	110.3	T269 V270 E303 L304 Y307	V265-T269 HydrophobicContact CG1-CG2 4.11Å; V265-V270 HydrophobicContact CG1-CG2 3.94Å; V265-E303 HydrophobicContact CB-CB 4.2Å; V265-E303 HydrophobicContact CG2-CB 3.7Å; V265-E303 PolarHBondContact N-OE2 3.39Å; V265-L304 HydrophobicContact CG2-CD2 3.63Å; V265-L304 HydrophobicContact CG2-CG 3.76Å; V265-Y307 HydrophobicContact CB-CE2 4.37Å; V265-Y307 HydrophobicContact CG1-CD2 3.97Å; V265-Y307 HydrophobicContact CG1-CE2 3.63Å
266	M	93.8	Very high	94.6	Very high	69 Å²	69	26.7 Å²	26.7	34%	0.34	13%	0.131	S	C	.	.			trans	-109.9	169.2	-180	-67.3	-65.9	-179.7	0	0	112	H188 D263 G264 Q268 T269 V270	H188-M266 HydrophobicContact CB-CB 4.17Å; D263-M266 HydrophobicContact CB-CE 3.93Å; G264-M266 PolarHBondContact O-N 3.35Å; M266-Q268 VanDerWaalsContact C-N 3.32Å; M266-Q268 PolarHBondContact O-N 3.31Å; M266-T269 WeakPolarHBondContact O-CA 3.28Å; M266-T269 VanDerWaalsContact O-CB 3.23Å; M266-T269 WeakPolarHBondContact O-CB 3.18Å; M266-T269 PolarHBondContact O-N 3.3Å; M266-V270 PolarHBondContact O-N 3.09Å; M266-V270 VanDerWaalsContact O-N 3.08Å
267	K	90.9	Very high	94.4	Very high	144 Å²	144	30.4 Å²	30.4	63%	0.626	15%	0.147	S	C	*	.	H	α-helix	trans	-50.1	-46.9	-178.4	-175	-177.2	173.7	-171.7	0	113.3	T269 V270 E271	K267-T269 VanDerWaalsContact C-N 3.32Å; K267-T269 PolarHBondContact O-N 3.45Å; K267-V270 WeakPolarHBondContact O-CB 3.47Å; K267-V270 PolarHBondContact O-N 3.21Å; K267-E271 PolarHBondContact O-N 2.84Å
268	Q	91.3	Very high	94.3	Very high	16 Å²	16	35.3 Å²	35.3	8%	0.075	17%	0.174	C	C	.	.	H	α-helix	trans	-69.9	-29.1	179.7	-66	165	-6.9	0	0	112.6	H188 G237 M266 V270 E271 S272	H188-Q268 HydrophobicContact CB-CB 4.27Å; H188-Q268 PolarHBondContact CE1-OE1 2.95Å; H188-Q268 VanDerWaalsContact ND1-CD 3.27Å; H188-Q268 PolarHBondContact ND1-OE1 2.84Å; G237-Q268 PolarHBondContact O-NE2 3.05Å; G237-Q268 PolarHBondContact O-OE1 3.49Å; M266-Q268 VanDerWaalsContact C-N 3.32Å; M266-Q268 PolarHBondContact O-N 3.31Å; Q268-V270 VanDerWaalsContact C-N 3.32Å; Q268-E271 PolarHBondContact O-N 3.31Å; Q268-S272 PolarHBondContact O-N 3.46Å; Q268-S272 PolarHBondContact O-OG 2.88Å; Q268-S272 VanDerWaalsContact O-OG 3.11Å
269	T	93.9	Very high	94.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.4	-42.4	171.3	-53.3	0	0	0	0	110.2	L257 V259 V265 M266 K267 S272 I273	L257-T269 HydrophobicContact CD1-CG2 3.99Å; L257-T269 HydrophobicContact CD2-CG2 4.11Å; L257-T269 HydrophobicContact CG-CG2 4.27Å; V259-T269 HydrophobicContact CG2-CG2 3.68Å; V265-T269 HydrophobicContact CG1-CG2 4.11Å; M266-T269 WeakPolarHBondContact O-CA 3.28Å; M266-T269 VanDerWaalsContact O-CB 3.23Å; M266-T269 WeakPolarHBondContact O-CB 3.18Å; M266-T269 PolarHBondContact O-N 3.3Å; K267-T269 VanDerWaalsContact C-N 3.32Å; K267-T269 PolarHBondContact O-N 3.45Å; T269-S272 WeakPolarHBondContact O-CB 3.25Å; T269-S272 PolarHBondContact O-N 3.27Å; T269-I273 HydrophobicContact CG2-CD1 4.29Å; T269-I273 VanDerWaalsContact O-CG1 3.31Å; T269-I273 WeakPolarHBondContact O-CG1 3.46Å; T269-I273 PolarHBondContact O-N 3.12Å
270	V	94.3	Very high	94.2	Very high	42 Å²	42	44.8 Å²	44.8	26%	0.255	22%	0.222	S	C	.	.	H	α-helix	trans	-62.6	-43.9	175.9	-178.2	0	0	0	0	111	V265 M266 K267 Q268 S272 I273 Q274 Y307	V265-V270 HydrophobicContact CG1-CG2 3.94Å; M266-V270 PolarHBondContact O-N 3.09Å; M266-V270 VanDerWaalsContact O-N 3.08Å; K267-V270 WeakPolarHBondContact O-CB 3.47Å; K267-V270 PolarHBondContact O-N 3.21Å; Q268-V270 VanDerWaalsContact C-N 3.32Å; V270-S272 VanDerWaalsContact C-N 3.34Å; V270-S272 PolarHBondContact O-N 3.09Å; V270-I273 PolarHBondContact O-N 3.29Å; V270-Q274 PolarHBondContact O-N 3.09Å; V270-Y307 HydrophobicContact CB-CE1 4.3Å; V270-Y307 HydrophobicContact CG1-CD1 3.95Å; V270-Y307 HydrophobicContact CG1-CE1 3.76Å; V270-Y307 HydrophobicContact CG2-CD1 4.04Å; V270-Y307 HydrophobicContact CG2-CE1 3.48Å; V270-Y307 VanDerWaalsContact CG2-CE1 3.48Å; V270-Y307 HydrophobicContact CG2-CE2 4.09Å; V270-Y307 VanDerWaalsContact CG2-CZ 3.5Å
271	E	92.3	Very high	94.2	Very high	46 Å²	46	45.7 Å²	45.7	22%	0.215	23%	0.227	C	C	.	.	H	α-helix	trans	-59.8	-42.8	173.9	-69.2	173	-163.2	0	0	112	R245 K267 Q268 I273 Q274 H275	R245-E271 IonicContact CZ-OE2 3.89Å; R245-E271 IonicContact NH2-OE2 2.85Å; R245-E271 PolarHBondContact NH2-OE2 3.12Å; K267-E271 PolarHBondContact O-N 2.84Å; Q268-E271 PolarHBondContact O-N 3.31Å; E271-I273 VanDerWaalsContact C-N 3.35Å; E271-I273 PolarHBondContact O-N 2.81Å; E271-Q274 PolarHBondContact O-N 3.16Å; E271-H275 PolarHBondContact O-CD2 3.37Å; E271-H275 PolarHBondContact O-N 3.19Å
272	S	94.6	Very high	94.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.5	-39.7	175.7	-66.6	0	0	0	0	112.8	Q268 T269 V270 Q274 H275 A276	Q268-S272 PolarHBondContact O-N 3.46Å; Q268-S272 PolarHBondContact O-OG 2.88Å; Q268-S272 VanDerWaalsContact O-OG 3.11Å; T269-S272 WeakPolarHBondContact O-CB 3.25Å; T269-S272 PolarHBondContact O-N 3.27Å; V270-S272 VanDerWaalsContact C-N 3.34Å; V270-S272 PolarHBondContact O-N 3.09Å; S272-Q274 VanDerWaalsContact C-N 3.32Å; S272-H275 PolarHBondContact O-N 3.18Å; S272-A276 PolarHBondContact O-N 3.48Å; S272-A276 VanDerWaalsContact O-N 3.1Å
273	I	94.6	Very high	94.2	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.026	24%	0.237	C	C	.	.	H	α-helix	trans	-62	-43.5	174.1	-68.1	163.4	0	0	0	110	L257 T269 V270 E271 A276 K277 L304 V309	L257-I273 HydrophobicContact CD1-CG1 4.47Å; L257-I273 HydrophobicContact CD2-CD1 4Å; L257-I273 HydrophobicContact CD2-CG1 3.62Å; T269-I273 HydrophobicContact CG2-CD1 4.29Å; T269-I273 VanDerWaalsContact O-CG1 3.31Å; T269-I273 WeakPolarHBondContact O-CG1 3.46Å; T269-I273 PolarHBondContact O-N 3.12Å; V270-I273 PolarHBondContact O-N 3.29Å; E271-I273 VanDerWaalsContact C-N 3.35Å; E271-I273 PolarHBondContact O-N 2.81Å; I273-A276 PolarHBondContact O-N 2.83Å; I273-K277 HydrophobicContact CG2-CD 4.08Å; I273-K277 HydrophobicContact CG2-CG 4.4Å; I273-K277 WeakPolarHBondContact O-CB 3.49Å; I273-K277 WeakPolarHBondContact O-CG 3.48Å; I273-K277 PolarHBondContact O-N 3.22Å; I273-L304 HydrophobicContact CD1-CD2 3.81Å; I273-V309 HydrophobicContact CD1-CG2 4.1Å; I273-V309 HydrophobicContact CG1-CG2 4.26Å; I273-V309 HydrophobicContact CG2-CG2 3.75Å
274	Q	94.9	Very high	94.3	Very high	94 Å²	94	44.7 Å²	44.7	44%	0.439	22%	0.223	S	C	.	.	H	α-helix	trans	-62.8	-47.6	179.4	-170.5	60	37.8	0	0	111.5	V270 E271 S272 A276 K277 D278	V270-Q274 PolarHBondContact O-N 3.09Å; E271-Q274 PolarHBondContact O-N 3.16Å; S272-Q274 VanDerWaalsContact C-N 3.32Å; Q274-A276 VanDerWaalsContact C-N 3.32Å; Q274-A276 PolarHBondContact O-N 2.82Å; Q274-K277 PolarHBondContact O-N 2.68Å; Q274-D278 WeakPolarHBondContact CG-OD2 3.45Å; Q274-D278 VanDerWaalsContact NE2-CG 3.28Å; Q274-D278 PolarHBondContact NE2-OD1 3.13Å; Q274-D278 PolarHBondContact NE2-OD2 3.46Å; Q274-D278 VanDerWaalsContact NE2-OD2 3.11Å; Q274-D278 WeakPolarHBondContact O-CB 3.47Å; Q274-D278 VanDerWaalsContact O-CG 3.24Å; Q274-D278 PolarHBondContact O-N 3.08Å
275	H	94.7	Very high	94.5	Very high	33 Å²	33	44.6 Å²	44.6	15%	0.153	22%	0.223	C	C	.	.	H	α-helix	trans	-58.5	-41.8	177	-72.8	-52.8	0	0	0	112.7	S242 A249 E271 S272 A279	S242-H275 PolarHBondContact OG-NE2 3.41Å; S242-H275 VanDerWaalsContact OG-NE2 3.12Å; A249-H275 HydrophobicContact CB-CB 4.28Å; E271-H275 PolarHBondContact O-CD2 3.37Å; E271-H275 PolarHBondContact O-N 3.19Å; S272-H275 PolarHBondContact O-N 3.18Å; H275-A279 VanDerWaalsContact O-CB 3.28Å; H275-A279 WeakPolarHBondContact O-CB 3.27Å; H275-A279 PolarHBondContact O-N 3.34Å
276	A	94.6	Very high	94.6	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-67.7	-40.9	177.3	0	0	0	0	0	112.3	V255 S272 I273 Q274 A279 Q280 V281 I283	V255-A276 HydrophobicContact CB-CB 4.39Å; V255-A276 HydrophobicContact CG1-CB 4.48Å; V255-A276 HydrophobicContact CG2-CB 4.21Å; S272-A276 PolarHBondContact O-N 3.48Å; S272-A276 VanDerWaalsContact O-N 3.1Å; I273-A276 PolarHBondContact O-N 2.83Å; Q274-A276 VanDerWaalsContact C-N 3.32Å; Q274-A276 PolarHBondContact O-N 2.82Å; A276-A279 PolarHBondContact O-N 3.26Å; A276-Q280 PolarHBondContact O-N 2.94Å; A276-Q280 VanDerWaalsContact O-N 3.08Å; A276-V281 PolarHBondContact O-N 2.79Å; A276-I283 HydrophobicContact CB-CD1 3.7Å; A276-I283 HydrophobicContact CB-CG1 3.85Å
277	K	93.9	Very high	94.7	Very high	79 Å²	79	40.3 Å²	40.3	34%	0.343	20%	0.2	S	C	.	.	H	α-helix	trans	-65.4	-44.5	175.7	-76.1	-176.8	-178.9	-178.3	0	112.3	I273 Q274 A279 Q280 Y307	I273-K277 HydrophobicContact CG2-CD 4.08Å; I273-K277 HydrophobicContact CG2-CG 4.4Å; I273-K277 WeakPolarHBondContact O-CB 3.49Å; I273-K277 WeakPolarHBondContact O-CG 3.48Å; I273-K277 PolarHBondContact O-N 3.22Å; Q274-K277 PolarHBondContact O-N 2.68Å; K277-A279 VanDerWaalsContact C-N 3.28Å; K277-A279 PolarHBondContact O-N 2.81Å; K277-Q280 PolarHBondContact O-N 2.86Å; K277-Y307 PolarHBondContact NZ-O 3.32Å
278	D	94.9	Very high	94.9	Very high	105 Å²	105	33.7 Å²	33.7	56%	0.561	17%	0.172	S	C	*	.	H	α-helix	trans	-65.2	-34.4	179.2	-69.5	-22	0	0	0	111.6	Q274 Q280	Q274-D278 WeakPolarHBondContact CG-OD2 3.45Å; Q274-D278 VanDerWaalsContact NE2-CG 3.28Å; Q274-D278 PolarHBondContact NE2-OD1 3.13Å; Q274-D278 PolarHBondContact NE2-OD2 3.46Å; Q274-D278 VanDerWaalsContact NE2-OD2 3.11Å; Q274-D278 WeakPolarHBondContact O-CB 3.47Å; Q274-D278 VanDerWaalsContact O-CG 3.24Å; Q274-D278 PolarHBondContact O-N 3.08Å; D278-Q280 VanDerWaalsContact C-N 3.29Å
279	A	94.6	Very high	95.1	Very high	21 Å²	21	34.4 Å²	34.4	17%	0.174	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-5.3	172.8	0	0	0	0	0	113.9	A249 H275 A276 K277 V281	A249-A279 HydrophobicContact CB-CB 3.81Å; H275-A279 VanDerWaalsContact O-CB 3.28Å; H275-A279 WeakPolarHBondContact O-CB 3.27Å; H275-A279 PolarHBondContact O-N 3.34Å; A276-A279 PolarHBondContact O-N 3.26Å; K277-A279 VanDerWaalsContact C-N 3.28Å; K277-A279 PolarHBondContact O-N 2.81Å; A279-V281 VanDerWaalsContact C-N 3.26Å; A279-V281 HydrophobicContact CB-CG2 3.75Å; A279-V281 PolarHBondContact O-N 3.39Å
280	Q	95.2	Very high	95	Very high	178 Å²	178	36.5 Å²	36.5	83%	0.832	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.2	36.4	-176	-56.4	-177.2	-19.4	0	0	113.7	A276 K277 D278	A276-Q280 PolarHBondContact O-N 2.94Å; A276-Q280 VanDerWaalsContact O-N 3.08Å; K277-Q280 PolarHBondContact O-N 2.86Å; D278-Q280 VanDerWaalsContact C-N 3.29Å
281	V	95.7	Very high	95	Very high	18 Å²	18	37.9 Å²	37.9	11%	0.109	19%	0.194	C	C	.	.			trans	-99.5	131.5	-177.6	-175.7	0	0	0	0	110.1	A249 T252 D253 V255 A276 A279	A249-V281 WeakPolarHBondContact O-CG2 3.2Å; T252-V281 WeakPolarHBondContact O-CG2 3.38Å; D253-V281 VanDerWaalsContact C-CG1 3.49Å; D253-V281 WeakPolarHBondContact O-CG1 3.42Å; V255-V281 HydrophobicContact CG2-CB 4.29Å; V255-V281 HydrophobicContact CG2-CG1 3.84Å; A276-V281 PolarHBondContact O-N 2.79Å; A279-V281 VanDerWaalsContact C-N 3.26Å; A279-V281 HydrophobicContact CB-CG2 3.75Å; A279-V281 PolarHBondContact O-N 3.39Å
282	P	95.9	Very high	95	Very high	44 Å²	44	40.4 Å²	40.4	29%	0.286	21%	0.205	S	C	.	.			trans	-66.3	146.2	177.9	28	-35.7	0	0	0	112	D253 I254 V255 L341 L345	D253-P282 WeakPolarHBondContact O-CD 3.28Å; D253-P282 WeakPolarHBondContact O-CG 3.42Å; I254-P282 HydrophobicContact CG1-CG 4.49Å; V255-P282 PolarHBondContact N-O 3.31Å; P282-L341 HydrophobicContact CB-CD1 4.46Å; P282-L341 HydrophobicContact CB-CD2 4.11Å; P282-L341 HydrophobicContact CG-CD2 4.3Å; P282-L345 HydrophobicContact CG-CD1 3.8Å; P282-L345 HydrophobicContact CG-CD2 4.27Å
283	I	95.5	Very high	94.8	Very high	21 Å²	21	45.8 Å²	45.8	11%	0.108	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	134.8	-172.9	-56.3	174.5	0	0	0	110.2	V255 L257 A276	V255-I283 CarbonylContact O-C 3.53Å; V255-I283 WeakPolarHBondContact O-CA 3.18Å; L257-I283 HydrophobicContact CB-CG2 3.7Å; L257-I283 HydrophobicContact CD2-CG2 4.47Å; A276-I283 HydrophobicContact CB-CD1 3.7Å; A276-I283 HydrophobicContact CB-CG1 3.85Å
284	V	96.4	Very high	94.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.7	165.1	179.4	0	0	0	0	108.2	I254 V255 I256 L257 L334 L341	I254-V284 HydrophobicContact CG2-CG2 3.88Å; V255-V284 PolarHBondContact O-N 2.85Å; I256-V284 CarbonylContact C-O 3.59Å; I256-V284 WeakPolarHBondContact CA-O 3.3Å; I256-V284 HydrophobicContact CG1-CB 4.39Å; L257-V284 PolarHBondContact N-O 2.84Å; V284-L334 HydrophobicContact CG1-CD1 3.81Å; V284-L341 HydrophobicContact CG2-CD2 3.51Å
285	L	96.8	Very high	94.7	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	120	-179.2	176.6	69.6	0	0	0	110.5	L257 V259 I287 L304 V318 Q319 A320 V321	L257-L285 HydrophobicContact CD2-CD1 4.26Å; L257-L285 HydrophobicContact CG-CD1 4.46Å; V259-L285 HydrophobicContact CB-CD1 4.35Å; V259-L285 HydrophobicContact CG2-CD1 3.79Å; L285-I287 HydrophobicContact CD2-CD1 4.06Å; L285-I287 HydrophobicContact CD2-CG1 3.92Å; L285-I287 HydrophobicContact CG-CG1 3.97Å; L285-L304 HydrophobicContact CD1-CD1 3.51Å; L285-L304 HydrophobicContact CD2-CD1 3.28Å; L285-L304 HydrophobicContact CG-CD1 4.02Å; L285-V318 HydrophobicContact CB-CG1 3.96Å; L285-Q319 PolarHBondContact N-O 2.77Å; L285-A320 HydrophobicContact CB-CB 4.4Å; L285-A320 HydrophobicContact CD2-CB 3.9Å; L285-V321 PolarHBondContact O-N 3.47Å
286	A	96.8	Very high	94.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	107.5	170.9	0	0	0	0	0	110.1	I256 L257 V258 V259 N288 V321 L334	I256-A286 HydrophobicContact CG2-CB 3.77Å; L257-A286 PolarHBondContact O-N 3.48Å; V258-A286 WeakPolarHBondContact CA-O 3.3Å; V258-A286 HydrophobicContact CG2-CB 4.35Å; V259-A286 PolarHBondContact N-O 3.41Å; A286-N288 PolarHBondContact O-N 3.04Å; A286-V321 WeakPolarHBondContact CA-O 3.34Å; A286-L334 HydrophobicContact CB-CD1 4Å; A286-L334 HydrophobicContact CB-CD2 4.02Å
287	I	96.5	Very high	94.7	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	102.4	177.5	-55.7	174.7	0	0	0	108.3	V259 A261 L285 C290 P297 V300 K301 V321 V323	V259-I287 CarbonylContact O-C 3.55Å; V259-I287 VanDerWaalsContact O-CA 3.29Å; V259-I287 WeakPolarHBondContact O-CA 3.44Å; A261-I287 HydrophobicContact CB-CG2 3.8Å; L285-I287 HydrophobicContact CD2-CD1 4.06Å; L285-I287 HydrophobicContact CD2-CG1 3.92Å; L285-I287 HydrophobicContact CG-CG1 3.97Å; I287-C290 PolarHBondContact O-SG 2.61Å; I287-P297 HydrophobicContact CD1-CB 4.01Å; I287-P297 HydrophobicContact CG2-CB 4.11Å; I287-P297 HydrophobicContact CG2-CG 4.45Å; I287-V300 HydrophobicContact CD1-CB 4.38Å; I287-V300 HydrophobicContact CD1-CG1 4.41Å; I287-V300 HydrophobicContact CG1-CG1 4.26Å; I287-V300 HydrophobicContact CG2-CG2 4.29Å; I287-K301 HydrophobicContact CD1-CD 4.45Å; I287-K301 HydrophobicContact CD1-CG 3.95Å; I287-V321 PolarHBondContact N-O 2.76Å; I287-V323 PolarHBondContact O-N 2.91Å; I287-V323 VanDerWaalsContact O-O 3.09Å
288	N	95.4	Very high	94.7	Very high	4 Å²	4	55.7 Å²	55.7	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	171.6	-172.7	-162.3	16.5	0	0	0	113	H191 V258 V259 A261 A286 C290 V323 A325	H191-N288 PolarHBondContact O-ND2 2.86Å; V258-N288 HydrophobicContact CG1-CB 3.85Å; V259-N288 PolarHBondContact O-N 3.14Å; A261-N288 VanDerWaalsContact CB-O 3.3Å; A261-N288 WeakPolarHBondContact CB-O 3.29Å; A261-N288 PolarHBondContact N-O 3.44Å; A286-N288 PolarHBondContact O-N 3.04Å; N288-C290 VanDerWaalsContact C-N 3.31Å; N288-C290 PolarHBondContact O-N 3.11Å; N288-V323 CarbonylContact C-O 3.54Å; N288-V323 WeakPolarHBondContact CA-O 3.25Å; N288-A325 WeakPolarHBondContact OD1-CB 3.36Å; N288-A325 PolarHBondContact OD1-N 2.96Å
289	K	94.9	Very high	94.7	Very high	32 Å²	32	56 Å²	56	14%	0.139	30%	0.3	C	S	.	.			trans	62.1	30.4	179.5	-48.6	-171	-157.9	151	0	114.4	D190 A260 D262 D263 D291 K292 V323	D190-K289 WeakPolarHBondContact O-CE 3.4Å; D190-K289 PolarHBondContact O-NZ 3.1Å; D190-K289 VanDerWaalsContact O-NZ 3.11Å; A260-K289 HydrophobicContact CB-CD 3.9Å; A260-K289 HydrophobicContact CB-CG 4.16Å; D262-K289 WeakPolarHBondContact OD1-CD 3.31Å; D262-K289 IonicContact OD1-NZ 2.64Å; D262-K289 PolarHBondContact OD1-NZ 2.99Å; D262-K289 WeakPolarHBondContact OD2-CD 3.41Å; D262-K289 IonicContact OD2-NZ 2.87Å; D262-K289 PolarHBondContact OD2-NZ 2.85Å; D263-K289 IonicContact OD2-NZ 3.45Å; D263-K289 PolarHBondContact OD2-NZ 2.64Å; K289-D291 WeakPolarHBondContact CA-OD1 3.25Å; K289-D291 PolarHBondContact O-N 3.01Å; K289-D291 VanDerWaalsContact O-N 3.1Å; K289-K292 HydrophobicContact CB-CD 4.38Å; K289-K292 HydrophobicContact CD-CD 4.4Å; K289-K292 PolarHBondContact O-N 3.25Å; K289-K292 VanDerWaalsContact O-N 3.16Å; K289-V323 PolarHBondContact N-O 2.97Å
290	C	93.1	Very high	94.8	Very high	43 Å²	43	55 Å²	55	29%	0.291	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-4.9	176.5	-66.7	0	0	0	0	114.2	I287 N288 V323	I287-C290 PolarHBondContact O-SG 2.61Å; N288-C290 VanDerWaalsContact C-N 3.31Å; N288-C290 PolarHBondContact O-N 3.11Å; C290-V323 PolarHBondContact N-O 3.24Å
291	D	93.4	Very high	94.7	Very high	71 Å²	71	47.9 Å²	47.9	38%	0.38	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-17	171.8	52.8	-72.5	0	0	0	113.8	K289 S324 T327	K289-D291 WeakPolarHBondContact CA-OD1 3.25Å; K289-D291 PolarHBondContact O-N 3.01Å; K289-D291 VanDerWaalsContact O-N 3.1Å; D291-S324 WeakPolarHBondContact CB-OG 3.48Å; D291-S324 VanDerWaalsContact CG-OG 3.24Å; D291-S324 WeakPolarHBondContact OD1-CB 3.41Å; D291-S324 PolarHBondContact OD1-OG 3.04Å; D291-T327 HydrophobicContact CB-CG2 4.18Å
292	K	92.6	Very high	94.7	Very high	99 Å²	99	52.5 Å²	52.5	43%	0.43	28%	0.277	S	S	.	.	S	Bend	trans	-76.5	146.6	178.2	-71	-172.3	174.7	-173.6	0	111.6	D262 K289 E294 A295	D262-K292 HydrophobicContact CB-CD 4.32Å; D262-K292 WeakPolarHBondContact OD2-CD 3.05Å; D262-K292 WeakPolarHBondContact OD2-CE 3.49Å; D262-K292 IonicContact OD2-NZ 3.66Å; D262-K292 PolarHBondContact OD2-NZ 2.95Å; K289-K292 HydrophobicContact CB-CD 4.38Å; K289-K292 HydrophobicContact CD-CD 4.4Å; K289-K292 PolarHBondContact O-N 3.25Å; K289-K292 VanDerWaalsContact O-N 3.16Å; K292-E294 PolarHBondContact O-N 3.01Å; K292-A295 HydrophobicContact CB-CB 4.5Å; K292-A295 WeakPolarHBondContact O-CB 3.34Å; K292-A295 PolarHBondContact O-N 3.44Å
293	A	91.1	Very high	94.6	Very high	114 Å²	114	52.9 Å²	52.9	94%	0.942	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-28.5	177.7	0	0	0	0	0	113.4	A295	A293-A295 VanDerWaalsContact C-N 3.32Å
294	E	93.3	Very high	94.6	Very high	166 Å²	166	51.9 Å²	51.9	78%	0.776	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	5.5	179.2	-62.3	177.5	179.5	0	0	113.1	K292 D296	K292-E294 PolarHBondContact O-N 3.01Å; E294-D296 PolarHBondContact O-N 3.05Å
295	A	93.9	Very high	94.4	Very high	27 Å²	27	54.7 Å²	54.7	22%	0.223	28%	0.284	C	S	.	.			trans	-67.6	121.1	-177.7	0	0	0	0	0	111.5	A261 K292 A293	A261-A295 HydrophobicContact CB-CB 3.69Å; K292-A295 HydrophobicContact CB-CB 4.5Å; K292-A295 WeakPolarHBondContact O-CB 3.34Å; K292-A295 PolarHBondContact O-N 3.44Å; A293-A295 VanDerWaalsContact C-N 3.32Å
296	D	94.5	Very high	94.2	Very high	72 Å²	72	58.5 Å²	58.5	39%	0.385	32%	0.316	S	S	.	.			trans	-125.5	90.6	175.4	-173	-8.5	0	0	0	111.4	A261 E294 E298 R299 V300	A261-D296 PolarHBondContact O-N 2.93Å; A261-D296 VanDerWaalsContact O-N 3.07Å; E294-D296 PolarHBondContact O-N 3.05Å; D296-E298 VanDerWaalsContact C-N 3.27Å; D296-E298 PolarHBondContact O-N 3.49Å; D296-E298 WeakPolarHBondContact OD1-CB 3.04Å; D296-E298 PolarHBondContact OD1-N 2.94Å; D296-R299 HydrophobicContact CB-CB 4.01Å; D296-R299 PolarHBondContact O-N 3.01Å; D296-R299 PolarHBondContact OD1-N 2.96Å; D296-R299 VanDerWaalsContact OD1-N 3.1Å; D296-R299 WeakPolarHBondContact OD2-CB 3.48Å; D296-V300 PolarHBondContact O-N 3.3Å
297	P	94.6	Very high	94.1	Very high	36 Å²	36	63 Å²	63	23%	0.234	33%	0.334	C	S	.	.	H	α-helix	trans	-64.1	-27.7	177	-22.9	34.5	0	0	0	114	I287 K301	I287-P297 HydrophobicContact CD1-CB 4.01Å; I287-P297 HydrophobicContact CG2-CB 4.11Å; I287-P297 HydrophobicContact CG2-CG 4.45Å; P297-K301 WeakPolarHBondContact O-CG 3.42Å; P297-K301 PolarHBondContact O-N 3.42Å
298	E	94	Very high	93.8	Very high	119 Å²	119	69.2 Å²	69.2	56%	0.556	37%	0.367	S	S	*	.	H	α-helix	trans	-70.8	-38.7	-179.9	-67.8	-169.8	-177.6	0	0	111.3	D296 V300 K301 K302	D296-E298 VanDerWaalsContact C-N 3.27Å; D296-E298 PolarHBondContact O-N 3.49Å; D296-E298 WeakPolarHBondContact OD1-CB 3.04Å; D296-E298 PolarHBondContact OD1-N 2.94Å; E298-V300 VanDerWaalsContact C-N 3.34Å; E298-K301 PolarHBondContact O-N 3.36Å; E298-K302 WeakPolarHBondContact O-CG 3.42Å; E298-K302 PolarHBondContact O-N 3.47Å; E298-K302 IonicContact OE2-NZ 2.71Å
299	R	95.1	Very high	93.7	Very high	112 Å²	112	69.3 Å²	69.3	42%	0.423	37%	0.367	S	S	.	.	H	α-helix	trans	-57.9	-47.3	174.4	177.1	179.3	167.6	-149.5	-15.1	111.3	D296 K301 K302 E303	D296-R299 HydrophobicContact CB-CB 4.01Å; D296-R299 PolarHBondContact O-N 3.01Å; D296-R299 PolarHBondContact OD1-N 2.96Å; D296-R299 VanDerWaalsContact OD1-N 3.1Å; D296-R299 WeakPolarHBondContact OD2-CB 3.48Å; R299-K301 VanDerWaalsContact C-N 3.34Å; R299-K301 PolarHBondContact O-N 2.87Å; R299-K302 PolarHBondContact O-N 3.37Å; R299-E303 HydrophobicContact CG-CG 4.47Å; R299-E303 IonicContact CZ-OE1 3.71Å; R299-E303 IonicContact NE-OE1 3.99Å; R299-E303 PolarHBondContact NE-OE1 3.35Å; R299-E303 IonicContact NH2-OE1 3.41Å; R299-E303 PolarHBondContact NH2-OE1 2.82Å; R299-E303 WeakPolarHBondContact O-CG 3.3Å; R299-E303 PolarHBondContact O-N 2.8Å
300	V	95.4	Very high	93.7	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-57.7	-46.9	178	179	0	0	0	0	111.3	V259 I287 D296 E298 K302 E303 L304	V259-V300 HydrophobicContact CB-CG1 3.92Å; V259-V300 HydrophobicContact CG1-CG1 3.59Å; V259-V300 HydrophobicContact CG1-CG2 4.38Å; I287-V300 HydrophobicContact CD1-CB 4.38Å; I287-V300 HydrophobicContact CD1-CG1 4.41Å; I287-V300 HydrophobicContact CG1-CG1 4.26Å; I287-V300 HydrophobicContact CG2-CG2 4.29Å; D296-V300 PolarHBondContact O-N 3.3Å; E298-V300 VanDerWaalsContact C-N 3.34Å; V300-K302 VanDerWaalsContact C-N 3.32Å; V300-K302 PolarHBondContact O-N 2.98Å; V300-E303 PolarHBondContact O-N 2.97Å; V300-L304 HydrophobicContact CG1-CD1 3.99Å; V300-L304 HydrophobicContact CG1-CG 4.48Å; V300-L304 WeakPolarHBondContact O-CG 3.33Å; V300-L304 PolarHBondContact O-N 3.47Å
301	K	94.6	Very high	93.8	Very high	28 Å²	28	68.5 Å²	68.5	12%	0.122	36%	0.364	C	S	.	.	H	α-helix	trans	-61.5	-40.2	178.7	-65.2	174.3	-176.5	-176.4	0	111.9	I287 P297 E298 R299 L304 L305 D313 Y314	I287-K301 HydrophobicContact CD1-CD 4.45Å; I287-K301 HydrophobicContact CD1-CG 3.95Å; P297-K301 WeakPolarHBondContact O-CG 3.42Å; P297-K301 PolarHBondContact O-N 3.42Å; E298-K301 PolarHBondContact O-N 3.36Å; R299-K301 VanDerWaalsContact C-N 3.34Å; R299-K301 PolarHBondContact O-N 2.87Å; K301-L304 PolarHBondContact O-N 2.97Å; K301-L305 PolarHBondContact O-N 3.21Å; K301-D313 WeakPolarHBondContact CE-OD2 3.21Å; K301-D313 IonicContact NZ-OD2 3.45Å; K301-D313 PolarHBondContact NZ-OD2 3.35Å; K301-Y314 HydrophobicContact CB-CE2 3.94Å
302	K	94.2	Very high	93.7	Very high	114 Å²	114	70.8 Å²	70.8	50%	0.496	37%	0.372	S	S	.	.	H	α-helix	trans	-65.8	-42	176.5	-72.2	168.3	-174.7	156.2	0	112.4	E298 R299 V300 L304 L305	E298-K302 WeakPolarHBondContact O-CG 3.42Å; E298-K302 PolarHBondContact O-N 3.47Å; E298-K302 IonicContact OE2-NZ 2.71Å; R299-K302 PolarHBondContact O-N 3.37Å; V300-K302 VanDerWaalsContact C-N 3.32Å; V300-K302 PolarHBondContact O-N 2.98Å; K302-L304 VanDerWaalsContact C-N 3.33Å; K302-L305 WeakPolarHBondContact O-CB 3.37Å; K302-L305 PolarHBondContact O-N 2.98Å
303	E	95	Very high	93.6	Very high	52 Å²	52	71.4 Å²	71.4	24%	0.243	38%	0.38	C	S	.	.	H	α-helix	trans	-64.5	-37.9	177.4	-72.6	176	-177.9	0	0	111.6	G264 V265 R299 V300 L305 A306 Y307	G264-E303 WeakPolarHBondContact CA-OE2 3.4Å; V265-E303 HydrophobicContact CB-CB 4.2Å; V265-E303 HydrophobicContact CG2-CB 3.7Å; V265-E303 PolarHBondContact N-OE2 3.39Å; R299-E303 HydrophobicContact CG-CG 4.47Å; R299-E303 IonicContact CZ-OE1 3.71Å; R299-E303 IonicContact NE-OE1 3.99Å; R299-E303 PolarHBondContact NE-OE1 3.35Å; R299-E303 IonicContact NH2-OE1 3.41Å; R299-E303 PolarHBondContact NH2-OE1 2.82Å; R299-E303 WeakPolarHBondContact O-CG 3.3Å; R299-E303 PolarHBondContact O-N 2.8Å; V300-E303 PolarHBondContact O-N 2.97Å; E303-L305 VanDerWaalsContact C-N 3.31Å; E303-L305 PolarHBondContact O-N 3.35Å; E303-A306 WeakPolarHBondContact O-CB 3.3Å; E303-A306 PolarHBondContact O-N 3.08Å; E303-A306 VanDerWaalsContact O-N 3.15Å; E303-Y307 WeakPolarHBondContact O-CD2 3.45Å
304	L	94.4	Very high	93.6	Very high	0 Å²	0	71 Å²	71	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-27.8	178.1	-74.1	172	0	0	0	114	L257 V265 I273 L285 V300 K301 K302 A306 Y307 V309	L257-L304 HydrophobicContact CD2-CD2 4.36Å; V265-L304 HydrophobicContact CG2-CD2 3.63Å; V265-L304 HydrophobicContact CG2-CG 3.76Å; I273-L304 HydrophobicContact CD1-CD2 3.81Å; L285-L304 HydrophobicContact CD1-CD1 3.51Å; L285-L304 HydrophobicContact CD2-CD1 3.28Å; L285-L304 HydrophobicContact CG-CD1 4.02Å; V300-L304 HydrophobicContact CG1-CD1 3.99Å; V300-L304 HydrophobicContact CG1-CG 4.48Å; V300-L304 WeakPolarHBondContact O-CG 3.33Å; V300-L304 PolarHBondContact O-N 3.47Å; K301-L304 PolarHBondContact O-N 2.97Å; K302-L304 VanDerWaalsContact C-N 3.33Å; L304-A306 PolarHBondContact O-N 3.47Å; L304-Y307 PolarHBondContact O-N 2.78Å; L304-V309 CarbonylContact C-O 3.49Å; L304-V309 HydrophobicContact CB-CB 4.18Å; L304-V309 HydrophobicContact CB-CG1 4.46Å; L304-V309 HydrophobicContact CD2-CB 4.44Å; L304-V309 PolarHBondContact O-N 3.45Å; L304-V309 VanDerWaalsContact O-N 3.13Å
305	L	93.1	Very high	93.5	Very high	60 Å²	60	66.4 Å²	66.4	31%	0.314	35%	0.352	S	S	.	.	H	α-helix	trans	-59.8	-31	172.6	-68.1	173.1	0	0	0	112.1	K301 K302 E303 Y307 D308 V310 Y314	K301-L305 PolarHBondContact O-N 3.21Å; K302-L305 WeakPolarHBondContact O-CB 3.37Å; K302-L305 PolarHBondContact O-N 2.98Å; E303-L305 VanDerWaalsContact C-N 3.31Å; E303-L305 PolarHBondContact O-N 3.35Å; L305-Y307 PolarHBondContact O-N 2.64Å; L305-D308 PolarHBondContact O-N 3.48Å; L305-V310 HydrophobicContact CD2-CB 4.24Å; L305-V310 HydrophobicContact CD2-CG1 3.96Å; L305-V310 HydrophobicContact CD2-CG2 4.14Å; L305-Y314 HydrophobicContact CD1-CD1 4.27Å; L305-Y314 HydrophobicContact CD1-CD2 4.41Å; L305-Y314 HydrophobicContact CD1-CE1 4.29Å; L305-Y314 HydrophobicContact CD1-CE2 4.45Å; L305-Y314 HydrophobicContact CD1-CG 4.32Å
306	A	92.8	Very high	93.4	Very high	80 Å²	80	65.9 Å²	65.9	66%	0.661	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-16.7	177.3	0	0	0	0	0	113.3	E303 L304	E303-A306 WeakPolarHBondContact O-CB 3.3Å; E303-A306 PolarHBondContact O-N 3.08Å; E303-A306 VanDerWaalsContact O-N 3.15Å; L304-A306 PolarHBondContact O-N 3.47Å
307	Y	93.4	Very high	93.2	Very high	95 Å²	95	70.3 Å²	70.3	37%	0.373	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	21.7	179.7	-63	-78.7	0	0	0	112.3	V265 V270 K277 E303 L304 L305 V309	V265-Y307 HydrophobicContact CB-CE2 4.37Å; V265-Y307 HydrophobicContact CG1-CD2 3.97Å; V265-Y307 HydrophobicContact CG1-CE2 3.63Å; V270-Y307 HydrophobicContact CB-CE1 4.3Å; V270-Y307 HydrophobicContact CG1-CD1 3.95Å; V270-Y307 HydrophobicContact CG1-CE1 3.76Å; V270-Y307 HydrophobicContact CG2-CD1 4.04Å; V270-Y307 HydrophobicContact CG2-CE1 3.48Å; V270-Y307 VanDerWaalsContact CG2-CE1 3.48Å; V270-Y307 HydrophobicContact CG2-CE2 4.09Å; V270-Y307 VanDerWaalsContact CG2-CZ 3.5Å; K277-Y307 PolarHBondContact NZ-O 3.32Å; E303-Y307 WeakPolarHBondContact O-CD2 3.45Å; L304-Y307 PolarHBondContact O-N 2.78Å; L305-Y307 PolarHBondContact O-N 2.64Å; Y307-V309 PolarHBondContact O-N 2.98Å
308	D	91.6	Very high	93.2	Very high	130 Å²	130	69.6 Å²	69.6	70%	0.695	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	32.8	-177.2	-48.9	-49.6	0	0	0	113.9	L305	L305-D308 PolarHBondContact O-N 3.48Å
309	V	93.7	Very high	93.3	Very high	5 Å²	5	66 Å²	66	3%	0.03	35%	0.351	C	S	.	.			trans	-107.1	91.9	172.3	-179.3	0	0	0	0	107.5	I273 L304 Y307 V318	I273-V309 HydrophobicContact CD1-CG2 4.1Å; I273-V309 HydrophobicContact CG1-CG2 4.26Å; I273-V309 HydrophobicContact CG2-CG2 3.75Å; L304-V309 CarbonylContact C-O 3.49Å; L304-V309 HydrophobicContact CB-CB 4.18Å; L304-V309 HydrophobicContact CB-CG1 4.46Å; L304-V309 HydrophobicContact CD2-CB 4.44Å; L304-V309 PolarHBondContact O-N 3.45Å; L304-V309 VanDerWaalsContact O-N 3.13Å; Y307-V309 PolarHBondContact O-N 2.98Å; V309-V318 HydrophobicContact CG1-CB 4.35Å; V309-V318 HydrophobicContact CG1-CG1 4.05Å; V309-V318 HydrophobicContact CG1-CG2 3.95Å
310	V	95.1	Very high	93.3	Very high	58 Å²	58	61.7 Å²	61.7	35%	0.352	34%	0.339	S	S	.	.			trans	-89	116.3	-175	-170.4	0	0	0	0	110.4	L305 G316 V318	L305-V310 HydrophobicContact CD2-CB 4.24Å; L305-V310 HydrophobicContact CD2-CG1 3.96Å; L305-V310 HydrophobicContact CD2-CG2 4.14Å; V310-G316 WeakPolarHBondContact O-CA 3.39Å; V310-V318 WeakPolarHBondContact O-CB 3.41Å; V310-V318 PolarHBondContact O-N 3.22Å
311	C	93.4	Very high	93.3	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-74.9	156.7	178.9	-58.3	0	0	0	0	112.2	D313 Y314 G316 V318 A320	C311-D313 VanDerWaalsContact C-N 3.28Å; C311-D313 PolarHBondContact O-N 3.41Å; C311-Y314 HydrophobicContact CB-CD2 4.24Å; C311-Y314 PolarHBondContact O-N 3.24Å; C311-G316 PolarHBondContact O-N 3.23Å; C311-G316 VanDerWaalsContact O-N 3.16Å; C311-V318 CarbonylContact C-O 3.49Å; C311-V318 VanDerWaalsContact CA-O 3.3Å; C311-V318 WeakPolarHBondContact CA-O 3.07Å; C311-A320 HydrophobicContact CB-CB 4.13Å
312	E	91.1	Very high	93.4	Very high	119 Å²	119	63.4 Å²	63.4	56%	0.556	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-53.8	-38.5	179.9	-169	177.6	178.8	0	0	113.8	Y314 G315 G316 V318	E312-Y314 PolarHBondContact O-N 3.31Å; E312-Y314 VanDerWaalsContact O-N 3.11Å; E312-G315 PolarHBondContact O-N 3.32Å; E312-G316 WeakPolarHBondContact CA-O 3.13Å; E312-V318 PolarHBondContact N-O 3.12Å
313	D	90.6	Very high	93.4	Very high	113 Å²	113	58 Å²	58	60%	0.604	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-60.3	-25.3	177.6	-57.6	-47	0	0	0	113.6	K301 C311	K301-D313 WeakPolarHBondContact CE-OD2 3.21Å; K301-D313 IonicContact NZ-OD2 3.45Å; K301-D313 PolarHBondContact NZ-OD2 3.35Å; C311-D313 VanDerWaalsContact C-N 3.28Å; C311-D313 PolarHBondContact O-N 3.41Å
314	Y	91.8	Very high	93.5	Very high	106 Å²	106	55.6 Å²	55.6	42%	0.416	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-99.5	9.4	178.3	-62	-83.1	0	0	0	112.2	K301 L305 C311 E312	K301-Y314 HydrophobicContact CB-CE2 3.94Å; L305-Y314 HydrophobicContact CD1-CD1 4.27Å; L305-Y314 HydrophobicContact CD1-CD2 4.41Å; L305-Y314 HydrophobicContact CD1-CE1 4.29Å; L305-Y314 HydrophobicContact CD1-CE2 4.45Å; L305-Y314 HydrophobicContact CD1-CG 4.32Å; C311-Y314 HydrophobicContact CB-CD2 4.24Å; C311-Y314 PolarHBondContact O-N 3.24Å; E312-Y314 PolarHBondContact O-N 3.31Å; E312-Y314 VanDerWaalsContact O-N 3.11Å
315	G	90.8	Very high	93.3	Very high	69 Å²	69	55.7 Å²	55.7	71%	0.711	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	19.2	179.9	0	0	0	0	0	114.8	E312	E312-G315 PolarHBondContact O-N 3.32Å
316	G	92.5	Very high	93.2	Very high	16 Å²	16	59 Å²	59	17%	0.165	34%	0.336	C	S	.	.			trans	-93.5	179.2	173	0	0	0	0	0	113.7	V310 C311 E312	V310-G316 WeakPolarHBondContact O-CA 3.39Å; C311-G316 PolarHBondContact O-N 3.23Å; C311-G316 VanDerWaalsContact O-N 3.16Å; E312-G316 WeakPolarHBondContact CA-O 3.13Å
317	D	90.6	Very high	93	Very high	164 Å²	164	59.5 Å²	59.5	88%	0.877	33%	0.331	S	S	*	.	S	Bend	trans	-90.5	-10.8	-176.7	-56.5	-42.8	0	0	0	113.5	Q319	D317-Q319 PolarHBondContact O-N 3.28Å
318	V	94.8	Very high	92.7	Very high	21 Å²	21	56.1 Å²	56.1	13%	0.127	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-82.7	110.5	-175.3	-179.4	0	0	0	0	110	L285 V309 V310 C311 E312 A320	L285-V318 HydrophobicContact CB-CG1 3.96Å; V309-V318 HydrophobicContact CG1-CB 4.35Å; V309-V318 HydrophobicContact CG1-CG1 4.05Å; V309-V318 HydrophobicContact CG1-CG2 3.95Å; V310-V318 WeakPolarHBondContact O-CB 3.41Å; V310-V318 PolarHBondContact O-N 3.22Å; C311-V318 CarbonylContact C-O 3.49Å; C311-V318 VanDerWaalsContact CA-O 3.3Å; C311-V318 WeakPolarHBondContact CA-O 3.07Å; E312-V318 PolarHBondContact N-O 3.12Å; V318-A320 PolarHBondContact O-N 2.99Å
319	Q	94.6	Very high	92.7	Very high	45 Å²	45	54.4 Å²	54.4	21%	0.21	32%	0.316	C	S	.	.			trans	-68.9	125.9	174.8	-67.2	-179.3	3	0	0	110.3	L285 D317 A337	L285-Q319 PolarHBondContact N-O 2.77Å; D317-Q319 PolarHBondContact O-N 3.28Å; Q319-A337 PolarHBondContact OE1-O 3.12Å
320	A	95.6	Very high	92.5	Very high	20 Å²	20	57.4 Å²	57.4	17%	0.165	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	104.6	-176.8	0	0	0	0	0	111.3	L285 C311 V318	L285-A320 HydrophobicContact CB-CB 4.4Å; L285-A320 HydrophobicContact CD2-CB 3.9Å; C311-A320 HydrophobicContact CB-CB 4.13Å; V318-A320 PolarHBondContact O-N 2.99Å
321	V	96.1	Very high	92.2	Very high	17 Å²	17	55.3 Å²	55.3	10%	0.103	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	115.9	-177.3	-171.4	0	0	0	0	110.2	L285 A286 I287 V323 N330 A333 L334 A337	L285-V321 PolarHBondContact O-N 3.47Å; A286-V321 WeakPolarHBondContact CA-O 3.34Å; I287-V321 PolarHBondContact N-O 2.76Å; V321-V323 HydrophobicContact CB-CG2 4.38Å; V321-V323 HydrophobicContact CG1-CG2 3.85Å; V321-N330 HydrophobicContact CG1-CB 4.49Å; V321-A333 HydrophobicContact CG1-CB 4.12Å; V321-L334 HydrophobicContact CB-CD1 4.23Å; V321-L334 HydrophobicContact CG1-CB 4.22Å; V321-L334 HydrophobicContact CG2-CD1 4.35Å; V321-A337 HydrophobicContact CG2-CB 4.03Å
322	P	95.8	Very high	91.8	Very high	47 Å²	47	60 Å²	60	31%	0.305	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	126.2	171.5	29.7	-31.3	0	0	0	110.6	N330	P322-N330 WeakPolarHBondContact O-CB 3.15Å; P322-N330 PolarHBondContact O-ND2 2.96Å
323	V	95.8	Very high	91.8	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.006	33%	0.33	C	S	.	.			trans	-132.6	152.2	-170.3	179.4	0	0	0	0	110.4	I287 N288 K289 C290 V321 N329 N330 L331 L334	I287-V323 PolarHBondContact O-N 2.91Å; I287-V323 VanDerWaalsContact O-O 3.09Å; N288-V323 CarbonylContact C-O 3.54Å; N288-V323 WeakPolarHBondContact CA-O 3.25Å; K289-V323 PolarHBondContact N-O 2.97Å; C290-V323 PolarHBondContact N-O 3.24Å; V321-V323 HydrophobicContact CB-CG2 4.38Å; V321-V323 HydrophobicContact CG1-CG2 3.85Å; V323-N329 WeakPolarHBondContact CG1-O 3.28Å; V323-N330 HydrophobicContact CG2-CB 4.39Å; V323-L331 HydrophobicContact CG1-CD2 3.5Å; V323-L331 VanDerWaalsContact CG1-CD2 3.5Å; V323-L331 HydrophobicContact CG1-CG 4.14Å; V323-L334 HydrophobicContact CG2-CB 4.25Å; V323-L334 HydrophobicContact CG2-CD2 4.37Å
324	S	95.3	Very high	91.9	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.014	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-124.8	107.3	163.2	170.1	0	0	0	0	109.3	D291 L326 T327 G328 N329	D291-S324 WeakPolarHBondContact CB-OG 3.48Å; D291-S324 VanDerWaalsContact CG-OG 3.24Å; D291-S324 WeakPolarHBondContact OD1-CB 3.41Å; D291-S324 PolarHBondContact OD1-OG 3.04Å; S324-L326 VanDerWaalsContact C-N 3.27Å; S324-L326 PolarHBondContact O-N 2.91Å; S324-T327 WeakPolarHBondContact CB-OG1 3.25Å; S324-T327 PolarHBondContact OG-N 2.73Å; S324-T327 PolarHBondContact OG-OG1 3.44Å; S324-G328 CarbonylContact O-C 3.55Å; S324-G328 WeakPolarHBondContact O-CA 3.45Å; S324-G328 PolarHBondContact O-N 3.06Å; S324-N329 PolarHBondContact N-O 2.98Å; S324-N329 PolarHBondContact O-N 3.4Å
325	A	92	Very high	91.8	Very high	2 Å²	2	46.2 Å²	46.2	2%	0.017	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-33	179.8	0	0	0	0	0	112.9	T195 L196 N288	T195-A325 HydrophobicContact CG2-CB 4.06Å; L196-A325 HydrophobicContact CB-CB 4.19Å; N288-A325 WeakPolarHBondContact OD1-CB 3.36Å; N288-A325 PolarHBondContact OD1-N 2.96Å
326	L	89.7	Confident	91.6	Very high	128 Å²	128	48.8 Å²	48.8	67%	0.67	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-46	-179.7	-70.4	176	0	0	0	112.8	T195 S324 G328	T195-L326 HydrophobicContact CG2-CD2 4.13Å; S324-L326 VanDerWaalsContact C-N 3.27Å; S324-L326 PolarHBondContact O-N 2.91Å; L326-G328 VanDerWaalsContact C-N 3.33Å
327	T	89.3	Confident	91.6	Very high	92 Å²	92	48.6 Å²	48.6	56%	0.564	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-15.3	-179.4	62.2	0	0	0	0	112.4	D291 S324 N329	D291-T327 HydrophobicContact CB-CG2 4.18Å; S324-T327 WeakPolarHBondContact CB-OG1 3.25Å; S324-T327 PolarHBondContact OG-N 2.73Å; S324-T327 PolarHBondContact OG-OG1 3.44Å; T327-N329 WeakPolarHBondContact OG1-CB 3.39Å; T327-N329 PolarHBondContact OG1-N 3.46Å
328	G	87.4	Confident	91.7	Very high	23 Å²	23	40.9 Å²	40.9	24%	0.237	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	14	-172.2	0	0	0	0	0	113.8	S324 L326	S324-G328 CarbonylContact O-C 3.55Å; S324-G328 WeakPolarHBondContact O-CA 3.45Å; S324-G328 PolarHBondContact O-N 3.06Å; L326-G328 VanDerWaalsContact C-N 3.33Å
329	N	91.3	Very high	91.5	Very high	94 Å²	94	40.6 Å²	40.6	50%	0.503	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-68.5	138	-178.7	-167.2	14.1	0	0	0	111.2	V323 S324 T327 L331	V323-N329 WeakPolarHBondContact CG1-O 3.28Å; S324-N329 PolarHBondContact N-O 2.98Å; S324-N329 PolarHBondContact O-N 3.4Å; T327-N329 WeakPolarHBondContact OG1-CB 3.39Å; T327-N329 PolarHBondContact OG1-N 3.46Å; N329-L331 PolarHBondContact O-N 2.93Å; N329-L331 VanDerWaalsContact O-N 3.12Å
330	N	89.9	Confident	91.4	Very high	69 Å²	69	40.1 Å²	40.1	37%	0.369	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	15.1	178.9	-74.9	-13.6	0	0	0	117.1	V321 P322 V323 M332 A333 L334	V321-N330 HydrophobicContact CG1-CB 4.49Å; P322-N330 WeakPolarHBondContact O-CB 3.15Å; P322-N330 PolarHBondContact O-ND2 2.96Å; V323-N330 HydrophobicContact CG2-CB 4.39Å; N330-M332 VanDerWaalsContact C-N 3.3Å; N330-M332 PolarHBondContact O-N 3.4Å; N330-A333 HydrophobicContact CB-CB 4.48Å; N330-A333 PolarHBondContact O-N 3.47Å; N330-L334 PolarHBondContact O-N 3.23Å; N330-L334 VanDerWaalsContact O-N 3.13Å
331	L	87.9	Confident	91.3	Very high	13 Å²	13	40.5 Å²	40.5	7%	0.068	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-34.8	174.5	-70.8	175.2	0	0	0	112.9	L196 Q199 L200 V323 N329 L334 A335	L196-L331 HydrophobicContact CD2-CD2 4.43Å; L196-L331 HydrophobicContact CG-CD2 3.98Å; Q199-L331 HydrophobicContact CB-CD1 3.8Å; Q199-L331 HydrophobicContact CG-CD1 3.28Å; L200-L331 HydrophobicContact CD2-CB 4.42Å; V323-L331 HydrophobicContact CG1-CD2 3.5Å; V323-L331 VanDerWaalsContact CG1-CD2 3.5Å; V323-L331 HydrophobicContact CG1-CG 4.14Å; N329-L331 PolarHBondContact O-N 2.93Å; N329-L331 VanDerWaalsContact O-N 3.12Å; L331-L334 PolarHBondContact O-N 3.45Å; L331-A335 PolarHBondContact O-N 3.34Å
332	M	85.9	Confident	91.1	Very high	98 Å²	98	40.2 Å²	40.2	48%	0.483	24%	0.235	S	C	.	.	H	α-helix	trans	-65.8	-40.7	176.1	-66.6	-63.2	-67.3	0	0	111.4	P225 N330 L334 A335 E336	P225-M332 HydrophobicContact CB-CE 4.46Å; P225-M332 HydrophobicContact CG-CE 3.81Å; P225-M332 HydrophobicContact CG-SD 4.38Å; N330-M332 VanDerWaalsContact C-N 3.3Å; N330-M332 PolarHBondContact O-N 3.4Å; M332-L334 VanDerWaalsContact C-N 3.32Å; M332-L334 PolarHBondContact O-N 3.44Å; M332-A335 WeakPolarHBondContact O-CB 3.04Å; M332-A335 PolarHBondContact O-N 3.19Å; M332-E336 WeakPolarHBondContact O-CB 3.38Å; M332-E336 WeakPolarHBondContact O-CG 3.34Å; M332-E336 PolarHBondContact O-N 2.91Å
333	A	90.9	Very high	90.9	Very high	38 Å²	38	44.3 Å²	44.3	31%	0.314	25%	0.25	S	S	.	.	H	α-helix	trans	-63.6	-38.4	175.8	0	0	0	0	0	111.8	V321 N330 E336 A337	V321-A333 HydrophobicContact CG1-CB 4.12Å; N330-A333 HydrophobicContact CB-CB 4.48Å; N330-A333 PolarHBondContact O-N 3.47Å; A333-E336 PolarHBondContact O-N 3.49Å; A333-A337 VanDerWaalsContact O-CB 3.25Å; A333-A337 WeakPolarHBondContact O-CB 3.49Å; A333-A337 PolarHBondContact O-N 3.11Å
334	L	92.4	Very high	90.7	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-64.5	-41	174.2	179.9	66	0	0	0	111.8	L196 I256 V284 A286 V321 V323 N330 L331 M332 T338	L196-L334 HydrophobicContact CD1-CD2 3.96Å; L196-L334 HydrophobicContact CD2-CD2 4.43Å; I256-L334 HydrophobicContact CD1-CD2 4.44Å; I256-L334 HydrophobicContact CD1-CG 4.45Å; I256-L334 HydrophobicContact CG2-CD1 4.43Å; I256-L334 HydrophobicContact CG2-CD2 4.44Å; V284-L334 HydrophobicContact CG1-CD1 3.81Å; A286-L334 HydrophobicContact CB-CD1 4Å; A286-L334 HydrophobicContact CB-CD2 4.02Å; V321-L334 HydrophobicContact CB-CD1 4.23Å; V321-L334 HydrophobicContact CG1-CB 4.22Å; V321-L334 HydrophobicContact CG2-CD1 4.35Å; V323-L334 HydrophobicContact CG2-CB 4.25Å; V323-L334 HydrophobicContact CG2-CD2 4.37Å; N330-L334 PolarHBondContact O-N 3.23Å; N330-L334 VanDerWaalsContact O-N 3.13Å; L331-L334 PolarHBondContact O-N 3.45Å; M332-L334 VanDerWaalsContact C-N 3.32Å; M332-L334 PolarHBondContact O-N 3.44Å; L334-T338 PolarHBondContact O-N 3.26Å; L334-T338 PolarHBondContact O-OG1 3.25Å
335	A	89	Confident	90.6	Very high	7 Å²	7	53.5 Å²	53.5	6%	0.058	30%	0.297	C	S	.	.	H	α-helix	trans	-64.4	-47	175.9	0	0	0	0	0	111.3	L224 L331 M332 A337 T338 V339	L224-A335 HydrophobicContact CD1-CB 3.94Å; L224-A335 HydrophobicContact CD2-CB 3.66Å; L224-A335 HydrophobicContact CG-CB 4.48Å; L331-A335 PolarHBondContact O-N 3.34Å; M332-A335 WeakPolarHBondContact O-CB 3.04Å; M332-A335 PolarHBondContact O-N 3.19Å; A335-A337 PolarHBondContact O-N 2.82Å; A335-T338 WeakPolarHBondContact O-CB 3.45Å; A335-T338 PolarHBondContact O-N 3.15Å; A335-V339 WeakPolarHBondContact O-CG2 3.43Å; A335-V339 PolarHBondContact O-N 3.43Å
336	E	87.5	Confident	90.6	Very high	124 Å²	124	59.5 Å²	59.5	58%	0.579	33%	0.325	S	S	*	.	H	α-helix	trans	-61.7	-41	177	-72.9	172.1	-175.6	0	0	112.3	M332 A333 T338 V339 A340	M332-E336 WeakPolarHBondContact O-CB 3.38Å; M332-E336 WeakPolarHBondContact O-CG 3.34Å; M332-E336 PolarHBondContact O-N 2.91Å; A333-E336 PolarHBondContact O-N 3.49Å; E336-T338 VanDerWaalsContact C-N 3.33Å; E336-T338 PolarHBondContact O-N 3.12Å; E336-V339 PolarHBondContact O-N 2.88Å; E336-A340 WeakPolarHBondContact O-CB 3.08Å; E336-A340 PolarHBondContact O-N 3.18Å
337	A	92.3	Very high	90.7	Very high	12 Å²	12	54.7 Å²	54.7	10%	0.099	30%	0.3	C	S	.	.	H	α-helix	trans	-57.4	-45.4	172.2	0	0	0	0	0	112	Q319 V321 A333 A335 A340 L341	Q319-A337 PolarHBondContact OE1-O 3.12Å; V321-A337 HydrophobicContact CG2-CB 4.03Å; A333-A337 VanDerWaalsContact O-CB 3.25Å; A333-A337 WeakPolarHBondContact O-CB 3.49Å; A333-A337 PolarHBondContact O-N 3.11Å; A335-A337 PolarHBondContact O-N 2.82Å; A337-A340 PolarHBondContact O-N 3.12Å; A337-L341 PolarHBondContact O-N 2.87Å
338	T	92.6	Very high	90.9	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-65.3	-40.9	178.7	-53.7	0	0	0	0	111.7	V183 I254 L334 A335 E336 A342	V183-T338 HydrophobicContact CG1-CG2 4.31Å; V183-T338 HydrophobicContact CG2-CG2 3.69Å; I254-T338 HydrophobicContact CD1-CG2 4.05Å; I254-T338 WeakPolarHBondContact CD1-O 3.48Å; I254-T338 HydrophobicContact CG2-CG2 4.47Å; L334-T338 PolarHBondContact O-N 3.26Å; L334-T338 PolarHBondContact O-OG1 3.25Å; A335-T338 WeakPolarHBondContact O-CB 3.45Å; A335-T338 PolarHBondContact O-N 3.15Å; E336-T338 VanDerWaalsContact C-N 3.33Å; E336-T338 PolarHBondContact O-N 3.12Å; T338-A342 WeakPolarHBondContact O-CB 3.44Å; T338-A342 PolarHBondContact O-N 3.44Å
339	V	91.4	Very high	91.1	Very high	15 Å²	15	54 Å²	54	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-63.1	-49.2	175.1	164.3	0	0	0	0	111.1	L224 E228 I230 A335 E336 L341 A342 E343	L224-V339 HydrophobicContact CD1-CG2 3.76Å; E228-V339 VanDerWaalsContact CD-CG1 3.44Å; E228-V339 VanDerWaalsContact OE1-CG1 3.24Å; E228-V339 WeakPolarHBondContact OE1-CG1 3.31Å; E228-V339 WeakPolarHBondContact OE2-CG1 3.49Å; E228-V339 WeakPolarHBondContact OE2-CG2 3.46Å; I230-V339 HydrophobicContact CD1-CG2 4.06Å; A335-V339 WeakPolarHBondContact O-CG2 3.43Å; A335-V339 PolarHBondContact O-N 3.43Å; E336-V339 PolarHBondContact O-N 2.88Å; V339-L341 VanDerWaalsContact C-N 3.28Å; V339-L341 PolarHBondContact O-N 3.5Å; V339-A342 WeakPolarHBondContact O-CA 3.36Å; V339-A342 WeakPolarHBondContact O-CB 3.47Å; V339-A342 PolarHBondContact O-N 2.89Å; V339-E343 PolarHBondContact O-N 2.82Å
340	A	91.8	Very high	91.3	Very high	36 Å²	36	50.4 Å²	50.4	30%	0.298	26%	0.264	S	S	.	.	H	α-helix	trans	-58.4	-42.1	179.1	0	0	0	0	0	111.5	E336 A337 E343 I344	E336-A340 WeakPolarHBondContact O-CB 3.08Å; E336-A340 PolarHBondContact O-N 3.18Å; A337-A340 PolarHBondContact O-N 3.12Å; A340-E343 PolarHBondContact O-N 2.75Å; A340-I344 VanDerWaalsContact O-CG1 3.3Å; A340-I344 WeakPolarHBondContact O-CG1 3.42Å; A340-I344 PolarHBondContact O-N 3.42Å; A340-I344 VanDerWaalsContact O-N 3.13Å
341	L	93.4	Very high	91.4	Very high	27 Å²	27	48.9 Å²	48.9	14%	0.141	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-40.3	174.5	-177.1	61.7	0	0	0	112	I254 P282 V284 A337 V339 E343 I344 L345	I254-L341 HydrophobicContact CD1-CB 4.13Å; I254-L341 HydrophobicContact CD1-CD2 4.02Å; I254-L341 HydrophobicContact CD1-CG 4Å; I254-L341 HydrophobicContact CG1-CD2 4.01Å; I254-L341 HydrophobicContact CG1-CG 4.31Å; I254-L341 HydrophobicContact CG2-CD2 3.75Å; P282-L341 HydrophobicContact CB-CD1 4.46Å; P282-L341 HydrophobicContact CB-CD2 4.11Å; P282-L341 HydrophobicContact CG-CD2 4.3Å; V284-L341 HydrophobicContact CG2-CD2 3.51Å; A337-L341 PolarHBondContact O-N 2.87Å; V339-L341 VanDerWaalsContact C-N 3.28Å; V339-L341 PolarHBondContact O-N 3.5Å; L341-E343 VanDerWaalsContact C-N 3.33Å; L341-E343 PolarHBondContact O-N 3.37Å; L341-I344 PolarHBondContact O-N 3.37Å; L341-L345 HydrophobicContact CG-CD1 4.35Å; L341-L345 VanDerWaalsContact O-CG 3.3Å; L341-L345 WeakPolarHBondContact O-CG 3.24Å; L341-L345 PolarHBondContact O-N 3.15Å; L341-L345 VanDerWaalsContact O-N 3.08Å
342	A	91.9	Very high	91.6	Very high	11 Å²	11	54.8 Å²	54.8	9%	0.091	29%	0.29	C	S	.	.	H	α-helix	trans	-63.9	-36.6	177	0	0	0	0	0	112.9	P181 I254 T338 V339 L345 E346 L347	P181-A342 HydrophobicContact CB-CB 3.81Å; P181-A342 HydrophobicContact CG-CB 3.89Å; I254-A342 HydrophobicContact CD1-CB 3.97Å; T338-A342 WeakPolarHBondContact O-CB 3.44Å; T338-A342 PolarHBondContact O-N 3.44Å; V339-A342 WeakPolarHBondContact O-CA 3.36Å; V339-A342 WeakPolarHBondContact O-CB 3.47Å; V339-A342 PolarHBondContact O-N 2.89Å; A342-L345 PolarHBondContact O-N 2.97Å; A342-E346 PolarHBondContact O-N 2.95Å; A342-L347 HydrophobicContact CB-CD1 4.12Å
343	E	90.4	Very high	91.8	Very high	133 Å²	133	50.8 Å²	50.8	62%	0.621	27%	0.274	S	S	*	.	H	α-helix	trans	-66.1	-42.1	174.5	-69.7	-174.4	157.2	0	0	111.7	V339 A340 L341 L345 E346	V339-E343 PolarHBondContact O-N 2.82Å; A340-E343 PolarHBondContact O-N 2.75Å; L341-E343 VanDerWaalsContact C-N 3.33Å; L341-E343 PolarHBondContact O-N 3.37Å; E343-L345 VanDerWaalsContact C-N 3.27Å; E343-L345 PolarHBondContact O-N 3.1Å; E343-E346 PolarHBondContact O-N 3.11Å; E343-E346 VanDerWaalsContact O-N 3.07Å
344	I	93.2	Very high	91.9	Very high	125 Å²	125	50.6 Å²	50.6	64%	0.641	27%	0.269	S	S	*	.	H	α-helix	trans	-61.2	-37	176	-67.9	164.9	0	0	0	111.3	A340 L341 E346	A340-I344 VanDerWaalsContact O-CG1 3.3Å; A340-I344 WeakPolarHBondContact O-CG1 3.42Å; A340-I344 PolarHBondContact O-N 3.42Å; A340-I344 VanDerWaalsContact O-N 3.13Å; L341-I344 PolarHBondContact O-N 3.37Å; I344-E346 PolarHBondContact O-N 3.29Å
345	L	92.5	Very high	92.1	Very high	71 Å²	71	50.5 Å²	50.5	37%	0.372	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.2	177.8	-66.8	171.1	0	0	0	113.7	I254 P282 L341 A342 E343 L347	I254-L345 HydrophobicContact CD1-CD1 4.32Å; I254-L345 HydrophobicContact CG1-CD1 3.94Å; P282-L345 HydrophobicContact CG-CD1 3.8Å; P282-L345 HydrophobicContact CG-CD2 4.27Å; L341-L345 HydrophobicContact CG-CD1 4.35Å; L341-L345 VanDerWaalsContact O-CG 3.3Å; L341-L345 WeakPolarHBondContact O-CG 3.24Å; L341-L345 PolarHBondContact O-N 3.15Å; L341-L345 VanDerWaalsContact O-N 3.08Å; A342-L345 PolarHBondContact O-N 2.97Å; E343-L345 VanDerWaalsContact C-N 3.27Å; E343-L345 PolarHBondContact O-N 3.1Å; L345-L347 VanDerWaalsContact C-N 3.3Å; L345-L347 HydrophobicContact CB-CD2 3.87Å; L345-L347 HydrophobicContact CB-CG 4.09Å; L345-L347 HydrophobicContact CD1-CD2 4.42Å; L345-L347 PolarHBondContact O-N 3.31Å
346	E	92.3	Very high	92.4	Very high	129 Å²	129	50.6 Å²	50.6	60%	0.603	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.1	50.6	-175.7	-64	-166.3	179.1	0	0	113.3	A342 E343 I344 K348	A342-E346 PolarHBondContact O-N 2.95Å; E343-E346 PolarHBondContact O-N 3.11Å; E343-E346 VanDerWaalsContact O-N 3.07Å; I344-E346 PolarHBondContact O-N 3.29Å; E346-K348 WeakPolarHBondContact O-CG 3.09Å; E346-K348 PolarHBondContact O-N 3.32Å; E346-K348 VanDerWaalsContact O-N 3.16Å; E346-K348 IonicContact OE2-NZ 3.82Å; E346-K348 PolarHBondContact OE2-NZ 3.44Å
347	L	92.5	Very high	92.8	Very high	26 Å²	26	44.7 Å²	44.7	14%	0.136	24%	0.241	C	C	.	.			trans	-58.7	120.4	-174.9	-61.9	179.7	0	0	0	111.9	P178 R179 P181 D253 A342 L345	P178-L347 WeakPolarHBondContact CA-O 3.27Å; R179-L347 HydrophobicContact CG-CB 3.97Å; R179-L347 PolarHBondContact N-O 3.38Å; P181-L347 HydrophobicContact CB-CD1 3.7Å; D253-L347 HydrophobicContact CB-CD1 3.83Å; D253-L347 HydrophobicContact CB-CD2 4.05Å; A342-L347 HydrophobicContact CB-CD1 4.12Å; L345-L347 VanDerWaalsContact C-N 3.3Å; L345-L347 HydrophobicContact CB-CD2 3.87Å; L345-L347 HydrophobicContact CB-CG 4.09Å; L345-L347 HydrophobicContact CD1-CD2 4.42Å; L345-L347 PolarHBondContact O-N 3.31Å
348	K	92.1	Very high	92.9	Very high	96 Å²	96	45.1 Å²	45.1	42%	0.417	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	147.1	-176.6	-74.7	161.7	-165	162.5	0	111.8	L176 T177 R179 E346	L176-K348 HydrophobicContact CB-CB 3.92Å; L176-K348 HydrophobicContact CB-CD 4.05Å; L176-K348 HydrophobicContact CB-CG 4.17Å; L176-K348 HydrophobicContact CD1-CB 4.18Å; L176-K348 HydrophobicContact CD1-CD 4.09Å; L176-K348 HydrophobicContact CD2-CB 4.13Å; L176-K348 HydrophobicContact CG-CB 4.3Å; T177-K348 CarbonylContact O-C 3.58Å; T177-K348 VanDerWaalsContact O-CA 3.22Å; T177-K348 WeakPolarHBondContact O-CA 3.28Å; R179-K348 PolarHBondContact NE-O 2.85Å; E346-K348 WeakPolarHBondContact O-CG 3.09Å; E346-K348 PolarHBondContact O-N 3.32Å; E346-K348 VanDerWaalsContact O-N 3.16Å; E346-K348 IonicContact OE2-NZ 3.82Å; E346-K348 PolarHBondContact OE2-NZ 3.44Å
349	A	92.8	Very high	93.1	Very high	5 Å²	5	45.1 Å²	45.1	4%	0.041	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	156.2	167.6	0	0	0	0	0	111.9	T177 R179 P351 P412	T177-A349 PolarHBondContact N-O 3.42Å; T177-A349 PolarHBondContact O-N 2.98Å; T177-A349 PolarHBondContact OG1-O 2.94Å; R179-A349 HydrophobicContact CB-CB 4.13Å; R179-A349 HydrophobicContact CG-CB 4.38Å; A349-P351 WeakPolarHBondContact O-CD 3.23Å; A349-P412 HydrophobicContact CB-CB 3.57Å; A349-P412 HydrophobicContact CB-CG 3.85Å
350	D	93.9	Very high	93.2	Very high	18 Å²	18	44.6 Å²	44.6	10%	0.096	24%	0.238	C	C	.	.			trans	-88	116.1	168.2	171.4	13.3	0	0	0	109.4	A171 L175 N352 G353 G379	A171-D350 HydrophobicContact CB-CB 3.94Å; L175-D350 HydrophobicContact CD2-CB 4.47Å; L175-D350 VanDerWaalsContact CD2-CG 3.45Å; L175-D350 VanDerWaalsContact CD2-OD1 3.25Å; L175-D350 WeakPolarHBondContact CD2-OD1 3.39Å; L175-D350 WeakPolarHBondContact CD2-OD2 3.45Å; L175-D350 WeakPolarHBondContact CG-OD1 3.41Å; D350-N352 PolarHBondContact OD1-N 3.32Å; D350-G353 PolarHBondContact OD1-N 2.95Å; D350-G353 WeakPolarHBondContact OD2-CA 3.39Å; D350-G353 PolarHBondContact OD2-N 2.79Å; D350-G379 WeakPolarHBondContact O-CA 3.33Å; D350-G379 PolarHBondContact O-N 3.45Å
351	P	92.6	Very high	93.2	Very high	37 Å²	37	43.4 Å²	43.4	24%	0.24	23%	0.227	C	C	.	.	S	Bend	trans	-86.5	-17.8	178.5	34.1	-32.9	0	0	0	113.3	T177 A349 G379 T380	T177-P351 HydrophobicContact CG2-CG 4.03Å; T177-P351 WeakPolarHBondContact OG1-CD 3.41Å; A349-P351 WeakPolarHBondContact O-CD 3.23Å; P351-G379 CarbonylContact O-C 3.52Å; P351-T380 WeakPolarHBondContact O-CB 3.43Å; P351-T380 PolarHBondContact O-N 3.01Å; P351-T380 PolarHBondContact O-OG1 3.48Å
352	N	91.9	Very high	93.3	Very high	137 Å²	137	42.1 Å²	42.1	73%	0.733	22%	0.22	S	C	*	.	S	Bend	trans	-96.5	-22.1	-170.6	-167.7	37.3	0	0	0	112.9	L175 D350	L175-N352 HydrophobicContact CD1-CB 4.42Å; D350-N352 PolarHBondContact OD1-N 3.32Å
353	G	90.7	Very high	93.4	Very high	15 Å²	15	44.5 Å²	44.5	16%	0.155	23%	0.228	C	C	.	.	S	Bend	trans	-62.3	172.4	172.3	0	0	0	0	0	113.9	D350 G379	D350-G353 PolarHBondContact OD1-N 2.95Å; D350-G353 WeakPolarHBondContact OD2-CA 3.39Å; D350-G353 PolarHBondContact OD2-N 2.79Å; G353-G379 WeakPolarHBondContact O-CA 3.29Å
354	P	93.6	Very high	93.4	Very high	33 Å²	33	41.2 Å²	41.2	21%	0.214	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-64.8	159.9	172	34.3	-40.1	0	0	0	110.3	R168 E356 E433	R168-P354 VanDerWaalsContact NE-CG 3.34Å; P354-E356 PolarHBondContact O-N 2.92Å; P354-E433 WeakPolarHBondContact CA-OE2 3.39Å; P354-E433 HydrophobicContact CB-CB 4.19Å
355	V	96.1	Very high	93.3	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.012	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-70.8	127.1	-178.7	-178.3	0	0	0	0	110.7	I376 R378 L381 L387 E433	V355-I376 HydrophobicContact CG1-CD1 3.96Å; V355-I376 HydrophobicContact CG1-CG2 4.19Å; V355-R378 WeakPolarHBondContact CA-O 3.32Å; V355-L381 HydrophobicContact CB-CD1 4.29Å; V355-L381 HydrophobicContact CG1-CB 4.2Å; V355-L381 HydrophobicContact CG1-CD1 4.17Å; V355-L381 VanDerWaalsContact CG2-CA 3.44Å; V355-L381 HydrophobicContact CG2-CB 3.72Å; V355-L381 HydrophobicContact CG2-CD1 3.79Å; V355-L381 HydrophobicContact CG2-CG 4.38Å; V355-L387 HydrophobicContact CB-CD2 4.48Å; V355-E433 HydrophobicContact CB-CB 3.99Å; V355-E433 WeakPolarHBondContact CG2-OE2 3.47Å; V355-E433 PolarHBondContact N-OE2 3.14Å; V355-E433 WeakPolarHBondContact O-CB 3.33Å; V355-E433 PolarHBondContact O-N 3.47Å
356	E	95.7	Very high	92.9	Very high	10 Å²	10	42.8 Å²	42.8	5%	0.047	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.3	159.6	160.8	-169	140.7	0	0	107.9	R167 P354 Q377 R378 I431 L432	R167-E356 VanDerWaalsContact CG-OE2 3.31Å; R167-E356 WeakPolarHBondContact CG-OE2 3.4Å; R167-E356 IonicContact CZ-OE1 3.78Å; R167-E356 VanDerWaalsContact CZ-OE1 3.28Å; R167-E356 IonicContact NE-OE1 3.46Å; R167-E356 PolarHBondContact NE-OE1 3.32Å; R167-E356 IonicContact NE-OE2 2.9Å; R167-E356 IonicContact NH2-OE1 2.71Å; R167-E356 PolarHBondContact NH2-OE1 3.4Å; P354-E356 PolarHBondContact O-N 2.92Å; E356-Q377 WeakPolarHBondContact O-CA 3.41Å; E356-Q377 PolarHBondContact O-N 3.13Å; E356-R378 HydrophobicContact CB-CG 3.62Å; E356-R378 VanDerWaalsContact CD-NH2 3.28Å; E356-R378 HydrophobicContact CG-CG 4.28Å; E356-R378 PolarHBondContact N-O 3.35Å; E356-R378 PolarHBondContact O-N 3.25Å; E356-R378 VanDerWaalsContact O-O 3.13Å; E356-R378 IonicContact OE1-CZ 3.87Å; E356-R378 IonicContact OE1-NE 3.8Å; E356-R378 PolarHBondContact OE1-NE 3.29Å; E356-R378 IonicContact OE1-NH2 3.98Å; E356-R378 PolarHBondContact OE1-NH2 2.97Å; E356-R378 IonicContact OE2-CZ 3.98Å; E356-R378 IonicContact OE2-NE 2.64Å; E356-R378 PolarHBondContact OE2-NE 3.02Å; E356-R378 IonicContact OE2-NH1 3.31Å; E356-R378 IonicContact OE2-NH2 3.83Å; E356-R378 PolarHBondContact OE2-NH2 3.24Å; E356-I431 VanDerWaalsContact CA-O 3.26Å; E356-I431 WeakPolarHBondContact CA-O 3.46Å; E356-L432 HydrophobicContact CB-CD2 4.15Å; E356-L432 HydrophobicContact CG-CD2 4.15Å
357	G	95	Very high	92.6	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	-177.6	-178.4	0	0	0	0	0	111.4	I375 E430 I431	G357-I375 CarbonylContact C-O 3.55Å; G357-I375 WeakPolarHBondContact CA-O 3.48Å; G357-E430 CarbonylContact O-C 3.54Å; G357-E430 WeakPolarHBondContact O-CA 3.38Å; G357-I431 PolarHBondContact N-O 2.93Å; G357-I431 PolarHBondContact O-N 3.46Å
358	T	95.6	Very high	92.4	Very high	21 Å²	21	44.2 Å²	44.2	13%	0.129	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	135.8	179.5	-48.4	0	0	0	0	109.4	V251 A374 I375	V251-T358 HydrophobicContact CG2-CG2 3.71Å; T358-A374 CarbonylContact O-C 3.5Å; T358-A374 VanDerWaalsContact O-CA 3.22Å; T358-A374 WeakPolarHBondContact O-CA 3.46Å; T358-A374 WeakPolarHBondContact O-CB 3.46Å; T358-I375 PolarHBondContact N-O 3.4Å; T358-I375 PolarHBondContact O-N 3.29Å
359	V	96	Very high	92.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	125.3	173.5	-178.3	0	0	0	0	108.8	S362 A389 P425 G428 E429 I431	V359-S362 WeakPolarHBondContact CG1-OG 3.34Å; V359-A389 HydrophobicContact CG2-CB 4.35Å; V359-P425 HydrophobicContact CG2-CB 4.44Å; V359-P425 HydrophobicContact CG2-CG 4.2Å; V359-G428 VanDerWaalsContact O-CA 3.23Å; V359-G428 WeakPolarHBondContact O-CA 3.4Å; V359-G428 PolarHBondContact O-N 3.47Å; V359-E429 PolarHBondContact N-O 3.46Å; V359-I431 HydrophobicContact CG2-CD1 3.77Å; V359-I431 HydrophobicContact CG2-CG1 3.67Å
360	I	93.3	Very high	92.4	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.021	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-53.4	173.5	-51.5	172.7	0	0	0	109.4	I217 A219 L233 R247 T373 I375	I217-I360 HydrophobicContact CB-CG2 3.82Å; I217-I360 HydrophobicContact CD1-CG2 4.43Å; I217-I360 HydrophobicContact CG2-CG2 3.4Å; I217-I360 VanDerWaalsContact CG2-CG2 3.4Å; A219-I360 HydrophobicContact CB-CD1 3.5Å; L233-I360 HydrophobicContact CD2-CD1 4.02Å; R247-I360 PolarHBondContact NH1-O 2.86Å; I360-T373 WeakPolarHBondContact CB-O 3.26Å; I360-T373 HydrophobicContact CD1-CG2 3.95Å; I360-T373 PolarHBondContact N-O 2.82Å; I360-I375 HydrophobicContact CD1-CD1 3.7Å; I360-I375 HydrophobicContact CD1-CG1 3.25Å; I360-I375 HydrophobicContact CG1-CD1 4.21Å; I360-I375 HydrophobicContact CG1-CG1 3.71Å
361	E	92.4	Very high	92.4	Very high	11 Å²	11	41.7 Å²	41.7	5%	0.051	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	149.4	-179.6	-75	-162.6	155.3	0	0	111.5	H216 I217 T372 T373	H216-E361 WeakPolarHBondContact CA-OE1 3.24Å; I217-E361 HydrophobicContact CB-CG 4.25Å; I217-E361 PolarHBondContact N-OE1 3.28Å; E361-T372 CarbonylContact O-C 3.53Å; E361-T372 VanDerWaalsContact O-CA 3.32Å; E361-T372 WeakPolarHBondContact O-CA 3.38Å; E361-T373 PolarHBondContact N-O 3.26Å; E361-T373 PolarHBondContact O-N 2.98Å
362	S	94.1	Very high	92.6	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133	177.2	-63.2	0	0	0	0	109.5	V359 P425 V524 D525	V359-S362 WeakPolarHBondContact CG1-OG 3.34Å; S362-P425 VanDerWaalsContact CB-O 3.25Å; S362-P425 WeakPolarHBondContact CB-O 3.47Å; S362-P425 PolarHBondContact OG-O 3.33Å; S362-V524 WeakPolarHBondContact O-CA 3.34Å; S362-D525 PolarHBondContact O-N 3.04Å
363	F	93.8	Very high	92.7	Very high	61 Å²	61	35 Å²	35	27%	0.268	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	164.1	-179.3	66.3	-89.1	0	0	0	112.2	D365 V371 L424 D523 V524	F363-D365 HydrophobicContact CE2-CB 4.45Å; F363-V371 HydrophobicContact CD2-CB 4.29Å; F363-V371 HydrophobicContact CE1-CB 4.18Å; F363-V371 HydrophobicContact CE1-CG1 4.07Å; F363-V371 HydrophobicContact CE2-CB 3.86Å; F363-V371 HydrophobicContact CE2-CG1 4.22Å; F363-V371 HydrophobicContact CE2-CG2 4.2Å; F363-V371 HydrophobicContact CZ-CB 3.8Å; F363-V371 HydrophobicContact CZ-CG1 3.69Å; F363-V371 HydrophobicContact CZ-CG2 4.5Å; F363-V371 PolarHBondContact N-O 2.98Å; F363-V371 PolarHBondContact O-N 3.27Å; F363-L424 WeakPolarHBondContact O-CD2 3.07Å; F363-D523 WeakPolarHBondContact CB-O 3.16Å; F363-V524 HydrophobicContact CB-CB 4.37Å; F363-V524 HydrophobicContact CB-CG1 3.87Å
364	T	92.4	Very high	92.9	Very high	64 Å²	64	34.2 Å²	34.2	39%	0.393	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	121.4	178.5	-58	0	0	0	0	111.1	L424	T364-L424 WeakPolarHBondContact OG1-CD1 3.27Å
365	D	90.5	Very high	93	Very high	61 Å²	61	32.7 Å²	32.7	33%	0.326	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	141.1	171.6	177.4	47.3	0	0	0	111.5	F363 G367 R368 G369 V371	F363-D365 HydrophobicContact CE2-CB 4.45Å; D365-G367 VanDerWaalsContact C-N 3.28Å; D365-G367 PolarHBondContact O-N 3.17Å; D365-G367 PolarHBondContact OD2-N 3.21Å; D365-R368 HydrophobicContact CB-CB 4.21Å; D365-R368 WeakPolarHBondContact OD2-CB 3.06Å; D365-R368 VanDerWaalsContact OD2-CG 3.31Å; D365-R368 WeakPolarHBondContact OD2-CG 3.27Å; D365-R368 PolarHBondContact OD2-N 3.06Å; D365-G369 PolarHBondContact N-O 3.05Å; D365-G369 VanDerWaalsContact O-CA 3.31Å; D365-G369 WeakPolarHBondContact O-CA 3.37Å; D365-G369 PolarHBondContact O-N 3.38Å; D365-V371 HydrophobicContact CB-CG2 4.02Å
366	K	84.6	Confident	93	Very high	169 Å²	169	32.6 Å²	32.6	74%	0.735	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-28.4	-177	-70.8	178.5	179.8	167.9	0	113.2	D555	K366-D555 WeakPolarHBondContact CE-OD2 3.5Å; K366-D555 IonicContact NZ-OD2 2.83Å; K366-D555 PolarHBondContact NZ-OD2 2.83Å
367	G	85.6	Confident	92.8	Very high	71 Å²	71	33.8 Å²	33.8	73%	0.732	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-41.1	179.6	0	0	0	0	0	113	D365	D365-G367 VanDerWaalsContact C-N 3.28Å; D365-G367 PolarHBondContact O-N 3.17Å; D365-G367 PolarHBondContact OD2-N 3.21Å
368	R	87.9	Confident	92.7	Very high	114 Å²	114	35.5 Å²	35.5	43%	0.43	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-12.9	-171.2	-60.7	173.1	-173.4	-168.9	1.6	113.8	D365 V371 T419	D365-R368 HydrophobicContact CB-CB 4.21Å; D365-R368 WeakPolarHBondContact OD2-CB 3.06Å; D365-R368 VanDerWaalsContact OD2-CG 3.31Å; D365-R368 WeakPolarHBondContact OD2-CG 3.27Å; D365-R368 PolarHBondContact OD2-N 3.06Å; R368-V371 HydrophobicContact CB-CG2 3.96Å; R368-T419 HydrophobicContact CB-CG2 4.19Å
369	G	91.1	Very high	92.6	Very high	24 Å²	24	34.5 Å²	34.5	25%	0.247	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	77.7	-151.8	-172.5	0	0	0	0	0	111.5	D365 V371	D365-G369 PolarHBondContact N-O 3.05Å; D365-G369 VanDerWaalsContact O-CA 3.31Å; D365-G369 WeakPolarHBondContact O-CA 3.37Å; D365-G369 PolarHBondContact O-N 3.38Å; G369-V371 VanDerWaalsContact O-CG2 3.3Å; G369-V371 WeakPolarHBondContact O-CG2 3.33Å; G369-V371 PolarHBondContact O-N 3.15Å
370	P	93.9	Very high	92.6	Very high	37 Å²	37	35.5 Å²	35.5	24%	0.24	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	125.4	175.8	-25.1	37	0	0	0	112	W421 L424	P370-W421 HydrophobicContact CB-CB 3.99Å; P370-L424 HydrophobicContact CB-CD2 3.78Å; P370-L424 HydrophobicContact CB-CG 4.13Å
371	V	94.7	Very high	92.7	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.03	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	144.4	-179	-169.9	0	0	0	0	109	F363 D365 R368 G369 I418 T419	F363-V371 HydrophobicContact CD2-CB 4.29Å; F363-V371 HydrophobicContact CE1-CB 4.18Å; F363-V371 HydrophobicContact CE1-CG1 4.07Å; F363-V371 HydrophobicContact CE2-CB 3.86Å; F363-V371 HydrophobicContact CE2-CG1 4.22Å; F363-V371 HydrophobicContact CE2-CG2 4.2Å; F363-V371 HydrophobicContact CZ-CB 3.8Å; F363-V371 HydrophobicContact CZ-CG1 3.69Å; F363-V371 HydrophobicContact CZ-CG2 4.5Å; F363-V371 PolarHBondContact N-O 2.98Å; F363-V371 PolarHBondContact O-N 3.27Å; D365-V371 HydrophobicContact CB-CG2 4.02Å; R368-V371 HydrophobicContact CB-CG2 3.96Å; G369-V371 VanDerWaalsContact O-CG2 3.3Å; G369-V371 WeakPolarHBondContact O-CG2 3.33Å; G369-V371 PolarHBondContact O-N 3.15Å; V371-I418 WeakPolarHBondContact CA-O 3.45Å; V371-T419 HydrophobicContact CB-CG2 4.35Å; V371-T419 HydrophobicContact CG1-CG2 4Å; V371-T419 HydrophobicContact CG2-CG2 3.85Å
372	T	95.2	Very high	92.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	136.5	175	61.7	0	0	0	0	109.9	E361 G417 I418 W421 P425	E361-T372 CarbonylContact O-C 3.53Å; E361-T372 VanDerWaalsContact O-CA 3.32Å; E361-T372 WeakPolarHBondContact O-CA 3.38Å; T372-G417 CarbonylContact O-C 3.55Å; T372-G417 WeakPolarHBondContact O-CA 3.4Å; T372-I418 PolarHBondContact N-O 3.42Å; T372-I418 PolarHBondContact O-N 3.37Å; T372-W421 HydrophobicContact CG2-CD2 4.22Å; T372-W421 HydrophobicContact CG2-CG 4.23Å; T372-W421 HydrophobicContact CG2-CZ2 4.29Å; T372-W421 PolarHBondContact OG1-NE1 3.32Å; T372-P425 HydrophobicContact CG2-CG 3.44Å; T372-P425 VanDerWaalsContact CG2-CG 3.44Å
373	T	94.5	Very high	92.9	Very high	32 Å²	32	47.2 Å²	47.2	20%	0.196	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	123	166.3	-54.9	0	0	0	0	107.9	I360 E361 V416	I360-T373 WeakPolarHBondContact CB-O 3.26Å; I360-T373 HydrophobicContact CD1-CG2 3.95Å; I360-T373 PolarHBondContact N-O 2.82Å; E361-T373 PolarHBondContact N-O 3.26Å; E361-T373 PolarHBondContact O-N 2.98Å; T373-V416 WeakPolarHBondContact CA-O 3.29Å
374	A	95.3	Very high	92.9	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	150.9	-177.5	0	0	0	0	0	111.5	T358 P415 V416 I418 I431	T358-A374 CarbonylContact O-C 3.5Å; T358-A374 VanDerWaalsContact O-CA 3.22Å; T358-A374 WeakPolarHBondContact O-CA 3.46Å; T358-A374 WeakPolarHBondContact O-CB 3.46Å; A374-P415 CarbonylContact O-C 3.53Å; A374-P415 WeakPolarHBondContact O-CA 3.26Å; A374-V416 PolarHBondContact N-O 3.04Å; A374-V416 PolarHBondContact O-N 3.34Å; A374-I418 HydrophobicContact CB-CD1 3.89Å; A374-I431 HydrophobicContact CB-CD1 3.38Å
375	I	95.6	Very high	93	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	129.2	168	-46.5	-174.5	0	0	0	108.8	I182 L233 V251 G357 T358 I360	I182-I375 HydrophobicContact CD1-CG2 3.66Å; I182-I375 HydrophobicContact CG1-CG2 4.34Å; I182-I375 HydrophobicContact CG2-CD1 3.74Å; L233-I375 HydrophobicContact CD1-CD1 3.86Å; L233-I375 HydrophobicContact CD2-CD1 3.69Å; L233-I375 HydrophobicContact CG-CD1 4.18Å; V251-I375 HydrophobicContact CG1-CB 4.34Å; V251-I375 HydrophobicContact CG1-CD1 3.45Å; V251-I375 VanDerWaalsContact CG1-CD1 3.45Å; V251-I375 HydrophobicContact CG1-CG1 4.16Å; G357-I375 CarbonylContact C-O 3.55Å; G357-I375 WeakPolarHBondContact CA-O 3.48Å; T358-I375 PolarHBondContact N-O 3.4Å; T358-I375 PolarHBondContact O-N 3.29Å; I360-I375 HydrophobicContact CD1-CD1 3.7Å; I360-I375 HydrophobicContact CD1-CG1 3.25Å; I360-I375 HydrophobicContact CG1-CD1 4.21Å; I360-I375 HydrophobicContact CG1-CG1 3.71Å
376	I	95.6	Very high	93.3	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	122.4	174.6	-51.3	-52.3	0	0	0	108.4	V355 R378 G379 L381 A410 P412 S413 M414	V355-I376 HydrophobicContact CG1-CD1 3.96Å; V355-I376 HydrophobicContact CG1-CG2 4.19Å; I376-R378 WeakPolarHBondContact CG2-O 3.43Å; I376-G379 WeakPolarHBondContact CG2-O 3.45Å; I376-L381 HydrophobicContact CD1-CB 4.13Å; I376-L381 HydrophobicContact CD1-CD2 3.93Å; I376-L381 HydrophobicContact CG1-CB 4.48Å; I376-A410 HydrophobicContact CG1-CB 4.33Å; I376-P412 CarbonylContact O-C 3.59Å; I376-S413 WeakPolarHBondContact O-CA 3.31Å; I376-S413 PolarHBondContact O-N 3.11Å; I376-M414 PolarHBondContact N-O 3.08Å
377	Q	92.4	Very high	94	Very high	34 Å²	34	33.4 Å²	33.4	16%	0.159	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-41.9	178.4	-68.5	-67.1	-17.2	0	0	110.9	V251 E356	V251-Q377 PolarHBondContact O-NE2 3.16Å; E356-Q377 WeakPolarHBondContact O-CA 3.41Å; E356-Q377 PolarHBondContact O-N 3.13Å
378	R	92.4	Very high	94.5	Very high	36 Å²	36	30 Å²	30	14%	0.136	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	163.6	175.2	63.3	175.1	100.4	176.6	16.9	110.8	R168 P169 V355 E356 I376	R168-R378 PolarHBondContact O-NH1 2.7Å; P169-R378 PolarHBondContact O-NH1 3.38Å; V355-R378 WeakPolarHBondContact CA-O 3.32Å; E356-R378 HydrophobicContact CB-CG 3.62Å; E356-R378 VanDerWaalsContact CD-NH2 3.28Å; E356-R378 HydrophobicContact CG-CG 4.28Å; E356-R378 PolarHBondContact N-O 3.35Å; E356-R378 PolarHBondContact O-N 3.25Å; E356-R378 VanDerWaalsContact O-O 3.13Å; E356-R378 IonicContact OE1-CZ 3.87Å; E356-R378 IonicContact OE1-NE 3.8Å; E356-R378 PolarHBondContact OE1-NE 3.29Å; E356-R378 IonicContact OE1-NH2 3.98Å; E356-R378 PolarHBondContact OE1-NH2 2.97Å; E356-R378 IonicContact OE2-CZ 3.98Å; E356-R378 IonicContact OE2-NE 2.64Å; E356-R378 PolarHBondContact OE2-NE 3.02Å; E356-R378 IonicContact OE2-NH1 3.31Å; E356-R378 IonicContact OE2-NH2 3.83Å; E356-R378 PolarHBondContact OE2-NH2 3.24Å; I376-R378 WeakPolarHBondContact CG2-O 3.43Å
379	G	93.9	Very high	94.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	77.8	169.8	-176.5	0	0	0	0	0	112.9	D350 P351 G353 I376 P412	D350-G379 WeakPolarHBondContact O-CA 3.33Å; D350-G379 PolarHBondContact O-N 3.45Å; P351-G379 CarbonylContact O-C 3.52Å; G353-G379 WeakPolarHBondContact O-CA 3.29Å; I376-G379 WeakPolarHBondContact CG2-O 3.45Å; G379-P412 WeakPolarHBondContact O-CD 3.41Å
380	T	95.3	Very high	95	Very high	22 Å²	22	24.1 Å²	24.1	14%	0.135	13%	0.127	C	C	.	.			trans	-110.7	113.5	176.1	-60.5	0	0	0	0	109.5	P351 R382 E409 A410	P351-T380 WeakPolarHBondContact O-CB 3.43Å; P351-T380 PolarHBondContact O-N 3.01Å; P351-T380 PolarHBondContact O-OG1 3.48Å; T380-R382 HydrophobicContact CG2-CG 4.46Å; T380-E409 HydrophobicContact CG2-CB 4.24Å; T380-A410 CarbonylContact C-O 3.5Å; T380-A410 WeakPolarHBondContact CA-O 3.26Å
381	L	96.4	Very high	95	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	127.8	179.6	-176	66.3	0	0	0	110.8	V355 I376 C385 L387 V396 M399 E409 A410 I418	V355-L381 HydrophobicContact CB-CD1 4.29Å; V355-L381 HydrophobicContact CG1-CB 4.2Å; V355-L381 HydrophobicContact CG1-CD1 4.17Å; V355-L381 VanDerWaalsContact CG2-CA 3.44Å; V355-L381 HydrophobicContact CG2-CB 3.72Å; V355-L381 HydrophobicContact CG2-CD1 3.79Å; V355-L381 HydrophobicContact CG2-CG 4.38Å; I376-L381 HydrophobicContact CD1-CB 4.13Å; I376-L381 HydrophobicContact CD1-CD2 3.93Å; I376-L381 HydrophobicContact CG1-CB 4.48Å; L381-C385 HydrophobicContact CD1-CB 3.91Å; L381-L387 HydrophobicContact CD1-CD1 4.02Å; L381-L387 HydrophobicContact CD1-CD2 3.94Å; L381-L387 HydrophobicContact CD1-CG 4.38Å; L381-L387 HydrophobicContact CD2-CD1 4.49Å; L381-V396 HydrophobicContact CD1-CG2 4.21Å; L381-M399 HydrophobicContact CB-SD 4.23Å; L381-M399 HydrophobicContact CD2-CG 4.49Å; L381-M399 HydrophobicContact CD2-SD 3.5Å; L381-M399 VanDerWaalsContact CD2-SD 3.5Å; L381-M399 HydrophobicContact CG-SD 3.5Å; L381-M399 VanDerWaalsContact CG-SD 3.5Å; L381-E409 CarbonylContact O-C 3.58Å; L381-E409 WeakPolarHBondContact O-CA 3.48Å; L381-A410 HydrophobicContact CB-CB 4.27Å; L381-A410 PolarHBondContact N-O 3.12Å; L381-A410 PolarHBondContact O-N 2.97Å; L381-I418 HydrophobicContact CD2-CD1 3.7Å; L381-I418 HydrophobicContact CD2-CG1 4.02Å
382	R	95.3	Very high	95	Very high	117 Å²	117	24.9 Å²	24.9	44%	0.442	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	155.8	-179.6	-63.6	175.8	179.9	-83.2	-17.2	110.6	T380 G384 C385 E409	T380-R382 HydrophobicContact CG2-CG 4.46Å; R382-G384 PolarHBondContact O-N 3.18Å; R382-C385 WeakPolarHBondContact O-CB 3.46Å; R382-C385 PolarHBondContact O-N 3.08Å; R382-C385 PolarHBondContact O-SG 3.22Å; R382-E409 HydrophobicContact CG-CG 4.43Å; R382-E409 VanDerWaalsContact CZ-CD 3.48Å; R382-E409 IonicContact CZ-OE1 3.44Å; R382-E409 IonicContact CZ-OE2 3.4Å; R382-E409 IonicContact NH1-OE1 2.65Å; R382-E409 PolarHBondContact NH1-OE1 3.48Å; R382-E409 IonicContact NH1-OE2 3.44Å; R382-E409 PolarHBondContact NH1-OE2 3.05Å; R382-E409 VanDerWaalsContact NH2-CD 3.35Å; R382-E409 IonicContact NH2-OE1 3.35Å; R382-E409 PolarHBondContact NH2-OE1 3.44Å; R382-E409 IonicContact NH2-OE2 3.71Å; R382-E409 PolarHBondContact NH2-OE2 3.03Å
383	K	94.8	Very high	95.1	Very high	143 Å²	143	26 Å²	26	62%	0.622	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	131	172.1	177.6	172.9	169.5	163.7	0	110.2	R397	K383-R397 WeakPolarHBondContact CD-O 3.41Å; K383-R397 WeakPolarHBondContact CE-O 3.5Å; K383-R397 PolarHBondContact NZ-O 3.49Å
384	G	93.3	Very high	95.2	Very high	36 Å²	36	24.5 Å²	24.5	37%	0.371	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.5	-10	179.6	0	0	0	0	0	115	R382 V396	R382-G384 PolarHBondContact O-N 3.18Å; G384-V396 WeakPolarHBondContact CA-O 3.28Å; G384-V396 PolarHBondContact N-O 3.36Å
385	C	95.4	Very high	95.2	Very high	18 Å²	18	28.9 Å²	28.9	12%	0.122	14%	0.144	C	C	.	.			trans	-57.8	150	172.6	-66.7	0	0	0	0	111.5	L381 R382 V396 E433	L381-C385 HydrophobicContact CD1-CB 3.91Å; R382-C385 WeakPolarHBondContact O-CB 3.46Å; R382-C385 PolarHBondContact O-N 3.08Å; R382-C385 PolarHBondContact O-SG 3.22Å; C385-V396 HydrophobicContact CB-CG2 4.42Å; C385-V396 PolarHBondContact O-N 2.94Å; C385-E433 WeakPolarHBondContact CB-OE1 3.46Å; C385-E433 PolarHBondContact SG-OE1 3.11Å
386	V	97.3	Very high	95.3	Very high	12 Å²	12	29 Å²	29	7%	0.073	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.7	177.8	-174.3	0	0	0	0	108.2	W393 A394 E433 V434 E437 A440	V386-W393 HydrophobicContact CG1-CE3 4.32Å; V386-A394 WeakPolarHBondContact CA-O 3.41Å; V386-E433 WeakPolarHBondContact O-CA 3.43Å; V386-V434 HydrophobicContact CB-CG2 4.06Å; V386-V434 HydrophobicContact CG1-CG2 3.7Å; V386-V434 PolarHBondContact O-N 3.28Å; V386-E437 HydrophobicContact CG2-CG 4.12Å; V386-A440 HydrophobicContact CG1-CB 3.73Å
387	L	97.3	Very high	95.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	147.7	-174.4	-58	177.4	0	0	0	110.1	V355 L381 W393 A394 V396 I418 W421 I431 E433	V355-L387 HydrophobicContact CB-CD2 4.48Å; L381-L387 HydrophobicContact CD1-CD1 4.02Å; L381-L387 HydrophobicContact CD1-CD2 3.94Å; L381-L387 HydrophobicContact CD1-CG 4.38Å; L381-L387 HydrophobicContact CD2-CD1 4.49Å; L387-W393 CarbonylContact O-C 3.53Å; L387-W393 VanDerWaalsContact O-CA 3.25Å; L387-W393 WeakPolarHBondContact O-CA 3.4Å; L387-W393 WeakPolarHBondContact O-CB 3.31Å; L387-A394 HydrophobicContact CB-CB 4.5Å; L387-A394 PolarHBondContact N-O 2.95Å; L387-A394 PolarHBondContact O-N 2.84Å; L387-V396 HydrophobicContact CD1-CG2 3.56Å; L387-V396 HydrophobicContact CG-CG2 3.98Å; L387-I418 HydrophobicContact CD1-CD1 4Å; L387-I418 HydrophobicContact CD1-CG2 4.14Å; L387-W421 HydrophobicContact CB-CH2 4.42Å; L387-I431 HydrophobicContact CB-CG2 3.98Å; L387-I431 HydrophobicContact CD1-CG2 3.99Å; L387-I431 HydrophobicContact CD2-CG2 3.94Å; L387-I431 HydrophobicContact CG-CG2 4.18Å; L387-E433 HydrophobicContact CD2-CB 3.95Å; L387-E433 HydrophobicContact CD2-CG 4.44Å
388	V	97.1	Very high	95.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.7	170.9	-177.6	0	0	0	0	107.8	W393 I431 L432 V434 A440 V443 V444	V388-W393 HydrophobicContact CG2-CB 4.25Å; V388-I431 WeakPolarHBondContact O-CA 3.31Å; V388-L432 PolarHBondContact N-O 3.43Å; V388-L432 PolarHBondContact O-N 3.11Å; V388-V434 HydrophobicContact CG2-CG1 3.95Å; V388-V434 HydrophobicContact CG2-CG2 3.91Å; V388-A440 HydrophobicContact CG2-CB 3.79Å; V388-V443 HydrophobicContact CG1-CG1 3.85Å; V388-V444 HydrophobicContact CG1-CG2 4.16Å
389	A	96.2	Very high	95.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	125.9	170.5	0	0	0	0	0	108.3	V359 N391 C392 W421 P425 E429 E430 I431	V359-A389 HydrophobicContact CG2-CB 4.35Å; A389-N391 PolarHBondContact O-N 3.2Å; A389-C392 PolarHBondContact N-O 3.48Å; A389-C392 CarbonylContact O-C 3.48Å; A389-C392 WeakPolarHBondContact O-CA 3.4Å; A389-C392 WeakPolarHBondContact O-CB 3.23Å; A389-C392 PolarHBondContact O-N 3.39Å; A389-W421 HydrophobicContact CB-CH2 3.47Å; A389-W421 VanDerWaalsContact CB-CH2 3.47Å; A389-W421 HydrophobicContact CB-CZ3 3.7Å; A389-P425 HydrophobicContact CB-CB 3.76Å; A389-P425 HydrophobicContact CB-CG 4.44Å; A389-E429 HydrophobicContact CB-CB 4.48Å; A389-E430 WeakPolarHBondContact CA-O 3.38Å; A389-I431 HydrophobicContact CB-CG1 4.09Å
390	G	93.6	Very high	95.3	Very high	13 Å²	13	35.4 Å²	35.4	13%	0.134	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	-122.3	-173.4	0	0	0	0	0	112.8	C392 E429 R447	G390-C392 VanDerWaalsContact C-N 3.34Å; G390-E429 VanDerWaalsContact CA-CD 3.45Å; G390-E429 WeakPolarHBondContact CA-OE1 3.43Å; G390-E429 VanDerWaalsContact CA-OE2 3.29Å; G390-E429 WeakPolarHBondContact CA-OE2 3.38Å; G390-E429 PolarHBondContact N-OE2 2.96Å; G390-R447 WeakPolarHBondContact O-CD 3.38Å; G390-R447 PolarHBondContact O-NH1 3.35Å
391	N	93.6	Very high	95.1	Very high	45 Å²	45	36.3 Å²	36.3	24%	0.241	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	10.6	179.7	-70.2	-26.7	0	0	0	114.1	A389 V444 R447 K448 Q451	A389-N391 PolarHBondContact O-N 3.2Å; N391-V444 WeakPolarHBondContact O-CG1 3.47Å; N391-R447 WeakPolarHBondContact OD1-CB 3.34Å; N391-K448 HydrophobicContact CB-CG 4.49Å; N391-Q451 PolarHBondContact ND2-OE1 2.97Å
392	C	94.6	Very high	94.3	Very high	13 Å²	13	39.8 Å²	39.8	9%	0.088	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	154.5	-171.2	-61.1	0	0	0	0	110.3	A389 G390 W421 D423 L424 P425	A389-C392 PolarHBondContact N-O 3.48Å; A389-C392 CarbonylContact O-C 3.48Å; A389-C392 WeakPolarHBondContact O-CA 3.4Å; A389-C392 WeakPolarHBondContact O-CB 3.23Å; A389-C392 PolarHBondContact O-N 3.39Å; G390-C392 VanDerWaalsContact C-N 3.34Å; C392-W421 HydrophobicContact CB-CE3 4.29Å; C392-W421 HydrophobicContact CB-CZ3 4.45Å; C392-D423 HydrophobicContact CB-CB 4.34Å; C392-D423 VanDerWaalsContact SG-CB 3.53Å; C392-L424 PolarHBondContact SG-O 3.15Å; C392-P425 HydrophobicContact CB-CB 4.32Å
393	W	96.6	Very high	93.7	Very high	25 Å²	25	39.3 Å²	39.3	10%	0.095	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	154.5	173.7	72	-85	0	0	0	111.2	V386 L387 V388 K395 R422 E437 A440 R441 V444	V386-W393 HydrophobicContact CG1-CE3 4.32Å; L387-W393 CarbonylContact O-C 3.53Å; L387-W393 VanDerWaalsContact O-CA 3.25Å; L387-W393 WeakPolarHBondContact O-CA 3.4Å; L387-W393 WeakPolarHBondContact O-CB 3.31Å; V388-W393 HydrophobicContact CG2-CB 4.25Å; W393-K395 HydrophobicContact CZ3-CB 4.41Å; W393-R422 HydrophobicContact CD2-CG 4.21Å; W393-R422 HydrophobicContact CH2-CG 4.33Å; W393-R422 HydrophobicContact CZ2-CG 3.79Å; W393-R422 PolarHBondContact O-N 3.29Å; W393-R422 VanDerWaalsContact O-N 3.12Å; W393-E437 HydrophobicContact CH2-CB 4.42Å; W393-E437 HydrophobicContact CH2-CG 4.35Å; W393-E437 HydrophobicContact CZ3-CB 4.32Å; W393-E437 HydrophobicContact CZ3-CG 4Å; W393-A440 HydrophobicContact CB-CB 4Å; W393-A440 HydrophobicContact CD2-CB 4.27Å; W393-A440 HydrophobicContact CE3-CB 4.31Å; W393-A440 HydrophobicContact CG-CB 4.15Å; W393-R441 HydrophobicContact CZ2-CG 4.47Å; W393-V444 HydrophobicContact CB-CG2 4.15Å
394	A	96.6	Very high	93.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.9	179.8	0	0	0	0	0	111.6	V386 L387 G420 W421	V386-A394 WeakPolarHBondContact CA-O 3.41Å; L387-A394 HydrophobicContact CB-CB 4.5Å; L387-A394 PolarHBondContact N-O 2.95Å; L387-A394 PolarHBondContact O-N 2.84Å; A394-G420 WeakPolarHBondContact CA-O 3.4Å; A394-W421 HydrophobicContact CB-CB 4.27Å; A394-W421 HydrophobicContact CB-CD2 3.46Å; A394-W421 VanDerWaalsContact CB-CD2 3.46Å; A394-W421 HydrophobicContact CB-CE3 3.61Å; A394-W421 HydrophobicContact CB-CG 3.79Å; A394-W421 HydrophobicContact CB-CH2 4.34Å; A394-W421 HydrophobicContact CB-CZ2 4.27Å; A394-W421 HydrophobicContact CB-CZ3 4.04Å
395	K	96.8	Very high	92.9	Very high	92 Å²	92	39.5 Å²	39.5	40%	0.4	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117.2	157.9	-176.9	-176.7	-161.8	159.2	0	107.7	W393 R397 G420 E437	W393-K395 HydrophobicContact CZ3-CB 4.41Å; K395-R397 PolarHBondContact O-N 3.23Å; K395-G420 PolarHBondContact N-O 3.45Å; K395-E437 VanDerWaalsContact CD-OE1 3.31Å; K395-E437 WeakPolarHBondContact CD-OE1 3.46Å; K395-E437 WeakPolarHBondContact CE-OE1 3.34Å; K395-E437 IonicContact NZ-OE1 3.49Å; K395-E437 PolarHBondContact NZ-OE1 2.95Å
396	V	96.6	Very high	92.8	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	109.9	-173.3	-179	0	0	0	0	110.3	L381 G384 C385 L387 M399 I418 T419	L381-V396 HydrophobicContact CD1-CG2 4.21Å; G384-V396 WeakPolarHBondContact CA-O 3.28Å; G384-V396 PolarHBondContact N-O 3.36Å; C385-V396 HydrophobicContact CB-CG2 4.42Å; C385-V396 PolarHBondContact O-N 2.94Å; L387-V396 HydrophobicContact CD1-CG2 3.56Å; L387-V396 HydrophobicContact CG-CG2 3.98Å; V396-M399 HydrophobicContact CG1-CG 3.5Å; V396-M399 HydrophobicContact CG1-SD 4.06Å; V396-I418 HydrophobicContact CG1-CG2 4.37Å; V396-I418 HydrophobicContact CG2-CG2 3.88Å; V396-T419 WeakPolarHBondContact CA-O 3.19Å
397	R	94.1	Very high	92.7	Very high	152 Å²	152	43.8 Å²	43.8	57%	0.574	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	-43.3	177.9	-66.8	-176.8	-174.8	175.4	3.1	111.8	K383 K395 T419	K383-R397 WeakPolarHBondContact CD-O 3.41Å; K383-R397 WeakPolarHBondContact CE-O 3.5Å; K383-R397 PolarHBondContact NZ-O 3.49Å; K395-R397 PolarHBondContact O-N 3.23Å; R397-T419 PolarHBondContact N-O 3.14Å
398	S	93.9	Very high	92.5	Very high	32 Å²	32	50.6 Å²	50.6	22%	0.224	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	148.5	-179.1	31.6	0	0	0	0	109.2	F400 T419	S398-F400 VanDerWaalsContact CB-CZ 3.45Å; S398-F400 WeakPolarHBondContact OG-CE2 3.38Å; S398-F400 WeakPolarHBondContact OG-CZ 3.29Å; S398-T419 PolarHBondContact N-OG1 3.09Å; S398-T419 PolarHBondContact O-N 2.86Å; S398-T419 PolarHBondContact O-OG1 2.93Å; S398-T419 PolarHBondContact OG-OG1 2.87Å
399	M	95.1	Very high	92.4	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	141	175.1	-63.2	-178.1	-59.6	0	0	108.3	L381 V396 T406 I407 H408 V416 G417	L381-M399 HydrophobicContact CB-SD 4.23Å; L381-M399 HydrophobicContact CD2-CG 4.49Å; L381-M399 HydrophobicContact CD2-SD 3.5Å; L381-M399 VanDerWaalsContact CD2-SD 3.5Å; L381-M399 HydrophobicContact CG-SD 3.5Å; L381-M399 VanDerWaalsContact CG-SD 3.5Å; V396-M399 HydrophobicContact CG1-CG 3.5Å; V396-M399 HydrophobicContact CG1-SD 4.06Å; M399-T406 WeakPolarHBondContact O-CA 3.44Å; M399-I407 HydrophobicContact CB-CD1 4.32Å; M399-I407 HydrophobicContact CB-CG1 3.67Å; M399-I407 PolarHBondContact O-N 3.43Å; M399-H408 VanDerWaalsContact CE-C 3.42Å; M399-H408 WeakPolarHBondContact CE-O 3.47Å; M399-V416 HydrophobicContact CB-CG1 3.77Å; M399-V416 HydrophobicContact CG-CG1 4.08Å; M399-V416 HydrophobicContact SD-CG1 4.33Å; M399-G417 CarbonylContact C-O 3.45Å; M399-G417 VanDerWaalsContact CA-O 3.31Å; M399-G417 WeakPolarHBondContact CA-O 3.38Å
400	F	92.5	Very high	92.3	Very high	19 Å²	19	54.4 Å²	54.4	8%	0.083	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	146	-177.6	-52	-84.1	0	0	0	110.3	S398 K405 G417 T419	S398-F400 VanDerWaalsContact CB-CZ 3.45Å; S398-F400 WeakPolarHBondContact OG-CE2 3.38Å; S398-F400 WeakPolarHBondContact OG-CZ 3.29Å; F400-K405 CarbonylContact C-O 3.55Å; F400-K405 VanDerWaalsContact CA-O 3.27Å; F400-K405 WeakPolarHBondContact CA-O 3.43Å; F400-G417 PolarHBondContact N-O 2.79Å; F400-G417 PolarHBondContact O-N 3.22Å; F400-T419 HydrophobicContact CD2-CG2 4.08Å; F400-T419 HydrophobicContact CE2-CG2 3.54Å
401	D	89.4	Confident	92.3	Very high	42 Å²	42	58 Å²	58	23%	0.225	29%	0.287	C	S	.	.			trans	-80.8	167.7	166.5	-170.8	21.1	0	0	0	110.4	N403 G404 K405 I407	D401-N403 PolarHBondContact O-N 2.76Å; D401-N403 VanDerWaalsContact O-N 3.14Å; D401-G404 WeakPolarHBondContact O-CA 3.47Å; D401-G404 PolarHBondContact O-N 3.08Å; D401-K405 HydrophobicContact CB-CB 4.46Å; D401-K405 PolarHBondContact N-O 3.35Å; D401-I407 HydrophobicContact CB-CG2 4.09Å
402	E	79.8	Confident	92.3	Very high	73 Å²	73	56.7 Å²	56.7	34%	0.341	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-33.3	176.6	66	-147.8	-139.9	0	0	113.2	F220 L221 G404	F220-E402 WeakPolarHBondContact CA-OE2 3.42Å; L221-E402 PolarHBondContact N-OE1 3.36Å; L221-E402 PolarHBondContact N-OE2 2.98Å; E402-G404 PolarHBondContact O-N 3.4Å
403	N	82.3	Confident	92.3	Very high	106 Å²	106	56.1 Å²	56.1	57%	0.567	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	6.2	178.5	-63.2	-64	0	0	0	113.1	D401 K405	D401-N403 PolarHBondContact O-N 2.76Å; D401-N403 VanDerWaalsContact O-N 3.14Å; N403-K405 PolarHBondContact O-N 3.01Å
404	G	82.9	Confident	92.1	Very high	36 Å²	36	57.1 Å²	57.1	37%	0.371	28%	0.283	S	S	.	.	S	Bend	trans	75.4	4.3	-177.4	0	0	0	0	0	114.9	D401 E402	D401-G404 WeakPolarHBondContact O-CA 3.47Å; D401-G404 PolarHBondContact O-N 3.08Å; E402-G404 PolarHBondContact O-N 3.4Å
405	K	89.8	Confident	92	Very high	147 Å²	147	57.4 Å²	57.4	64%	0.639	29%	0.285	S	S	*	.			trans	-71.2	138	175.8	-70.4	-179.9	-177.9	171.4	0	110.2	F400 D401 N403	F400-K405 CarbonylContact C-O 3.55Å; F400-K405 VanDerWaalsContact CA-O 3.27Å; F400-K405 WeakPolarHBondContact CA-O 3.43Å; D401-K405 HydrophobicContact CB-CB 4.46Å; D401-K405 PolarHBondContact N-O 3.35Å; N403-K405 PolarHBondContact O-N 3.01Å
406	T	93.7	Very high	91.9	Very high	88 Å²	88	53.1 Å²	53.1	54%	0.54	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	131.4	177.2	-54	0	0	0	0	110.2	M399	M399-T406 WeakPolarHBondContact O-CA 3.44Å
407	I	94.4	Very high	91.8	Very high	33 Å²	33	53.5 Å²	53.5	17%	0.169	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	149.5	176.7	63	173.2	0	0	0	110.6	M399 D401 A410 V416	M399-I407 HydrophobicContact CB-CD1 4.32Å; M399-I407 HydrophobicContact CB-CG1 3.67Å; M399-I407 PolarHBondContact O-N 3.43Å; D401-I407 HydrophobicContact CB-CG2 4.09Å; I407-A410 HydrophobicContact CD1-CB 4.15Å; I407-V416 HydrophobicContact CD1-CG1 4.07Å; I407-V416 HydrophobicContact CD1-CG2 3.78Å
408	H	93.1	Very high	91.9	Very high	143 Å²	143	46.3 Å²	46.3	66%	0.662	24%	0.244	S	C	*	.	S	Bend	trans	-96.7	-32.5	-177.7	-70	-65.5	0	0	0	113.4	M399	M399-H408 VanDerWaalsContact CE-C 3.42Å; M399-H408 WeakPolarHBondContact CE-O 3.47Å
409	E	94	Very high	92	Very high	79 Å²	79	44.9 Å²	44.9	37%	0.369	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	143.5	-178.7	-58.9	-172.5	-166	0	0	108.2	T380 L381 R382	T380-E409 HydrophobicContact CG2-CB 4.24Å; L381-E409 CarbonylContact O-C 3.58Å; L381-E409 WeakPolarHBondContact O-CA 3.48Å; R382-E409 HydrophobicContact CG-CG 4.43Å; R382-E409 VanDerWaalsContact CZ-CD 3.48Å; R382-E409 IonicContact CZ-OE1 3.44Å; R382-E409 IonicContact CZ-OE2 3.4Å; R382-E409 IonicContact NH1-OE1 2.65Å; R382-E409 PolarHBondContact NH1-OE1 3.48Å; R382-E409 IonicContact NH1-OE2 3.44Å; R382-E409 PolarHBondContact NH1-OE2 3.05Å; R382-E409 VanDerWaalsContact NH2-CD 3.35Å; R382-E409 IonicContact NH2-OE1 3.35Å; R382-E409 PolarHBondContact NH2-OE1 3.44Å; R382-E409 IonicContact NH2-OE2 3.71Å; R382-E409 PolarHBondContact NH2-OE2 3.03Å
410	A	94.4	Very high	92	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.4	171.6	0	0	0	0	0	110.4	I376 T380 L381 I407 V416	I376-A410 HydrophobicContact CG1-CB 4.33Å; T380-A410 CarbonylContact C-O 3.5Å; T380-A410 WeakPolarHBondContact CA-O 3.26Å; L381-A410 HydrophobicContact CB-CB 4.27Å; L381-A410 PolarHBondContact N-O 3.12Å; L381-A410 PolarHBondContact O-N 2.97Å; I407-A410 HydrophobicContact CD1-CB 4.15Å; A410-V416 HydrophobicContact CB-CG2 3.33Å
411	H	94.1	Very high	92.1	Very high	89 Å²	89	44.7 Å²	44.7	41%	0.412	24%	0.235	S	C	.	.			trans	-93	167.6	-177.5	-63.7	-64.9	0	0	0	111.2	M414	H411-M414 HydrophobicContact CB-CG 4.41Å; H411-M414 HydrophobicContact CB-SD 3.84Å; H411-M414 PolarHBondContact N-SD 3.01Å; H411-M414 WeakPolarHBondContact O-CB 3.28Å; H411-M414 PolarHBondContact O-N 3.34Å
412	P	94.5	Very high	92.4	Very high	18 Å²	18	49 Å²	49	12%	0.117	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	143.1	171.9	-27.8	36.5	0	0	0	112.4	A349 I376 G379 M414	A349-P412 HydrophobicContact CB-CB 3.57Å; A349-P412 HydrophobicContact CB-CG 3.85Å; I376-P412 CarbonylContact O-C 3.59Å; G379-P412 WeakPolarHBondContact O-CD 3.41Å; P412-M414 PolarHBondContact O-N 2.94Å
413	S	93.1	Very high	93	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.007	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	0.8	-176.1	-52.9	0	0	0	0	116.4	R179 S180 T231 I376	R179-S413 PolarHBondContact NH1-OG 2.89Å; S180-S413 WeakPolarHBondContact O-CB 3.37Å; S180-S413 PolarHBondContact O-OG 2.88Å; T231-S413 WeakPolarHBondContact CB-O 3.35Å; T231-S413 PolarHBondContact OG1-O 2.81Å; I376-S413 WeakPolarHBondContact O-CA 3.31Å; I376-S413 PolarHBondContact O-N 3.11Å
414	M	92.8	Very high	93.5	Very high	45 Å²	45	47 Å²	47	22%	0.222	24%	0.24	C	C	.	.			trans	-81.6	133.6	174	-67	-179.1	61	0	0	111.7	I376 H411 P412	I376-M414 PolarHBondContact N-O 3.08Å; H411-M414 HydrophobicContact CB-CG 4.41Å; H411-M414 HydrophobicContact CB-SD 3.84Å; H411-M414 PolarHBondContact N-SD 3.01Å; H411-M414 WeakPolarHBondContact O-CB 3.28Å; H411-M414 PolarHBondContact O-N 3.34Å; P412-M414 PolarHBondContact O-N 2.94Å
415	P	94.7	Very high	94.1	Very high	7 Å²	7	45.4 Å²	45.4	5%	0.045	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	137.2	169.4	32.4	-32.5	0	0	0	110.7	A219 T231 A374	A219-P415 HydrophobicContact CB-CB 3.56Å; A219-P415 HydrophobicContact CB-CG 4.29Å; T231-P415 HydrophobicContact CG2-CB 4.4Å; T231-P415 HydrophobicContact CG2-CG 3.99Å; A374-P415 CarbonylContact O-C 3.53Å; A374-P415 WeakPolarHBondContact O-CA 3.26Å
416	V	95.3	Very high	94.3	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	132.5	-176.1	179.3	0	0	0	0	111.9	T373 A374 M399 I407 A410 I418	T373-V416 WeakPolarHBondContact CA-O 3.29Å; A374-V416 PolarHBondContact N-O 3.04Å; A374-V416 PolarHBondContact O-N 3.34Å; M399-V416 HydrophobicContact CB-CG1 3.77Å; M399-V416 HydrophobicContact CG-CG1 4.08Å; M399-V416 HydrophobicContact SD-CG1 4.33Å; I407-V416 HydrophobicContact CD1-CG1 4.07Å; I407-V416 HydrophobicContact CD1-CG2 3.78Å; A410-V416 HydrophobicContact CB-CG2 3.33Å; V416-I418 HydrophobicContact CB-CG1 4.48Å; V416-I418 HydrophobicContact CG1-CG1 3.95Å
417	G	95.3	Very high	94.2	Very high	12 Å²	12	37.7 Å²	37.7	12%	0.124	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	109.7	164.9	0	0	0	0	0	111.4	T372 M399 F400	T372-G417 CarbonylContact O-C 3.55Å; T372-G417 WeakPolarHBondContact O-CA 3.4Å; M399-G417 CarbonylContact C-O 3.45Å; M399-G417 VanDerWaalsContact CA-O 3.31Å; M399-G417 WeakPolarHBondContact CA-O 3.38Å; F400-G417 PolarHBondContact N-O 2.79Å; F400-G417 PolarHBondContact O-N 3.22Å
418	I	95.9	Very high	94	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	137	-177.8	-54.1	172.6	0	0	0	110	V371 T372 A374 L381 L387 V396 V416 I431	V371-I418 WeakPolarHBondContact CA-O 3.45Å; T372-I418 PolarHBondContact N-O 3.42Å; T372-I418 PolarHBondContact O-N 3.37Å; A374-I418 HydrophobicContact CB-CD1 3.89Å; L381-I418 HydrophobicContact CD2-CD1 3.7Å; L381-I418 HydrophobicContact CD2-CG1 4.02Å; L387-I418 HydrophobicContact CD1-CD1 4Å; L387-I418 HydrophobicContact CD1-CG2 4.14Å; V396-I418 HydrophobicContact CG1-CG2 4.37Å; V396-I418 HydrophobicContact CG2-CG2 3.88Å; V416-I418 HydrophobicContact CB-CG1 4.48Å; V416-I418 HydrophobicContact CG1-CG1 3.95Å; I418-I431 HydrophobicContact CD1-CD1 4.27Å
419	T	95.7	Very high	94	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.012	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	154.7	176.7	57.4	0	0	0	0	112.4	R368 V371 V396 R397 S398 F400	R368-T419 HydrophobicContact CB-CG2 4.19Å; V371-T419 HydrophobicContact CB-CG2 4.35Å; V371-T419 HydrophobicContact CG1-CG2 4Å; V371-T419 HydrophobicContact CG2-CG2 3.85Å; V396-T419 WeakPolarHBondContact CA-O 3.19Å; R397-T419 PolarHBondContact N-O 3.14Å; S398-T419 PolarHBondContact N-OG1 3.09Å; S398-T419 PolarHBondContact O-N 2.86Å; S398-T419 PolarHBondContact O-OG1 2.93Å; S398-T419 PolarHBondContact OG-OG1 2.87Å; F400-T419 HydrophobicContact CD2-CG2 4.08Å; F400-T419 HydrophobicContact CE2-CG2 3.54Å
420	G	94.3	Very high	94.1	Very high	7 Å²	7	34.1 Å²	34.1	7%	0.072	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	107.4	16.1	179.6	0	0	0	0	0	114.4	A394 K395	A394-G420 WeakPolarHBondContact CA-O 3.4Å; K395-G420 PolarHBondContact N-O 3.45Å
421	W	96	Very high	94.2	Very high	9 Å²	9	34.1 Å²	34.1	3%	0.034	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	141.9	167.6	-63.6	95.8	0	0	0	111.1	P370 T372 L387 A389 C392 A394 D423 P425	P370-W421 HydrophobicContact CB-CB 3.99Å; T372-W421 HydrophobicContact CG2-CD2 4.22Å; T372-W421 HydrophobicContact CG2-CG 4.23Å; T372-W421 HydrophobicContact CG2-CZ2 4.29Å; T372-W421 PolarHBondContact OG1-NE1 3.32Å; L387-W421 HydrophobicContact CB-CH2 4.42Å; A389-W421 HydrophobicContact CB-CH2 3.47Å; A389-W421 VanDerWaalsContact CB-CH2 3.47Å; A389-W421 HydrophobicContact CB-CZ3 3.7Å; C392-W421 HydrophobicContact CB-CE3 4.29Å; C392-W421 HydrophobicContact CB-CZ3 4.45Å; A394-W421 HydrophobicContact CB-CB 4.27Å; A394-W421 HydrophobicContact CB-CD2 3.46Å; A394-W421 VanDerWaalsContact CB-CD2 3.46Å; A394-W421 HydrophobicContact CB-CE3 3.61Å; A394-W421 HydrophobicContact CB-CG 3.79Å; A394-W421 HydrophobicContact CB-CH2 4.34Å; A394-W421 HydrophobicContact CB-CZ2 4.27Å; A394-W421 HydrophobicContact CB-CZ3 4.04Å; W421-D423 WeakPolarHBondContact CB-O 3.39Å; W421-P425 HydrophobicContact CD2-CG 4Å; W421-P425 HydrophobicContact CE3-CB 4.39Å; W421-P425 HydrophobicContact CE3-CG 3.88Å; W421-P425 HydrophobicContact CH2-CB 4.5Å; W421-P425 HydrophobicContact CH2-CG 4.06Å; W421-P425 HydrophobicContact CZ2-CG 4.13Å; W421-P425 HydrophobicContact CZ3-CB 4.16Å; W421-P425 HydrophobicContact CZ3-CG 3.92Å
422	R	93.9	Very high	94.3	Very high	134 Å²	134	30.6 Å²	30.6	51%	0.506	17%	0.167	S	C	.	.	S	Bend	trans	-78.5	-46.6	172.9	-66.6	-60.7	-174.6	172.9	-0.4	111.3	W393	W393-R422 HydrophobicContact CD2-CG 4.21Å; W393-R422 HydrophobicContact CH2-CG 4.33Å; W393-R422 HydrophobicContact CZ2-CG 3.79Å; W393-R422 PolarHBondContact O-N 3.29Å; W393-R422 VanDerWaalsContact O-N 3.12Å
423	D	92.9	Very high	94.4	Very high	88 Å²	88	32.4 Å²	32.4	47%	0.471	17%	0.174	S	C	.	.	S	Bend	trans	-128.1	154.4	176	-61.1	-45.7	0	0	0	107.3	C392 W421	C392-D423 HydrophobicContact CB-CB 4.34Å; C392-D423 VanDerWaalsContact SG-CB 3.53Å; W421-D423 WeakPolarHBondContact CB-O 3.39Å
424	L	93.1	Very high	94.6	Very high	49 Å²	49	32.9 Å²	32.9	26%	0.257	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-70.8	127.1	178.1	-74.1	160.9	0	0	0	109.7	F363 T364 P370 C392 V553	F363-L424 WeakPolarHBondContact O-CD2 3.07Å; T364-L424 WeakPolarHBondContact OG1-CD1 3.27Å; P370-L424 HydrophobicContact CB-CD2 3.78Å; P370-L424 HydrophobicContact CB-CG 4.13Å; C392-L424 PolarHBondContact SG-O 3.15Å; L424-V553 HydrophobicContact CD1-CB 3.88Å; L424-V553 HydrophobicContact CD1-CG1 4.2Å
425	P	95.2	Very high	94.6	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.013	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-74.9	154.2	169	32.2	-32.6	0	0	0	110.3	V359 S362 T372 A389 C392 W421 E429	V359-P425 HydrophobicContact CG2-CB 4.44Å; V359-P425 HydrophobicContact CG2-CG 4.2Å; S362-P425 VanDerWaalsContact CB-O 3.25Å; S362-P425 WeakPolarHBondContact CB-O 3.47Å; S362-P425 PolarHBondContact OG-O 3.33Å; T372-P425 HydrophobicContact CG2-CG 3.44Å; T372-P425 VanDerWaalsContact CG2-CG 3.44Å; A389-P425 HydrophobicContact CB-CB 3.76Å; A389-P425 HydrophobicContact CB-CG 4.44Å; C392-P425 HydrophobicContact CB-CB 4.32Å; W421-P425 HydrophobicContact CD2-CG 4Å; W421-P425 HydrophobicContact CE3-CB 4.39Å; W421-P425 HydrophobicContact CE3-CG 3.88Å; W421-P425 HydrophobicContact CH2-CB 4.5Å; W421-P425 HydrophobicContact CH2-CG 4.06Å; W421-P425 HydrophobicContact CZ2-CG 4.13Å; W421-P425 HydrophobicContact CZ3-CB 4.16Å; W421-P425 HydrophobicContact CZ3-CG 3.92Å; P425-E429 WeakPolarHBondContact CB-OE2 3.49Å
426	S	93.3	Very high	94.6	Very high	61 Å²	61	40.2 Å²	40.2	43%	0.427	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-72.8	146	175.9	-67.8	0	0	0	0	110.5	E429 D525	S426-E429 PolarHBondContact N-OE2 2.88Å; S426-E429 VanDerWaalsContact N-OE2 3.13Å; S426-E429 WeakPolarHBondContact O-CB 3.38Å; S426-E429 VanDerWaalsContact O-CG 3.31Å; S426-E429 WeakPolarHBondContact O-CG 3.35Å; S426-E429 PolarHBondContact O-N 3.23Å; S426-D525 WeakPolarHBondContact CA-OD2 3.48Å
427	A	91.8	Very high	94.6	Very high	12 Å²	12	42.7 Å²	42.7	10%	0.099	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	137.1	-179.2	0	0	0	0	0	110.8	R247 D525	R247-A427 VanDerWaalsContact CZ-C 3.42Å; R247-A427 VanDerWaalsContact NE-C 3.27Å; R247-A427 PolarHBondContact NE-O 3.33Å; R247-A427 PolarHBondContact NH2-O 3.26Å; R247-A427 VanDerWaalsContact NH2-O 3.07Å; A427-D525 HydrophobicContact CB-CB 4.21Å; A427-D525 WeakPolarHBondContact CB-OD2 3.11Å; A427-D525 PolarHBondContact N-OD2 3.37Å
428	G	91.1	Very high	94.7	Very high	31 Å²	31	46.2 Å²	46.2	32%	0.32	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.5	-7	-172.3	0	0	0	0	0	114.5	V359	V359-G428 VanDerWaalsContact O-CA 3.23Å; V359-G428 WeakPolarHBondContact O-CA 3.4Å; V359-G428 PolarHBondContact O-N 3.47Å
429	E	93.5	Very high	94.6	Very high	48 Å²	48	49.4 Å²	49.4	22%	0.224	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-69.2	146.1	177	-71.1	-176.3	156.7	0	0	112.5	V359 A389 G390 P425 S426	V359-E429 PolarHBondContact N-O 3.46Å; A389-E429 HydrophobicContact CB-CB 4.48Å; G390-E429 VanDerWaalsContact CA-CD 3.45Å; G390-E429 WeakPolarHBondContact CA-OE1 3.43Å; G390-E429 VanDerWaalsContact CA-OE2 3.29Å; G390-E429 WeakPolarHBondContact CA-OE2 3.38Å; G390-E429 PolarHBondContact N-OE2 2.96Å; P425-E429 WeakPolarHBondContact CB-OE2 3.49Å; S426-E429 PolarHBondContact N-OE2 2.88Å; S426-E429 VanDerWaalsContact N-OE2 3.13Å; S426-E429 WeakPolarHBondContact O-CB 3.38Å; S426-E429 VanDerWaalsContact O-CG 3.31Å; S426-E429 WeakPolarHBondContact O-CG 3.35Å; S426-E429 PolarHBondContact O-N 3.23Å
430	E	94.7	Very high	94.6	Very high	100 Å²	100	49.3 Å²	49.3	47%	0.467	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	136	171.9	-61.5	-176.3	174.7	0	0	111	G357 A389	G357-E430 CarbonylContact O-C 3.54Å; G357-E430 WeakPolarHBondContact O-CA 3.38Å; A389-E430 WeakPolarHBondContact CA-O 3.38Å
431	I	96.9	Very high	94.6	Very high	1 Å²	1	55 Å²	55	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126.4	174.7	-58.4	171.5	0	0	0	107.7	E356 G357 V359 A374 L387 V388 A389 I418	E356-I431 VanDerWaalsContact CA-O 3.26Å; E356-I431 WeakPolarHBondContact CA-O 3.46Å; G357-I431 PolarHBondContact N-O 2.93Å; G357-I431 PolarHBondContact O-N 3.46Å; V359-I431 HydrophobicContact CG2-CD1 3.77Å; V359-I431 HydrophobicContact CG2-CG1 3.67Å; A374-I431 HydrophobicContact CB-CD1 3.38Å; L387-I431 HydrophobicContact CB-CG2 3.98Å; L387-I431 HydrophobicContact CD1-CG2 3.99Å; L387-I431 HydrophobicContact CD2-CG2 3.94Å; L387-I431 HydrophobicContact CG-CG2 4.18Å; V388-I431 WeakPolarHBondContact O-CA 3.31Å; A389-I431 HydrophobicContact CB-CG1 4.09Å; I418-I431 HydrophobicContact CD1-CD1 4.27Å
432	L	96.8	Very high	94.5	Very high	15 Å²	15	58.1 Å²	58.1	8%	0.079	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.3	173.5	-61	176.2	0	0	0	110.2	A165 E356 V388	A165-L432 HydrophobicContact CB-CB 4.31Å; A165-L432 HydrophobicContact CB-CD1 3.87Å; A165-L432 VanDerWaalsContact O-CD1 3.27Å; A165-L432 WeakPolarHBondContact O-CD1 3.38Å; E356-L432 HydrophobicContact CB-CD2 4.15Å; E356-L432 HydrophobicContact CG-CD2 4.15Å; V388-L432 PolarHBondContact N-O 3.43Å; V388-L432 PolarHBondContact O-N 3.11Å
433	E	96.7	Very high	94.6	Very high	55 Å²	55	51.7 Å²	51.7	26%	0.257	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139	171.6	179.7	175.4	-154	0	0	111.9	P354 V355 C385 V386 L387	P354-E433 WeakPolarHBondContact CA-OE2 3.39Å; P354-E433 HydrophobicContact CB-CB 4.19Å; V355-E433 HydrophobicContact CB-CB 3.99Å; V355-E433 WeakPolarHBondContact CG2-OE2 3.47Å; V355-E433 PolarHBondContact N-OE2 3.14Å; V355-E433 WeakPolarHBondContact O-CB 3.33Å; V355-E433 PolarHBondContact O-N 3.47Å; C385-E433 WeakPolarHBondContact CB-OE1 3.46Å; C385-E433 PolarHBondContact SG-OE1 3.11Å; V386-E433 WeakPolarHBondContact O-CA 3.43Å; L387-E433 HydrophobicContact CD2-CB 3.95Å; L387-E433 HydrophobicContact CD2-CG 4.44Å
434	V	95.9	Very high	94.7	Very high	12 Å²	12	47.8 Å²	47.8	7%	0.073	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	158.9	176.9	-63.3	0	0	0	0	110.9	A165 V386 V388 S436 R439 A440	A165-V434 HydrophobicContact CB-CG1 4.16Å; V386-V434 HydrophobicContact CB-CG2 4.06Å; V386-V434 HydrophobicContact CG1-CG2 3.7Å; V386-V434 PolarHBondContact O-N 3.28Å; V388-V434 HydrophobicContact CG2-CG1 3.95Å; V388-V434 HydrophobicContact CG2-CG2 3.91Å; V434-S436 VanDerWaalsContact C-N 3.35Å; V434-S436 PolarHBondContact O-N 2.99Å; V434-R439 HydrophobicContact CB-CG 4.18Å; V434-A440 HydrophobicContact CG2-CB 3.73Å
435	E	93.4	Very high	94.7	Very high	157 Å²	157	50.5 Å²	50.5	73%	0.734	26%	0.263	S	S	*	.	S	Bend	trans	-72.5	-27.6	-169.1	-49.7	85.4	174.1	0	0	113.3
436	S	95.4	Very high	94.7	Very high	49 Å²	49	52.2 Å²	52.2	34%	0.343	27%	0.269	S	S	.	.			trans	-155.4	157.4	-172.6	68.3	0	0	0	0	114	V434 R439 A440	V434-S436 VanDerWaalsContact C-N 3.35Å; V434-S436 PolarHBondContact O-N 2.99Å; S436-R439 WeakPolarHBondContact O-CB 3.45Å; S436-R439 PolarHBondContact O-N 3.38Å; S436-R439 VanDerWaalsContact O-N 3.16Å; S436-R439 WeakPolarHBondContact OG-CB 3.39Å; S436-R439 PolarHBondContact OG-N 3.22Å; S436-A440 PolarHBondContact O-N 2.97Å
437	E	95	Very high	94.7	Very high	53 Å²	53	51.2 Å²	51.2	25%	0.248	26%	0.256	C	S	.	.	H	α-helix	trans	-59.4	-40.1	176.8	-60.9	-178.9	-152.8	0	0	113.8	V386 W393 K395 R439 A440 R441	V386-E437 HydrophobicContact CG2-CG 4.12Å; W393-E437 HydrophobicContact CH2-CB 4.42Å; W393-E437 HydrophobicContact CH2-CG 4.35Å; W393-E437 HydrophobicContact CZ3-CB 4.32Å; W393-E437 HydrophobicContact CZ3-CG 4Å; K395-E437 VanDerWaalsContact CD-OE1 3.31Å; K395-E437 WeakPolarHBondContact CD-OE1 3.46Å; K395-E437 WeakPolarHBondContact CE-OE1 3.34Å; K395-E437 IonicContact NZ-OE1 3.49Å; K395-E437 PolarHBondContact NZ-OE1 2.95Å; E437-R439 VanDerWaalsContact C-N 3.31Å; E437-R439 PolarHBondContact O-N 2.86Å; E437-A440 WeakPolarHBondContact O-CB 3.46Å; E437-A440 PolarHBondContact O-N 3Å; E437-R441 WeakPolarHBondContact O-CG 3.33Å; E437-R441 PolarHBondContact O-N 3.23Å; E437-R441 VanDerWaalsContact O-N 3.14Å
438	P	96.2	Very high	94.8	Very high	86 Å²	86	54.5 Å²	54.5	56%	0.558	27%	0.268	S	S	*	.	H	α-helix	trans	-61.1	-40.7	173.8	-24	35.5	0	0	0	112.2	A440 R441 E442	P438-A440 PolarHBondContact O-N 2.87Å; P438-R441 PolarHBondContact O-N 3.4Å; P438-E442 WeakPolarHBondContact O-CG 3.23Å; P438-E442 PolarHBondContact O-N 3.3Å
439	R	95.3	Very high	94.9	Very high	66 Å²	66	56.5 Å²	56.5	25%	0.249	27%	0.267	C	S	.	.	H	α-helix	trans	-61.8	-43.7	176.7	-177.4	66.6	177.3	130.4	12.6	111.4	K163 D164 V434 S436 E437 R441 E442 V443	K163-R439 PolarHBondContact O-NH1 2.95Å; K163-R439 PolarHBondContact O-NH2 2.78Å; D164-R439 PolarHBondContact O-NH2 2.96Å; V434-R439 HydrophobicContact CB-CG 4.18Å; S436-R439 WeakPolarHBondContact O-CB 3.45Å; S436-R439 PolarHBondContact O-N 3.38Å; S436-R439 VanDerWaalsContact O-N 3.16Å; S436-R439 WeakPolarHBondContact OG-CB 3.39Å; S436-R439 PolarHBondContact OG-N 3.22Å; E437-R439 VanDerWaalsContact C-N 3.31Å; E437-R439 PolarHBondContact O-N 2.86Å; R439-R441 VanDerWaalsContact C-N 3.3Å; R439-R441 PolarHBondContact O-N 3.35Å; R439-E442 IonicContact NH1-OE2 2.72Å; R439-E442 PolarHBondContact O-N 3.43Å; R439-V443 WeakPolarHBondContact O-CG2 3.32Å; R439-V443 PolarHBondContact O-N 2.96Å; R439-V443 VanDerWaalsContact O-N 3.07Å
440	A	94.9	Very high	94.9	Very high	0 Å²	0	58 Å²	58	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-56.9	-43.5	175.9	0	0	0	0	0	112.4	V386 V388 W393 V434 S436 E437 P438 V443 V444	V386-A440 HydrophobicContact CG1-CB 3.73Å; V388-A440 HydrophobicContact CG2-CB 3.79Å; W393-A440 HydrophobicContact CB-CB 4Å; W393-A440 HydrophobicContact CD2-CB 4.27Å; W393-A440 HydrophobicContact CE3-CB 4.31Å; W393-A440 HydrophobicContact CG-CB 4.15Å; V434-A440 HydrophobicContact CG2-CB 3.73Å; S436-A440 PolarHBondContact O-N 2.97Å; E437-A440 WeakPolarHBondContact O-CB 3.46Å; E437-A440 PolarHBondContact O-N 3Å; P438-A440 PolarHBondContact O-N 2.87Å; A440-V443 PolarHBondContact O-N 3.49Å; A440-V444 WeakPolarHBondContact O-CG2 3.07Å; A440-V444 PolarHBondContact O-N 2.92Å
441	R	94.6	Very high	94.8	Very high	126 Å²	126	58.4 Å²	58.4	48%	0.475	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-42.1	176.8	-66.8	-179.9	-166.3	179	5.7	112.2	W393 E437 P438 R439 V443 V444 D445	W393-R441 HydrophobicContact CZ2-CG 4.47Å; E437-R441 WeakPolarHBondContact O-CG 3.33Å; E437-R441 PolarHBondContact O-N 3.23Å; E437-R441 VanDerWaalsContact O-N 3.14Å; P438-R441 PolarHBondContact O-N 3.4Å; R439-R441 VanDerWaalsContact C-N 3.3Å; R439-R441 PolarHBondContact O-N 3.35Å; R441-V443 VanDerWaalsContact C-N 3.26Å; R441-V443 PolarHBondContact O-N 3.49Å; R441-V444 PolarHBondContact O-N 3.07Å; R441-D445 VanDerWaalsContact O-CB 3.31Å; R441-D445 WeakPolarHBondContact O-CB 3.3Å; R441-D445 PolarHBondContact O-N 3.3Å
442	E	94.4	Very high	94.5	Very high	75 Å²	75	64.5 Å²	64.5	35%	0.35	30%	0.304	S	S	.	.	H	α-helix	trans	-59.9	-38.1	176.3	-68.4	-168.1	159	0	0	112.5	K163 P438 R439 W446	K163-E442 HydrophobicContact CD-CB 4.46Å; K163-E442 WeakPolarHBondContact CD-OE2 3.49Å; K163-E442 IonicContact NZ-OE1 2.72Å; K163-E442 PolarHBondContact NZ-OE1 3.35Å; K163-E442 IonicContact NZ-OE2 3Å; K163-E442 PolarHBondContact NZ-OE2 3.34Å; P438-E442 WeakPolarHBondContact O-CG 3.23Å; P438-E442 PolarHBondContact O-N 3.3Å; R439-E442 IonicContact NH1-OE2 2.72Å; R439-E442 PolarHBondContact O-N 3.43Å; E442-W446 VanDerWaalsContact O-CB 3.32Å; E442-W446 WeakPolarHBondContact O-CB 3.15Å; E442-W446 PolarHBondContact O-N 2.77Å
443	V	95.2	Very high	94.3	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.9	-49.2	176.7	174.4	0	0	0	0	110.6	K163 D164 A165 V388 R439 A440 R441 D445 W446 R447	K163-V443 WeakPolarHBondContact O-CG2 3.44Å; D164-V443 VanDerWaalsContact OD1-CG1 3.27Å; D164-V443 WeakPolarHBondContact OD1-CG1 3.47Å; A165-V443 HydrophobicContact CB-CG1 4.12Å; A165-V443 HydrophobicContact CB-CG2 4.15Å; V388-V443 HydrophobicContact CG1-CG1 3.85Å; R439-V443 WeakPolarHBondContact O-CG2 3.32Å; R439-V443 PolarHBondContact O-N 2.96Å; R439-V443 VanDerWaalsContact O-N 3.07Å; A440-V443 PolarHBondContact O-N 3.49Å; R441-V443 VanDerWaalsContact C-N 3.26Å; R441-V443 PolarHBondContact O-N 3.49Å; V443-D445 PolarHBondContact O-N 3.36Å; V443-W446 WeakPolarHBondContact O-CB 3.36Å; V443-W446 PolarHBondContact O-N 2.85Å; V443-R447 WeakPolarHBondContact O-CG 3.49Å; V443-R447 PolarHBondContact O-N 2.68Å
444	V	95	Very high	94.2	Very high	6 Å²	6	70.4 Å²	70.4	4%	0.036	33%	0.331	C	S	.	.	H	α-helix	trans	-62.6	-43.9	178.9	167.9	0	0	0	0	111.8	V388 N391 W393 A440 R441 W446 R447 K448	V388-V444 HydrophobicContact CG1-CG2 4.16Å; N391-V444 WeakPolarHBondContact O-CG1 3.47Å; W393-V444 HydrophobicContact CB-CG2 4.15Å; A440-V444 WeakPolarHBondContact O-CG2 3.07Å; A440-V444 PolarHBondContact O-N 2.92Å; R441-V444 PolarHBondContact O-N 3.07Å; V444-W446 VanDerWaalsContact C-N 3.25Å; V444-W446 PolarHBondContact O-N 2.82Å; V444-R447 PolarHBondContact O-N 2.85Å; V444-K448 HydrophobicContact CG1-CD 4.03Å; V444-K448 HydrophobicContact CG1-CG 4.43Å; V444-K448 WeakPolarHBondContact O-CB 3.18Å; V444-K448 WeakPolarHBondContact O-CG 3.15Å; V444-K448 PolarHBondContact O-N 3.3Å
445	D	93.9	Very high	94.1	Very high	106 Å²	106	75.9 Å²	75.9	57%	0.567	35%	0.354	S	S	*	.	H	α-helix	trans	-64.1	-33.7	177.9	-69.7	-17.5	0	0	0	111.5	R441 V443 Y449	R441-D445 VanDerWaalsContact O-CB 3.31Å; R441-D445 WeakPolarHBondContact O-CB 3.3Å; R441-D445 PolarHBondContact O-N 3.3Å; V443-D445 PolarHBondContact O-N 3.36Å; D445-Y449 VanDerWaalsContact O-CB 3.23Å; D445-Y449 WeakPolarHBondContact O-CB 3.4Å; D445-Y449 PolarHBondContact O-N 2.99Å
446	W	94.4	Very high	94.1	Very high	37 Å²	37	69.7 Å²	69.7	14%	0.14	33%	0.333	C	S	.	.	H	α-helix	trans	-66.6	-50.7	173.7	175.8	-95.8	0	0	0	111.8	K160 N162 E442 V443 V444 K448 Y449 E450	K160-W446 HydrophobicContact CB-CZ3 3.66Å; K160-W446 HydrophobicContact CD-CZ3 4.46Å; N162-W446 HydrophobicContact CB-CH2 4.36Å; N162-W446 HydrophobicContact CB-CZ2 3.86Å; N162-W446 PolarHBondContact OD1-NE1 2.93Å; E442-W446 VanDerWaalsContact O-CB 3.32Å; E442-W446 WeakPolarHBondContact O-CB 3.15Å; E442-W446 PolarHBondContact O-N 2.77Å; V443-W446 WeakPolarHBondContact O-CB 3.36Å; V443-W446 PolarHBondContact O-N 2.85Å; V444-W446 VanDerWaalsContact C-N 3.25Å; V444-W446 PolarHBondContact O-N 2.82Å; W446-K448 PolarHBondContact O-N 3.01Å; W446-Y449 HydrophobicContact CE3-CD1 4.35Å; W446-Y449 HydrophobicContact CZ3-CD1 4.2Å; W446-Y449 HydrophobicContact CZ3-CE1 4.4Å; W446-Y449 WeakPolarHBondContact O-CB 3.3Å; W446-Y449 PolarHBondContact O-N 3.07Å; W446-Y449 VanDerWaalsContact O-N 3.17Å; W446-E450 PolarHBondContact NE1-OE2 3.02Å; W446-E450 PolarHBondContact O-N 2.89Å
447	R	94.4	Very high	94.1	Very high	41 Å²	41	73.8 Å²	73.8	16%	0.155	34%	0.344	C	S	.	.	H	α-helix	trans	-61.3	-42.8	179.4	-69.2	177	-179.6	-169.9	-7.1	112.3	D164 A165 G390 N391 V443 V444 Y449 E450 Q451	D164-R447 IonicContact OD1-CZ 2.77Å; D164-R447 VanDerWaalsContact OD1-CZ 3.3Å; D164-R447 IonicContact OD1-NE 3.03Å; D164-R447 PolarHBondContact OD1-NE 3.32Å; D164-R447 IonicContact OD1-NH2 3.27Å; D164-R447 PolarHBondContact OD1-NH2 3.48Å; D164-R447 IonicContact OD2-NE 2.87Å; D164-R447 IonicContact OD2-NH2 3.44Å; A165-R447 PolarHBondContact O-NH2 2.83Å; G390-R447 WeakPolarHBondContact O-CD 3.38Å; G390-R447 PolarHBondContact O-NH1 3.35Å; N391-R447 WeakPolarHBondContact OD1-CB 3.34Å; V443-R447 WeakPolarHBondContact O-CG 3.49Å; V443-R447 PolarHBondContact O-N 2.68Å; V444-R447 PolarHBondContact O-N 2.85Å; R447-Y449 PolarHBondContact O-N 2.76Å; R447-E450 PolarHBondContact O-N 3.07Å; R447-Q451 WeakPolarHBondContact O-CB 3.47Å; R447-Q451 PolarHBondContact O-N 2.81Å
448	K	93	Very high	94.1	Very high	80 Å²	80	76.9 Å²	76.9	35%	0.348	36%	0.358	S	S	.	.	H	α-helix	trans	-60.9	-44.2	173.5	-74.1	-179.4	178.7	-179.3	0	112	N391 V444 W446 E450 Q451 E452	N391-K448 HydrophobicContact CB-CG 4.49Å; V444-K448 HydrophobicContact CG1-CD 4.03Å; V444-K448 HydrophobicContact CG1-CG 4.43Å; V444-K448 WeakPolarHBondContact O-CB 3.18Å; V444-K448 WeakPolarHBondContact O-CG 3.15Å; V444-K448 PolarHBondContact O-N 3.3Å; W446-K448 PolarHBondContact O-N 3.01Å; K448-E450 PolarHBondContact O-N 2.86Å; K448-Q451 PolarHBondContact O-N 2.91Å; K448-E452 WeakPolarHBondContact O-CB 3.34Å; K448-E452 VanDerWaalsContact O-CG 3.29Å; K448-E452 WeakPolarHBondContact O-CG 3.27Å; K448-E452 PolarHBondContact O-N 3.11Å
449	Y	93.3	Very high	94	Very high	74 Å²	74	76.1 Å²	76.1	29%	0.29	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-44.2	176.8	171.2	-105.6	0	0	0	111.8	K160 D445 W446 R447 E452 Q453	K160-Y449 HydrophobicContact CD-CD1 4.05Å; K160-Y449 HydrophobicContact CD-CE1 3.79Å; K160-Y449 HydrophobicContact CD-CE2 4.44Å; K160-Y449 HydrophobicContact CD-CG 4.48Å; K160-Y449 VanDerWaalsContact NZ-CE2 3.32Å; D445-Y449 VanDerWaalsContact O-CB 3.23Å; D445-Y449 WeakPolarHBondContact O-CB 3.4Å; D445-Y449 PolarHBondContact O-N 2.99Å; W446-Y449 HydrophobicContact CE3-CD1 4.35Å; W446-Y449 HydrophobicContact CZ3-CD1 4.2Å; W446-Y449 HydrophobicContact CZ3-CE1 4.4Å; W446-Y449 WeakPolarHBondContact O-CB 3.3Å; W446-Y449 PolarHBondContact O-N 3.07Å; W446-Y449 VanDerWaalsContact O-N 3.17Å; R447-Y449 PolarHBondContact O-N 2.76Å; Y449-E452 PolarHBondContact O-N 3.23Å; Y449-Q453 HydrophobicContact CD1-CG 4.49Å; Y449-Q453 HydrophobicContact CD2-CG 4.31Å; Y449-Q453 HydrophobicContact CE1-CG 4.03Å; Y449-Q453 HydrophobicContact CE2-CG 3.82Å; Y449-Q453 VanDerWaalsContact O-CG 3.31Å; Y449-Q453 WeakPolarHBondContact O-CG 3.41Å; Y449-Q453 PolarHBondContact O-N 3.16Å
450	E	92.8	Very high	93.9	Very high	80 Å²	80	77.1 Å²	77.1	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-61.1	-49.3	177.8	-175	162.6	-152.2	0	0	111.6	W446 R447 K448 E452 Q453 E454	W446-E450 PolarHBondContact NE1-OE2 3.02Å; W446-E450 PolarHBondContact O-N 2.89Å; R447-E450 PolarHBondContact O-N 3.07Å; K448-E450 PolarHBondContact O-N 2.86Å; E450-E452 VanDerWaalsContact C-N 3.35Å; E450-E452 PolarHBondContact O-N 3.03Å; E450-Q453 WeakPolarHBondContact O-CB 3.45Å; E450-Q453 PolarHBondContact O-N 3.33Å; E450-E454 PolarHBondContact O-N 3.18Å
451	Q	92.5	Very high	94	Very high	108 Å²	108	84 Å²	84	51%	0.505	39%	0.388	S	S	.	.	H	α-helix	trans	-60.3	-41.6	176.5	-169.5	-180	15	0	0	112.5	N391 R447 K448 Q453 E454 K455	N391-Q451 PolarHBondContact ND2-OE1 2.97Å; R447-Q451 WeakPolarHBondContact O-CB 3.47Å; R447-Q451 PolarHBondContact O-N 2.81Å; K448-Q451 PolarHBondContact O-N 2.91Å; Q451-Q453 VanDerWaalsContact C-N 3.32Å; Q451-Q453 PolarHBondContact O-N 3.4Å; Q451-E454 PolarHBondContact O-N 3.46Å; Q451-K455 WeakPolarHBondContact O-CB 3.49Å; Q451-K455 PolarHBondContact O-N 3.02Å
452	E	92.4	Very high	94	Very high	129 Å²	129	81.6 Å²	81.6	60%	0.603	38%	0.384	S	S	*	.	H	α-helix	trans	-64.1	-34.7	174.6	-76.8	175.2	-177	0	0	112.4	K448 Y449 E450 G456	K448-E452 WeakPolarHBondContact O-CB 3.34Å; K448-E452 VanDerWaalsContact O-CG 3.29Å; K448-E452 WeakPolarHBondContact O-CG 3.27Å; K448-E452 PolarHBondContact O-N 3.11Å; Y449-E452 PolarHBondContact O-N 3.23Å; E450-E452 VanDerWaalsContact C-N 3.35Å; E450-E452 PolarHBondContact O-N 3.03Å; E452-G456 WeakPolarHBondContact O-CA 3.18Å; E452-G456 PolarHBondContact O-N 3.29Å
453	Q	92.3	Very high	94	Very high	85 Å²	85	81.1 Å²	81.1	40%	0.397	38%	0.383	S	S	.	.	H	α-helix	trans	-70.1	-40.9	175.3	-69.7	-47.3	-70.6	0	0	112	Y449 E450 Q451 G456 K457	Y449-Q453 HydrophobicContact CD1-CG 4.49Å; Y449-Q453 HydrophobicContact CD2-CG 4.31Å; Y449-Q453 HydrophobicContact CE1-CG 4.03Å; Y449-Q453 HydrophobicContact CE2-CG 3.82Å; Y449-Q453 VanDerWaalsContact O-CG 3.31Å; Y449-Q453 WeakPolarHBondContact O-CG 3.41Å; Y449-Q453 PolarHBondContact O-N 3.16Å; E450-Q453 WeakPolarHBondContact O-CB 3.45Å; E450-Q453 PolarHBondContact O-N 3.33Å; Q451-Q453 VanDerWaalsContact C-N 3.32Å; Q451-Q453 PolarHBondContact O-N 3.4Å; Q453-G456 PolarHBondContact O-N 2.94Å; Q453-K457 VanDerWaalsContact O-CG 3.3Å; Q453-K457 WeakPolarHBondContact O-CG 3.39Å; Q453-K457 PolarHBondContact O-N 3.23Å
454	E	93.5	Very high	94	Very high	109 Å²	109	86.6 Å²	86.6	51%	0.509	41%	0.409	S	S	.	.	H	α-helix	trans	-64.1	-52.5	177.1	-71.3	-176.1	158.3	0	0	111.2	E450 Q451 G456 K457 E458	E450-E454 PolarHBondContact O-N 3.18Å; Q451-E454 PolarHBondContact O-N 3.46Å; E454-G456 VanDerWaalsContact C-N 3.25Å; E454-G456 PolarHBondContact O-N 3.41Å; E454-K457 WeakPolarHBondContact O-CB 3.42Å; E454-K457 PolarHBondContact O-N 3.49Å; E454-E458 PolarHBondContact O-N 3.43Å; E454-E458 VanDerWaalsContact O-N 3.09Å
455	K	94	Very high	94	Very high	126 Å²	126	92.1 Å²	92.1	55%	0.548	43%	0.434	S	S	.	.	H	α-helix	trans	-56.7	-42.5	173.7	-176.6	175	-179.9	173.5	0	111.6	Q451 K457 E458 D459	Q451-K455 WeakPolarHBondContact O-CB 3.49Å; Q451-K455 PolarHBondContact O-N 3.02Å; K455-K457 VanDerWaalsContact C-N 3.3Å; K455-K457 PolarHBondContact O-N 2.85Å; K455-E458 PolarHBondContact O-N 2.94Å; K455-D459 WeakPolarHBondContact O-CB 3.43Å; K455-D459 VanDerWaalsContact O-CG 3.31Å; K455-D459 PolarHBondContact O-N 2.71Å
456	G	94.3	Very high	94	Very high	28 Å²	28	93.6 Å²	93.6	29%	0.289	44%	0.436	S	S	.	.	H	α-helix	trans	-59.3	-38.5	175.9	0	0	0	0	0	112.9	E452 Q453 E454 M460	E452-G456 WeakPolarHBondContact O-CA 3.18Å; E452-G456 PolarHBondContact O-N 3.29Å; Q453-G456 PolarHBondContact O-N 2.94Å; E454-G456 VanDerWaalsContact C-N 3.25Å; E454-G456 PolarHBondContact O-N 3.41Å; G456-M460 WeakPolarHBondContact O-CB 3.48Å; G456-M460 WeakPolarHBondContact O-CG 3.32Å; G456-M460 PolarHBondContact O-N 3.11Å
457	K	94.7	Very high	93.9	Very high	134 Å²	134	99.6 Å²	99.6	58%	0.583	46%	0.458	S	S	*	.	H	α-helix	trans	-67.8	-40.7	175.9	-71.8	166.2	-174.8	171.9	0	112	Q453 E454 K455 M460 K461	Q453-K457 VanDerWaalsContact O-CG 3.3Å; Q453-K457 WeakPolarHBondContact O-CG 3.39Å; Q453-K457 PolarHBondContact O-N 3.23Å; E454-K457 WeakPolarHBondContact O-CB 3.42Å; E454-K457 PolarHBondContact O-N 3.49Å; K455-K457 VanDerWaalsContact C-N 3.3Å; K455-K457 PolarHBondContact O-N 2.85Å; K457-M460 PolarHBondContact O-N 3.02Å; K457-K461 WeakPolarHBondContact O-CG 3.49Å; K457-K461 PolarHBondContact O-N 3.28Å; K457-K461 VanDerWaalsContact O-N 3.12Å
458	E	94.3	Very high	94	Very high	118 Å²	118	103.9 Å²	103.9	55%	0.551	48%	0.478	S	S	*	.	H	α-helix	trans	-64.9	-50.1	176.4	-67.4	173.9	173.1	0	0	111.1	E454 K455 M460 K461 I462	E454-E458 PolarHBondContact O-N 3.43Å; E454-E458 VanDerWaalsContact O-N 3.09Å; K455-E458 PolarHBondContact O-N 2.94Å; E458-M460 VanDerWaalsContact C-N 3.25Å; E458-M460 PolarHBondContact O-N 3.24Å; E458-K461 WeakPolarHBondContact O-CB 3.23Å; E458-K461 PolarHBondContact O-N 3.34Å; E458-K461 VanDerWaalsContact O-N 3.09Å; E458-I462 WeakPolarHBondContact O-CG1 3.25Å; E458-I462 PolarHBondContact O-N 3.19Å; E458-I462 VanDerWaalsContact O-N 3.09Å
459	D	94.2	Very high	94	Very high	71 Å²	71	105.5 Å²	105.5	38%	0.38	49%	0.487	S	S	.	.	H	α-helix	trans	-57.7	-40.5	175.4	-73.6	-19.7	0	0	0	111	K455 K461 I462 I463	K455-D459 WeakPolarHBondContact O-CB 3.43Å; K455-D459 VanDerWaalsContact O-CG 3.31Å; K455-D459 PolarHBondContact O-N 2.71Å; D459-K461 PolarHBondContact O-N 3.39Å; D459-I462 PolarHBondContact O-N 3.44Å; D459-I463 WeakPolarHBondContact O-CB 3.29Å; D459-I463 WeakPolarHBondContact O-CD1 3.47Å; D459-I463 WeakPolarHBondContact O-CG1 2.84Å; D459-I463 PolarHBondContact O-N 3.1Å
460	M	94.4	Very high	93.8	Very high	86 Å²	86	108.4 Å²	108.4	42%	0.424	50%	0.503	S	S	.	.	H	α-helix	trans	-62.2	-41.1	176.5	-80.4	-62.2	-56.4	0	0	112.5	G456 K457 E458 I463 E464	G456-M460 WeakPolarHBondContact O-CB 3.48Å; G456-M460 WeakPolarHBondContact O-CG 3.32Å; G456-M460 PolarHBondContact O-N 3.11Å; K457-M460 PolarHBondContact O-N 3.02Å; E458-M460 VanDerWaalsContact C-N 3.25Å; E458-M460 PolarHBondContact O-N 3.24Å; M460-I463 PolarHBondContact O-N 2.86Å; M460-E464 WeakPolarHBondContact O-CB 3.31Å; M460-E464 VanDerWaalsContact O-CG 3.3Å; M460-E464 WeakPolarHBondContact O-CG 3.47Å; M460-E464 PolarHBondContact O-N 2.75Å
461	K	95.8	Very high	93.7	Very high	145 Å²	145	110.2 Å²	110.2	63%	0.63	51%	0.511	S	S	*	.	H	α-helix	trans	-61.2	-46.8	174.4	-69.4	171	-177.1	175.6	0	111.2	K457 E458 D459 I463 E464 E465	K457-K461 WeakPolarHBondContact O-CG 3.49Å; K457-K461 PolarHBondContact O-N 3.28Å; K457-K461 VanDerWaalsContact O-N 3.12Å; E458-K461 WeakPolarHBondContact O-CB 3.23Å; E458-K461 PolarHBondContact O-N 3.34Å; E458-K461 VanDerWaalsContact O-N 3.09Å; D459-K461 PolarHBondContact O-N 3.39Å; K461-I463 VanDerWaalsContact C-N 3.32Å; K461-I463 PolarHBondContact O-N 3.48Å; K461-E464 PolarHBondContact O-N 2.83Å; K461-E465 PolarHBondContact O-N 2.95Å
462	I	94.8	Very high	93.7	Very high	75 Å²	75	108.8 Å²	108.8	39%	0.385	51%	0.505	S	S	.	.	H	α-helix	trans	-62.2	-41.6	178.2	-62.6	166.2	0	0	0	110.6	E458 D459 E465 K466	E458-I462 WeakPolarHBondContact O-CG1 3.25Å; E458-I462 PolarHBondContact O-N 3.19Å; E458-I462 VanDerWaalsContact O-N 3.09Å; D459-I462 PolarHBondContact O-N 3.44Å; I462-E465 PolarHBondContact O-N 3.16Å; I462-K466 HydrophobicContact CG2-CD 4.06Å; I462-K466 WeakPolarHBondContact O-CB 3.44Å; I462-K466 WeakPolarHBondContact O-CG 3.47Å; I462-K466 PolarHBondContact O-N 2.99Å
463	I	94.7	Very high	93.5	Very high	65 Å²	65	105.5 Å²	105.5	33%	0.333	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-43.4	177.6	-71.9	163.7	0	0	0	110.8	D459 M460 K461 R467	D459-I463 WeakPolarHBondContact O-CB 3.29Å; D459-I463 WeakPolarHBondContact O-CD1 3.47Å; D459-I463 WeakPolarHBondContact O-CG1 2.84Å; D459-I463 PolarHBondContact O-N 3.1Å; M460-I463 PolarHBondContact O-N 2.86Å; K461-I463 VanDerWaalsContact C-N 3.32Å; K461-I463 PolarHBondContact O-N 3.48Å; I463-R467 HydrophobicContact CG2-CG 4.27Å; I463-R467 VanDerWaalsContact CG2-NE 3.32Å; I463-R467 VanDerWaalsContact O-CB 3.24Å; I463-R467 WeakPolarHBondContact O-CB 3.49Å; I463-R467 WeakPolarHBondContact O-CG 3.36Å; I463-R467 PolarHBondContact O-N 3.41Å
464	E	95.1	Very high	93.1	Very high	116 Å²	116	106.4 Å²	106.4	54%	0.542	50%	0.5	S	S	.	.	H	α-helix	trans	-62.5	-44.3	177.6	-77.9	175.3	-174.2	0	0	111.6	M460 K461 R467 K468	M460-E464 WeakPolarHBondContact O-CB 3.31Å; M460-E464 VanDerWaalsContact O-CG 3.3Å; M460-E464 WeakPolarHBondContact O-CG 3.47Å; M460-E464 PolarHBondContact O-N 2.75Å; K461-E464 PolarHBondContact O-N 2.83Å; E464-R467 PolarHBondContact O-N 3.14Å; E464-K468 WeakPolarHBondContact O-CB 3.47Å; E464-K468 PolarHBondContact O-N 3.14Å
465	E	95.3	Very high	92.7	Very high	122 Å²	122	105.7 Å²	105.7	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-60.7	-53.5	175.3	-174.4	169.7	-151.4	0	0	111.4	K461 I462 R467 K468 E469	K461-E465 PolarHBondContact O-N 2.95Å; I462-E465 PolarHBondContact O-N 3.16Å; E465-R467 VanDerWaalsContact C-N 3.27Å; E465-R467 PolarHBondContact O-N 3.14Å; E465-K468 WeakPolarHBondContact O-CB 3.47Å; E465-K468 PolarHBondContact O-N 3.37Å; E465-E469 WeakPolarHBondContact O-CG 3.36Å; E465-E469 PolarHBondContact O-N 3.36Å
466	K	94	Very high	92.5	Very high	137 Å²	137	106.2 Å²	106.2	60%	0.596	50%	0.499	S	S	*	.	H	α-helix	trans	-59	-36.7	176.8	-73.2	178.9	179.1	175.9	0	112.7	I462 H470	I462-K466 HydrophobicContact CG2-CD 4.06Å; I462-K466 WeakPolarHBondContact O-CB 3.44Å; I462-K466 WeakPolarHBondContact O-CG 3.47Å; I462-K466 PolarHBondContact O-N 2.99Å; K466-H470 WeakPolarHBondContact O-CB 3.42Å; K466-H470 PolarHBondContact O-N 3.45Å
467	R	93	Very high	91.9	Very high	163 Å²	163	106.8 Å²	106.8	62%	0.615	50%	0.501	S	S	*	.	H	α-helix	trans	-67.6	-41.5	175.4	-79.7	175.1	-177.7	-179.4	5.9	111.5	I463 E464 E465 H470 Q471	I463-R467 HydrophobicContact CG2-CG 4.27Å; I463-R467 VanDerWaalsContact CG2-NE 3.32Å; I463-R467 VanDerWaalsContact O-CB 3.24Å; I463-R467 WeakPolarHBondContact O-CB 3.49Å; I463-R467 WeakPolarHBondContact O-CG 3.36Å; I463-R467 PolarHBondContact O-N 3.41Å; E464-R467 PolarHBondContact O-N 3.14Å; E465-R467 VanDerWaalsContact C-N 3.27Å; E465-R467 PolarHBondContact O-N 3.14Å; R467-H470 PolarHBondContact O-N 3.1Å; R467-Q471 VanDerWaalsContact O-CB 3.31Å; R467-Q471 WeakPolarHBondContact O-CB 3.27Å; R467-Q471 PolarHBondContact O-N 3.3Å
468	K	95.3	Very high	91.1	Very high	131 Å²	131	107.4 Å²	107.4	57%	0.57	50%	0.5	S	S	*	.	H	α-helix	trans	-63.6	-48.1	177.4	-174.4	-176.5	175.8	-170.1	0	110.8	E464 E465 H470 Q471 E472	E464-K468 WeakPolarHBondContact O-CB 3.47Å; E464-K468 PolarHBondContact O-N 3.14Å; E465-K468 WeakPolarHBondContact O-CB 3.47Å; E465-K468 PolarHBondContact O-N 3.37Å; K468-H470 VanDerWaalsContact C-N 3.32Å; K468-H470 PolarHBondContact O-N 3.43Å; K468-Q471 WeakPolarHBondContact O-CB 3.26Å; K468-Q471 PolarHBondContact O-N 3.34Å; K468-Q471 VanDerWaalsContact O-N 3.1Å; K468-E472 WeakPolarHBondContact CE-OE1 3.47Å; K468-E472 WeakPolarHBondContact O-CG 3.46Å; K468-E472 PolarHBondContact O-N 3.15Å
469	E	92.7	Very high	90.6	Very high	113 Å²	113	107.8 Å²	107.8	53%	0.528	50%	0.501	S	S	.	.	H	α-helix	trans	-56	-46.7	174.1	-70	179.7	165.5	0	0	111.8	E465 Q471 E472 A473	E465-E469 WeakPolarHBondContact O-CG 3.36Å; E465-E469 PolarHBondContact O-N 3.36Å; E469-Q471 VanDerWaalsContact C-N 3.31Å; E469-Q471 PolarHBondContact O-N 3.1Å; E469-E472 PolarHBondContact O-N 3.32Å; E469-A473 VanDerWaalsContact O-CB 3.31Å; E469-A473 WeakPolarHBondContact O-CB 3.44Å; E469-A473 PolarHBondContact O-N 3.35Å
470	H	89.1	Confident	89.9	Confident	136 Å²	136	111.1 Å²	111.1	63%	0.63	51%	0.512	S	S	*	.	H	α-helix	trans	-60.8	-41.7	176.6	-175.8	74.4	0	0	0	111.9	K466 R467 K468 Y474	K466-H470 WeakPolarHBondContact O-CB 3.42Å; K466-H470 PolarHBondContact O-N 3.45Å; R467-H470 PolarHBondContact O-N 3.1Å; K468-H470 VanDerWaalsContact C-N 3.32Å; K468-H470 PolarHBondContact O-N 3.43Å; H470-Y474 VanDerWaalsContact O-CB 3.25Å; H470-Y474 WeakPolarHBondContact O-CB 3.49Å; H470-Y474 PolarHBondContact O-N 3.16Å
471	Q	91.1	Very high	88.8	Confident	118 Å²	118	108.5 Å²	108.5	55%	0.551	50%	0.498	S	S	*	.	H	α-helix	trans	-67.9	-42	179.5	-174.3	170.1	-8.6	0	0	111.9	R467 K468 E469 Y474 Q475	R467-Q471 VanDerWaalsContact O-CB 3.31Å; R467-Q471 WeakPolarHBondContact O-CB 3.27Å; R467-Q471 PolarHBondContact O-N 3.3Å; K468-Q471 WeakPolarHBondContact O-CB 3.26Å; K468-Q471 PolarHBondContact O-N 3.34Å; K468-Q471 VanDerWaalsContact O-N 3.1Å; E469-Q471 VanDerWaalsContact C-N 3.31Å; E469-Q471 PolarHBondContact O-N 3.1Å; Q471-Y474 WeakPolarHBondContact O-CB 3.44Å; Q471-Y474 PolarHBondContact O-N 3.37Å; Q471-Q475 WeakPolarHBondContact O-CB 3.45Å; Q471-Q475 WeakPolarHBondContact O-CG 3.28Å; Q471-Q475 PolarHBondContact O-N 3.48Å
472	E	92.8	Very high	87.4	Confident	78 Å²	78	105.4 Å²	105.4	36%	0.364	50%	0.495	S	S	.	.	H	α-helix	trans	-64.7	-45.4	174.8	-72.6	-178.9	-166.8	0	0	111.7	K468 E469 Y474 Q475 K476	K468-E472 WeakPolarHBondContact CE-OE1 3.47Å; K468-E472 WeakPolarHBondContact O-CG 3.46Å; K468-E472 PolarHBondContact O-N 3.15Å; E469-E472 PolarHBondContact O-N 3.32Å; E472-Y474 VanDerWaalsContact C-N 3.28Å; E472-Y474 PolarHBondContact O-N 3.33Å; E472-Q475 PolarHBondContact O-N 3.33Å; E472-K476 WeakPolarHBondContact O-CB 3.44Å; E472-K476 WeakPolarHBondContact O-CG 3.38Å; E472-K476 PolarHBondContact O-N 3.41Å
473	A	88.1	Confident	86.3	Confident	59 Å²	59	109.6 Å²	109.6	49%	0.488	52%	0.518	S	S	.	.	H	α-helix	trans	-59.9	-41.3	174.3	0	0	0	0	0	111.2	E469 A477	E469-A473 VanDerWaalsContact O-CB 3.31Å; E469-A473 WeakPolarHBondContact O-CB 3.44Å; E469-A473 PolarHBondContact O-N 3.35Å; A473-A477 VanDerWaalsContact O-CB 3.27Å; A473-A477 WeakPolarHBondContact O-CB 3.25Å; A473-A477 PolarHBondContact O-N 3.01Å
474	Y	83.4	Confident	85.3	Confident	104 Å²	104	108.9 Å²	108.9	41%	0.408	52%	0.517	S	S	.	.	H	α-helix	trans	-64.2	-41.8	175.5	-174.2	-84.3	0	0	0	112.3	H470 Q471 E472 R478	H470-Y474 VanDerWaalsContact O-CB 3.25Å; H470-Y474 WeakPolarHBondContact O-CB 3.49Å; H470-Y474 PolarHBondContact O-N 3.16Å; Q471-Y474 WeakPolarHBondContact O-CB 3.44Å; Q471-Y474 PolarHBondContact O-N 3.37Å; E472-Y474 VanDerWaalsContact C-N 3.28Å; E472-Y474 PolarHBondContact O-N 3.33Å; Y474-R478 VanDerWaalsContact O-CB 3.32Å; Y474-R478 WeakPolarHBondContact O-CB 3.34Å; Y474-R478 PolarHBondContact O-N 3.43Å
475	Q	86.9	Confident	84.4	Confident	94 Å²	94	110.5 Å²	110.5	44%	0.439	52%	0.524	S	S	.	.	H	α-helix	trans	-64.3	-50.7	176.4	-77.2	176.9	-1.4	0	0	111.6	Q471 E472 A477 R478 E479	Q471-Q475 WeakPolarHBondContact O-CB 3.45Å; Q471-Q475 WeakPolarHBondContact O-CG 3.28Å; Q471-Q475 PolarHBondContact O-N 3.48Å; E472-Q475 PolarHBondContact O-N 3.33Å; Q475-A477 VanDerWaalsContact C-N 3.32Å; Q475-A477 PolarHBondContact O-N 3.29Å; Q475-R478 CarbonylContact O-C 3.56Å; Q475-R478 WeakPolarHBondContact O-CA 3.03Å; Q475-R478 WeakPolarHBondContact O-CB 2.91Å; Q475-R478 PolarHBondContact O-N 3.43Å; Q475-E479 WeakPolarHBondContact O-CG 3.49Å; Q475-E479 PolarHBondContact O-N 3.44Å
476	K	88.1	Confident	83.3	Confident	137 Å²	137	113.5 Å²	113.5	60%	0.596	53%	0.53	S	S	*	.	H	α-helix	trans	-55.6	-46	175.7	-72.7	172.7	-179.3	168.4	0	111.7	E472 R478 E479 K480	E472-K476 WeakPolarHBondContact O-CB 3.44Å; E472-K476 WeakPolarHBondContact O-CG 3.38Å; E472-K476 PolarHBondContact O-N 3.41Å; K476-R478 VanDerWaalsContact C-N 3.26Å; K476-R478 PolarHBondContact O-N 3.48Å; K476-E479 PolarHBondContact O-N 2.94Å; K476-K480 WeakPolarHBondContact O-CB 3.45Å; K476-K480 PolarHBondContact O-N 3.41Å
477	A	81.9	Confident	82.3	Confident	41 Å²	41	113.8 Å²	113.8	34%	0.339	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-31.9	175.4	0	0	0	0	0	112.4	A473 Q475 Y481	A473-A477 VanDerWaalsContact O-CB 3.27Å; A473-A477 WeakPolarHBondContact O-CB 3.25Å; A473-A477 PolarHBondContact O-N 3.01Å; Q475-A477 VanDerWaalsContact C-N 3.32Å; Q475-A477 PolarHBondContact O-N 3.29Å; A477-Y481 VanDerWaalsContact O-CD2 3.22Å; A477-Y481 WeakPolarHBondContact O-CD2 3.49Å
478	R	78.6	Confident	81.4	Confident	147 Å²	147	113 Å²	113	56%	0.555	53%	0.532	S	S	*	.	H	α-helix	trans	-73.9	-39.4	176.9	173.4	163.7	-169.7	-177.9	2.3	112.6	Y474 Q475 K476 S482 R489	Y474-R478 VanDerWaalsContact O-CB 3.32Å; Y474-R478 WeakPolarHBondContact O-CB 3.34Å; Y474-R478 PolarHBondContact O-N 3.43Å; Q475-R478 CarbonylContact O-C 3.56Å; Q475-R478 WeakPolarHBondContact O-CA 3.03Å; Q475-R478 WeakPolarHBondContact O-CB 2.91Å; Q475-R478 PolarHBondContact O-N 3.43Å; K476-R478 VanDerWaalsContact C-N 3.26Å; K476-R478 PolarHBondContact O-N 3.48Å; R478-S482 PolarHBondContact O-N 2.66Å; R478-R489 VanDerWaalsContact CA-NH2 3.32Å; R478-R489 VanDerWaalsContact CG-NH2 3.34Å
479	E	83.3	Confident	80.4	Confident	126 Å²	126	109.6 Å²	109.6	59%	0.589	52%	0.516	S	S	*	.	H	α-helix	trans	-69.9	-40.1	178.6	-72.3	171.6	-177.9	0	0	112.3	Q475 K476 Y481 S482	Q475-E479 WeakPolarHBondContact O-CG 3.49Å; Q475-E479 PolarHBondContact O-N 3.44Å; K476-E479 PolarHBondContact O-N 2.94Å; E479-Y481 PolarHBondContact O-N 2.72Å; E479-S482 VanDerWaalsContact O-CB 3.26Å; E479-S482 WeakPolarHBondContact O-CB 3.49Å; E479-S482 PolarHBondContact O-N 3.43Å; E479-S482 PolarHBondContact O-OG 3.07Å
480	K	79.5	Confident	79.4	Confident	140 Å²	140	107.8 Å²	107.8	61%	0.609	52%	0.516	S	S	*	.	H	α-helix	trans	-52.3	-29.6	175.5	-168	-179.6	179.7	-171.5	0	113.1	K476 E496	K476-K480 WeakPolarHBondContact O-CB 3.45Å; K476-K480 PolarHBondContact O-N 3.41Å; K480-E496 IonicContact NZ-OE1 2.77Å; K480-E496 PolarHBondContact NZ-OE1 3.34Å
481	Y	71.3	Confident	78.8	Confident	32 Å²	32	106.8 Å²	106.8	13%	0.125	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	21	-180	-58	-67.9	0	0	0	113.9	A477 E479 N483 V484 R489 L492 E496	A477-Y481 VanDerWaalsContact O-CD2 3.22Å; A477-Y481 WeakPolarHBondContact O-CD2 3.49Å; E479-Y481 PolarHBondContact O-N 2.72Å; Y481-N483 VanDerWaalsContact C-N 3.3Å; Y481-N483 PolarHBondContact O-N 2.67Å; Y481-V484 PolarHBondContact O-N 3.31Å; Y481-R489 HydrophobicContact CG-CG 4.37Å; Y481-L492 HydrophobicContact CD1-CD1 4.26Å; Y481-L492 HydrophobicContact CE1-CB 4.19Å; Y481-L492 HydrophobicContact CE1-CD1 4.13Å; Y481-E496 WeakPolarHBondContact CE2-OE2 3.47Å; Y481-E496 PolarHBondContact OH-OE1 3.17Å; Y481-E496 PolarHBondContact OH-OE2 3.03Å
482	S	66.9	Low	78.1	Confident	80 Å²	80	104.6 Å²	104.6	56%	0.559	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-36.9	-178.2	55.7	0	0	0	0	113.3	R478 E479 V484	R478-S482 PolarHBondContact O-N 2.66Å; E479-S482 VanDerWaalsContact O-CB 3.26Å; E479-S482 WeakPolarHBondContact O-CB 3.49Å; E479-S482 PolarHBondContact O-N 3.43Å; E479-S482 PolarHBondContact O-OG 3.07Å; S482-V484 VanDerWaalsContact C-N 3.3Å; S482-V484 PolarHBondContact O-N 2.81Å
483	N	71.1	Confident	77.1	Confident	162 Å²	162	106 Å²	106	87%	0.866	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	4.2	-177.4	-69	-20.4	0	0	0	114.8	Y481	Y481-N483 VanDerWaalsContact C-N 3.3Å; Y481-N483 PolarHBondContact O-N 2.67Å
484	V	74.3	Confident	76.5	Confident	51 Å²	51	110 Å²	110	31%	0.309	51%	0.512	S	S	.	.	S	Bend	trans	-113.8	133.5	-171.9	-173.5	0	0	0	0	111.8	Y481 S482 K488	Y481-V484 PolarHBondContact O-N 3.31Å; S482-V484 VanDerWaalsContact C-N 3.3Å; S482-V484 PolarHBondContact O-N 2.81Å; V484-K488 HydrophobicContact CG1-CB 3.55Å
485	Q	76.1	Confident	76.2	Confident	150 Å²	150	109.2 Å²	109.2	70%	0.701	51%	0.514	S	S	*	.			trans	-58.8	138.9	177	-147.7	172.9	20	0	0	111.5	K487 K488 R489	Q485-K487 PolarHBondContact O-N 3.3Å; Q485-K488 PolarHBondContact O-N 3.3Å; Q485-R489 PolarHBondContact O-N 3.1Å; Q485-R489 VanDerWaalsContact O-N 3.14Å
486	W	72.6	Confident	75.6	Confident	185 Å²	185	107 Å²	107	70%	0.701	50%	0.504	S	S	*	.	H	α-helix	trans	-51.1	-34.9	-167.4	75.3	-91.5	0	0	0	115.4	R489 S490	W486-R489 PolarHBondContact O-N 3.37Å; W486-S490 PolarHBondContact O-N 2.87Å
487	K	72.9	Confident	75.1	Confident	143 Å²	143	104.4 Å²	104.4	62%	0.622	50%	0.496	S	S	*	.	H	α-helix	trans	-65.1	-43.6	178	-68.3	-174.5	179.7	175.9	0	112.6	Q485	Q485-K487 PolarHBondContact O-N 3.3Å
488	K	72.6	Confident	74.9	Confident	145 Å²	145	108.7 Å²	108.7	63%	0.63	51%	0.507	S	S	*	.	H	α-helix	trans	-72	-36.4	177.6	-73.7	-178.1	179.1	-179.8	0	111.1	V484 Q485 S490 L491 L492	V484-K488 HydrophobicContact CG1-CB 3.55Å; Q485-K488 PolarHBondContact O-N 3.3Å; K488-S490 PolarHBondContact O-N 3.33Å; K488-L491 PolarHBondContact O-N 3.45Å; K488-L492 PolarHBondContact O-N 2.95Å; K488-L492 VanDerWaalsContact O-N 3.13Å
489	R	74.3	Confident	74.6	Confident	60 Å²	60	107.9 Å²	107.9	23%	0.226	51%	0.509	C	S	.	.	H	α-helix	trans	-60.6	-41.1	174.4	-179.4	173.5	172.4	-177.3	-6.6	112.8	R478 Y481 Q485 W486 L491 R493	R478-R489 VanDerWaalsContact CA-NH2 3.32Å; R478-R489 VanDerWaalsContact CG-NH2 3.34Å; Y481-R489 HydrophobicContact CG-CG 4.37Å; Q485-R489 PolarHBondContact O-N 3.1Å; Q485-R489 VanDerWaalsContact O-N 3.14Å; W486-R489 PolarHBondContact O-N 3.37Å; R489-L491 PolarHBondContact O-N 3.39Å; R489-R493 WeakPolarHBondContact O-CB 3.5Å; R489-R493 PolarHBondContact O-N 2.86Å
490	S	72	Confident	74	Confident	75 Å²	75	107 Å²	107	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-60.9	-43.6	177.3	-173.8	0	0	0	0	112.3	W486 K488 Y494	W486-S490 PolarHBondContact O-N 2.87Å; K488-S490 PolarHBondContact O-N 3.33Å; S490-Y494 PolarHBondContact O-N 2.88Å; S490-Y494 VanDerWaalsContact O-N 3.08Å
491	L	77.6	Confident	73.7	Confident	116 Å²	116	103.2 Å²	103.2	61%	0.607	49%	0.494	S	S	*	.	H	α-helix	trans	-65.7	-46.1	179.1	-165.2	93.7	0	0	0	112.2	K488 R489 R493 Y494 L495	K488-L491 PolarHBondContact O-N 3.45Å; R489-L491 PolarHBondContact O-N 3.39Å; L491-R493 PolarHBondContact O-N 3.2Å; L491-Y494 WeakPolarHBondContact O-CB 3.41Å; L491-Y494 PolarHBondContact O-N 3.3Å; L491-L495 PolarHBondContact O-N 2.72Å; L491-L495 VanDerWaalsContact O-N 3.14Å
492	L	75.4	Confident	73.8	Confident	72 Å²	72	104.9 Å²	104.9	38%	0.377	51%	0.51	S	S	.	.	H	α-helix	trans	-61.9	-43.4	178.2	-73.1	166.9	0	0	0	111.6	Y481 K488 Y494 L495 E496	Y481-L492 HydrophobicContact CD1-CD1 4.26Å; Y481-L492 HydrophobicContact CE1-CB 4.19Å; Y481-L492 HydrophobicContact CE1-CD1 4.13Å; K488-L492 PolarHBondContact O-N 2.95Å; K488-L492 VanDerWaalsContact O-N 3.13Å; L492-Y494 VanDerWaalsContact C-N 3.32Å; L492-Y494 PolarHBondContact O-N 2.87Å; L492-L495 PolarHBondContact O-N 2.85Å; L492-E496 PolarHBondContact O-N 3.34Å
493	R	72.8	Confident	73.9	Confident	107 Å²	107	105.7 Å²	105.7	40%	0.404	51%	0.508	S	S	.	.	H	α-helix	trans	-62.1	-38.8	176.5	-165.4	-178	-169.9	-179.3	5.3	112.2	R489 L491 I497	R489-R493 WeakPolarHBondContact O-CB 3.5Å; R489-R493 PolarHBondContact O-N 2.86Å; L491-R493 PolarHBondContact O-N 3.2Å; R493-I497 HydrophobicContact CG-CD1 3.89Å; R493-I497 HydrophobicContact CG-CG1 4.46Å; R493-I497 WeakPolarHBondContact O-CB 3.42Å; R493-I497 WeakPolarHBondContact O-CD1 3.49Å; R493-I497 WeakPolarHBondContact O-CG1 3.4Å; R493-I497 PolarHBondContact O-N 2.88Å
494	Y	75.7	Confident	73.8	Confident	144 Å²	144	103.9 Å²	103.9	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-63.5	-42	176.4	173	-97.3	0	0	0	112.2	S490 L491 L492 K498	S490-Y494 PolarHBondContact O-N 2.88Å; S490-Y494 VanDerWaalsContact O-N 3.08Å; L491-Y494 WeakPolarHBondContact O-CB 3.41Å; L491-Y494 PolarHBondContact O-N 3.3Å; L492-Y494 VanDerWaalsContact C-N 3.32Å; L492-Y494 PolarHBondContact O-N 2.87Å; Y494-K498 HydrophobicContact CE1-CD 4.39Å; Y494-K498 VanDerWaalsContact O-CB 3.31Å; Y494-K498 WeakPolarHBondContact O-CB 3.46Å; Y494-K498 PolarHBondContact O-N 3Å
495	L	76.1	Confident	73.4	Confident	86 Å²	86	109.6 Å²	109.6	45%	0.45	51%	0.508	S	S	.	.	H	α-helix	trans	-63.9	-46.8	177.3	-69.4	166.6	0	0	0	111.4	L491 L492 I497 K498 E499	L491-L495 PolarHBondContact O-N 2.72Å; L491-L495 VanDerWaalsContact O-N 3.14Å; L492-L495 PolarHBondContact O-N 2.85Å; L495-I497 PolarHBondContact O-N 2.83Å; L495-K498 WeakPolarHBondContact O-CB 3.36Å; L495-K498 PolarHBondContact O-N 2.88Å; L495-E499 PolarHBondContact O-N 3.07Å
496	E	75.2	Confident	72.8	Confident	49 Å²	49	109.5 Å²	109.5	23%	0.229	51%	0.505	C	S	.	.	H	α-helix	trans	-64	-41.7	179.7	-150	172.2	-155.2	0	0	111.4	K480 Y481 L492 E499 Q500	K480-E496 IonicContact NZ-OE1 2.77Å; K480-E496 PolarHBondContact NZ-OE1 3.34Å; Y481-E496 WeakPolarHBondContact CE2-OE2 3.47Å; Y481-E496 PolarHBondContact OH-OE1 3.17Å; Y481-E496 PolarHBondContact OH-OE2 3.03Å; L492-E496 PolarHBondContact O-N 3.34Å; E496-E499 PolarHBondContact O-N 3.31Å; E496-Q500 WeakPolarHBondContact O-CB 3.29Å; E496-Q500 WeakPolarHBondContact O-CG 3.47Å; E496-Q500 PolarHBondContact O-N 2.8Å
497	I	77	Confident	72.2	Confident	82 Å²	82	104.9 Å²	104.9	42%	0.421	49%	0.491	S	S	.	.	H	α-helix	trans	-64.2	-40.9	173.9	-70.5	167.9	0	0	0	111.1	R493 L495 E499 Q500 T501	R493-I497 HydrophobicContact CG-CD1 3.89Å; R493-I497 HydrophobicContact CG-CG1 4.46Å; R493-I497 WeakPolarHBondContact O-CB 3.42Å; R493-I497 WeakPolarHBondContact O-CD1 3.49Å; R493-I497 WeakPolarHBondContact O-CG1 3.4Å; R493-I497 PolarHBondContact O-N 2.88Å; L495-I497 PolarHBondContact O-N 2.83Å; I497-E499 VanDerWaalsContact C-N 3.33Å; I497-E499 PolarHBondContact O-N 2.88Å; I497-Q500 PolarHBondContact O-N 3.2Å; I497-T501 VanDerWaalsContact O-CB 3.24Å; I497-T501 WeakPolarHBondContact O-CB 3.34Å; I497-T501 PolarHBondContact O-N 2.83Å; I497-T501 PolarHBondContact O-OG1 2.61Å
498	K	76.9	Confident	71.6	Confident	131 Å²	131	103.2 Å²	103.2	57%	0.57	49%	0.486	S	S	*	.	H	α-helix	trans	-63.4	-41.7	-179.8	-172.2	-179.2	177.5	-173.7	0	111.2	Y494 L495 S502	Y494-K498 HydrophobicContact CE1-CD 4.39Å; Y494-K498 VanDerWaalsContact O-CB 3.31Å; Y494-K498 WeakPolarHBondContact O-CB 3.46Å; Y494-K498 PolarHBondContact O-N 3Å; L495-K498 WeakPolarHBondContact O-CB 3.36Å; L495-K498 PolarHBondContact O-N 2.88Å; K498-S502 PolarHBondContact O-N 3.4Å; K498-S502 PolarHBondContact O-OG 3.41Å
499	E	73.1	Confident	71	Confident	130 Å²	130	103.3 Å²	103.3	61%	0.607	49%	0.49	S	S	*	.	H	α-helix	trans	-64.6	-51.4	173.4	-74.6	178.6	167.9	0	0	111.4	L495 E496 I497 T501 S502 L503	L495-E499 PolarHBondContact O-N 3.07Å; E496-E499 PolarHBondContact O-N 3.31Å; I497-E499 VanDerWaalsContact C-N 3.33Å; I497-E499 PolarHBondContact O-N 2.88Å; E499-T501 VanDerWaalsContact C-N 3.35Å; E499-T501 PolarHBondContact O-N 2.83Å; E499-S502 PolarHBondContact O-N 3.2Å; E499-S502 VanDerWaalsContact O-N 3.13Å; E499-S502 PolarHBondContact O-OG 3.43Å; E499-L503 PolarHBondContact O-N 2.88Å
500	Q	71.6	Confident	70.3	Confident	106 Å²	106	107 Å²	107	50%	0.495	51%	0.51	S	S	.	.	H	α-helix	trans	-61	-39.6	179.1	-74.7	-178.3	-6.8	0	0	113.3	E496 I497 S502 L503 K504	E496-Q500 WeakPolarHBondContact O-CB 3.29Å; E496-Q500 WeakPolarHBondContact O-CG 3.47Å; E496-Q500 PolarHBondContact O-N 2.8Å; I497-Q500 PolarHBondContact O-N 3.2Å; Q500-S502 VanDerWaalsContact C-N 3.28Å; Q500-S502 PolarHBondContact O-N 3.13Å; Q500-L503 PolarHBondContact O-N 3.29Å; Q500-K504 WeakPolarHBondContact O-CB 3.45Å; Q500-K504 WeakPolarHBondContact O-CG 3.3Å; Q500-K504 PolarHBondContact O-N 3.41Å
501	T	73.2	Confident	69.7	Low	62 Å²	62	110.4 Å²	110.4	38%	0.38	51%	0.511	S	S	.	.	H	α-helix	trans	-66.5	-34.5	178.3	-53.3	0	0	0	0	111.1	I497 E499 R505	I497-T501 VanDerWaalsContact O-CB 3.24Å; I497-T501 WeakPolarHBondContact O-CB 3.34Å; I497-T501 PolarHBondContact O-N 2.83Å; I497-T501 PolarHBondContact O-OG1 2.61Å; E499-T501 VanDerWaalsContact C-N 3.35Å; E499-T501 PolarHBondContact O-N 2.83Å; T501-R505 WeakPolarHBondContact O-CG 3.3Å; T501-R505 PolarHBondContact O-N 3.14Å; T501-R505 VanDerWaalsContact O-N 3.17Å
502	S	71.6	Confident	68.9	Low	66 Å²	66	111 Å²	111	46%	0.462	52%	0.515	S	S	.	.	H	α-helix	trans	-71.3	-35.1	176.4	70.7	0	0	0	0	112.8	K498 E499 Q500 K506	K498-S502 PolarHBondContact O-N 3.4Å; K498-S502 PolarHBondContact O-OG 3.41Å; E499-S502 PolarHBondContact O-N 3.2Å; E499-S502 VanDerWaalsContact O-N 3.13Å; E499-S502 PolarHBondContact O-OG 3.43Å; Q500-S502 VanDerWaalsContact C-N 3.28Å; Q500-S502 PolarHBondContact O-N 3.13Å; S502-K506 PolarHBondContact O-N 3.44Å
503	L	69.7	Low	68.4	Low	98 Å²	98	111.5 Å²	111.5	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-70	-49.2	174.4	-69.9	166.5	0	0	0	111.1	E499 Q500 R505 K506 E507	E499-L503 PolarHBondContact O-N 2.88Å; Q500-L503 PolarHBondContact O-N 3.29Å; L503-R505 VanDerWaalsContact C-N 3.32Å; L503-R505 PolarHBondContact O-N 3.43Å; L503-K506 WeakPolarHBondContact O-CB 3.43Å; L503-K506 PolarHBondContact O-N 2.98Å; L503-E507 PolarHBondContact O-N 3.43Å
504	K	70.3	Confident	68.8	Low	123 Å²	123	108.8 Å²	108.8	54%	0.535	52%	0.518	S	S	.	.	H	α-helix	trans	-56.1	-42.8	177.5	-77.5	-173	175.3	-166	0	113.2	Q500 K506 E507 E508	Q500-K504 WeakPolarHBondContact O-CB 3.45Å; Q500-K504 WeakPolarHBondContact O-CG 3.3Å; Q500-K504 PolarHBondContact O-N 3.41Å; K504-K506 VanDerWaalsContact C-N 3.28Å; K504-K506 PolarHBondContact O-N 2.92Å; K504-E507 PolarHBondContact O-N 3.41Å; K504-E508 WeakPolarHBondContact O-CB 3.36Å; K504-E508 VanDerWaalsContact O-CG 3.3Å; K504-E508 WeakPolarHBondContact O-CG 3.27Å; K504-E508 PolarHBondContact O-N 3.49Å
505	R	65.9	Low	69.4	Low	171 Å²	171	102.8 Å²	102.8	65%	0.645	50%	0.496	S	S	*	.	H	α-helix	trans	-63.2	-33.1	176.9	-80.7	-177.6	178.1	-177.4	-1.7	113.4	T501 L503 M509	T501-R505 WeakPolarHBondContact O-CG 3.3Å; T501-R505 PolarHBondContact O-N 3.14Å; T501-R505 VanDerWaalsContact O-N 3.17Å; L503-R505 VanDerWaalsContact C-N 3.32Å; L503-R505 PolarHBondContact O-N 3.43Å; R505-M509 WeakPolarHBondContact O-CG 3.49Å; R505-M509 PolarHBondContact O-N 3.31Å
506	K	61.8	Low	70.2	Confident	148 Å²	148	98.7 Å²	98.7	64%	0.643	48%	0.475	S	S	*	.	H	α-helix	trans	-71.4	-45.7	174.9	-75.3	-176.9	174	-172.5	0	110.6	S502 L503 K504 E508 M509 E510	S502-K506 PolarHBondContact O-N 3.44Å; L503-K506 WeakPolarHBondContact O-CB 3.43Å; L503-K506 PolarHBondContact O-N 2.98Å; K504-K506 VanDerWaalsContact C-N 3.28Å; K504-K506 PolarHBondContact O-N 2.92Å; K506-E508 VanDerWaalsContact C-N 3.34Å; K506-E508 PolarHBondContact O-N 3.14Å; K506-M509 PolarHBondContact O-N 3.43Å; K506-E510 PolarHBondContact O-N 3.37Å; K506-E510 VanDerWaalsContact O-N 3.12Å
507	E	60.3	Low	71.1	Confident	88 Å²	88	96.8 Å²	96.8	41%	0.411	47%	0.467	S	S	.	.	H	α-helix	trans	-61.7	-38.9	177.2	-68.2	172.5	-169.8	0	0	112.5	L503 K504 E510 R511	L503-E507 PolarHBondContact O-N 3.43Å; K504-E507 PolarHBondContact O-N 3.41Å; E507-E510 PolarHBondContact O-N 3.1Å; E507-R511 WeakPolarHBondContact O-CG 2.82Å; E507-R511 PolarHBondContact O-N 2.99Å; E507-R511 IonicContact OE2-NH2 2.72Å
508	E	60.5	Low	72	Confident	109 Å²	109	92.9 Å²	92.9	51%	0.509	45%	0.447	S	S	.	.	H	α-helix	trans	-65.5	-42.3	176.6	-76.3	167.5	-179.7	0	0	111.7	K504 K506 E510 R511 D512	K504-E508 WeakPolarHBondContact O-CB 3.36Å; K504-E508 VanDerWaalsContact O-CG 3.3Å; K504-E508 WeakPolarHBondContact O-CG 3.27Å; K504-E508 PolarHBondContact O-N 3.49Å; K506-E508 VanDerWaalsContact C-N 3.34Å; K506-E508 PolarHBondContact O-N 3.14Å; E508-E510 PolarHBondContact O-N 2.65Å; E508-R511 PolarHBondContact O-N 3.14Å; E508-D512 WeakPolarHBondContact O-CB 3.45Å; E508-D512 PolarHBondContact O-N 3.21Å
509	M	60.3	Low	73	Confident	146 Å²	146	86.7 Å²	86.7	72%	0.719	42%	0.42	S	S	*	.	H	α-helix	trans	-67.1	-34	177.5	-74.7	-177.8	69.2	0	0	113.3	R505 K506 S513	R505-M509 WeakPolarHBondContact O-CG 3.49Å; R505-M509 PolarHBondContact O-N 3.31Å; K506-M509 PolarHBondContact O-N 3.43Å; M509-S513 PolarHBondContact O-N 3.04Å
510	E	59.1	Low	74.1	Confident	139 Å²	139	80.5 Å²	80.5	65%	0.65	39%	0.391	S	S	*	.	H	α-helix	trans	-72.7	-37.3	175.9	-73.4	176.6	179.2	0	0	111.6	K506 E507 E508	K506-E510 PolarHBondContact O-N 3.37Å; K506-E510 VanDerWaalsContact O-N 3.12Å; E507-E510 PolarHBondContact O-N 3.1Å; E508-E510 PolarHBondContact O-N 2.65Å
511	R	59.3	Low	75.3	Confident	145 Å²	145	76.3 Å²	76.3	55%	0.547	37%	0.371	S	S	.	.	H	α-helix	trans	-65.6	-49.2	173.8	-74	-176.9	-137.5	-163.8	2.4	112	E507 E508 S513 N514 V515	E507-R511 WeakPolarHBondContact O-CG 2.82Å; E507-R511 PolarHBondContact O-N 2.99Å; E507-R511 IonicContact OE2-NH2 2.72Å; E508-R511 PolarHBondContact O-N 3.14Å; R511-S513 PolarHBondContact O-N 3.49Å; R511-N514 PolarHBondContact O-N 3.33Å; R511-V515 WeakPolarHBondContact O-CG2 3.38Å; R511-V515 PolarHBondContact O-N 3.19Å
512	D	61	Low	76.4	Confident	129 Å²	129	73.3 Å²	73.3	69%	0.69	35%	0.353	S	S	*	.	H	α-helix	trans	-58.7	-24.9	-179.2	-76.2	-7.8	0	0	0	112.9	E508	E508-D512 WeakPolarHBondContact O-CB 3.45Å; E508-D512 PolarHBondContact O-N 3.21Å
513	S	65.6	Low	77.4	Confident	82 Å²	82	71.4 Å²	71.4	57%	0.573	34%	0.338	S	S	*	.	H	α-helix	trans	-73.7	-25.7	177.3	-171.8	0	0	0	0	113.6	M509 R511	M509-S513 PolarHBondContact O-N 3.04Å; R511-S513 PolarHBondContact O-N 3.49Å
514	N	80.8	Confident	78.6	Confident	51 Å²	51	67.2 Å²	67.2	27%	0.273	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	15	-172.1	-67.2	0.8	0	0	0	112.7	R511 C544 E545	R511-N514 PolarHBondContact O-N 3.33Å; N514-C544 CarbonylContact O-C 3.53Å; N514-C544 VanDerWaalsContact O-CA 3.28Å; N514-C544 WeakPolarHBondContact O-CA 3.25Å; N514-C544 PolarHBondContact O-SG 2.89Å; N514-E545 PolarHBondContact O-N 2.91Å
515	V	88.8	Confident	79.7	Confident	17 Å²	17	62.8 Å²	62.8	10%	0.103	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	138.5	170.4	-177	0	0	0	0	108.6	R511 P517 E545 E547 R613	R511-V515 WeakPolarHBondContact O-CG2 3.38Å; R511-V515 PolarHBondContact O-N 3.19Å; V515-P517 HydrophobicContact CG1-CG 4.02Å; V515-P517 WeakPolarHBondContact O-CD 3.46Å; V515-E545 CarbonylContact C-O 3.52Å; V515-E545 WeakPolarHBondContact CA-O 3.39Å; V515-E545 HydrophobicContact CG1-CB 4.43Å; V515-E545 HydrophobicContact CG2-CB 4.06Å; V515-E547 HydrophobicContact CG1-CB 3.91Å; V515-R613 PolarHBondContact O-NH1 3.38Å
516	L	92	Very high	80.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	96.7	168.2	177.5	60.6	0	0	0	109.7	V518 E545 L546 E547 V570 E609 L610	L516-V518 HydrophobicContact CD1-CG2 4.45Å; L516-V518 HydrophobicContact CD2-CG2 4.18Å; L516-V518 HydrophobicContact CG-CG2 3.81Å; L516-E545 PolarHBondContact N-O 3.11Å; L516-L546 HydrophobicContact CB-CD1 4.43Å; L516-L546 HydrophobicContact CD2-CD1 4.09Å; L516-L546 HydrophobicContact CG-CD1 4.25Å; L516-E547 PolarHBondContact O-N 2.76Å; L516-V570 HydrophobicContact CD1-CG2 4.24Å; L516-E609 HydrophobicContact CD1-CG 3.81Å; L516-E609 HydrophobicContact CD2-CB 4.23Å; L516-E609 HydrophobicContact CD2-CG 4.13Å; L516-L610 HydrophobicContact CB-CD2 3.97Å; L516-L610 HydrophobicContact CD2-CD2 3.5Å; L516-L610 VanDerWaalsContact CD2-CD2 3.5Å; L516-L610 HydrophobicContact CD2-CG 3.71Å; L516-L610 HydrophobicContact CG-CD2 4.35Å
517	P	94.3	Very high	82.3	Confident	10 Å²	10	47.6 Å²	47.6	7%	0.065	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	127.5	173.2	-21.6	37.6	0	0	0	110.7	V515 E547 V549 F567 G569 V570	V515-P517 HydrophobicContact CG1-CG 4.02Å; V515-P517 WeakPolarHBondContact O-CD 3.46Å; P517-E547 CarbonylContact C-O 3.58Å; P517-E547 WeakPolarHBondContact CA-O 3.49Å; P517-V549 HydrophobicContact CB-CG2 3.65Å; P517-F567 HydrophobicContact CB-CB 4.05Å; P517-F567 HydrophobicContact CG-CB 4.4Å; P517-F567 WeakPolarHBondContact CG-O 3.35Å; P517-G569 CarbonylContact O-C 3.57Å; P517-G569 WeakPolarHBondContact O-CA 3.24Å; P517-V570 PolarHBondContact O-N 3.14Å
518	V	96.2	Very high	83.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.3	-175.1	175.7	0	0	0	0	110.8	L516 I520 L546 E547 V549 Y572	L516-V518 HydrophobicContact CD1-CG2 4.45Å; L516-V518 HydrophobicContact CD2-CG2 4.18Å; L516-V518 HydrophobicContact CG-CG2 3.81Å; V518-I520 HydrophobicContact CG1-CD1 4.23Å; V518-I520 HydrophobicContact CG1-CG1 3.75Å; V518-L546 HydrophobicContact CB-CD1 4.42Å; V518-L546 HydrophobicContact CG2-CD1 3.58Å; V518-E547 PolarHBondContact N-O 3.16Å; V518-V549 PolarHBondContact O-N 3.45Å; V518-Y572 HydrophobicContact CG1-CD2 3.75Å; V518-Y572 HydrophobicContact CG1-CE2 4.24Å; V518-Y572 HydrophobicContact CG2-CE2 4.38Å
519	I	97.1	Very high	85.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.1	168.7	-61.2	-177.6	0	0	0	109	V549 H550 D560 L563 A564 V570 I571 Y572	I519-V549 HydrophobicContact CG1-CB 4.17Å; I519-H550 VanDerWaalsContact CA-O 3.26Å; I519-H550 WeakPolarHBondContact CA-O 3.5Å; I519-H550 HydrophobicContact CG1-CB 4.27Å; I519-H550 HydrophobicContact CG2-CB 4.2Å; I519-D560 WeakPolarHBondContact CD1-O 3.38Å; I519-D560 HydrophobicContact CG2-CB 4.38Å; I519-L563 HydrophobicContact CD1-CB 3.65Å; I519-A564 HydrophobicContact CD1-CB 3.93Å; I519-V570 PolarHBondContact N-O 3.26Å; I519-I571 HydrophobicContact CB-CG1 4.31Å; I519-I571 HydrophobicContact CB-CG2 4.45Å; I519-I571 HydrophobicContact CG2-CG2 4.3Å; I519-I571 WeakPolarHBondContact O-CA 3.5Å; I519-Y572 PolarHBondContact O-N 3.31Å
520	I	97.3	Very high	87	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.5	-175.2	-54.1	177	0	0	0	110.1	V518 I531 L532 I535 L548 H550 F551 G552 Y572	V518-I520 HydrophobicContact CG1-CD1 4.23Å; V518-I520 HydrophobicContact CG1-CG1 3.75Å; I520-I531 HydrophobicContact CD1-CG2 3.8Å; I520-I531 HydrophobicContact CG2-CD1 4.22Å; I520-I531 HydrophobicContact CG2-CG2 4.21Å; I520-L532 HydrophobicContact CD1-CD2 4.2Å; I520-I535 HydrophobicContact CD1-CD1 3.16Å; I520-I535 HydrophobicContact CG1-CD1 4.46Å; I520-L548 HydrophobicContact CD1-CD1 3.53Å; I520-L548 HydrophobicContact CG1-CD1 3.84Å; I520-H550 PolarHBondContact N-O 2.91Å; I520-F551 HydrophobicContact CB-CB 4.39Å; I520-F551 CarbonylContact O-C 3.53Å; I520-F551 VanDerWaalsContact O-CA 3.28Å; I520-F551 WeakPolarHBondContact O-CA 3.49Å; I520-G552 PolarHBondContact O-N 2.96Å; I520-Y572 WeakPolarHBondContact CA-O 3.48Å
521	K	96.6	Very high	88.6	Confident	17 Å²	17	27.8 Å²	27.8	7%	0.074	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	113.3	172.7	-69.3	-61.5	-172.5	-179.7	0	110.4	H550 G552 I556 D560 Y572 G573 F574 V576	K521-H550 PolarHBondContact NZ-NE2 3.48Å; K521-G552 WeakPolarHBondContact CA-O 3.35Å; K521-G552 WeakPolarHBondContact CD-O 3.25Å; K521-I556 HydrophobicContact CB-CG1 4.21Å; K521-I556 HydrophobicContact CG-CG1 4.21Å; K521-D560 WeakPolarHBondContact CE-OD1 3.37Å; K521-D560 WeakPolarHBondContact CE-OD2 3.41Å; K521-D560 IonicContact NZ-OD1 2.76Å; K521-D560 PolarHBondContact NZ-OD1 3.16Å; K521-D560 IonicContact NZ-OD2 3.61Å; K521-D560 PolarHBondContact NZ-OD2 3.46Å; K521-Y572 PolarHBondContact N-O 3.47Å; K521-G573 CarbonylContact O-C 3.5Å; K521-G573 VanDerWaalsContact O-CA 3.31Å; K521-G573 WeakPolarHBondContact O-CA 3.4Å; K521-F574 PolarHBondContact O-N 3.23Å; K521-V576 HydrophobicContact CB-CG2 4.39Å
522	G	95.5	Very high	90.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	163.3	172.4	0	0	0	0	0	111.3	G552 V553 G554 F574 V576	G522-G552 PolarHBondContact N-O 3.42Å; G522-G552 VanDerWaalsContact N-O 3.17Å; G522-V553 CarbonylContact O-C 3.54Å; G522-V553 WeakPolarHBondContact O-CA 3.47Å; G522-G554 PolarHBondContact O-N 3.41Å; G522-F574 WeakPolarHBondContact CA-O 3.3Å; G522-V576 VanDerWaalsContact C-CG1 3.46Å; G522-V576 WeakPolarHBondContact O-CG1 3.46Å
523	D	93.8	Very high	91.8	Very high	25 Å²	25	19.9 Å²	19.9	13%	0.134	11%	0.112	C	C	.	.	S	Bend	trans	-75.8	-40.6	174.8	64	-34.4	0	0	0	112.8	H216 F363 S527 V553 F574 N575 V576	H216-D523 IonicContact CE1-OD1 3.27Å; H216-D523 PolarHBondContact CE1-OD1 3.1Å; H216-D523 IonicContact CE1-OD2 2.76Å; H216-D523 PolarHBondContact CE1-OD2 3.4Å; H216-D523 IonicContact ND1-OD2 3.8Å; H216-D523 IonicContact NE2-OD2 2.78Å; H216-D523 PolarHBondContact NE2-OD2 2.86Å; F363-D523 WeakPolarHBondContact CB-O 3.16Å; D523-S527 PolarHBondContact OD1-OG 3.41Å; D523-V553 WeakPolarHBondContact O-CG1 3.45Å; D523-F574 PolarHBondContact N-O 2.84Å; D523-F574 VanDerWaalsContact N-O 3.15Å; D523-N575 HydrophobicContact CB-CB 4.01Å; D523-N575 PolarHBondContact OD2-ND2 3.37Å; D523-V576 HydrophobicContact CB-CG1 4.37Å
524	V	93.8	Very high	93.1	Very high	10 Å²	10	16.3 Å²	16.3	6%	0.061	9%	0.086	C	C	.	.	B	Isolated β-bridge	trans	-123.7	155.9	177.4	-50.3	0	0	0	0	111	H216 S362 F363 G526 S527 V528	H216-V524 WeakPolarHBondContact ND1-CG2 3.38Å; S362-V524 WeakPolarHBondContact O-CA 3.34Å; F363-V524 HydrophobicContact CB-CB 4.37Å; F363-V524 HydrophobicContact CB-CG1 3.87Å; V524-G526 PolarHBondContact O-N 2.98Å; V524-S527 WeakPolarHBondContact CG2-OG 3.48Å; V524-S527 PolarHBondContact O-N 3.41Å; V524-V528 PolarHBondContact O-N 2.92Å
525	D	93.4	Very high	93.6	Very high	30 Å²	30	14.9 Å²	14.9	16%	0.16	8%	0.079	C	C	.	.	H	α-helix	trans	-60	-43.5	-178.4	-168.3	52.1	0	0	0	113	S362 S426 A427 S527 V528 E529 V553	S362-D525 PolarHBondContact O-N 3.04Å; S426-D525 WeakPolarHBondContact CA-OD2 3.48Å; A427-D525 HydrophobicContact CB-CB 4.21Å; A427-D525 WeakPolarHBondContact CB-OD2 3.11Å; A427-D525 PolarHBondContact N-OD2 3.37Å; D525-S527 VanDerWaalsContact C-N 3.3Å; D525-S527 PolarHBondContact O-N 3.48Å; D525-V528 WeakPolarHBondContact O-CB 3.43Å; D525-V528 PolarHBondContact O-N 3.35Å; D525-V528 VanDerWaalsContact O-N 3.1Å; D525-E529 PolarHBondContact O-N 2.62Å; D525-V553 HydrophobicContact CB-CG2 4.04Å
526	G	90.1	Very high	93.8	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-62.7	-34.1	-180	0	0	0	0	0	113.6	M244 V524 A530	M244-G526 VanDerWaalsContact CE-O 3.25Å; M244-G526 WeakPolarHBondContact CE-O 3.38Å; V524-G526 PolarHBondContact O-N 2.98Å; G526-A530 WeakPolarHBondContact O-CB 3.31Å; G526-A530 PolarHBondContact O-N 3.31Å
527	S	92.2	Very high	93.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66.3	-41.1	174.9	-61.6	0	0	0	0	111.5	D523 V524 D525 A530 I531 F574	D523-S527 PolarHBondContact OD1-OG 3.41Å; V524-S527 WeakPolarHBondContact CG2-OG 3.48Å; V524-S527 PolarHBondContact O-N 3.41Å; D525-S527 VanDerWaalsContact C-N 3.3Å; D525-S527 PolarHBondContact O-N 3.48Å; S527-A530 PolarHBondContact O-N 2.79Å; S527-I531 VanDerWaalsContact O-CG1 3.29Å; S527-I531 WeakPolarHBondContact O-CG1 3.4Å; S527-I531 PolarHBondContact O-N 3.32Å; S527-I531 VanDerWaalsContact O-N 3.11Å; S527-F574 WeakPolarHBondContact OG-CE1 3.46Å
528	V	94.7	Very high	93.6	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-63.8	-49.3	176.8	178.9	0	0	0	0	109.4	V524 D525 A530 I531 L532 F551 V553	V524-V528 PolarHBondContact O-N 2.92Å; D525-V528 WeakPolarHBondContact O-CB 3.43Å; D525-V528 PolarHBondContact O-N 3.35Å; D525-V528 VanDerWaalsContact O-N 3.1Å; V528-A530 VanDerWaalsContact C-N 3.31Å; V528-A530 PolarHBondContact O-N 2.9Å; V528-I531 PolarHBondContact O-N 2.86Å; V528-I531 VanDerWaalsContact O-N 3.11Å; V528-L532 HydrophobicContact CG1-CD1 3.99Å; V528-L532 HydrophobicContact CG1-CG 4.17Å; V528-L532 VanDerWaalsContact O-CG 3.26Å; V528-L532 WeakPolarHBondContact O-CG 3.5Å; V528-L532 PolarHBondContact O-N 2.85Å; V528-F551 HydrophobicContact CG1-CB 4.05Å; V528-F551 HydrophobicContact CG1-CD2 3.84Å; V528-F551 HydrophobicContact CG1-CG 4.35Å; V528-V553 HydrophobicContact CG2-CG2 4.21Å
529	E	93.2	Very high	93.3	Very high	60 Å²	60	30.1 Å²	30.1	28%	0.28	16%	0.159	S	C	.	.	H	α-helix	trans	-55.1	-44.3	176.2	-174.7	-173.8	-172.1	0	0	112.3	R247 D525 I531 L532 N533	R247-E529 IonicContact CZ-OE2 2.64Å; R247-E529 IonicContact NH2-OE1 2.86Å; R247-E529 IonicContact NH2-OE2 2.79Å; R247-E529 PolarHBondContact NH2-OE2 3.46Å; D525-E529 PolarHBondContact O-N 2.62Å; E529-I531 VanDerWaalsContact C-N 3.35Å; E529-I531 PolarHBondContact O-N 2.86Å; E529-L532 PolarHBondContact O-N 2.98Å; E529-N533 VanDerWaalsContact O-CG 3.23Å; E529-N533 PolarHBondContact O-N 2.8Å; E529-N533 PolarHBondContact O-ND2 3.48Å
530	A	91.7	Very high	92.8	Very high	3 Å²	3	30.1 Å²	30.1	3%	0.025	16%	0.16	C	C	.	.	H	α-helix	trans	-60.2	-43.5	176.7	0	0	0	0	0	112.2	F241 G526 S527 V528 N533 I534 I599	F241-A530 HydrophobicContact CD1-CB 3.56Å; F241-A530 HydrophobicContact CE1-CB 3.66Å; G526-A530 WeakPolarHBondContact O-CB 3.31Å; G526-A530 PolarHBondContact O-N 3.31Å; S527-A530 PolarHBondContact O-N 2.79Å; V528-A530 VanDerWaalsContact C-N 3.31Å; V528-A530 PolarHBondContact O-N 2.9Å; A530-N533 PolarHBondContact O-N 3.12Å; A530-I534 VanDerWaalsContact O-CG1 3.29Å; A530-I534 WeakPolarHBondContact O-CG1 3.43Å; A530-I534 PolarHBondContact O-N 2.99Å; A530-I534 VanDerWaalsContact O-N 3.15Å; A530-I599 HydrophobicContact CB-CD1 4.2Å
531	I	93.9	Very high	92.2	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-67.7	-38.8	177	-61.4	163.9	0	0	0	110.8	I520 S527 V528 E529 I534 I535 F574 I599 L602	I520-I531 HydrophobicContact CD1-CG2 3.8Å; I520-I531 HydrophobicContact CG2-CD1 4.22Å; I520-I531 HydrophobicContact CG2-CG2 4.21Å; S527-I531 VanDerWaalsContact O-CG1 3.29Å; S527-I531 WeakPolarHBondContact O-CG1 3.4Å; S527-I531 PolarHBondContact O-N 3.32Å; S527-I531 VanDerWaalsContact O-N 3.11Å; V528-I531 PolarHBondContact O-N 2.86Å; V528-I531 VanDerWaalsContact O-N 3.11Å; E529-I531 VanDerWaalsContact C-N 3.35Å; E529-I531 PolarHBondContact O-N 2.86Å; I531-I534 WeakPolarHBondContact O-CB 3.08Å; I531-I534 PolarHBondContact O-N 3.43Å; I531-I535 HydrophobicContact CG2-CD1 4.1Å; I531-I535 WeakPolarHBondContact O-CG1 3.39Å; I531-I535 PolarHBondContact O-N 3.46Å; I531-F574 HydrophobicContact CD1-CB 3.77Å; I531-F574 HydrophobicContact CD1-CD1 4.45Å; I531-F574 HydrophobicContact CD1-CD2 4.26Å; I531-F574 HydrophobicContact CD1-CG 3.9Å; I531-I599 HydrophobicContact CG1-CD1 3.92Å; I531-I599 HydrophobicContact CG1-CG1 4.12Å; I531-L602 HydrophobicContact CD1-CD1 4.04Å; I531-L602 HydrophobicContact CG2-CD2 4.12Å
532	L	94.4	Very high	91.6	Very high	37 Å²	37	39.9 Å²	39.9	19%	0.194	21%	0.213	C	C	.	.	H	α-helix	trans	-62.7	-43.2	176.6	-67.8	179.1	0	0	0	111.7	I520 V528 E529 I534 I535 D536 L548 F551	I520-L532 HydrophobicContact CD1-CD2 4.2Å; V528-L532 HydrophobicContact CG1-CD1 3.99Å; V528-L532 HydrophobicContact CG1-CG 4.17Å; V528-L532 VanDerWaalsContact O-CG 3.26Å; V528-L532 WeakPolarHBondContact O-CG 3.5Å; V528-L532 PolarHBondContact O-N 2.85Å; E529-L532 PolarHBondContact O-N 2.98Å; L532-I534 VanDerWaalsContact C-N 3.26Å; L532-I534 PolarHBondContact O-N 2.71Å; L532-I535 PolarHBondContact O-N 3.3Å; L532-I535 VanDerWaalsContact O-N 3.1Å; L532-D536 PolarHBondContact O-N 3.08Å; L532-L548 HydrophobicContact CD2-CD1 4.05Å; L532-L548 HydrophobicContact CD2-CD2 3.28Å; L532-L548 HydrophobicContact CD2-CG 4.3Å; L532-F551 HydrophobicContact CD1-CD1 4.28Å; L532-F551 HydrophobicContact CD1-CD2 3.84Å; L532-F551 HydrophobicContact CD1-CE1 4.44Å; L532-F551 HydrophobicContact CD1-CE2 4.02Å; L532-F551 HydrophobicContact CD1-CG 3.97Å; L532-F551 HydrophobicContact CD1-CZ 4.31Å; L532-F551 HydrophobicContact CD2-CB 4.23Å; L532-F551 HydrophobicContact CD2-CD1 4.42Å; L532-F551 HydrophobicContact CD2-CG 4.3Å
533	N	92.3	Very high	91.1	Very high	71 Å²	71	41.9 Å²	41.9	38%	0.38	22%	0.222	S	C	.	.	H	α-helix	trans	-62.3	-35.3	175.6	-68.9	-24.2	0	0	0	111.8	E529 A530 D536 T537	E529-N533 VanDerWaalsContact O-CG 3.23Å; E529-N533 PolarHBondContact O-N 2.8Å; E529-N533 PolarHBondContact O-ND2 3.48Å; A530-N533 PolarHBondContact O-N 3.12Å; N533-D536 PolarHBondContact O-N 2.98Å; N533-T537 WeakPolarHBondContact O-CG2 3.22Å; N533-T537 PolarHBondContact O-N 2.89Å
534	I	92.3	Very high	90.9	Very high	7 Å²	7	40.8 Å²	40.8	4%	0.036	22%	0.216	C	C	.	.	H	α-helix	trans	-67	-41.5	173.4	-65.3	162.7	0	0	0	110.7	A240 A530 I531 L532 D536 T537 I599 V603 W723 P725 F727	A240-I534 HydrophobicContact CB-CD1 3.73Å; A240-I534 HydrophobicContact CB-CG1 4.22Å; A530-I534 VanDerWaalsContact O-CG1 3.29Å; A530-I534 WeakPolarHBondContact O-CG1 3.43Å; A530-I534 PolarHBondContact O-N 2.99Å; A530-I534 VanDerWaalsContact O-N 3.15Å; I531-I534 WeakPolarHBondContact O-CB 3.08Å; I531-I534 PolarHBondContact O-N 3.43Å; L532-I534 VanDerWaalsContact C-N 3.26Å; L532-I534 PolarHBondContact O-N 2.71Å; I534-D536 VanDerWaalsContact C-N 3.25Å; I534-D536 PolarHBondContact O-N 2.85Å; I534-T537 PolarHBondContact O-N 2.79Å; I534-T537 VanDerWaalsContact O-N 3.15Å; I534-T537 PolarHBondContact O-OG1 3.39Å; I534-I599 HydrophobicContact CD1-CD1 3.76Å; I534-I599 HydrophobicContact CD1-CG1 4.13Å; I534-V603 HydrophobicContact CD1-CG2 4.09Å; I534-V603 HydrophobicContact CG2-CG1 4.32Å; I534-V603 HydrophobicContact CG2-CG2 3.96Å; I534-W723 HydrophobicContact CG2-CH2 3.97Å; I534-W723 HydrophobicContact CG2-CZ2 3.8Å; I534-W723 WeakPolarHBondContact O-CZ2 3.27Å; I534-P725 HydrophobicContact CG2-CB 4.11Å; I534-F727 HydrophobicContact CB-CE1 4.44Å; I534-F727 HydrophobicContact CD1-CE1 3.7Å; I534-F727 HydrophobicContact CD1-CZ 4.1Å; I534-F727 HydrophobicContact CG1-CD1 4.4Å; I534-F727 HydrophobicContact CG1-CE1 3.69Å; I534-F727 HydrophobicContact CG2-CE1 3.87Å
535	I	92.5	Very high	90.6	Very high	22 Å²	22	45 Å²	45	11%	0.113	24%	0.236	C	C	.	.	H	α-helix	trans	-66.5	-32.3	178.1	-72.4	171.5	0	0	0	111.3	I520 I531 L532 T537 Y538 L546 L606	I520-I535 HydrophobicContact CD1-CD1 3.16Å; I520-I535 HydrophobicContact CG1-CD1 4.46Å; I531-I535 HydrophobicContact CG2-CD1 4.1Å; I531-I535 WeakPolarHBondContact O-CG1 3.39Å; I531-I535 PolarHBondContact O-N 3.46Å; L532-I535 PolarHBondContact O-N 3.3Å; L532-I535 VanDerWaalsContact O-N 3.1Å; I535-T537 PolarHBondContact O-N 3.43Å; I535-Y538 WeakPolarHBondContact O-CB 3.41Å; I535-Y538 PolarHBondContact O-N 3.28Å; I535-Y538 VanDerWaalsContact O-N 3.12Å; I535-L546 HydrophobicContact CB-CD2 4.41Å; I535-L546 HydrophobicContact CG1-CD2 4.23Å; I535-L546 HydrophobicContact CG2-CD2 3.75Å; I535-L546 HydrophobicContact CG2-CG 4.25Å; I535-L606 HydrophobicContact CD1-CD1 4.32Å; I535-L606 HydrophobicContact CG1-CD1 4.39Å
536	D	91.6	Very high	90.6	Very high	141 Å²	141	45 Å²	45	75%	0.754	24%	0.235	S	C	*	.	H	α-helix	trans	-67.3	-22	174.7	-162.7	57.1	0	0	0	112.8	L532 N533 I534 Y538	L532-D536 PolarHBondContact O-N 3.08Å; N533-D536 PolarHBondContact O-N 2.98Å; I534-D536 VanDerWaalsContact C-N 3.25Å; I534-D536 PolarHBondContact O-N 2.85Å; D536-Y538 PolarHBondContact O-N 2.8Å
537	T	91.5	Very high	90.7	Very high	65 Å²	65	49.4 Å²	49.4	40%	0.399	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-2.2	172.4	74.1	0	0	0	0	113.6	N533 I534 I535 D539 W723	N533-T537 WeakPolarHBondContact O-CG2 3.22Å; N533-T537 PolarHBondContact O-N 2.89Å; I534-T537 PolarHBondContact O-N 2.79Å; I534-T537 VanDerWaalsContact O-N 3.15Å; I534-T537 PolarHBondContact O-OG1 3.39Å; I535-T537 PolarHBondContact O-N 3.43Å; T537-D539 PolarHBondContact O-N 3.34Å; T537-W723 PolarHBondContact O-NE1 3.07Å; T537-W723 PolarHBondContact OG1-NE1 3.2Å
538	Y	92	Very high	90.8	Very high	26 Å²	26	52.3 Å²	52.3	10%	0.102	27%	0.271	C	S	.	.			trans	-66.1	115.5	180	-174.1	-104.9	0	0	0	112.3	I535 D536 A540 C544 L546 L610 W723	I535-Y538 WeakPolarHBondContact O-CB 3.41Å; I535-Y538 PolarHBondContact O-N 3.28Å; I535-Y538 VanDerWaalsContact O-N 3.12Å; D536-Y538 PolarHBondContact O-N 2.8Å; Y538-A540 HydrophobicContact CE2-CB 3.92Å; Y538-A540 PolarHBondContact OH-O 3.41Å; Y538-C544 VanDerWaalsContact CE1-O 3.27Å; Y538-C544 WeakPolarHBondContact CE1-O 3.17Å; Y538-C544 PolarHBondContact OH-O 3.06Å; Y538-L546 HydrophobicContact CD1-CB 3.93Å; Y538-L546 HydrophobicContact CD2-CD2 4.3Å; Y538-L546 HydrophobicContact CE1-CB 4Å; Y538-L546 HydrophobicContact CG-CB 4.29Å; Y538-L546 HydrophobicContact CG-CD2 4.13Å; Y538-L610 HydrophobicContact CD2-CD1 4.36Å; Y538-L610 HydrophobicContact CE2-CD1 3.76Å; Y538-W723 HydrophobicContact CD2-CB 3.89Å; Y538-W723 AromaticContact CD2-CD1 3.93Å; Y538-W723 AromaticContact CD2-CD2 3.66Å; Y538-W723 HydrophobicContact CD2-CD2 3.66Å; Y538-W723 HydrophobicContact CD2-CE3 4.11Å; Y538-W723 AromaticContact CD2-CG 3.55Å; Y538-W723 HydrophobicContact CD2-CG 3.55Å; Y538-W723 HydrophobicContact CE2-CB 3.82Å; Y538-W723 HydrophobicContact CE2-CD2 4.27Å; Y538-W723 HydrophobicContact CE2-CE3 4.48Å; Y538-W723 AromaticContact CE2-CG 3.99Å; Y538-W723 HydrophobicContact CE2-CG 3.99Å
539	D	90.4	Very high	90.9	Very high	114 Å²	114	54.1 Å²	54.1	61%	0.61	28%	0.282	S	S	*	.			trans	-110.6	-9.2	-175.3	64.9	-18.4	0	0	0	113.9	T537 S541	T537-D539 PolarHBondContact O-N 3.34Å; D539-S541 VanDerWaalsContact C-N 3.33Å; D539-S541 PolarHBondContact O-N 3.38Å
540	A	86.7	Confident	91	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.008	28%	0.282	C	S	.	.			trans	-90.8	34.1	-173.3	0	0	0	0	0	114.4	Y538 H542 E543 C544 S722 W723	Y538-A540 HydrophobicContact CE2-CB 3.92Å; Y538-A540 PolarHBondContact OH-O 3.41Å; A540-H542 PolarHBondContact O-N 3.36Å; A540-E543 WeakPolarHBondContact O-CB 3.32Å; A540-E543 PolarHBondContact O-N 3.31Å; A540-C544 PolarHBondContact O-N 3.03Å; A540-S722 WeakPolarHBondContact CB-OG 3.31Å; A540-W723 HydrophobicContact CB-CB 4.24Å
541	S	84.6	Confident	91.2	Very high	69 Å²	69	59 Å²	59	48%	0.483	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-16.5	-176.5	-42.2	0	0	0	0	115	D539 C544	D539-S541 VanDerWaalsContact C-N 3.33Å; D539-S541 PolarHBondContact O-N 3.38Å; S541-C544 WeakPolarHBondContact CA-O 3.47Å
542	H	83.4	Confident	91.2	Very high	154 Å²	154	59.7 Å²	59.7	71%	0.713	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-20.6	176.1	67.3	-79.4	0	0	0	113.4	A540	A540-H542 PolarHBondContact O-N 3.36Å
543	E	85.3	Confident	91.2	Very high	41 Å²	41	59.2 Å²	59.2	19%	0.192	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-55	177.1	-76.9	177.4	-162.9	0	0	111.1	A540 L614 S722	A540-E543 WeakPolarHBondContact O-CB 3.32Å; A540-E543 PolarHBondContact O-N 3.31Å; E543-L614 HydrophobicContact CB-CD2 3.71Å; E543-L614 HydrophobicContact CB-CG 4.49Å; E543-L614 HydrophobicContact CG-CD2 3.92Å; E543-S722 VanDerWaalsContact OE1-CB 3.24Å; E543-S722 WeakPolarHBondContact OE1-CB 3.44Å; E543-S722 PolarHBondContact OE1-OG 2.99Å; E543-S722 PolarHBondContact OE2-N 2.86Å; E543-S722 PolarHBondContact OE2-OG 2.65Å
544	C	88.2	Confident	91.2	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.014	30%	0.296	C	S	.	.			trans	-146	139	-178	-172.5	0	0	0	0	108.1	N514 Y538 A540 S541 L610	N514-C544 CarbonylContact O-C 3.53Å; N514-C544 VanDerWaalsContact O-CA 3.28Å; N514-C544 WeakPolarHBondContact O-CA 3.25Å; N514-C544 PolarHBondContact O-SG 2.89Å; Y538-C544 VanDerWaalsContact CE1-O 3.27Å; Y538-C544 WeakPolarHBondContact CE1-O 3.17Å; Y538-C544 PolarHBondContact OH-O 3.06Å; A540-C544 PolarHBondContact O-N 3.03Å; S541-C544 WeakPolarHBondContact CA-O 3.47Å; C544-L610 HydrophobicContact CB-CD2 4.03Å; C544-L610 VanDerWaalsContact SG-CD2 3.54Å
545	E	89.3	Confident	91.3	Very high	100 Å²	100	58.8 Å²	58.8	47%	0.467	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	113.9	175.3	-74.2	-175.8	-176.4	0	0	109.1	N514 V515 L516 E547	N514-E545 PolarHBondContact O-N 2.91Å; V515-E545 CarbonylContact C-O 3.52Å; V515-E545 WeakPolarHBondContact CA-O 3.39Å; V515-E545 HydrophobicContact CG1-CB 4.43Å; V515-E545 HydrophobicContact CG2-CB 4.06Å; L516-E545 PolarHBondContact N-O 3.11Å; E545-E547 PolarHBondContact O-N 2.71Å
546	L	92.4	Very high	91.4	Very high	28 Å²	28	58.1 Å²	58.1	15%	0.147	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	109.4	173.9	-178.8	60.7	0	0	0	109.3	L516 V518 I535 Y538 L606 L610	L516-L546 HydrophobicContact CB-CD1 4.43Å; L516-L546 HydrophobicContact CD2-CD1 4.09Å; L516-L546 HydrophobicContact CG-CD1 4.25Å; V518-L546 HydrophobicContact CB-CD1 4.42Å; V518-L546 HydrophobicContact CG2-CD1 3.58Å; I535-L546 HydrophobicContact CB-CD2 4.41Å; I535-L546 HydrophobicContact CG1-CD2 4.23Å; I535-L546 HydrophobicContact CG2-CD2 3.75Å; I535-L546 HydrophobicContact CG2-CG 4.25Å; Y538-L546 HydrophobicContact CD1-CB 3.93Å; Y538-L546 HydrophobicContact CD2-CD2 4.3Å; Y538-L546 HydrophobicContact CE1-CB 4Å; Y538-L546 HydrophobicContact CG-CB 4.29Å; Y538-L546 HydrophobicContact CG-CD2 4.13Å; L546-L606 HydrophobicContact CD1-CD2 4.37Å; L546-L606 HydrophobicContact CD2-CD2 4.04Å; L546-L610 HydrophobicContact CD1-CD2 4.42Å
547	E	92.3	Very high	91.5	Very high	95 Å²	95	53.7 Å²	53.7	44%	0.444	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.3	-177.2	-171.4	-179.3	-172.2	0	0	110.9	V515 L516 P517 V518 E545 V549	V515-E547 HydrophobicContact CG1-CB 3.91Å; L516-E547 PolarHBondContact O-N 2.76Å; P517-E547 CarbonylContact C-O 3.58Å; P517-E547 WeakPolarHBondContact CA-O 3.49Å; V518-E547 PolarHBondContact N-O 3.16Å; E545-E547 PolarHBondContact O-N 2.71Å; E547-V549 PolarHBondContact O-N 2.74Å
548	L	95.1	Very high	91.6	Very high	60 Å²	60	52.9 Å²	52.9	31%	0.314	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	105.1	172.5	-176.7	74.3	0	0	0	110.2	I520 L532 F551	I520-L548 HydrophobicContact CD1-CD1 3.53Å; I520-L548 HydrophobicContact CG1-CD1 3.84Å; L532-L548 HydrophobicContact CD2-CD1 4.05Å; L532-L548 HydrophobicContact CD2-CD2 3.28Å; L532-L548 HydrophobicContact CD2-CG 4.3Å; L548-F551 HydrophobicContact CD1-CB 4.49Å; L548-F551 HydrophobicContact CD2-CD1 3.74Å; L548-F551 HydrophobicContact CD2-CE1 4.43Å; L548-F551 HydrophobicContact CD2-CG 4.5Å; L548-F551 HydrophobicContact CG-CD1 4.5Å
549	V	94.9	Very high	91.8	Very high	39 Å²	39	56.1 Å²	56.1	24%	0.236	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-45.4	-179.2	177.6	0	0	0	0	111.3	P517 V518 I519 E547 F567	P517-V549 HydrophobicContact CB-CG2 3.65Å; V518-V549 PolarHBondContact O-N 3.45Å; I519-V549 HydrophobicContact CG1-CB 4.17Å; E547-V549 PolarHBondContact O-N 2.74Å; V549-F567 HydrophobicContact CG1-CD2 3.6Å; V549-F567 HydrophobicContact CG1-CE2 3.74Å; V549-F567 HydrophobicContact CG1-CG 4.29Å; V549-F567 HydrophobicContact CG2-CB 4.3Å; V549-F567 HydrophobicContact CG2-CD2 4.36Å; V549-F567 HydrophobicContact CG2-CG 4.24Å
550	H	95.8	Very high	92	Very high	64 Å²	64	50.8 Å²	50.8	30%	0.296	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	140.6	-176.5	-173.6	59	0	0	0	110.9	I519 I520 K521 D560 L563	I519-H550 VanDerWaalsContact CA-O 3.26Å; I519-H550 WeakPolarHBondContact CA-O 3.5Å; I519-H550 HydrophobicContact CG1-CB 4.27Å; I519-H550 HydrophobicContact CG2-CB 4.2Å; I520-H550 PolarHBondContact N-O 2.91Å; K521-H550 PolarHBondContact NZ-NE2 3.48Å; H550-D560 IonicContact CD2-OD1 3.76Å; H550-D560 PolarHBondContact CD2-OD1 2.64Å; H550-D560 IonicContact NE2-OD1 2.68Å; H550-L563 HydrophobicContact CB-CD1 4.24Å
551	F	96.3	Very high	92.5	Very high	103 Å²	103	50.7 Å²	50.7	45%	0.452	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	155.2	169.2	66.2	-87.6	0	0	0	109.9	I520 V528 L532 L548	I520-F551 HydrophobicContact CB-CB 4.39Å; I520-F551 CarbonylContact O-C 3.53Å; I520-F551 VanDerWaalsContact O-CA 3.28Å; I520-F551 WeakPolarHBondContact O-CA 3.49Å; V528-F551 HydrophobicContact CG1-CB 4.05Å; V528-F551 HydrophobicContact CG1-CD2 3.84Å; V528-F551 HydrophobicContact CG1-CG 4.35Å; L532-F551 HydrophobicContact CD1-CD1 4.28Å; L532-F551 HydrophobicContact CD1-CD2 3.84Å; L532-F551 HydrophobicContact CD1-CE1 4.44Å; L532-F551 HydrophobicContact CD1-CE2 4.02Å; L532-F551 HydrophobicContact CD1-CG 3.97Å; L532-F551 HydrophobicContact CD1-CZ 4.31Å; L532-F551 HydrophobicContact CD2-CB 4.23Å; L532-F551 HydrophobicContact CD2-CD1 4.42Å; L532-F551 HydrophobicContact CD2-CG 4.3Å; L548-F551 HydrophobicContact CD1-CB 4.49Å; L548-F551 HydrophobicContact CD2-CD1 3.74Å; L548-F551 HydrophobicContact CD2-CE1 4.43Å; L548-F551 HydrophobicContact CD2-CG 4.5Å; L548-F551 HydrophobicContact CG-CD1 4.5Å
552	G	94.3	Very high	93	Very high	15 Å²	15	50.5 Å²	50.5	16%	0.155	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.2	171.8	171.5	0	0	0	0	0	113.9	I520 K521 G522	I520-G552 PolarHBondContact O-N 2.96Å; K521-G552 WeakPolarHBondContact CA-O 3.35Å; K521-G552 WeakPolarHBondContact CD-O 3.25Å; G522-G552 PolarHBondContact N-O 3.42Å; G522-G552 VanDerWaalsContact N-O 3.17Å
553	V	94.4	Very high	93.5	Very high	27 Å²	27	45.3 Å²	45.3	16%	0.164	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	138.8	-177.6	-176	0	0	0	0	110.3	L424 G522 D523 D525 V528	L424-V553 HydrophobicContact CD1-CB 3.88Å; L424-V553 HydrophobicContact CD1-CG1 4.2Å; G522-V553 CarbonylContact O-C 3.54Å; G522-V553 WeakPolarHBondContact O-CA 3.47Å; D523-V553 WeakPolarHBondContact O-CG1 3.45Å; D525-V553 HydrophobicContact CB-CG2 4.04Å; V528-V553 HydrophobicContact CG2-CG2 4.21Å
554	G	92.9	Very high	94	Very high	11 Å²	11	43.4 Å²	43.4	11%	0.113	24%	0.237	C	C	.	.	S	Bend	trans	104.9	173.5	179.1	0	0	0	0	0	114.5	G522	G522-G554 PolarHBondContact O-N 3.41Å
555	D	93.8	Very high	94.3	Very high	58 Å²	58	47.2 Å²	47.2	31%	0.31	26%	0.255	S	S	.	.	S	Bend	trans	-56.8	152.6	-178.2	-77.2	-4.8	0	0	0	113.6	K366 S557 N577	K366-D555 WeakPolarHBondContact CE-OD2 3.5Å; K366-D555 IonicContact NZ-OD2 2.83Å; K366-D555 PolarHBondContact NZ-OD2 2.83Å; D555-S557 PolarHBondContact O-N 2.87Å; D555-N577 VanDerWaalsContact CB-O 3.29Å; D555-N577 WeakPolarHBondContact CB-O 3.34Å; D555-N577 PolarHBondContact OD1-N 3.27Å
556	I	94.9	Very high	94.5	Very high	8 Å²	8	47.5 Å²	47.5	4%	0.041	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-64.4	124.2	-179	-55.3	-178.9	0	0	0	110.4	K521 D560 V561 I571 V576 V578 I582 M593 L595	K521-I556 HydrophobicContact CB-CG1 4.21Å; K521-I556 HydrophobicContact CG-CG1 4.21Å; I556-D560 HydrophobicContact CG2-CB 4.25Å; I556-V561 HydrophobicContact CG2-CG2 4.49Å; I556-I571 HydrophobicContact CD1-CG2 3.73Å; I556-I571 HydrophobicContact CG1-CG2 4.29Å; I556-I571 HydrophobicContact CG2-CD1 4.32Å; I556-I571 HydrophobicContact CG2-CG2 4.28Å; I556-V576 HydrophobicContact CG1-CG2 4.23Å; I556-V578 HydrophobicContact CB-CG2 4.13Å; I556-V578 HydrophobicContact CD1-CG2 3.64Å; I556-V578 HydrophobicContact CG1-CG2 4.01Å; I556-I582 HydrophobicContact CG2-CG2 4.23Å; I556-M593 HydrophobicContact CD1-SD 4.5Å; I556-M593 HydrophobicContact CG2-SD 4.37Å; I556-L595 HydrophobicContact CD1-CD2 3.8Å
557	S	93.1	Very high	94.5	Very high	47 Å²	47	50.8 Å²	50.8	33%	0.329	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-100.2	167.5	-178.8	80.4	0	0	0	0	112.5	D555 N559 D560 V561	D555-S557 PolarHBondContact O-N 2.87Å; S557-N559 PolarHBondContact O-N 3.42Å; S557-N559 PolarHBondContact OG-N 3.32Å; S557-D560 WeakPolarHBondContact CA-OD2 3.43Å; S557-D560 VanDerWaalsContact CB-OD2 3.28Å; S557-D560 WeakPolarHBondContact CB-OD2 3.26Å; S557-D560 PolarHBondContact N-OD2 3.15Å; S557-D560 PolarHBondContact O-N 2.79Å; S557-D560 VanDerWaalsContact OG-CG 3.3Å; S557-D560 PolarHBondContact OG-N 3.5Å; S557-D560 PolarHBondContact OG-OD2 2.76Å; S557-V561 PolarHBondContact O-N 2.82Å
558	A	94.3	Very high	94.4	Very high	48 Å²	48	52.5 Å²	52.5	40%	0.397	29%	0.289	S	S	.	.	H	α-helix	trans	-63.4	-27.9	174.2	0	0	0	0	0	112.8	D560 V561 N562 I582	A558-D560 VanDerWaalsContact C-N 3.34Å; A558-V561 PolarHBondContact O-N 3Å; A558-N562 PolarHBondContact O-N 2.99Å; A558-N562 VanDerWaalsContact O-N 3.14Å; A558-N562 PolarHBondContact O-ND2 2.8Å; A558-N562 PolarHBondContact O-OD1 3.05Å; A558-I582 HydrophobicContact CB-CD1 3.89Å
559	N	95.1	Very high	94.3	Very high	95 Å²	95	49.9 Å²	49.9	51%	0.508	28%	0.277	S	S	.	.	H	α-helix	trans	-66.2	-40.2	177.7	-168.1	38.3	0	0	0	111	S557 V561 N562 L563	S557-N559 PolarHBondContact O-N 3.42Å; S557-N559 PolarHBondContact OG-N 3.32Å; N559-V561 VanDerWaalsContact C-N 3.32Å; N559-V561 PolarHBondContact O-N 2.99Å; N559-N562 WeakPolarHBondContact O-CB 3.48Å; N559-N562 PolarHBondContact O-N 3.3Å; N559-N562 VanDerWaalsContact O-N 3.14Å; N559-L563 WeakPolarHBondContact O-CG 3.41Å; N559-L563 PolarHBondContact O-N 2.92Å
560	D	95.4	Very high	94.3	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-37.9	179.5	-49.4	-56.5	0	0	0	111.2	I519 K521 H550 I556 S557 A558 L563 A564 I571	I519-D560 WeakPolarHBondContact CD1-O 3.38Å; I519-D560 HydrophobicContact CG2-CB 4.38Å; K521-D560 WeakPolarHBondContact CE-OD1 3.37Å; K521-D560 WeakPolarHBondContact CE-OD2 3.41Å; K521-D560 IonicContact NZ-OD1 2.76Å; K521-D560 PolarHBondContact NZ-OD1 3.16Å; K521-D560 IonicContact NZ-OD2 3.61Å; K521-D560 PolarHBondContact NZ-OD2 3.46Å; H550-D560 IonicContact CD2-OD1 3.76Å; H550-D560 PolarHBondContact CD2-OD1 2.64Å; H550-D560 IonicContact NE2-OD1 2.68Å; I556-D560 HydrophobicContact CG2-CB 4.25Å; S557-D560 WeakPolarHBondContact CA-OD2 3.43Å; S557-D560 VanDerWaalsContact CB-OD2 3.28Å; S557-D560 WeakPolarHBondContact CB-OD2 3.26Å; S557-D560 PolarHBondContact N-OD2 3.15Å; S557-D560 PolarHBondContact O-N 2.79Å; S557-D560 VanDerWaalsContact OG-CG 3.3Å; S557-D560 PolarHBondContact OG-N 3.5Å; S557-D560 PolarHBondContact OG-OD2 2.76Å; A558-D560 VanDerWaalsContact C-N 3.34Å; D560-L563 PolarHBondContact O-N 3.04Å; D560-A564 WeakPolarHBondContact O-CB 3.33Å; D560-A564 PolarHBondContact O-N 3.04Å; D560-I571 HydrophobicContact CB-CD1 4.37Å
561	V	96.2	Very high	94.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.2	-39	173.3	-179.7	0	0	0	0	111.9	I556 S557 A558 N559 E565 I571 I582 A586 K589 V591 M593	I556-V561 HydrophobicContact CG2-CG2 4.49Å; S557-V561 PolarHBondContact O-N 2.82Å; A558-V561 PolarHBondContact O-N 3Å; N559-V561 VanDerWaalsContact C-N 3.32Å; N559-V561 PolarHBondContact O-N 2.99Å; V561-E565 WeakPolarHBondContact O-CB 3.47Å; V561-E565 PolarHBondContact O-N 2.7Å; V561-I571 HydrophobicContact CG2-CD1 4.13Å; V561-I582 HydrophobicContact CG2-CG2 3.72Å; V561-A586 HydrophobicContact CG1-CB 4.17Å; V561-A586 HydrophobicContact CG2-CB 4.39Å; V561-K589 HydrophobicContact CG1-CD 3.86Å; V561-V591 HydrophobicContact CG1-CB 4.42Å; V561-V591 HydrophobicContact CG1-CG2 4.23Å; V561-M593 HydrophobicContact CG2-SD 4.41Å
562	N	95.5	Very high	94.4	Very high	64 Å²	64	40.2 Å²	40.2	34%	0.342	23%	0.23	S	C	.	.	H	α-helix	trans	-69	-39.2	177.6	-61.8	-25.7	0	0	0	112.1	A558 N559 E565 T566 K589	A558-N562 PolarHBondContact O-N 2.99Å; A558-N562 VanDerWaalsContact O-N 3.14Å; A558-N562 PolarHBondContact O-ND2 2.8Å; A558-N562 PolarHBondContact O-OD1 3.05Å; N559-N562 WeakPolarHBondContact O-CB 3.48Å; N559-N562 PolarHBondContact O-N 3.3Å; N559-N562 VanDerWaalsContact O-N 3.14Å; N562-E565 PolarHBondContact O-N 2.8Å; N562-T566 PolarHBondContact O-N 2.77Å; N562-T566 PolarHBondContact O-OG1 3.22Å; N562-K589 PolarHBondContact OD1-NZ 2.8Å
563	L	94.9	Very high	94.5	Very high	46 Å²	46	39.5 Å²	39.5	24%	0.241	22%	0.223	C	C	.	.	H	α-helix	trans	-63.4	-49.2	174.7	-70.9	170.6	0	0	0	110	I519 H550 N559 D560 E565 T566 F567	I519-L563 HydrophobicContact CD1-CB 3.65Å; H550-L563 HydrophobicContact CB-CD1 4.24Å; N559-L563 WeakPolarHBondContact O-CG 3.41Å; N559-L563 PolarHBondContact O-N 2.92Å; D560-L563 PolarHBondContact O-N 3.04Å; L563-E565 VanDerWaalsContact C-N 3.31Å; L563-E565 PolarHBondContact O-N 2.95Å; L563-T566 PolarHBondContact O-N 2.75Å; L563-F567 HydrophobicContact CD2-CE2 4.5Å; L563-F567 VanDerWaalsContact O-CD2 3.27Å; L563-F567 WeakPolarHBondContact O-CD2 3.41Å; L563-F567 PolarHBondContact O-N 3.39Å; L563-F567 VanDerWaalsContact O-N 3.14Å
564	A	95.1	Very high	94.6	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-59.7	-39.9	177.6	0	0	0	0	0	112.7	I519 D560 T566 F567 N568 G569 I571 V591	I519-A564 HydrophobicContact CD1-CB 3.93Å; D560-A564 WeakPolarHBondContact O-CB 3.33Å; D560-A564 PolarHBondContact O-N 3.04Å; A564-T566 VanDerWaalsContact C-N 3.34Å; A564-T566 PolarHBondContact O-N 2.97Å; A564-F567 PolarHBondContact O-N 2.95Å; A564-N568 CarbonylContact O-C 3.54Å; A564-N568 WeakPolarHBondContact O-CA 3.46Å; A564-N568 PolarHBondContact O-N 2.81Å; A564-G569 PolarHBondContact O-N 3.29Å; A564-I571 HydrophobicContact CB-CD1 3.8Å; A564-I571 HydrophobicContact CB-CG1 3.67Å; A564-V591 HydrophobicContact CB-CG1 3.55Å; A564-V591 HydrophobicContact CB-CG2 4.29Å
565	E	94.6	Very high	94.6	Very high	82 Å²	82	40.7 Å²	40.7	38%	0.383	23%	0.226	S	C	.	.	H	α-helix	trans	-61.3	-41.3	174.2	178.4	-175.9	-149	0	0	111.9	V561 N562 L563 F567 K589 V591	V561-E565 WeakPolarHBondContact O-CB 3.47Å; V561-E565 PolarHBondContact O-N 2.7Å; N562-E565 PolarHBondContact O-N 2.8Å; L563-E565 VanDerWaalsContact C-N 3.31Å; L563-E565 PolarHBondContact O-N 2.95Å; E565-F567 VanDerWaalsContact C-N 3.34Å; E565-F567 PolarHBondContact O-N 2.82Å; E565-K589 HydrophobicContact CG-CB 4.42Å; E565-K589 WeakPolarHBondContact OE2-CD 3.43Å; E565-K589 WeakPolarHBondContact OE2-CE 3.42Å; E565-K589 IonicContact OE2-NZ 3.28Å; E565-K589 PolarHBondContact OE2-NZ 2.9Å; E565-V591 HydrophobicContact CB-CG2 3.96Å
566	T	93.3	Very high	94.6	Very high	105 Å²	105	38.3 Å²	38.3	64%	0.644	21%	0.214	S	C	*	.	H	α-helix	trans	-67.2	-36.8	-177.2	-56	0	0	0	0	111.9	N562 L563 A564	N562-T566 PolarHBondContact O-N 2.77Å; N562-T566 PolarHBondContact O-OG1 3.22Å; L563-T566 PolarHBondContact O-N 2.75Å; A564-T566 VanDerWaalsContact C-N 3.34Å; A564-T566 PolarHBondContact O-N 2.97Å
567	F	91.4	Very high	94.4	Very high	98 Å²	98	43 Å²	43	43%	0.43	24%	0.239	S	C	.	.	H	α-helix	trans	-101.4	4.2	-177.3	-64.4	-78.1	0	0	0	113.6	P517 V549 L563 A564 E565 G569	P517-F567 HydrophobicContact CB-CB 4.05Å; P517-F567 HydrophobicContact CG-CB 4.4Å; P517-F567 WeakPolarHBondContact CG-O 3.35Å; V549-F567 HydrophobicContact CG1-CD2 3.6Å; V549-F567 HydrophobicContact CG1-CE2 3.74Å; V549-F567 HydrophobicContact CG1-CG 4.29Å; V549-F567 HydrophobicContact CG2-CB 4.3Å; V549-F567 HydrophobicContact CG2-CD2 4.36Å; V549-F567 HydrophobicContact CG2-CG 4.24Å; L563-F567 HydrophobicContact CD2-CE2 4.5Å; L563-F567 VanDerWaalsContact O-CD2 3.27Å; L563-F567 WeakPolarHBondContact O-CD2 3.41Å; L563-F567 PolarHBondContact O-N 3.39Å; L563-F567 VanDerWaalsContact O-N 3.14Å; A564-F567 PolarHBondContact O-N 2.95Å; E565-F567 VanDerWaalsContact C-N 3.34Å; E565-F567 PolarHBondContact O-N 2.82Å; F567-G569 PolarHBondContact O-N 3.26Å
568	N	90.7	Very high	94.3	Very high	130 Å²	130	41.8 Å²	41.8	70%	0.695	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	39.1	-170.1	-64.3	-35.9	0	0	0	113.1	A564 R613	A564-N568 CarbonylContact O-C 3.54Å; A564-N568 WeakPolarHBondContact O-CA 3.46Å; A564-N568 PolarHBondContact O-N 2.81Å; N568-R613 PolarHBondContact O-NH2 2.85Å
569	G	92.7	Very high	94.1	Very high	6 Å²	6	41.5 Å²	41.5	6%	0.062	23%	0.231	C	C	.	.			trans	-88.6	166.9	-175.9	0	0	0	0	0	114	P517 A564 F567	P517-G569 CarbonylContact O-C 3.57Å; P517-G569 WeakPolarHBondContact O-CA 3.24Å; A564-G569 PolarHBondContact O-N 3.29Å; F567-G569 PolarHBondContact O-N 3.26Å
570	V	95.6	Very high	94	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	135.6	174.7	-176.5	0	0	0	0	109.3	L516 P517 I519 Y572 K592 K594 E609	L516-V570 HydrophobicContact CD1-CG2 4.24Å; P517-V570 PolarHBondContact O-N 3.14Å; I519-V570 PolarHBondContact N-O 3.26Å; V570-Y572 HydrophobicContact CB-CE2 3.99Å; V570-Y572 HydrophobicContact CG1-CD2 4.16Å; V570-Y572 HydrophobicContact CG1-CE2 3.65Å; V570-K592 HydrophobicContact CG1-CB 4.18Å; V570-K592 HydrophobicContact CG2-CB 4.42Å; V570-K592 HydrophobicContact CG2-CD 4.38Å; V570-K594 HydrophobicContact CG1-CD 4.4Å; V570-K594 HydrophobicContact CG1-CG 4.27Å; V570-E609 HydrophobicContact CG2-CG 4.24Å
571	I	97.3	Very high	94	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	119.8	176.9	-49.9	178.4	0	0	0	109.3	I519 I556 D560 V561 A564 V591 K592 M593 K594	I519-I571 HydrophobicContact CB-CG1 4.31Å; I519-I571 HydrophobicContact CB-CG2 4.45Å; I519-I571 HydrophobicContact CG2-CG2 4.3Å; I519-I571 WeakPolarHBondContact O-CA 3.5Å; I556-I571 HydrophobicContact CD1-CG2 3.73Å; I556-I571 HydrophobicContact CG1-CG2 4.29Å; I556-I571 HydrophobicContact CG2-CD1 4.32Å; I556-I571 HydrophobicContact CG2-CG2 4.28Å; D560-I571 HydrophobicContact CB-CD1 4.37Å; V561-I571 HydrophobicContact CG2-CD1 4.13Å; A564-I571 HydrophobicContact CB-CD1 3.8Å; A564-I571 HydrophobicContact CB-CG1 3.67Å; I571-V591 HydrophobicContact CD1-CG1 3.91Å; I571-V591 HydrophobicContact CG1-CG1 4.1Å; I571-K592 PolarHBondContact N-O 2.78Å; I571-M593 HydrophobicContact CB-CG 4.33Å; I571-M593 HydrophobicContact CD1-CG 4.29Å; I571-M593 WeakPolarHBondContact O-CA 3.42Å; I571-K594 PolarHBondContact O-N 3.39Å
572	Y	97.4	Very high	94	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	118.8	171.9	-70.9	-87.7	0	0	0	110.1	V518 I519 I520 K521 V570 K594 L602 D605	V518-Y572 HydrophobicContact CG1-CD2 3.75Å; V518-Y572 HydrophobicContact CG1-CE2 4.24Å; V518-Y572 HydrophobicContact CG2-CE2 4.38Å; I519-Y572 PolarHBondContact O-N 3.31Å; I520-Y572 WeakPolarHBondContact CA-O 3.48Å; K521-Y572 PolarHBondContact N-O 3.47Å; V570-Y572 HydrophobicContact CB-CE2 3.99Å; V570-Y572 HydrophobicContact CG1-CD2 4.16Å; V570-Y572 HydrophobicContact CG1-CE2 3.65Å; Y572-K594 WeakPolarHBondContact CA-O 3.39Å; Y572-K594 HydrophobicContact CD1-CB 4.08Å; Y572-K594 HydrophobicContact CE1-CB 4.11Å; Y572-K594 HydrophobicContact CE1-CD 3.86Å; Y572-K594 HydrophobicContact CE1-CG 4.43Å; Y572-K594 PolarHBondContact OH-NZ 2.83Å; Y572-L602 HydrophobicContact CD1-CG 4.06Å; Y572-D605 HydrophobicContact CE1-CB 4.41Å; Y572-D605 WeakPolarHBondContact CE1-OD2 3.43Å; Y572-D605 PolarHBondContact OH-O 3.33Å
573	G	96.5	Very high	93.9	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.2	173.2	0	0	0	0	0	111	K521 K594 L595 H596	K521-G573 CarbonylContact O-C 3.5Å; K521-G573 VanDerWaalsContact O-CA 3.31Å; K521-G573 WeakPolarHBondContact O-CA 3.4Å; G573-K594 PolarHBondContact N-O 3.5Å; G573-L595 CarbonylContact O-C 3.6Å; G573-L595 WeakPolarHBondContact O-CA 3.4Å; G573-H596 PolarHBondContact O-N 3.33Å
574	F	95.7	Very high	94	Very high	1 Å²	1	56 Å²	56	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	114.2	176.7	-179	-95.6	0	0	0	110.7	K521 G522 D523 S527 I531 V576 H596 I599 L602	K521-F574 PolarHBondContact O-N 3.23Å; G522-F574 WeakPolarHBondContact CA-O 3.3Å; D523-F574 PolarHBondContact N-O 2.84Å; D523-F574 VanDerWaalsContact N-O 3.15Å; S527-F574 WeakPolarHBondContact OG-CE1 3.46Å; I531-F574 HydrophobicContact CD1-CB 3.77Å; I531-F574 HydrophobicContact CD1-CD1 4.45Å; I531-F574 HydrophobicContact CD1-CD2 4.26Å; I531-F574 HydrophobicContact CD1-CG 3.9Å; F574-V576 PolarHBondContact O-N 2.93Å; F574-H596 CarbonylContact C-O 3.57Å; F574-H596 WeakPolarHBondContact CA-O 3.39Å; F574-I599 HydrophobicContact CE2-CB 3.83Å; F574-I599 HydrophobicContact CE2-CG1 4.4Å; F574-I599 HydrophobicContact CZ-CB 4.31Å; F574-L602 HydrophobicContact CB-CD1 4.01Å; F574-L602 HydrophobicContact CD2-CD1 4.18Å
575	N	92.4	Very high	94	Very high	62 Å²	62	57.6 Å²	57.6	33%	0.332	31%	0.309	S	S	.	.	S	Bend	trans	53.3	21.5	-175.4	-158.5	39.3	0	0	0	115	D523 H596	D523-N575 HydrophobicContact CB-CB 4.01Å; D523-N575 PolarHBondContact OD2-ND2 3.37Å; N575-H596 PolarHBondContact N-O 2.76Å
576	V	93.5	Very high	94	Very high	9 Å²	9	53.9 Å²	53.9	6%	0.055	29%	0.292	C	S	.	.			trans	-101.4	156.6	178.1	-66.2	0	0	0	0	112.1	K521 G522 D523 I556 F574 L595	K521-V576 HydrophobicContact CB-CG2 4.39Å; G522-V576 VanDerWaalsContact C-CG1 3.46Å; G522-V576 WeakPolarHBondContact O-CG1 3.46Å; D523-V576 HydrophobicContact CB-CG1 4.37Å; I556-V576 HydrophobicContact CG1-CG2 4.23Å; F574-V576 PolarHBondContact O-N 2.93Å; V576-L595 HydrophobicContact CG2-CD2 4.16Å
577	N	90.6	Very high	94.1	Very high	107 Å²	107	52.7 Å²	52.7	57%	0.572	29%	0.293	S	S	*	.			trans	-103.9	157.9	174.6	-71.1	-58.7	0	0	0	111.4	D555	D555-N577 VanDerWaalsContact CB-O 3.29Å; D555-N577 WeakPolarHBondContact CB-O 3.34Å; D555-N577 PolarHBondContact OD1-N 3.27Å
578	V	92.3	Very high	94.2	Very high	21 Å²	21	56.3 Å²	56.3	13%	0.127	31%	0.309	C	S	.	.			trans	-127.9	126.7	176.7	-167.8	0	0	0	0	110	I556 I582 Q583 M593 L595	I556-V578 HydrophobicContact CB-CG2 4.13Å; I556-V578 HydrophobicContact CD1-CG2 3.64Å; I556-V578 HydrophobicContact CG1-CG2 4.01Å; V578-I582 HydrophobicContact CG1-CB 3.79Å; V578-I582 HydrophobicContact CG1-CG2 3.77Å; V578-Q583 HydrophobicContact CB-CG 4.2Å; V578-Q583 HydrophobicContact CG1-CG 3.78Å; V578-M593 HydrophobicContact CB-CE 4.5Å; V578-M593 HydrophobicContact CG1-CE 3.78Å; V578-M593 HydrophobicContact CG1-SD 4.4Å; V578-M593 HydrophobicContact CG2-CE 4.45Å; V578-L595 HydrophobicContact CB-CD1 4.48Å; V578-L595 HydrophobicContact CG2-CD1 3.7Å; V578-L595 HydrophobicContact CG2-CD2 3.7Å; V578-L595 HydrophobicContact CG2-CG 4.24Å
579	G	90.5	Very high	94.4	Very high	42 Å²	42	53.4 Å²	53.4	43%	0.433	29%	0.29	S	S	.	.			trans	-68.1	147.7	174.4	0	0	0	0	0	111.9	V581 I582 Q583	G579-V581 PolarHBondContact O-N 2.99Å; G579-I582 PolarHBondContact O-N 3.48Å; G579-Q583 PolarHBondContact O-N 2.84Å; G579-Q583 VanDerWaalsContact O-N 3.14Å
580	K	93.3	Very high	94.5	Very high	165 Å²	165	56.3 Å²	56.3	72%	0.717	32%	0.319	S	S	*	.	H	α-helix	trans	-53.6	-39.1	179.3	-65.8	-175.6	178.5	-177.4	0	113.1	I582 Q583 E584	K580-I582 VanDerWaalsContact C-N 3.29Å; K580-I582 PolarHBondContact O-N 3.35Å; K580-Q583 PolarHBondContact O-N 3.12Å; K580-E584 WeakPolarHBondContact O-CG 3.35Å; K580-E584 PolarHBondContact O-N 3.37Å
581	V	95.4	Very high	94.5	Very high	111 Å²	111	56.9 Å²	56.9	67%	0.673	32%	0.323	S	S	*	.	H	α-helix	trans	-59.7	-39.5	177.9	-178.1	0	0	0	0	111.9	G579 S585	G579-V581 PolarHBondContact O-N 2.99Å; V581-S585 WeakPolarHBondContact O-CB 3.02Å; V581-S585 PolarHBondContact O-N 3.07Å
582	I	95.1	Very high	94.3	Very high	29 Å²	29	62 Å²	62	15%	0.149	35%	0.345	C	S	.	.	H	α-helix	trans	-73.5	-39.9	179.9	-57.3	-57.3	0	0	0	110.4	I556 A558 V561 V578 G579 K580 E584 S585 A586 M593	I556-I582 HydrophobicContact CG2-CG2 4.23Å; A558-I582 HydrophobicContact CB-CD1 3.89Å; V561-I582 HydrophobicContact CG2-CG2 3.72Å; V578-I582 HydrophobicContact CG1-CB 3.79Å; V578-I582 HydrophobicContact CG1-CG2 3.77Å; G579-I582 PolarHBondContact O-N 3.48Å; K580-I582 VanDerWaalsContact C-N 3.29Å; K580-I582 PolarHBondContact O-N 3.35Å; I582-E584 PolarHBondContact O-N 2.96Å; I582-S585 WeakPolarHBondContact O-CB 3.48Å; I582-S585 PolarHBondContact O-N 2.87Å; I582-A586 WeakPolarHBondContact O-CB 3.41Å; I582-A586 PolarHBondContact O-N 2.87Å; I582-M593 HydrophobicContact CG2-SD 4.44Å
583	Q	94.6	Very high	94.2	Very high	93 Å²	93	64.3 Å²	64.3	44%	0.435	36%	0.356	S	S	.	.	H	α-helix	trans	-60.2	-44.9	173.7	-68.9	179.2	-18.9	0	0	112.3	V578 G579 K580 S585 A586 A587 M593	V578-Q583 HydrophobicContact CB-CG 4.2Å; V578-Q583 HydrophobicContact CG1-CG 3.78Å; G579-Q583 PolarHBondContact O-N 2.84Å; G579-Q583 VanDerWaalsContact O-N 3.14Å; K580-Q583 PolarHBondContact O-N 3.12Å; Q583-S585 VanDerWaalsContact C-N 3.33Å; Q583-S585 PolarHBondContact O-N 3.04Å; Q583-A586 PolarHBondContact O-N 3.18Å; Q583-A587 WeakPolarHBondContact O-CB 3.11Å; Q583-A587 PolarHBondContact O-N 3.1Å; Q583-M593 HydrophobicContact CB-CE 4.4Å; Q583-M593 HydrophobicContact CG-CE 3.81Å
584	E	95.1	Very high	94.1	Very high	113 Å²	113	66.1 Å²	66.1	53%	0.528	37%	0.365	S	S	.	.	H	α-helix	trans	-64.1	-38.7	175.8	-71.9	175.3	-162.6	0	0	112.1	K580 I582 K588	K580-E584 WeakPolarHBondContact O-CG 3.35Å; K580-E584 PolarHBondContact O-N 3.37Å; I582-E584 PolarHBondContact O-N 2.96Å; E584-K588 WeakPolarHBondContact O-CB 3.49Å; E584-K588 VanDerWaalsContact O-CG 3.26Å; E584-K588 WeakPolarHBondContact O-CG 3.47Å; E584-K588 PolarHBondContact O-N 3.3Å
585	S	95.6	Very high	94.1	Very high	34 Å²	34	69.9 Å²	69.9	24%	0.238	38%	0.384	C	S	.	.	H	α-helix	trans	-64.4	-45.3	175.9	-176.1	0	0	0	0	111.4	V581 I582 Q583 K588 K589	V581-S585 WeakPolarHBondContact O-CB 3.02Å; V581-S585 PolarHBondContact O-N 3.07Å; I582-S585 WeakPolarHBondContact O-CB 3.48Å; I582-S585 PolarHBondContact O-N 2.87Å; Q583-S585 VanDerWaalsContact C-N 3.33Å; Q583-S585 PolarHBondContact O-N 3.04Å; S585-K588 PolarHBondContact O-N 2.66Å; S585-K589 WeakPolarHBondContact O-CB 3.25Å; S585-K589 WeakPolarHBondContact O-CG 3.31Å; S585-K589 PolarHBondContact O-N 3.44Å; S585-K589 VanDerWaalsContact O-N 3.1Å
586	A	95.2	Very high	94.2	Very high	3 Å²	3	68.4 Å²	68.4	3%	0.025	38%	0.375	C	S	.	.	H	α-helix	trans	-62.9	-44	177.2	0	0	0	0	0	111.2	V561 I582 Q583 K588 K589 G590 V591 M593	V561-A586 HydrophobicContact CG1-CB 4.17Å; V561-A586 HydrophobicContact CG2-CB 4.39Å; I582-A586 WeakPolarHBondContact O-CB 3.41Å; I582-A586 PolarHBondContact O-N 2.87Å; Q583-A586 PolarHBondContact O-N 3.18Å; A586-K588 PolarHBondContact O-N 3.31Å; A586-K589 CarbonylContact O-C 3.59Å; A586-K589 PolarHBondContact O-N 3.32Å; A586-K589 VanDerWaalsContact O-N 3.14Å; A586-G590 PolarHBondContact O-N 3.16Å; A586-V591 HydrophobicContact CB-CB 4.3Å; A586-V591 PolarHBondContact O-N 2.85Å; A586-M593 HydrophobicContact CB-CE 4.13Å; A586-M593 HydrophobicContact CB-CG 4.05Å; A586-M593 HydrophobicContact CB-SD 3.65Å
587	A	94.6	Very high	94.2	Very high	81 Å²	81	73.7 Å²	73.7	67%	0.669	40%	0.397	S	S	*	.	H	α-helix	trans	-61.8	-40.7	176.5	0	0	0	0	0	112.5	Q583 K589 G590	Q583-A587 WeakPolarHBondContact O-CB 3.11Å; Q583-A587 PolarHBondContact O-N 3.1Å; A587-K589 VanDerWaalsContact C-N 3.27Å; A587-K589 PolarHBondContact O-N 3.34Å; A587-G590 PolarHBondContact O-N 2.93Å
588	K	95.4	Very high	94.2	Very high	174 Å²	174	69.5 Å²	69.5	76%	0.757	38%	0.375	S	S	*	.	H	α-helix	trans	-63.3	-33.8	175.2	-76.8	170.5	-175.4	170.2	0	112.8	E584 S585 A586	E584-K588 WeakPolarHBondContact O-CB 3.49Å; E584-K588 VanDerWaalsContact O-CG 3.26Å; E584-K588 WeakPolarHBondContact O-CG 3.47Å; E584-K588 PolarHBondContact O-N 3.3Å; S585-K588 PolarHBondContact O-N 2.66Å; A586-K588 PolarHBondContact O-N 3.31Å
589	K	94.5	Very high	94.1	Very high	69 Å²	69	68.5 Å²	68.5	30%	0.3	37%	0.369	S	S	.	.	H	α-helix	trans	-92.1	-4.3	-178	-67	175.1	168.9	-137.1	0	113.6	V561 N562 E565 S585 A586 A587 V591	V561-K589 HydrophobicContact CG1-CD 3.86Å; N562-K589 PolarHBondContact OD1-NZ 2.8Å; E565-K589 HydrophobicContact CG-CB 4.42Å; E565-K589 WeakPolarHBondContact OE2-CD 3.43Å; E565-K589 WeakPolarHBondContact OE2-CE 3.42Å; E565-K589 IonicContact OE2-NZ 3.28Å; E565-K589 PolarHBondContact OE2-NZ 2.9Å; S585-K589 WeakPolarHBondContact O-CB 3.25Å; S585-K589 WeakPolarHBondContact O-CG 3.31Å; S585-K589 PolarHBondContact O-N 3.44Å; S585-K589 VanDerWaalsContact O-N 3.1Å; A586-K589 CarbonylContact O-C 3.59Å; A586-K589 PolarHBondContact O-N 3.32Å; A586-K589 VanDerWaalsContact O-N 3.14Å; A587-K589 VanDerWaalsContact C-N 3.27Å; A587-K589 PolarHBondContact O-N 3.34Å; K589-V591 VanDerWaalsContact C-N 3.27Å; K589-V591 HydrophobicContact CB-CG2 4.06Å; K589-V591 PolarHBondContact O-N 3.37Å
590	G	93.8	Very high	93.9	Very high	66 Å²	66	69 Å²	69	68%	0.68	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	21.1	-176.9	0	0	0	0	0	114.4	A586 A587	A586-G590 PolarHBondContact O-N 3.16Å; A587-G590 PolarHBondContact O-N 2.93Å
591	V	95.2	Very high	93.9	Very high	15 Å²	15	68.5 Å²	68.5	9%	0.091	35%	0.351	C	S	.	.			trans	-83.9	125.9	179.9	175.6	0	0	0	0	109.9	V561 A564 E565 I571 A586 K589	V561-V591 HydrophobicContact CG1-CB 4.42Å; V561-V591 HydrophobicContact CG1-CG2 4.23Å; A564-V591 HydrophobicContact CB-CG1 3.55Å; A564-V591 HydrophobicContact CB-CG2 4.29Å; E565-V591 HydrophobicContact CB-CG2 3.96Å; I571-V591 HydrophobicContact CD1-CG1 3.91Å; I571-V591 HydrophobicContact CG1-CG1 4.1Å; A586-V591 HydrophobicContact CB-CB 4.3Å; A586-V591 PolarHBondContact O-N 2.85Å; K589-V591 VanDerWaalsContact C-N 3.27Å; K589-V591 HydrophobicContact CB-CG2 4.06Å; K589-V591 PolarHBondContact O-N 3.37Å
592	K	93.9	Very high	93.8	Very high	108 Å²	108	63.2 Å²	63.2	47%	0.47	32%	0.32	S	S	.	.			trans	-78.1	128.3	174.5	-59	-177.8	-170	176.2	0	109.9	V570 I571 E609	V570-K592 HydrophobicContact CG1-CB 4.18Å; V570-K592 HydrophobicContact CG2-CB 4.42Å; V570-K592 HydrophobicContact CG2-CD 4.38Å; I571-K592 PolarHBondContact N-O 2.78Å; K592-E609 IonicContact NZ-OE1 3.71Å; K592-E609 PolarHBondContact NZ-OE1 3.5Å; K592-E609 IonicContact NZ-OE2 3.2Å
593	M	94.6	Very high	93.7	Very high	47 Å²	47	62.1 Å²	62.1	23%	0.232	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	127.7	172.2	-54.8	-172.5	-42.7	0	0	109.5	I556 V561 I571 V578 I582 Q583 A586	I556-M593 HydrophobicContact CD1-SD 4.5Å; I556-M593 HydrophobicContact CG2-SD 4.37Å; V561-M593 HydrophobicContact CG2-SD 4.41Å; I571-M593 HydrophobicContact CB-CG 4.33Å; I571-M593 HydrophobicContact CD1-CG 4.29Å; I571-M593 WeakPolarHBondContact O-CA 3.42Å; V578-M593 HydrophobicContact CB-CE 4.5Å; V578-M593 HydrophobicContact CG1-CE 3.78Å; V578-M593 HydrophobicContact CG1-SD 4.4Å; V578-M593 HydrophobicContact CG2-CE 4.45Å; I582-M593 HydrophobicContact CG2-SD 4.44Å; Q583-M593 HydrophobicContact CB-CE 4.4Å; Q583-M593 HydrophobicContact CG-CE 3.81Å; A586-M593 HydrophobicContact CB-CE 4.13Å; A586-M593 HydrophobicContact CB-CG 4.05Å; A586-M593 HydrophobicContact CB-SD 3.65Å
594	K	95.2	Very high	93.5	Very high	39 Å²	39	63.1 Å²	63.1	17%	0.17	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	124	-179.2	-53	-167.8	-169.3	171.1	0	109.1	V570 I571 Y572 G573 D605 E609	V570-K594 HydrophobicContact CG1-CD 4.4Å; V570-K594 HydrophobicContact CG1-CG 4.27Å; I571-K594 PolarHBondContact O-N 3.39Å; Y572-K594 WeakPolarHBondContact CA-O 3.39Å; Y572-K594 HydrophobicContact CD1-CB 4.08Å; Y572-K594 HydrophobicContact CE1-CB 4.11Å; Y572-K594 HydrophobicContact CE1-CD 3.86Å; Y572-K594 HydrophobicContact CE1-CG 4.43Å; Y572-K594 PolarHBondContact OH-NZ 2.83Å; G573-K594 PolarHBondContact N-O 3.5Å; K594-D605 VanDerWaalsContact CD-CG 3.44Å; K594-D605 VanDerWaalsContact CD-OD1 3.32Å; K594-D605 WeakPolarHBondContact CD-OD1 3.5Å; K594-D605 WeakPolarHBondContact CD-OD2 3.18Å; K594-D605 WeakPolarHBondContact CE-OD1 3.33Å; K594-D605 IonicContact NZ-OD1 3.81Å; K594-D605 PolarHBondContact NZ-OD1 3.12Å; K594-D605 IonicContact NZ-OD2 2.83Å; K594-E609 WeakPolarHBondContact CE-OE2 3.41Å; K594-E609 IonicContact NZ-OE2 2.76Å; K594-E609 PolarHBondContact NZ-OE2 3.11Å
595	L	95.6	Very high	93.5	Very high	80 Å²	80	58.9 Å²	58.9	42%	0.419	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.2	-175.1	-60	177.8	0	0	0	110.2	I556 G573 V576 V578	I556-L595 HydrophobicContact CD1-CD2 3.8Å; G573-L595 CarbonylContact O-C 3.6Å; G573-L595 WeakPolarHBondContact O-CA 3.4Å; V576-L595 HydrophobicContact CG2-CD2 4.16Å; V578-L595 HydrophobicContact CB-CD1 4.48Å; V578-L595 HydrophobicContact CG2-CD1 3.7Å; V578-L595 HydrophobicContact CG2-CD2 3.7Å; V578-L595 HydrophobicContact CG2-CG 4.24Å
596	H	95.4	Very high	93.4	Very high	31 Å²	31	57.4 Å²	57.4	14%	0.144	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	149.4	-176.8	-66.6	-79.1	0	0	0	110.7	G573 F574 N575 R601 L602 D605	G573-H596 PolarHBondContact O-N 3.33Å; F574-H596 CarbonylContact C-O 3.57Å; F574-H596 WeakPolarHBondContact CA-O 3.39Å; N575-H596 PolarHBondContact N-O 2.76Å; H596-R601 PolarHBondContact CE1-O 2.86Å; H596-L602 HydrophobicContact CB-CB 3.88Å; H596-L602 HydrophobicContact CB-CD1 4.26Å; H596-L602 HydrophobicContact CB-CG 4.49Å; H596-D605 IonicContact CD2-OD2 2.85Å; H596-D605 IonicContact CE1-OD2 2.62Å; H596-D605 PolarHBondContact CE1-OD2 2.81Å; H596-D605 IonicContact NE2-OD2 3.98Å; H596-D605 PolarHBondContact NE2-OD2 2.93Å
597	K	91.8	Very high	93.3	Very high	119 Å²	119	59.5 Å²	59.5	52%	0.517	30%	0.299	S	S	.	.	S	Bend	trans	-116	-3.8	173.3	-63	-170	175.1	-169.7	0	113.2	V210 Q215	V210-K597 HydrophobicContact CB-CB 4.46Å; V210-K597 HydrophobicContact CB-CD 4.48Å; V210-K597 HydrophobicContact CG1-CB 3.73Å; V210-K597 HydrophobicContact CG1-CD 3.85Å; V210-K597 HydrophobicContact CG1-CG 4.47Å; V210-K597 HydrophobicContact CG2-CD 4.18Å; Q215-K597 PolarHBondContact NE2-O 3.14Å; Q215-K597 PolarHBondContact OE1-O 2.64Å
598	I	90.9	Very high	93.1	Very high	19 Å²	19	62 Å²	62	10%	0.097	30%	0.297	C	S	.	.	S	Bend	trans	-133.4	129.2	-177.5	-62.3	174.7	0	0	0	106.3	I213 Y600 R601 L602	I213-I598 HydrophobicContact CD1-CG2 4.09Å; I598-Y600 HydrophobicContact CG2-CD2 3.92Å; I598-Y600 HydrophobicContact CG2-CE2 4.36Å; I598-Y600 PolarHBondContact O-N 3.02Å; I598-R601 HydrophobicContact CB-CG 4.35Å; I598-R601 HydrophobicContact CG2-CG 4.45Å; I598-R601 PolarHBondContact O-N 3.39Å; I598-L602 PolarHBondContact O-N 2.94Å
599	I	89.9	Confident	92.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.1	-36.2	-169	-164.9	169.6	0	0	0	112.7	A240 F241 A530 I531 I534 F574 R601 L602 V603	A240-I599 HydrophobicContact CB-CD1 4.26Å; F241-I599 HydrophobicContact CE1-CD1 4.03Å; F241-I599 HydrophobicContact CE2-CG2 4.16Å; F241-I599 HydrophobicContact CZ-CB 4.4Å; F241-I599 HydrophobicContact CZ-CD1 3.81Å; F241-I599 HydrophobicContact CZ-CG2 4.1Å; A530-I599 HydrophobicContact CB-CD1 4.2Å; I531-I599 HydrophobicContact CG1-CD1 3.92Å; I531-I599 HydrophobicContact CG1-CG1 4.12Å; I534-I599 HydrophobicContact CD1-CD1 3.76Å; I534-I599 HydrophobicContact CD1-CG1 4.13Å; F574-I599 HydrophobicContact CE2-CB 3.83Å; F574-I599 HydrophobicContact CE2-CG1 4.4Å; F574-I599 HydrophobicContact CZ-CB 4.31Å; I599-R601 PolarHBondContact O-N 3.42Å; I599-L602 WeakPolarHBondContact O-CB 3.48Å; I599-L602 PolarHBondContact O-N 3.33Å; I599-L602 VanDerWaalsContact O-N 3.14Å; I599-V603 WeakPolarHBondContact O-CG2 3.47Å; I599-V603 PolarHBondContact O-N 3.13Å; I599-V603 VanDerWaalsContact O-N 3.1Å
600	Y	87.6	Confident	92.8	Very high	54 Å²	54	51.1 Å²	51.1	21%	0.212	25%	0.249	C	C	.	.	H	α-helix	trans	-66.5	-38	-179.9	-37.9	-48.8	0	0	0	112.4	I213 H238 I598 L602 V603 E604 F727	I213-Y600 HydrophobicContact CD1-CE2 4.12Å; H238-Y600 WeakPolarHBondContact CB-OH 3.46Å; H238-Y600 AromaticContact CD2-CE1 3.36Å; H238-Y600 WeakPolarHBondContact CD2-CE1 3.42Å; H238-Y600 AromaticContact CD2-CZ 3.23Å; H238-Y600 PolarHBondContact CD2-OH 3.02Å; H238-Y600 AromaticContact CE1-CD1 3.98Å; H238-Y600 AromaticContact CE1-CE1 3.15Å; H238-Y600 WeakPolarHBondContact CE1-CE1 3.41Å; H238-Y600 AromaticContact CE1-CZ 3.89Å; H238-Y600 AromaticContact CG-CE1 3.58Å; H238-Y600 AromaticContact CG-CZ 3.55Å; H238-Y600 AromaticContact ND1-CE1 3.45Å; H238-Y600 WeakPolarHBondContact ND1-CE1 3.49Å; H238-Y600 AromaticContact ND1-CZ 3.93Å; H238-Y600 AromaticContact NE2-CD1 3.89Å; H238-Y600 AromaticContact NE2-CE1 3.07Å; H238-Y600 WeakPolarHBondContact NE2-CE1 3.37Å; H238-Y600 AromaticContact NE2-CZ 3.47Å; I598-Y600 HydrophobicContact CG2-CD2 3.92Å; I598-Y600 HydrophobicContact CG2-CE2 4.36Å; I598-Y600 PolarHBondContact O-N 3.02Å; Y600-L602 PolarHBondContact O-N 3Å; Y600-V603 PolarHBondContact O-N 3.32Å; Y600-V603 VanDerWaalsContact O-N 3.1Å; Y600-E604 WeakPolarHBondContact O-CB 3.49Å; Y600-E604 VanDerWaalsContact O-CG 3.27Å; Y600-E604 WeakPolarHBondContact O-CG 3.24Å; Y600-E604 PolarHBondContact O-N 3.16Å; Y600-F727 HydrophobicContact CD1-CD2 4.11Å; Y600-F727 AromaticContact CD1-CE2 3.51Å; Y600-F727 HydrophobicContact CD1-CE2 3.51Å; Y600-F727 HydrophobicContact CD1-CZ 4.32Å; Y600-F727 HydrophobicContact CE1-CD2 4.36Å; Y600-F727 HydrophobicContact CE1-CE2 4.12Å
601	R	92.1	Very high	92.6	Very high	153 Å²	153	49.1 Å²	49.1	58%	0.577	23%	0.225	S	C	*	.	H	α-helix	trans	-63.7	-32.6	176.2	-66	-173.1	-178.8	174.7	2.1	111.9	H596 I598 I599 D605	H596-R601 PolarHBondContact CE1-O 2.86Å; I598-R601 HydrophobicContact CB-CG 4.35Å; I598-R601 HydrophobicContact CG2-CG 4.45Å; I598-R601 PolarHBondContact O-N 3.39Å; I599-R601 PolarHBondContact O-N 3.42Å; R601-D605 WeakPolarHBondContact O-CB 3.43Å; R601-D605 PolarHBondContact O-N 3.41Å; R601-D605 VanDerWaalsContact O-N 3.15Å
602	L	93.6	Very high	92.2	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-67.6	-43.3	173.9	-175.2	155.1	0	0	0	110.7	I531 Y572 F574 H596 I598 I599 Y600 D605 L606	I531-L602 HydrophobicContact CD1-CD1 4.04Å; I531-L602 HydrophobicContact CG2-CD2 4.12Å; Y572-L602 HydrophobicContact CD1-CG 4.06Å; F574-L602 HydrophobicContact CB-CD1 4.01Å; F574-L602 HydrophobicContact CD2-CD1 4.18Å; H596-L602 HydrophobicContact CB-CB 3.88Å; H596-L602 HydrophobicContact CB-CD1 4.26Å; H596-L602 HydrophobicContact CB-CG 4.49Å; I598-L602 PolarHBondContact O-N 2.94Å; I599-L602 WeakPolarHBondContact O-CB 3.48Å; I599-L602 PolarHBondContact O-N 3.33Å; I599-L602 VanDerWaalsContact O-N 3.14Å; Y600-L602 PolarHBondContact O-N 3Å; L602-D605 PolarHBondContact O-N 2.74Å; L602-L606 WeakPolarHBondContact O-CB 3.36Å; L602-L606 PolarHBondContact O-N 2.77Å
603	V	92.5	Very high	91.9	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.03	24%	0.241	C	C	.	.	H	α-helix	trans	-70.8	-41.4	-179.4	176.3	0	0	0	0	111.9	I534 I599 Y600 D605 L606 Q607 W723 P725 F727	I534-V603 HydrophobicContact CD1-CG2 4.09Å; I534-V603 HydrophobicContact CG2-CG1 4.32Å; I534-V603 HydrophobicContact CG2-CG2 3.96Å; I599-V603 WeakPolarHBondContact O-CG2 3.47Å; I599-V603 PolarHBondContact O-N 3.13Å; I599-V603 VanDerWaalsContact O-N 3.1Å; Y600-V603 PolarHBondContact O-N 3.32Å; Y600-V603 VanDerWaalsContact O-N 3.1Å; V603-D605 VanDerWaalsContact C-N 3.3Å; V603-D605 PolarHBondContact O-N 3.17Å; V603-L606 WeakPolarHBondContact O-CB 3.38Å; V603-L606 PolarHBondContact O-N 3.46Å; V603-L606 VanDerWaalsContact O-N 3.14Å; V603-Q607 WeakPolarHBondContact O-CG 3.35Å; V603-Q607 PolarHBondContact O-N 3.11Å; V603-W723 HydrophobicContact CG1-CH2 3.85Å; V603-W723 HydrophobicContact CG1-CZ3 4.18Å; V603-P725 HydrophobicContact CG1-CB 4.31Å; V603-P725 HydrophobicContact CG1-CG 4Å; V603-F727 HydrophobicContact CB-CZ 4.19Å; V603-F727 HydrophobicContact CG1-CZ 4.02Å; V603-F727 HydrophobicContact CG2-CZ 4.02Å
604	E	92.1	Very high	91.4	Very high	114 Å²	114	49.5 Å²	49.5	53%	0.533	24%	0.235	S	C	.	.	H	α-helix	trans	-57.1	-44.2	172.5	-73.9	168.3	-177.3	0	0	111.2	Y600 L606 Q607 E608	Y600-E604 WeakPolarHBondContact O-CB 3.49Å; Y600-E604 VanDerWaalsContact O-CG 3.27Å; Y600-E604 WeakPolarHBondContact O-CG 3.24Å; Y600-E604 PolarHBondContact O-N 3.16Å; E604-L606 VanDerWaalsContact C-N 3.33Å; E604-Q607 WeakPolarHBondContact O-CB 3.41Å; E604-Q607 PolarHBondContact O-N 3.34Å; E604-E608 WeakPolarHBondContact O-CB 3.22Å; E604-E608 PolarHBondContact O-N 2.91Å
605	D	94.5	Very high	90.7	Very high	25 Å²	25	51.6 Å²	51.6	13%	0.134	25%	0.253	C	S	.	.	H	α-helix	trans	-71.1	-28.9	178.2	-175.9	28.7	0	0	0	112.4	Y572 K594 H596 R601 L602 V603 E609	Y572-D605 HydrophobicContact CE1-CB 4.41Å; Y572-D605 WeakPolarHBondContact CE1-OD2 3.43Å; Y572-D605 PolarHBondContact OH-O 3.33Å; K594-D605 VanDerWaalsContact CD-CG 3.44Å; K594-D605 VanDerWaalsContact CD-OD1 3.32Å; K594-D605 WeakPolarHBondContact CD-OD1 3.5Å; K594-D605 WeakPolarHBondContact CD-OD2 3.18Å; K594-D605 WeakPolarHBondContact CE-OD1 3.33Å; K594-D605 IonicContact NZ-OD1 3.81Å; K594-D605 PolarHBondContact NZ-OD1 3.12Å; K594-D605 IonicContact NZ-OD2 2.83Å; H596-D605 IonicContact CD2-OD2 2.85Å; H596-D605 IonicContact CE1-OD2 2.62Å; H596-D605 PolarHBondContact CE1-OD2 2.81Å; H596-D605 IonicContact NE2-OD2 3.98Å; H596-D605 PolarHBondContact NE2-OD2 2.93Å; R601-D605 WeakPolarHBondContact O-CB 3.43Å; R601-D605 PolarHBondContact O-N 3.41Å; R601-D605 VanDerWaalsContact O-N 3.15Å; L602-D605 PolarHBondContact O-N 2.74Å; V603-D605 VanDerWaalsContact C-N 3.3Å; V603-D605 PolarHBondContact O-N 3.17Å; D605-E609 PolarHBondContact O-N 3.1Å
606	L	93.2	Very high	90	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-68.6	-45	170.4	-167.6	150.1	0	0	0	111	I535 L546 L602 V603 E604 E608 E609 L610 W723	I535-L606 HydrophobicContact CD1-CD1 4.32Å; I535-L606 HydrophobicContact CG1-CD1 4.39Å; L546-L606 HydrophobicContact CD1-CD2 4.37Å; L546-L606 HydrophobicContact CD2-CD2 4.04Å; L602-L606 WeakPolarHBondContact O-CB 3.36Å; L602-L606 PolarHBondContact O-N 2.77Å; V603-L606 WeakPolarHBondContact O-CB 3.38Å; V603-L606 PolarHBondContact O-N 3.46Å; V603-L606 VanDerWaalsContact O-N 3.14Å; E604-L606 VanDerWaalsContact C-N 3.33Å; L606-E608 VanDerWaalsContact C-N 3.3Å; L606-E608 PolarHBondContact O-N 3.24Å; L606-E609 PolarHBondContact O-N 2.93Å; L606-L610 HydrophobicContact CD2-CD1 3.54Å; L606-L610 HydrophobicContact CD2-CG 4.11Å; L606-L610 WeakPolarHBondContact O-CG 3.44Å; L606-L610 PolarHBondContact O-N 3.23Å; L606-W723 HydrophobicContact CD2-CE3 4.37Å; L606-W723 HydrophobicContact CD2-CH2 4.02Å; L606-W723 HydrophobicContact CD2-CZ3 3.5Å; L606-W723 VanDerWaalsContact CD2-CZ3 3.5Å
607	Q	92.1	Very high	89.3	Confident	47 Å²	47	51.7 Å²	51.7	22%	0.22	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-39.4	172.7	-72.7	175.7	-35.5	0	0	111.7	V603 E604 S611 W723 P725	V603-Q607 WeakPolarHBondContact O-CG 3.35Å; V603-Q607 PolarHBondContact O-N 3.11Å; E604-Q607 WeakPolarHBondContact O-CB 3.41Å; E604-Q607 PolarHBondContact O-N 3.34Å; Q607-S611 VanDerWaalsContact O-CB 3.26Å; Q607-S611 WeakPolarHBondContact O-CB 3.39Å; Q607-S611 PolarHBondContact O-N 2.88Å; Q607-S611 PolarHBondContact O-OG 2.91Å; Q607-W723 HydrophobicContact CG-CE3 3.62Å; Q607-W723 HydrophobicContact CG-CZ3 3.62Å; Q607-W723 PolarHBondContact NE2-O 2.96Å; Q607-P725 VanDerWaalsContact NE2-CD 3.34Å
608	E	91.8	Very high	88.9	Confident	134 Å²	134	49.8 Å²	49.8	63%	0.626	26%	0.264	S	S	*	.	H	α-helix	trans	-64.4	-44.2	175.7	-172.6	176.1	-178.6	0	0	111.5	E604 L606 S611 S612	E604-E608 WeakPolarHBondContact O-CB 3.22Å; E604-E608 PolarHBondContact O-N 2.91Å; L606-E608 VanDerWaalsContact C-N 3.3Å; L606-E608 PolarHBondContact O-N 3.24Å; E608-S611 PolarHBondContact O-N 3.05Å; E608-S612 WeakPolarHBondContact O-CB 3.46Å; E608-S612 PolarHBondContact O-N 2.85Å
609	E	91.6	Very high	88.8	Confident	13 Å²	13	53.4 Å²	53.4	6%	0.061	28%	0.28	C	S	.	.	H	α-helix	trans	-67.6	-37.7	178.4	-165.6	74.8	-158.4	0	0	112	L516 V570 K592 K594 D605 L606 S612 R613	L516-E609 HydrophobicContact CD1-CG 3.81Å; L516-E609 HydrophobicContact CD2-CB 4.23Å; L516-E609 HydrophobicContact CD2-CG 4.13Å; V570-E609 HydrophobicContact CG2-CG 4.24Å; K592-E609 IonicContact NZ-OE1 3.71Å; K592-E609 PolarHBondContact NZ-OE1 3.5Å; K592-E609 IonicContact NZ-OE2 3.2Å; K594-E609 WeakPolarHBondContact CE-OE2 3.41Å; K594-E609 IonicContact NZ-OE2 2.76Å; K594-E609 PolarHBondContact NZ-OE2 3.11Å; D605-E609 PolarHBondContact O-N 3.1Å; L606-E609 PolarHBondContact O-N 2.93Å; E609-S612 WeakPolarHBondContact O-CB 3.46Å; E609-S612 PolarHBondContact O-N 2.99Å; E609-R613 PolarHBondContact O-N 3.27Å
610	L	90.8	Very high	88.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.8	-46.8	171.8	-73.8	172.1	0	0	0	111.1	L516 Y538 C544 L546 L606 S612 R613 L614 T721 W723	L516-L610 HydrophobicContact CB-CD2 3.97Å; L516-L610 HydrophobicContact CD2-CD2 3.5Å; L516-L610 VanDerWaalsContact CD2-CD2 3.5Å; L516-L610 HydrophobicContact CD2-CG 3.71Å; L516-L610 HydrophobicContact CG-CD2 4.35Å; Y538-L610 HydrophobicContact CD2-CD1 4.36Å; Y538-L610 HydrophobicContact CE2-CD1 3.76Å; C544-L610 HydrophobicContact CB-CD2 4.03Å; C544-L610 VanDerWaalsContact SG-CD2 3.54Å; L546-L610 HydrophobicContact CD1-CD2 4.42Å; L606-L610 HydrophobicContact CD2-CD1 3.54Å; L606-L610 HydrophobicContact CD2-CG 4.11Å; L606-L610 WeakPolarHBondContact O-CG 3.44Å; L606-L610 PolarHBondContact O-N 3.23Å; L610-S612 PolarHBondContact O-N 3.38Å; L610-R613 PolarHBondContact O-N 2.89Å; L610-R613 VanDerWaalsContact O-N 3.11Å; L610-L614 PolarHBondContact O-N 2.86Å; L610-L614 VanDerWaalsContact O-N 3.12Å; L610-T721 HydrophobicContact CB-CG2 3.28Å; L610-T721 HydrophobicContact CD1-CG2 4.08Å; L610-T721 HydrophobicContact CG-CG2 4.32Å; L610-W723 HydrophobicContact CD1-CE3 4.07Å; L610-W723 HydrophobicContact CD1-CZ3 4.39Å
611	S	89.9	Confident	88.9	Confident	25 Å²	25	56.5 Å²	56.5	18%	0.175	30%	0.297	C	S	.	.	H	α-helix	trans	-61.2	-33.3	176.8	-60.2	0	0	0	0	112.4	Q607 E608 R613 T721	Q607-S611 VanDerWaalsContact O-CB 3.26Å; Q607-S611 WeakPolarHBondContact O-CB 3.39Å; Q607-S611 PolarHBondContact O-N 2.88Å; Q607-S611 PolarHBondContact O-OG 2.91Å; E608-S611 PolarHBondContact O-N 3.05Å; S611-R613 VanDerWaalsContact C-N 3.33Å; S611-R613 PolarHBondContact O-N 3.06Å; S611-T721 PolarHBondContact OG-N 3.29Å; S611-T721 VanDerWaalsContact OG-N 3.12Å
612	S	88.2	Confident	88.9	Confident	93 Å²	93	54 Å²	54	65%	0.65	30%	0.301	S	S	*	.	H	α-helix	trans	-68.8	-30.2	177	-165.8	0	0	0	0	112.9	E608 E609 L610	E608-S612 WeakPolarHBondContact O-CB 3.46Å; E608-S612 PolarHBondContact O-N 2.85Å; E609-S612 WeakPolarHBondContact O-CB 3.46Å; E609-S612 PolarHBondContact O-N 2.99Å; L610-S612 PolarHBondContact O-N 3.38Å
613	R	85.8	Confident	88.9	Confident	67 Å²	67	55.7 Å²	55.7	25%	0.253	31%	0.311	S	S	.	.	H	α-helix	trans	-88.4	-18.6	178.6	-66.9	-168.2	-174.6	-157.3	2.3	113.6	V515 N568 E609 L610 S611	V515-R613 PolarHBondContact O-NH1 3.38Å; N568-R613 PolarHBondContact O-NH2 2.85Å; E609-R613 PolarHBondContact O-N 3.27Å; L610-R613 PolarHBondContact O-N 2.89Å; L610-R613 VanDerWaalsContact O-N 3.11Å; S611-R613 VanDerWaalsContact C-N 3.33Å; S611-R613 PolarHBondContact O-N 3.06Å
614	L	85.4	Confident	88.9	Confident	17 Å²	17	55.8 Å²	55.8	9%	0.089	31%	0.313	C	S	.	.	S	Bend	trans	-60	136.8	176.2	-95.5	144.7	0	0	0	111.6	E543 L610 C616 A719 T721	E543-L614 HydrophobicContact CB-CD2 3.71Å; E543-L614 HydrophobicContact CB-CG 4.49Å; E543-L614 HydrophobicContact CG-CD2 3.92Å; L610-L614 PolarHBondContact O-N 2.86Å; L610-L614 VanDerWaalsContact O-N 3.12Å; L614-C616 PolarHBondContact O-N 3.36Å; L614-A719 HydrophobicContact CB-CB 4.3Å; L614-A719 HydrophobicContact CD2-CB 4.39Å; L614-T721 HydrophobicContact CD1-CG2 3.68Å
615	P	79.8	Confident	89	Confident	84 Å²	84	52.1 Å²	52.1	55%	0.545	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-62.1	129.7	174.8	24.8	-32.4	0	0	0	110.2	A617	P615-A617 PolarHBondContact O-N 2.7Å
616	C	80.6	Confident	89	Confident	56 Å²	56	51 Å²	51	38%	0.378	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-61.8	128.1	178.4	-69.1	0	0	0	0	110.6	L614 V618 Q716	L614-C616 PolarHBondContact O-N 3.36Å; C616-V618 PolarHBondContact O-N 3.4Å; C616-Q716 HydrophobicContact CB-CB 4.21Å
617	A	80.8	Confident	89	Confident	56 Å²	56	51.5 Å²	51.5	46%	0.463	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	128.9	172.6	0	0	0	0	0	109	P615 I717	P615-A617 PolarHBondContact O-N 2.7Å; A617-I717 PolarHBondContact N-O 2.79Å; A617-I717 PolarHBondContact O-N 3.24Å
618	V	84.8	Confident	89.1	Confident	79 Å²	79	49.4 Å²	49.4	48%	0.479	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	109	178.7	-177.2	0	0	0	0	108.5	C616 E714	C616-V618 PolarHBondContact O-N 3.4Å; V618-E714 HydrophobicContact CG1-CB 3.6Å; V618-E714 HydrophobicContact CG1-CG 3.6Å
619	E	87.1	Confident	89.2	Confident	95 Å²	95	47.1 Å²	47.1	44%	0.444	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	128.1	173.1	-163.5	-179.8	160.7	0	0	110.1	H621 K715 I717	E619-H621 VanDerWaalsContact CD-CE1 3.49Å; E619-H621 PolarHBondContact O-N 2.76Å; E619-H621 IonicContact OE1-CE1 2.67Å; E619-H621 PolarHBondContact OE1-CE1 2.87Å; E619-H621 VanDerWaalsContact OE1-CE1 3.31Å; E619-H621 IonicContact OE1-ND1 3.9Å; E619-H621 IonicContact OE1-NE2 3.76Å; E619-H621 IonicContact OE2-CE1 2.81Å; E619-H621 IonicContact OE2-NE2 2.66Å; E619-K715 PolarHBondContact N-O 3.19Å; E619-K715 PolarHBondContact O-N 2.76Å; E619-I717 HydrophobicContact CB-CD1 3.82Å; E619-I717 WeakPolarHBondContact OE2-CD1 3.49Å
620	E	90.3	Very high	89.1	Confident	61 Å²	61	48.3 Å²	48.3	29%	0.285	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	105	176.4	-64.4	-175.7	-177.1	0	0	110	K660 K670 Y712	E620-K660 IonicContact OE2-NZ 3.97Å; E620-K660 PolarHBondContact OE2-NZ 2.78Å; E620-K670 IonicContact OE1-NZ 2.76Å; E620-K670 PolarHBondContact OE1-NZ 3.31Å; E620-K670 IonicContact OE2-NZ 3.94Å; E620-Y712 HydrophobicContact CB-CD2 3.88Å; E620-Y712 HydrophobicContact CB-CE2 4.45Å; E620-Y712 HydrophobicContact CB-CG 4.45Å; E620-Y712 HydrophobicContact CG-CD2 3.71Å; E620-Y712 HydrophobicContact CG-CE2 3.77Å
621	H	90.4	Very high	89.1	Confident	58 Å²	58	51.7 Å²	51.7	27%	0.269	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.6	172.2	-67.1	-73.5	0	0	0	110.9	E619 V623 Y712 E713 K715	E619-H621 VanDerWaalsContact CD-CE1 3.49Å; E619-H621 PolarHBondContact O-N 2.76Å; E619-H621 IonicContact OE1-CE1 2.67Å; E619-H621 PolarHBondContact OE1-CE1 2.87Å; E619-H621 VanDerWaalsContact OE1-CE1 3.31Å; E619-H621 IonicContact OE1-ND1 3.9Å; E619-H621 IonicContact OE1-NE2 3.76Å; E619-H621 IonicContact OE2-CE1 2.81Å; E619-H621 IonicContact OE2-NE2 2.66Å; H621-V623 PolarHBondContact O-N 2.89Å; H621-Y712 CarbonylContact O-C 3.56Å; H621-Y712 VanDerWaalsContact O-CA 3.27Å; H621-Y712 WeakPolarHBondContact O-CA 3.22Å; H621-Y712 WeakPolarHBondContact O-CB 3.37Å; H621-E713 PolarHBondContact N-O 2.87Å; H621-E713 PolarHBondContact O-N 2.93Å; H621-K715 VanDerWaalsContact CD2-CD 3.46Å; H621-K715 WeakPolarHBondContact CD2-CD 3.45Å
622	P	91.8	Very high	89	Confident	102 Å²	102	55.8 Å²	55.8	66%	0.662	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	126.7	178.1	28.4	-33	0	0	0	110.8	V710	P622-V710 HydrophobicContact CB-CG1 4.32Å
623	V	94	Very high	88.9	Confident	36 Å²	36	56.1 Å²	56.1	22%	0.218	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-36	177.1	-177.6	0	0	0	0	110.9	H621 G651 Q652 C711 E713	H621-V623 PolarHBondContact O-N 2.89Å; V623-G651 WeakPolarHBondContact O-CA 3.31Å; V623-Q652 HydrophobicContact CG1-CG 4.03Å; V623-Q652 PolarHBondContact O-N 2.77Å; V623-C711 PolarHBondContact N-O 2.84Å; V623-E713 HydrophobicContact CG2-CB 3.8Å
624	G	93.1	Very high	88.9	Confident	7 Å²	7	56.8 Å²	56.8	7%	0.072	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167	159.8	178.9	0	0	0	0	0	114	K650 Q652 V710 C711	G624-K650 CarbonylContact C-O 3.56Å; G624-K650 WeakPolarHBondContact CA-O 3.46Å; G624-Q652 WeakPolarHBondContact CA-O 3.42Å; G624-V710 CarbonylContact O-C 3.6Å; G624-V710 WeakPolarHBondContact O-CA 3.49Å; G624-C711 PolarHBondContact N-O 2.85Å; G624-C711 PolarHBondContact O-N 3.04Å
625	E	93.9	Very high	88.7	Confident	37 Å²	37	60.3 Å²	60.3	17%	0.173	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	131.7	179.5	-175.3	-178.9	-176.2	0	0	109.2	Q649 K650 R708 I709 V710	E625-Q649 PolarHBondContact O-N 3.36Å; E625-K650 HydrophobicContact CB-CB 4.47Å; E625-K650 PolarHBondContact N-O 3.18Å; E625-K650 PolarHBondContact O-N 2.9Å; E625-R708 WeakPolarHBondContact OE1-CD 3.34Å; E625-R708 IonicContact OE1-CZ 2.75Å; E625-R708 IonicContact OE1-NE 2.74Å; E625-R708 IonicContact OE1-NH1 3.39Å; E625-R708 PolarHBondContact OE1-NH1 2.98Å; E625-I709 WeakPolarHBondContact CA-O 3.48Å; E625-V710 HydrophobicContact CG-CG2 4.37Å
626	A	93.9	Very high	88.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	147	176.6	0	0	0	0	0	111.2	C646 R647 V648 L653 R708 I709	A626-C646 HydrophobicContact CB-CB 4.29Å; A626-R647 CarbonylContact C-O 3.6Å; A626-R647 VanDerWaalsContact CA-O 3.27Å; A626-R647 WeakPolarHBondContact CA-O 3.44Å; A626-R647 WeakPolarHBondContact CB-O 3.39Å; A626-V648 HydrophobicContact CB-CG2 4.36Å; A626-L653 HydrophobicContact CB-CD1 3.79Å; A626-L653 HydrophobicContact CB-CD2 4.25Å; A626-L653 HydrophobicContact CB-CG 4.43Å; A626-R708 CarbonylContact O-C 3.5Å; A626-R708 WeakPolarHBondContact O-CA 3.35Å; A626-I709 PolarHBondContact N-O 3.34Å; A626-I709 PolarHBondContact O-N 2.84Å
627	S	93.6	Very high	88.4	Confident	15 Å²	15	62.1 Å²	62.1	11%	0.105	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136	176.9	54.7	0	0	0	0	111	C646 R647 Q649	S627-C646 VanDerWaalsContact O-CA 3.31Å; S627-C646 WeakPolarHBondContact O-CA 3.29Å; S627-R647 PolarHBondContact N-O 2.93Å; S627-R647 PolarHBondContact O-N 2.84Å; S627-Q649 VanDerWaalsContact CB-NE2 3.26Å; S627-Q649 PolarHBondContact OG-NE2 2.71Å
628	I	94.2	Very high	88.3	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.01	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	123.6	176.5	-51.6	-168.7	0	0	0	109.6	T631 A644 L661 F703 G706 D707 I709	I628-T631 HydrophobicContact CG2-CG2 4.23Å; I628-A644 HydrophobicContact CD1-CB 3.92Å; I628-A644 HydrophobicContact CG1-CB 4.4Å; I628-A644 HydrophobicContact CG2-CB 4.12Å; I628-L661 HydrophobicContact CD1-CD1 3.89Å; I628-F703 HydrophobicContact CD1-CB 4.19Å; I628-F703 HydrophobicContact CD1-CD1 3.73Å; I628-F703 HydrophobicContact CD1-CG 4.34Å; I628-G706 PolarHBondContact O-N 3.2Å; I628-D707 HydrophobicContact CB-CB 4.4Å; I628-D707 HydrophobicContact CD1-CB 3.75Å; I628-D707 HydrophobicContact CG1-CB 4.05Å; I628-D707 PolarHBondContact N-O 3.37Å; I628-I709 HydrophobicContact CD1-CD1 3.72Å; I628-I709 HydrophobicContact CD1-CG1 4.16Å; I628-I709 HydrophobicContact CG1-CD1 3.86Å; I628-I709 HydrophobicContact CG1-CG1 4.22Å
629	L	93	Very high	88	Confident	87 Å²	87	72 Å²	72	46%	0.455	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-38.8	179.7	-62.4	177.6	0	0	0	112.2	G645 R647 V705	L629-G645 PolarHBondContact N-O 3.07Å; L629-R647 HydrophobicContact CD1-CB 3.78Å; L629-R647 HydrophobicContact CG-CB 4.43Å; L629-V705 WeakPolarHBondContact O-CG1 3.4Å
630	A	90.5	Very high	87.7	Confident	37 Å²	37	75.6 Å²	75.6	31%	0.306	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	155.6	-177.2	0	0	0	0	0	110.7	F632 G645	A630-F632 HydrophobicContact CB-CE2 3.86Å; A630-F632 HydrophobicContact CB-CZ 3.88Å; A630-G645 PolarHBondContact N-O 3.18Å; A630-G645 WeakPolarHBondContact O-CA 3.39Å; A630-G645 PolarHBondContact O-N 2.94Å
631	T	90.8	Very high	87.4	Confident	71 Å²	71	74.3 Å²	74.3	44%	0.436	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	136	177.7	56.6	0	0	0	0	109.4	I628 F703	I628-T631 HydrophobicContact CG2-CG2 4.23Å; T631-F703 HydrophobicContact CG2-CB 3.46Å; T631-F703 VanDerWaalsContact CG2-CB 3.46Å
632	F	88.2	Confident	87.3	Confident	112 Å²	112	73.4 Å²	73.4	49%	0.491	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	153.5	-176.7	-57.6	-83.3	0	0	0	109.7	A630 I634 P642 V643	A630-F632 HydrophobicContact CB-CE2 3.86Å; A630-F632 HydrophobicContact CB-CZ 3.88Å; F632-I634 HydrophobicContact CB-CG1 4.37Å; F632-P642 WeakPolarHBondContact O-CA 3.47Å; F632-V643 HydrophobicContact CB-CB 4.3Å; F632-V643 PolarHBondContact N-O 3.19Å; F632-V643 PolarHBondContact O-N 3.02Å
633	S	85.1	Confident	87.2	Confident	100 Å²	100	69.5 Å²	69.5	70%	0.699	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	101.2	170.4	-53.6	0	0	0	0	107.8
634	I	85.3	Confident	87.1	Confident	80 Å²	80	67.8 Å²	67.8	41%	0.41	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	132.7	-177.8	-55	-174.7	0	0	0	108.3	F632 E636 V641 V643	F632-I634 HydrophobicContact CB-CG1 4.37Å; I634-E636 HydrophobicContact CG2-CG 4.33Å; I634-E636 PolarHBondContact O-N 3.37Å; I634-V641 PolarHBondContact N-O 3.25Å; I634-V641 PolarHBondContact O-N 3.14Å; I634-V643 HydrophobicContact CB-CG2 4.33Å; I634-V643 HydrophobicContact CD1-CB 4.23Å; I634-V643 HydrophobicContact CD1-CG1 4.47Å; I634-V643 HydrophobicContact CD1-CG2 3.83Å; I634-V643 HydrophobicContact CG1-CB 4.43Å; I634-V643 HydrophobicContact CG1-CG2 3.98Å
635	T	82.5	Confident	87.1	Confident	92 Å²	92	68.1 Å²	68.1	56%	0.564	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	98.9	173.6	-51.5	0	0	0	0	108.6	K639	T635-K639 WeakPolarHBondContact CA-O 3.17Å
636	E	73.3	Confident	87.1	Confident	105 Å²	105	66.4 Å²	66.4	49%	0.491	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	107.5	169	-81.7	-173.2	167.9	0	0	108.6	I634 K638 K639 K677	I634-E636 HydrophobicContact CG2-CG 4.33Å; I634-E636 PolarHBondContact O-N 3.37Å; E636-K638 PolarHBondContact O-N 2.84Å; E636-K639 PolarHBondContact N-O 2.64Å; E636-K639 PolarHBondContact O-N 2.95Å; E636-K677 IonicContact OE1-NZ 2.71Å; E636-K677 PolarHBondContact OE1-NZ 3.35Å
637	G	79.4	Confident	87.1	Confident	72 Å²	72	71.8 Å²	71.8	74%	0.742	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	-120.1	-175.4	0	0	0	0	0	113
638	K	79.3	Confident	87.1	Confident	217 Å²	217	71.1 Å²	71.1	94%	0.943	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-0.4	177.8	-68.9	-175.3	-179.4	178.8	0	113.7	E636	E636-K638 PolarHBondContact O-N 2.84Å
639	K	78.5	Confident	87.1	Confident	126 Å²	126	75.4 Å²	75.4	55%	0.548	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	142.6	-176.4	-69.8	-172.3	168.7	-158.1	0	110.6	T635 E636 E699	T635-K639 WeakPolarHBondContact CA-O 3.17Å; E636-K639 PolarHBondContact N-O 2.64Å; E636-K639 PolarHBondContact O-N 2.95Å; K639-E699 IonicContact NZ-OE1 3.72Å; K639-E699 PolarHBondContact NZ-OE1 2.95Å
640	K	81.8	Confident	87.1	Confident	170 Å²	170	77.8 Å²	77.8	74%	0.739	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	113.7	169.2	-70.6	-173.7	177.3	-176.6	0	108
641	V	83.8	Confident	87.2	Confident	35 Å²	35	77.8 Å²	77.8	21%	0.212	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	122.6	179.7	-176	0	0	0	0	108.6	I634 V643	I634-V641 PolarHBondContact N-O 3.25Å; I634-V641 PolarHBondContact O-N 3.14Å; V641-V643 HydrophobicContact CG1-CG2 4.42Å
642	P	88.1	Confident	87.3	Confident	38 Å²	38	77.6 Å²	77.6	25%	0.247	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	130.7	172.4	30.9	-32.8	0	0	0	109.5	F632 F703	F632-P642 WeakPolarHBondContact O-CA 3.47Å; P642-F703 HydrophobicContact CB-CD2 4.17Å; P642-F703 HydrophobicContact CB-CE2 3.92Å; P642-F703 HydrophobicContact CG-CE2 4.31Å
643	V	89.9	Confident	87.6	Confident	20 Å²	20	72.3 Å²	72.3	12%	0.121	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	124.6	-179.7	-179.8	0	0	0	0	109.4	F632 I634 V641 L694	F632-V643 HydrophobicContact CB-CB 4.3Å; F632-V643 PolarHBondContact N-O 3.19Å; F632-V643 PolarHBondContact O-N 3.02Å; I634-V643 HydrophobicContact CB-CG2 4.33Å; I634-V643 HydrophobicContact CD1-CB 4.23Å; I634-V643 HydrophobicContact CD1-CG1 4.47Å; I634-V643 HydrophobicContact CD1-CG2 3.83Å; I634-V643 HydrophobicContact CG1-CB 4.43Å; I634-V643 HydrophobicContact CG1-CG2 3.98Å; V641-V643 HydrophobicContact CG1-CG2 4.42Å; V643-L694 CarbonylContact C-O 3.6Å; V643-L694 WeakPolarHBondContact CA-O 3.48Å
644	A	91.1	Very high	88	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	118.2	174.9	0	0	0	0	0	110.6	I628 C646 G693 L694 F703	I628-A644 HydrophobicContact CD1-CB 3.92Å; I628-A644 HydrophobicContact CG1-CB 4.4Å; I628-A644 HydrophobicContact CG2-CB 4.12Å; A644-C646 PolarHBondContact O-SG 3.35Å; A644-C646 VanDerWaalsContact O-SG 3.33Å; A644-G693 WeakPolarHBondContact O-CA 3.46Å; A644-L694 HydrophobicContact CB-CB 4.46Å; A644-L694 PolarHBondContact N-O 2.98Å; A644-L694 PolarHBondContact O-N 3.18Å; A644-F703 HydrophobicContact CB-CB 4.4Å; A644-F703 HydrophobicContact CB-CD1 3.71Å; A644-F703 HydrophobicContact CB-CD2 4.02Å; A644-F703 HydrophobicContact CB-CE1 3.75Å; A644-F703 HydrophobicContact CB-CE2 4.07Å; A644-F703 HydrophobicContact CB-CG 3.81Å; A644-F703 HydrophobicContact CB-CZ 3.9Å
645	G	93.7	Very high	88.3	Confident	14 Å²	14	69 Å²	69	14%	0.144	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	112.6	169.5	0	0	0	0	0	110.2	L629 A630	L629-G645 PolarHBondContact N-O 3.07Å; A630-G645 PolarHBondContact N-O 3.18Å; A630-G645 WeakPolarHBondContact O-CA 3.39Å; A630-G645 PolarHBondContact O-N 2.94Å
646	C	93.1	Very high	88.6	Confident	2 Å²	2	73.9 Å²	73.9	1%	0.014	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148.7	-169.4	-52.8	0	0	0	0	111.2	A626 S627 A644 D691 C692 L694	A626-C646 HydrophobicContact CB-CB 4.29Å; S627-C646 VanDerWaalsContact O-CA 3.31Å; S627-C646 WeakPolarHBondContact O-CA 3.29Å; A644-C646 PolarHBondContact O-SG 3.35Å; A644-C646 VanDerWaalsContact O-SG 3.33Å; C646-D691 CarbonylContact O-C 3.55Å; C646-D691 WeakPolarHBondContact O-CA 3.3Å; C646-C692 PolarHBondContact N-O 3.49Å; C646-C692 PolarHBondContact O-N 3.2Å; C646-L694 HydrophobicContact CB-CD1 4.06Å; C646-L694 VanDerWaalsContact SG-CD1 3.57Å
647	R	93.3	Very high	89.6	Confident	112 Å²	112	71.3 Å²	71.3	42%	0.423	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.6	170.7	-178.6	166.5	-68.5	171.4	-0.1	110.2	A626 S627 L629 Q649 D691	A626-R647 CarbonylContact C-O 3.6Å; A626-R647 VanDerWaalsContact CA-O 3.27Å; A626-R647 WeakPolarHBondContact CA-O 3.44Å; A626-R647 WeakPolarHBondContact CB-O 3.39Å; S627-R647 PolarHBondContact N-O 2.93Å; S627-R647 PolarHBondContact O-N 2.84Å; L629-R647 HydrophobicContact CD1-CB 3.78Å; L629-R647 HydrophobicContact CG-CB 4.43Å; R647-Q649 PolarHBondContact O-N 3.26Å; R647-D691 WeakPolarHBondContact CB-OD1 2.82Å; R647-D691 IonicContact CZ-OD1 2.81Å; R647-D691 VanDerWaalsContact CZ-OD1 3.27Å; R647-D691 IonicContact CZ-OD2 3.63Å; R647-D691 IonicContact NE-OD1 2.98Å; R647-D691 PolarHBondContact NE-OD1 3Å; R647-D691 IonicContact NE-OD2 3.85Å; R647-D691 VanDerWaalsContact NH2-CG 3.3Å; R647-D691 IonicContact NH2-OD1 3.02Å; R647-D691 PolarHBondContact NH2-OD1 2.8Å; R647-D691 IonicContact NH2-OD2 3.36Å; R647-D691 PolarHBondContact NH2-OD2 2.83Å
648	V	95.1	Very high	90.2	Very high	2 Å²	2	72.1 Å²	72.1	1%	0.012	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	117.9	179	-172.4	0	0	0	0	109.6	A626 G651 L653 V686 G689 M690	A626-V648 HydrophobicContact CB-CG2 4.36Å; V648-G651 WeakPolarHBondContact CG1-O 3.45Å; V648-L653 HydrophobicContact CG1-CG 4.46Å; V648-L653 HydrophobicContact CG2-CD1 3.77Å; V648-L653 HydrophobicContact CG2-CG 3.79Å; V648-V686 HydrophobicContact CG2-CB 4.32Å; V648-V686 HydrophobicContact CG2-CG1 3.69Å; V648-G689 PolarHBondContact O-N 3.43Å; V648-M690 PolarHBondContact N-O 2.76Å
649	Q	93.3	Very high	90.9	Very high	92 Å²	92	61.8 Å²	61.8	43%	0.43	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-43.9	-179.4	-63.2	-165.6	-4.2	0	0	112.1	E625 S627 R647 T688	E625-Q649 PolarHBondContact O-N 3.36Å; S627-Q649 VanDerWaalsContact CB-NE2 3.26Å; S627-Q649 PolarHBondContact OG-NE2 2.71Å; R647-Q649 PolarHBondContact O-N 3.26Å; Q649-T688 VanDerWaalsContact O-CG2 3.25Å; Q649-T688 WeakPolarHBondContact O-CG2 3.31Å
650	K	92.4	Very high	91.6	Very high	137 Å²	137	57.8 Å²	57.8	60%	0.596	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.2	142.2	-176.6	-64	178.9	-177.6	173	0	109.9	G624 E625	G624-K650 CarbonylContact C-O 3.56Å; G624-K650 WeakPolarHBondContact CA-O 3.46Å; E625-K650 HydrophobicContact CB-CB 4.47Å; E625-K650 PolarHBondContact N-O 3.18Å; E625-K650 PolarHBondContact O-N 2.9Å
651	G	93.7	Very high	92.1	Very high	37 Å²	37	49.8 Å²	49.8	38%	0.381	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	67.2	-147.3	177.7	0	0	0	0	0	113.1	V623 V648 T688	V623-G651 WeakPolarHBondContact O-CA 3.31Å; V648-G651 WeakPolarHBondContact CG1-O 3.45Å; G651-T688 PolarHBondContact O-N 3.12Å; G651-T688 PolarHBondContact O-OG1 2.64Å
652	Q	93.6	Very high	92.5	Very high	67 Å²	67	49.3 Å²	49.3	31%	0.313	24%	0.24	S	C	.	.			trans	-137.6	153.5	-178.5	65.3	-170.5	15.7	0	0	111.6	V623 G624 E654 I685 V686	V623-Q652 HydrophobicContact CG1-CG 4.03Å; V623-Q652 PolarHBondContact O-N 2.77Å; G624-Q652 WeakPolarHBondContact CA-O 3.42Å; Q652-E654 HydrophobicContact CG-CG 4.43Å; Q652-E654 PolarHBondContact NE2-OE1 3Å; Q652-I685 HydrophobicContact CB-CG2 4.29Å; Q652-I685 HydrophobicContact CG-CG2 4.4Å; Q652-V686 CarbonylContact C-O 3.58Å; Q652-V686 VanDerWaalsContact CA-O 3.28Å; Q652-V686 WeakPolarHBondContact CA-O 3.49Å; Q652-V686 WeakPolarHBondContact CB-O 3.2Å
653	L	93.6	Very high	92.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.7	173.7	-54.1	-178.1	0	0	0	109.4	A626 V648 F659 I685 V686 L694 C711	A626-L653 HydrophobicContact CB-CD1 3.79Å; A626-L653 HydrophobicContact CB-CD2 4.25Å; A626-L653 HydrophobicContact CB-CG 4.43Å; V648-L653 HydrophobicContact CG1-CG 4.46Å; V648-L653 HydrophobicContact CG2-CD1 3.77Å; V648-L653 HydrophobicContact CG2-CG 3.79Å; L653-F659 HydrophobicContact CB-CE1 4.2Å; L653-F659 HydrophobicContact CB-CZ 4.5Å; L653-F659 HydrophobicContact CD2-CE1 4.13Å; L653-I685 CarbonylContact O-C 3.51Å; L653-I685 WeakPolarHBondContact O-CA 3.35Å; L653-V686 HydrophobicContact CB-CB 4.41Å; L653-V686 PolarHBondContact N-O 2.65Å; L653-V686 PolarHBondContact O-N 2.85Å; L653-L694 HydrophobicContact CD1-CD1 4.42Å; L653-C711 HydrophobicContact CD2-CB 3.59Å
654	E	93.6	Very high	92.4	Very high	40 Å²	40	56.2 Å²	56.2	19%	0.187	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.7	179.3	-66.8	-178.5	-163.9	0	0	110.4	Q652 Q656 K657 F659 S684 I685	Q652-E654 HydrophobicContact CG-CG 4.43Å; Q652-E654 PolarHBondContact NE2-OE1 3Å; E654-Q656 PolarHBondContact O-N 2.81Å; E654-Q656 VanDerWaalsContact O-N 3.11Å; E654-K657 HydrophobicContact CB-CB 4.4Å; E654-K657 HydrophobicContact CB-CG 3.7Å; E654-K657 PolarHBondContact O-N 3.38Å; E654-K657 VanDerWaalsContact O-N 3.1Å; E654-K657 WeakPolarHBondContact OE2-CE 3.49Å; E654-F659 VanDerWaalsContact O-CE2 3.3Å; E654-F659 WeakPolarHBondContact O-CE2 3.1Å; E654-F659 WeakPolarHBondContact O-CZ 3.49Å; E654-S684 WeakPolarHBondContact CA-O 3.47Å; E654-I685 HydrophobicContact CG-CG1 4.16Å; E654-I685 HydrophobicContact CG-CG2 4.22Å
655	K	90.6	Very high	92.1	Very high	72 Å²	72	59.4 Å²	59.4	31%	0.313	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-31.7	-174.8	-171.8	175.4	-179.1	175.7	0	113.8	T674 L676 S684	K655-T674 WeakPolarHBondContact CE-O 3.11Å; K655-T674 PolarHBondContact NZ-O 3.06Å; K655-L676 HydrophobicContact CB-CB 4.19Å; K655-L676 HydrophobicContact CB-CD2 3.89Å; K655-L676 HydrophobicContact CD-CB 4.18Å; K655-L676 HydrophobicContact CG-CB 4.11Å; K655-S684 PolarHBondContact N-O 2.87Å
656	Q	90.5	Very high	91.9	Very high	193 Å²	193	65.5 Å²	65.5	90%	0.902	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-13.5	-176.8	-65	-174.6	-15.1	0	0	114	E654	E654-Q656 PolarHBondContact O-N 2.81Å; E654-Q656 VanDerWaalsContact O-N 3.11Å
657	K	92.5	Very high	91.8	Very high	52 Å²	52	69 Å²	69	23%	0.226	35%	0.348	C	S	.	.	S	Bend	trans	-86.2	172.1	-178.3	-59.3	-63.7	-177.1	-173.5	0	110.8	E654 F659 E713	E654-K657 HydrophobicContact CB-CB 4.4Å; E654-K657 HydrophobicContact CB-CG 3.7Å; E654-K657 PolarHBondContact O-N 3.38Å; E654-K657 VanDerWaalsContact O-N 3.1Å; E654-K657 WeakPolarHBondContact OE2-CE 3.49Å; K657-F659 VanDerWaalsContact O-CD2 3.25Å; K657-F659 WeakPolarHBondContact O-CD2 3.38Å; K657-F659 WeakPolarHBondContact O-CE2 3.44Å; K657-E713 HydrophobicContact CD-CB 4.23Å; K657-E713 HydrophobicContact CD-CG 4.36Å; K657-E713 IonicContact NZ-OE1 2.98Å; K657-E713 PolarHBondContact NZ-OE1 3.22Å
658	K	92.9	Very high	91.7	Very high	88 Å²	88	66.7 Å²	66.7	38%	0.383	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	150.9	177.1	-74.2	176.9	170.6	179	0	110.5	Y712 E714	K658-Y712 HydrophobicContact CB-CD1 4.47Å; K658-Y712 HydrophobicContact CB-CD2 4.34Å; K658-Y712 HydrophobicContact CB-CE1 3.94Å; K658-Y712 HydrophobicContact CB-CE2 3.81Å; K658-Y712 HydrophobicContact CD-CE2 4.29Å; K658-Y712 PolarHBondContact N-O 2.83Å; K658-Y712 WeakPolarHBondContact O-CD1 3.46Å; K658-Y712 PolarHBondContact O-N 3.15Å; K658-Y712 VanDerWaalsContact O-O 3.14Å; K658-E714 VanDerWaalsContact CD-CD 3.48Å; K658-E714 HydrophobicContact CD-CG 4.26Å; K658-E714 WeakPolarHBondContact CD-OE1 3.41Å; K658-E714 WeakPolarHBondContact CE-OE1 3.17Å; K658-E714 IonicContact NZ-OE1 3.34Å; K658-E714 PolarHBondContact NZ-OE1 3.45Å; K658-E714 IonicContact NZ-OE2 2.79Å; K658-E714 PolarHBondContact NZ-OE2 2.89Å
659	F	93.3	Very high	91.4	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	141.8	-175.4	-68.4	-96.3	0	0	0	109.8	L653 E654 K657 W669 K670 G671 L673 I709 V710 C711	L653-F659 HydrophobicContact CB-CE1 4.2Å; L653-F659 HydrophobicContact CB-CZ 4.5Å; L653-F659 HydrophobicContact CD2-CE1 4.13Å; E654-F659 VanDerWaalsContact O-CE2 3.3Å; E654-F659 WeakPolarHBondContact O-CE2 3.1Å; E654-F659 WeakPolarHBondContact O-CZ 3.49Å; K657-F659 VanDerWaalsContact O-CD2 3.25Å; K657-F659 WeakPolarHBondContact O-CD2 3.38Å; K657-F659 WeakPolarHBondContact O-CE2 3.44Å; F659-W669 HydrophobicContact CB-CZ3 3.86Å; F659-W669 WeakPolarHBondContact O-CZ3 3.49Å; F659-K670 WeakPolarHBondContact O-CA 3.45Å; F659-G671 PolarHBondContact N-O 2.93Å; F659-G671 PolarHBondContact O-N 3.47Å; F659-L673 HydrophobicContact CD1-CD1 4.17Å; F659-L673 HydrophobicContact CD1-CG 4.4Å; F659-L673 HydrophobicContact CD2-CD1 3.78Å; F659-L673 HydrophobicContact CD2-CD2 4.33Å; F659-L673 HydrophobicContact CD2-CG 3.53Å; F659-L673 HydrophobicContact CE1-CD1 3.72Å; F659-L673 HydrophobicContact CE1-CG 4.4Å; F659-L673 HydrophobicContact CE2-CB 4.49Å; F659-L673 HydrophobicContact CE2-CD1 3.3Å; F659-L673 HydrophobicContact CE2-CG 3.56Å; F659-L673 HydrophobicContact CG-CD1 4.19Å; F659-L673 HydrophobicContact CG-CD2 4.32Å; F659-L673 HydrophobicContact CG-CG 3.98Å; F659-L673 HydrophobicContact CZ-CD1 3.27Å; F659-L673 HydrophobicContact CZ-CG 4.02Å; F659-I709 HydrophobicContact CD1-CG2 3.78Å; F659-V710 WeakPolarHBondContact CA-O 3.35Å; F659-C711 HydrophobicContact CD1-CB 3.91Å; F659-C711 HydrophobicContact CE1-CB 3.59Å; F659-C711 HydrophobicContact CZ-CB 4.19Å
660	K	93.4	Very high	91.3	Very high	43 Å²	43	68.3 Å²	68.3	19%	0.187	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132.3	169.8	62.1	-172.9	172.9	-170	0	111	E620 V667 W669 K670 V710 Y712	E620-K660 IonicContact OE2-NZ 3.97Å; E620-K660 PolarHBondContact OE2-NZ 2.78Å; K660-V667 HydrophobicContact CB-CG1 4.13Å; K660-W669 CarbonylContact C-O 3.48Å; K660-W669 WeakPolarHBondContact CA-O 3.32Å; K660-K670 HydrophobicContact CB-CG 4.04Å; K660-V710 HydrophobicContact CG-CB 3.82Å; K660-V710 HydrophobicContact CG-CG1 4.47Å; K660-V710 PolarHBondContact N-O 2.78Å; K660-V710 PolarHBondContact O-N 2.98Å; K660-Y712 HydrophobicContact CB-CD1 4.3Å; K660-Y712 HydrophobicContact CB-CE1 3.81Å; K660-Y712 HydrophobicContact CD-CD1 3.98Å; K660-Y712 HydrophobicContact CD-CE1 4.01Å; K660-Y712 HydrophobicContact CG-CD1 3.88Å; K660-Y712 HydrophobicContact CG-CE1 3.9Å
661	L	92.3	Very high	91.3	Very high	2 Å²	2	62.9 Å²	62.9	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	128.9	175.5	-176.3	69.9	0	0	0	108.9	I628 V667 I668 W669 D707 I709	I628-L661 HydrophobicContact CD1-CD1 3.89Å; L661-V667 CarbonylContact O-C 3.5Å; L661-V667 WeakPolarHBondContact O-CA 3.24Å; L661-I668 HydrophobicContact CD2-CB 4.38Å; L661-I668 HydrophobicContact CD2-CG2 4.47Å; L661-I668 PolarHBondContact O-N 3.45Å; L661-W669 HydrophobicContact CB-CB 3.96Å; L661-W669 HydrophobicContact CB-CE3 4.49Å; L661-W669 PolarHBondContact N-O 3.06Å; L661-D707 HydrophobicContact CD1-CB 3.93Å; L661-I709 HydrophobicContact CD1-CD1 4.13Å; L661-I709 HydrophobicContact CD1-CG1 3.47Å; L661-I709 VanDerWaalsContact CD1-CG1 3.47Å
662	T	92.3	Very high	91.2	Very high	24 Å²	24	64 Å²	64	15%	0.147	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	128	-178.2	-47.2	0	0	0	0	110.2	H666 R708	T662-H666 CarbonylContact C-O 3.55Å; T662-H666 VanDerWaalsContact CA-O 3.24Å; T662-H666 WeakPolarHBondContact CA-O 3.02Å; T662-R708 PolarHBondContact N-O 3.38Å; T662-R708 PolarHBondContact O-N 3.48Å
663	R	91.8	Very high	91	Very high	51 Å²	51	61.3 Å²	61.3	19%	0.192	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.2	175.1	-177.2	179.2	-64.1	156	2	108.6	G665 H666 I668 E702 D707	R663-G665 PolarHBondContact O-N 3.45Å; R663-H666 PolarHBondContact N-O 3.02Å; R663-H666 PolarHBondContact O-N 3.41Å; R663-I668 HydrophobicContact CB-CD1 3.27Å; R663-I668 HydrophobicContact CB-CG1 4.11Å; R663-I668 HydrophobicContact CG-CD1 4.1Å; R663-I668 VanDerWaalsContact CZ-CD1 3.4Å; R663-E702 PolarHBondContact NH2-O 3.36Å; R663-D707 VanDerWaalsContact CG-OD1 3.28Å; R663-D707 WeakPolarHBondContact CG-OD1 3.34Å; R663-D707 IonicContact CZ-OD1 2.99Å; R663-D707 IonicContact CZ-OD2 2.84Å; R663-D707 IonicContact NE-OD1 2.68Å; R663-D707 PolarHBondContact NE-OD1 2.86Å; R663-D707 IonicContact NE-OD2 3.68Å; R663-D707 PolarHBondContact NE-OD2 3.2Å; R663-D707 IonicContact NH2-OD1 2.77Å; R663-D707 IonicContact NH2-OD2 3.67Å; R663-D707 PolarHBondContact NH2-OD2 3.13Å
664	D	85.4	Confident	90.8	Very high	153 Å²	153	64.8 Å²	64.8	82%	0.818	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	32.7	-178.2	-54.3	-43	0	0	0	113.9
665	G	84.6	Confident	90.6	Very high	66 Å²	66	63.7 Å²	63.7	68%	0.68	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	88	-8.6	-177.9	0	0	0	0	0	115.5	R663	R663-G665 PolarHBondContact O-N 3.45Å
666	H	88.1	Confident	90.7	Very high	143 Å²	143	60.2 Å²	60.2	66%	0.662	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	132.9	177.9	-63.1	-74.5	0	0	0	112.1	T662 R663 I668	T662-H666 CarbonylContact C-O 3.55Å; T662-H666 VanDerWaalsContact CA-O 3.24Å; T662-H666 WeakPolarHBondContact CA-O 3.02Å; R663-H666 PolarHBondContact N-O 3.02Å; R663-H666 PolarHBondContact O-N 3.41Å; H666-I668 PolarHBondContact O-N 3.29Å
667	V	91.1	Very high	90.7	Very high	75 Å²	75	53.8 Å²	53.8	46%	0.455	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	111.6	174.5	-178.5	0	0	0	0	109.1	K660 L661 K670	K660-V667 HydrophobicContact CB-CG1 4.13Å; L661-V667 CarbonylContact O-C 3.5Å; L661-V667 WeakPolarHBondContact O-CA 3.24Å; V667-K670 HydrophobicContact CG1-CG 3.83Å
668	I	90.9	Very high	90.6	Very high	63 Å²	63	52.6 Å²	52.6	32%	0.323	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-37	179	-65.1	175.5	0	0	0	110.9	L661 R663 H666 M701	L661-I668 HydrophobicContact CD2-CB 4.38Å; L661-I668 HydrophobicContact CD2-CG2 4.47Å; L661-I668 PolarHBondContact O-N 3.45Å; R663-I668 HydrophobicContact CB-CD1 3.27Å; R663-I668 HydrophobicContact CB-CG1 4.11Å; R663-I668 HydrophobicContact CG-CD1 4.1Å; R663-I668 VanDerWaalsContact CZ-CD1 3.4Å; H666-I668 PolarHBondContact O-N 3.29Å; I668-M701 HydrophobicContact CG2-CE 3.73Å; I668-M701 HydrophobicContact CG2-SD 3.85Å
669	W	90.7	Very high	90.4	Very high	17 Å²	17	56 Å²	56	6%	0.064	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	145.5	-170.3	-179.2	82.7	0	0	0	111.1	F659 K660 L661 G671 S672 L696 E698 M701	F659-W669 HydrophobicContact CB-CZ3 3.86Å; F659-W669 WeakPolarHBondContact O-CZ3 3.49Å; K660-W669 CarbonylContact C-O 3.48Å; K660-W669 WeakPolarHBondContact CA-O 3.32Å; L661-W669 HydrophobicContact CB-CB 3.96Å; L661-W669 HydrophobicContact CB-CE3 4.49Å; L661-W669 PolarHBondContact N-O 3.06Å; W669-G671 VanDerWaalsContact CZ2-CA 3.43Å; W669-S672 VanDerWaalsContact CH2-O 3.28Å; W669-S672 WeakPolarHBondContact CH2-O 3.03Å; W669-L696 HydrophobicContact CD2-CD1 3.84Å; W669-L696 HydrophobicContact CE3-CD1 3.93Å; W669-L696 HydrophobicContact CE3-CD2 4.03Å; W669-L696 HydrophobicContact CG-CD1 4.31Å; W669-L696 HydrophobicContact CH2-CB 4.33Å; W669-L696 HydrophobicContact CH2-CD1 4.43Å; W669-L696 HydrophobicContact CH2-CD2 3.54Å; W669-L696 HydrophobicContact CH2-CG 4.26Å; W669-L696 HydrophobicContact CZ2-CB 4.09Å; W669-L696 HydrophobicContact CZ2-CD1 4.35Å; W669-L696 HydrophobicContact CZ2-CD2 4.13Å; W669-L696 HydrophobicContact CZ2-CG 4.37Å; W669-L696 HydrophobicContact CZ3-CD1 4.23Å; W669-L696 HydrophobicContact CZ3-CD2 3.48Å; W669-L696 VanDerWaalsContact CZ3-CD2 3.48Å; W669-L696 HydrophobicContact CZ3-CG 4.34Å; W669-E698 PolarHBondContact NE1-OE2 3.03Å; W669-M701 HydrophobicContact CB-CE 3.82Å; W669-M701 HydrophobicContact CB-CG 4.46Å; W669-M701 HydrophobicContact CB-SD 3.9Å; W669-M701 HydrophobicContact CG-CE 4.16Å; W669-M701 HydrophobicContact CG-CG 4.15Å; W669-M701 HydrophobicContact CG-SD 4.23Å
670	K	91.1	Very high	90	Very high	112 Å²	112	65.2 Å²	65.2	49%	0.487	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	131.4	170.7	-67.2	-166.5	176.7	-168.1	0	109	E620 F659 K660 V667	E620-K670 IonicContact OE1-NZ 2.76Å; E620-K670 PolarHBondContact OE1-NZ 3.31Å; E620-K670 IonicContact OE2-NZ 3.94Å; F659-K670 WeakPolarHBondContact O-CA 3.45Å; K660-K670 HydrophobicContact CB-CG 4.04Å; V667-K670 HydrophobicContact CG1-CG 3.83Å
671	G	90.9	Very high	89.7	Confident	22 Å²	22	68.4 Å²	68.4	23%	0.227	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172	-161.6	176.1	0	0	0	0	0	114	F659 W669	F659-G671 PolarHBondContact N-O 2.93Å; F659-G671 PolarHBondContact O-N 3.47Å; W669-G671 VanDerWaalsContact CZ2-CA 3.43Å
672	S	91.9	Very high	89.6	Confident	60 Å²	60	72.8 Å²	72.8	42%	0.42	39%	0.388	S	S	.	.			trans	-102.7	159.8	176.3	42.6	0	0	0	0	112.4	W669 D697	W669-S672 VanDerWaalsContact CH2-O 3.28Å; W669-S672 WeakPolarHBondContact CH2-O 3.03Å; S672-D697 WeakPolarHBondContact CB-OD2 3Å; S672-D697 VanDerWaalsContact O-OD2 3.11Å; S672-D697 PolarHBondContact OG-OD2 3.22Å
673	L	90.5	Very high	89.6	Confident	11 Å²	11	74.4 Å²	74.4	6%	0.058	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	140	173.8	-63.4	173.3	0	0	0	110.8	F659 L676 L694 L696	F659-L673 HydrophobicContact CD1-CD1 4.17Å; F659-L673 HydrophobicContact CD1-CG 4.4Å; F659-L673 HydrophobicContact CD2-CD1 3.78Å; F659-L673 HydrophobicContact CD2-CD2 4.33Å; F659-L673 HydrophobicContact CD2-CG 3.53Å; F659-L673 HydrophobicContact CE1-CD1 3.72Å; F659-L673 HydrophobicContact CE1-CG 4.4Å; F659-L673 HydrophobicContact CE2-CB 4.49Å; F659-L673 HydrophobicContact CE2-CD1 3.3Å; F659-L673 HydrophobicContact CE2-CG 3.56Å; F659-L673 HydrophobicContact CG-CD1 4.19Å; F659-L673 HydrophobicContact CG-CD2 4.32Å; F659-L673 HydrophobicContact CG-CG 3.98Å; F659-L673 HydrophobicContact CZ-CD1 3.27Å; F659-L673 HydrophobicContact CZ-CG 4.02Å; L673-L676 HydrophobicContact CD1-CB 4.34Å; L673-L676 HydrophobicContact CD1-CD1 4.47Å; L673-L694 HydrophobicContact CD1-CD2 3.55Å; L673-L694 HydrophobicContact CD2-CB 4.23Å; L673-L694 HydrophobicContact CD2-CD2 4.09Å; L673-L694 HydrophobicContact CG-CD2 4.48Å; L673-L696 HydrophobicContact CD2-CD2 3.59Å
674	T	89.6	Confident	89.5	Confident	74 Å²	74	76.1 Å²	76.1	45%	0.454	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-46.7	169.2	-36.5	0	0	0	0	110.6	K655 S695 L696 D697	K655-T674 WeakPolarHBondContact CE-O 3.11Å; K655-T674 PolarHBondContact NZ-O 3.06Å; T674-S695 PolarHBondContact N-O 2.95Å; T674-L696 PolarHBondContact OG1-O 3.32Å; T674-D697 VanDerWaalsContact CA-OD1 3.27Å; T674-D697 WeakPolarHBondContact CA-OD1 3.31Å; T674-D697 VanDerWaalsContact CB-OD1 3.28Å; T674-D697 WeakPolarHBondContact CB-OD1 3.37Å; T674-D697 PolarHBondContact N-OD1 3.35Å; T674-D697 VanDerWaalsContact OG1-CA 3.27Å; T674-D697 WeakPolarHBondContact OG1-CA 3.42Å; T674-D697 PolarHBondContact OG1-N 2.9Å; T674-D697 PolarHBondContact OG1-OD1 3.33Å
675	S	88.9	Confident	89.9	Confident	16 Å²	16	72.7 Å²	72.7	11%	0.112	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	142.4	-178.6	-179.2	0	0	0	0	111.2	K677 D682 S695	S675-K677 WeakPolarHBondContact OG-CE 3.21Å; S675-K677 WeakPolarHBondContact OG-CG 3.42Å; S675-D682 PolarHBondContact OG-OD1 3.09Å; S675-S695 WeakPolarHBondContact CB-OG 3.31Å; S675-S695 PolarHBondContact N-OG 3.24Å; S675-S695 VanDerWaalsContact N-OG 3.15Å; S675-S695 PolarHBondContact O-N 2.71Å; S675-S695 VanDerWaalsContact O-N 3.07Å
676	L	92.6	Very high	90.4	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	104.2	176.3	174.8	64.1	0	0	0	106.2	K655 L673 I683 V686 C692 L694	K655-L676 HydrophobicContact CB-CB 4.19Å; K655-L676 HydrophobicContact CB-CD2 3.89Å; K655-L676 HydrophobicContact CD-CB 4.18Å; K655-L676 HydrophobicContact CG-CB 4.11Å; L673-L676 HydrophobicContact CD1-CB 4.34Å; L673-L676 HydrophobicContact CD1-CD1 4.47Å; L676-I683 WeakPolarHBondContact CD2-O 3.47Å; L676-I683 WeakPolarHBondContact CG-O 3.36Å; L676-I683 PolarHBondContact O-N 3.06Å; L676-V686 HydrophobicContact CD1-CG2 3.93Å; L676-V686 HydrophobicContact CD2-CG2 4.09Å; L676-V686 HydrophobicContact CG-CG2 4.11Å; L676-C692 HydrophobicContact CD1-CB 4.04Å; L676-L694 HydrophobicContact CD1-CD2 3.21Å; L676-L694 HydrophobicContact CD1-CG 4.44Å; L676-L694 HydrophobicContact CG-CD2 4.49Å
677	K	90.8	Very high	90.6	Very high	57 Å²	57	69.4 Å²	69.4	25%	0.248	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	139.6	-176.6	-73.5	174.6	179.1	175	0	110.6	E636 S675 D681 D682 C692 G693	E636-K677 IonicContact OE1-NZ 2.71Å; E636-K677 PolarHBondContact OE1-NZ 3.35Å; S675-K677 WeakPolarHBondContact OG-CE 3.21Å; S675-K677 WeakPolarHBondContact OG-CG 3.42Å; K677-D681 CarbonylContact C-O 3.6Å; K677-D681 VanDerWaalsContact CA-O 3.28Å; K677-D681 WeakPolarHBondContact CA-O 3.15Å; K677-D682 VanDerWaalsContact CE-CG 3.45Å; K677-D682 WeakPolarHBondContact CE-OD1 3.15Å; K677-D682 WeakPolarHBondContact CE-OD2 3.37Å; K677-D682 HydrophobicContact CG-CB 4.4Å; K677-D682 VanDerWaalsContact CG-OD1 3.25Å; K677-D682 WeakPolarHBondContact CG-OD1 3.44Å; K677-D682 IonicContact NZ-OD2 3.75Å; K677-C692 CarbonylContact O-C 3.49Å; K677-C692 WeakPolarHBondContact O-CA 3.45Å; K677-G693 PolarHBondContact N-O 2.88Å; K677-G693 PolarHBondContact O-N 2.95Å
678	H	90.6	Very high	90.8	Very high	28 Å²	28	69.7 Å²	69.7	13%	0.13	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	116.7	167.4	179.5	-78.9	0	0	0	107.1	K680 D681 I683 D691	H678-K680 PolarHBondContact O-N 2.86Å; H678-K680 VanDerWaalsContact O-N 3.1Å; H678-D681 PolarHBondContact N-O 3.41Å; H678-D681 PolarHBondContact O-N 3.47Å; H678-D681 VanDerWaalsContact O-N 3.14Å; H678-I683 HydrophobicContact CB-CD1 3.48Å; H678-I683 VanDerWaalsContact CB-CD1 3.48Å; H678-I683 HydrophobicContact CB-CG1 4.02Å; H678-D691 PolarHBondContact CD2-O 3.46Å; H678-D691 PolarHBondContact NE2-O 2.88Å
679	H	87.1	Confident	90.7	Very high	158 Å²	158	69.1 Å²	69.1	73%	0.731	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	-109.2	-165.6	-57.6	-57.8	0	0	0	112.7
680	K	85.2	Confident	90.7	Very high	195 Å²	195	72.2 Å²	72.2	85%	0.848	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-6.9	-179.5	-67.5	-174.3	179.3	-179.8	0	113.2	H678	H678-K680 PolarHBondContact O-N 2.86Å; H678-K680 VanDerWaalsContact O-N 3.1Å
681	D	88.1	Confident	90.8	Very high	110 Å²	110	70 Å²	70	59%	0.588	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.4	132.8	-173	-56.1	-38.8	0	0	0	110	K677 H678 I683	K677-D681 CarbonylContact C-O 3.6Å; K677-D681 VanDerWaalsContact CA-O 3.28Å; K677-D681 WeakPolarHBondContact CA-O 3.15Å; H678-D681 PolarHBondContact N-O 3.41Å; H678-D681 PolarHBondContact O-N 3.47Å; H678-D681 VanDerWaalsContact O-N 3.14Å; D681-I683 HydrophobicContact CB-CG1 4.34Å; D681-I683 PolarHBondContact O-N 3.28Å
682	D	89.4	Confident	90.9	Very high	94 Å²	94	69.1 Å²	69.1	50%	0.503	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	118.9	167.9	-89.2	-68.6	0	0	0	108.5	S675 K677	S675-D682 PolarHBondContact OG-OD1 3.09Å; K677-D682 VanDerWaalsContact CE-CG 3.45Å; K677-D682 WeakPolarHBondContact CE-OD1 3.15Å; K677-D682 WeakPolarHBondContact CE-OD2 3.37Å; K677-D682 HydrophobicContact CG-CB 4.4Å; K677-D682 VanDerWaalsContact CG-OD1 3.25Å; K677-D682 WeakPolarHBondContact CG-OD1 3.44Å; K677-D682 IonicContact NZ-OD2 3.75Å
683	I	91.4	Very high	90.9	Very high	58 Å²	58	67.2 Å²	67.2	30%	0.297	36%	0.362	S	S	.	.			trans	-118.3	139.5	-177.6	-57.3	-166	0	0	0	109.5	L676 H678 D681 I685	L676-I683 WeakPolarHBondContact CD2-O 3.47Å; L676-I683 WeakPolarHBondContact CG-O 3.36Å; L676-I683 PolarHBondContact O-N 3.06Å; H678-I683 HydrophobicContact CB-CD1 3.48Å; H678-I683 VanDerWaalsContact CB-CD1 3.48Å; H678-I683 HydrophobicContact CB-CG1 4.02Å; D681-I683 HydrophobicContact CB-CG1 4.34Å; D681-I683 PolarHBondContact O-N 3.28Å; I683-I685 WeakPolarHBondContact CG2-O 3.11Å
684	S	91.3	Very high	90.9	Very high	87 Å²	87	66.7 Å²	66.7	61%	0.608	36%	0.359	S	S	*	.	S	Bend	trans	-76.7	-35.7	179.4	-33.1	0	0	0	0	113	E654 K655	E654-S684 WeakPolarHBondContact CA-O 3.47Å; K655-S684 PolarHBondContact N-O 2.87Å
685	I	93.4	Very high	90.9	Very high	81 Å²	81	63.6 Å²	63.6	42%	0.415	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	125.2	-173.5	-49.4	-178	0	0	0	110.3	Q652 L653 E654 I683	Q652-I685 HydrophobicContact CB-CG2 4.29Å; Q652-I685 HydrophobicContact CG-CG2 4.4Å; L653-I685 CarbonylContact O-C 3.51Å; L653-I685 WeakPolarHBondContact O-CA 3.35Å; E654-I685 HydrophobicContact CG-CG1 4.16Å; E654-I685 HydrophobicContact CG-CG2 4.22Å; I683-I685 WeakPolarHBondContact CG2-O 3.11Å
686	V	93.9	Very high	90.9	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.006	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.9	175.4	-176.2	0	0	0	0	109.3	V648 Q652 L653 L676 M690 C692	V648-V686 HydrophobicContact CG2-CB 4.32Å; V648-V686 HydrophobicContact CG2-CG1 3.69Å; Q652-V686 CarbonylContact C-O 3.58Å; Q652-V686 VanDerWaalsContact CA-O 3.28Å; Q652-V686 WeakPolarHBondContact CA-O 3.49Å; Q652-V686 WeakPolarHBondContact CB-O 3.2Å; L653-V686 HydrophobicContact CB-CB 4.41Å; L653-V686 PolarHBondContact N-O 2.65Å; L653-V686 PolarHBondContact O-N 2.85Å; L676-V686 HydrophobicContact CD1-CG2 3.93Å; L676-V686 HydrophobicContact CD2-CG2 4.09Å; L676-V686 HydrophobicContact CG-CG2 4.11Å; V686-M690 HydrophobicContact CG1-CB 3.66Å; V686-C692 HydrophobicContact CB-CB 4.42Å; V686-C692 HydrophobicContact CG1-CB 3.98Å; V686-C692 HydrophobicContact CG2-CB 3.91Å
687	K	93.7	Very high	90.4	Very high	138 Å²	138	67.6 Å²	67.6	60%	0.6	36%	0.361	S	S	*	.			trans	-84	166.5	-177.4	-64.8	-175.8	180	-179	0	112.1	G689 M690	K687-G689 PolarHBondContact O-N 2.87Å; K687-M690 HydrophobicContact CB-SD 4.15Å; K687-M690 PolarHBondContact O-N 3.36Å; K687-M690 WeakPolarHBondContact O-CB 3.36Å
688	T	94.6	Very high	89.9	Confident	82 Å²	82	69.3 Å²	69.3	50%	0.503	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	134.5	177.1	-40.8	0	0	0	0	111.8	Q649 G651 M690	Q649-T688 VanDerWaalsContact O-CG2 3.25Å; Q649-T688 WeakPolarHBondContact O-CG2 3.31Å; G651-T688 PolarHBondContact O-N 3.12Å; G651-T688 PolarHBondContact O-OG1 2.64Å; T688-M690 VanDerWaalsContact C-N 3.31Å; T688-M690 PolarHBondContact O-N 2.93Å
689	G	89.2	Confident	88.9	Confident	50 Å²	50	74.4 Å²	74.4	52%	0.515	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-8.8	179.3	0	0	0	0	0	115.6	V648 K687	V648-G689 PolarHBondContact O-N 3.43Å; K687-G689 PolarHBondContact O-N 2.87Å
690	M	91.5	Very high	88.1	Confident	82 Å²	82	73.9 Å²	73.9	40%	0.404	40%	0.396	S	S	.	.			trans	-84.8	151	176.7	-63.6	-176.5	115.6	0	0	112.1	V648 V686 K687 T688	V648-M690 PolarHBondContact N-O 2.76Å; V686-M690 HydrophobicContact CG1-CB 3.66Å; K687-M690 HydrophobicContact CB-SD 4.15Å; K687-M690 PolarHBondContact O-N 3.36Å; K687-M690 WeakPolarHBondContact O-CB 3.36Å; T688-M690 VanDerWaalsContact C-N 3.31Å; T688-M690 PolarHBondContact O-N 2.93Å
691	D	92.9	Very high	87.8	Confident	65 Å²	65	66.3 Å²	66.3	35%	0.348	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127.8	178.7	-71.2	-26.6	0	0	0	110.9	C646 R647 H678	C646-D691 CarbonylContact O-C 3.55Å; C646-D691 WeakPolarHBondContact O-CA 3.3Å; R647-D691 WeakPolarHBondContact CB-OD1 2.82Å; R647-D691 IonicContact CZ-OD1 2.81Å; R647-D691 VanDerWaalsContact CZ-OD1 3.27Å; R647-D691 IonicContact CZ-OD2 3.63Å; R647-D691 IonicContact NE-OD1 2.98Å; R647-D691 PolarHBondContact NE-OD1 3Å; R647-D691 IonicContact NE-OD2 3.85Å; R647-D691 VanDerWaalsContact NH2-CG 3.3Å; R647-D691 IonicContact NH2-OD1 3.02Å; R647-D691 PolarHBondContact NH2-OD1 2.8Å; R647-D691 IonicContact NH2-OD2 3.36Å; R647-D691 PolarHBondContact NH2-OD2 2.83Å; H678-D691 PolarHBondContact CD2-O 3.46Å; H678-D691 PolarHBondContact NE2-O 2.88Å
692	C	91.6	Very high	87.5	Confident	5 Å²	5	68.1 Å²	68.1	3%	0.034	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145.8	-178.2	55.6	0	0	0	0	112	C646 L676 K677 V686	C646-C692 PolarHBondContact N-O 3.49Å; C646-C692 PolarHBondContact O-N 3.2Å; L676-C692 HydrophobicContact CD1-CB 4.04Å; K677-C692 CarbonylContact O-C 3.49Å; K677-C692 WeakPolarHBondContact O-CA 3.45Å; V686-C692 HydrophobicContact CB-CB 4.42Å; V686-C692 HydrophobicContact CG1-CB 3.98Å; V686-C692 HydrophobicContact CG2-CB 3.91Å
693	G	92.1	Very high	87.4	Confident	19 Å²	19	64.7 Å²	64.7	20%	0.196	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	125.1	167.2	0	0	0	0	0	109.9	A644 K677	A644-G693 WeakPolarHBondContact O-CA 3.46Å; K677-G693 PolarHBondContact N-O 2.88Å; K677-G693 PolarHBondContact O-N 2.95Å
694	L	91.3	Very high	87.3	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.7	179.3	-60.6	174.5	0	0	0	110.2	V643 A644 C646 L653 L673 L676 I709	V643-L694 CarbonylContact C-O 3.6Å; V643-L694 WeakPolarHBondContact CA-O 3.48Å; A644-L694 HydrophobicContact CB-CB 4.46Å; A644-L694 PolarHBondContact N-O 2.98Å; A644-L694 PolarHBondContact O-N 3.18Å; C646-L694 HydrophobicContact CB-CD1 4.06Å; C646-L694 VanDerWaalsContact SG-CD1 3.57Å; L653-L694 HydrophobicContact CD1-CD1 4.42Å; L673-L694 HydrophobicContact CD1-CD2 3.55Å; L673-L694 HydrophobicContact CD2-CB 4.23Å; L673-L694 HydrophobicContact CD2-CD2 4.09Å; L673-L694 HydrophobicContact CG-CD2 4.48Å; L676-L694 HydrophobicContact CD1-CD2 3.21Å; L676-L694 HydrophobicContact CD1-CG 4.44Å; L676-L694 HydrophobicContact CG-CD2 4.49Å; L694-I709 HydrophobicContact CD1-CD1 3.45Å; L694-I709 VanDerWaalsContact CD1-CD1 3.45Å; L694-I709 HydrophobicContact CD1-CG2 4.23Å
695	S	89.3	Confident	87.2	Confident	10 Å²	10	67.8 Å²	67.8	7%	0.07	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.3	165	71.8	0	0	0	0	110.2	T674 S675	T674-S695 PolarHBondContact N-O 2.95Å; S675-S695 WeakPolarHBondContact CB-OG 3.31Å; S675-S695 PolarHBondContact N-OG 3.24Å; S675-S695 VanDerWaalsContact N-OG 3.15Å; S675-S695 PolarHBondContact O-N 2.71Å; S675-S695 VanDerWaalsContact O-N 3.07Å
696	L	88.8	Confident	86.9	Confident	16 Å²	16	66.7 Å²	66.7	8%	0.084	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	156.3	177.9	-57	-178.2	0	0	0	110.7	W669 L673 T674 E698 M701 F703	W669-L696 HydrophobicContact CD2-CD1 3.84Å; W669-L696 HydrophobicContact CE3-CD1 3.93Å; W669-L696 HydrophobicContact CE3-CD2 4.03Å; W669-L696 HydrophobicContact CG-CD1 4.31Å; W669-L696 HydrophobicContact CH2-CB 4.33Å; W669-L696 HydrophobicContact CH2-CD1 4.43Å; W669-L696 HydrophobicContact CH2-CD2 3.54Å; W669-L696 HydrophobicContact CH2-CG 4.26Å; W669-L696 HydrophobicContact CZ2-CB 4.09Å; W669-L696 HydrophobicContact CZ2-CD1 4.35Å; W669-L696 HydrophobicContact CZ2-CD2 4.13Å; W669-L696 HydrophobicContact CZ2-CG 4.37Å; W669-L696 HydrophobicContact CZ3-CD1 4.23Å; W669-L696 HydrophobicContact CZ3-CD2 3.48Å; W669-L696 VanDerWaalsContact CZ3-CD2 3.48Å; W669-L696 HydrophobicContact CZ3-CG 4.34Å; L673-L696 HydrophobicContact CD2-CD2 3.59Å; T674-L696 PolarHBondContact OG1-O 3.32Å; L696-E698 PolarHBondContact O-N 3.33Å; L696-M701 HydrophobicContact CD1-CB 3.98Å; L696-M701 HydrophobicContact CD1-CG 4.13Å; L696-F703 HydrophobicContact CG-CZ 3.64Å; L696-F703 HydrophobicContact CG-CE1 3.75Å; L696-F703 HydrophobicContact CD2-CE1 4.43Å; L696-F703 HydrophobicContact CD1-CE1 3.58Å; L696-F703 HydrophobicContact CD1-CZ 3.86Å; L696-F703 HydrophobicContact CB-CZ 4.49Å
697	D	83.1	Confident	86.8	Confident	83 Å²	83	66.9 Å²	66.9	44%	0.444	37%	0.368	S	S	.	.	S	Bend	trans	-68	-14.4	175.4	-70.1	-31.4	0	0	0	113.6	S672 T674	S672-D697 WeakPolarHBondContact CB-OD2 3Å; S672-D697 VanDerWaalsContact O-OD2 3.11Å; S672-D697 PolarHBondContact OG-OD2 3.22Å; T674-D697 VanDerWaalsContact CA-OD1 3.27Å; T674-D697 WeakPolarHBondContact CA-OD1 3.31Å; T674-D697 VanDerWaalsContact CB-OD1 3.28Å; T674-D697 WeakPolarHBondContact CB-OD1 3.37Å; T674-D697 PolarHBondContact N-OD1 3.35Å; T674-D697 VanDerWaalsContact OG1-CA 3.27Å; T674-D697 WeakPolarHBondContact OG1-CA 3.42Å; T674-D697 PolarHBondContact OG1-N 2.9Å; T674-D697 PolarHBondContact OG1-OD1 3.33Å
698	E	79.6	Confident	86.8	Confident	94 Å²	94	66.5 Å²	66.5	44%	0.439	36%	0.363	S	S	.	.			trans	-102.6	111.2	-175.3	-163.1	161.1	-165.6	0	0	112	W669 L696 N700 M701	W669-E698 PolarHBondContact NE1-OE2 3.03Å; L696-E698 PolarHBondContact O-N 3.33Å; E698-N700 PolarHBondContact O-N 2.75Å; E698-M701 HydrophobicContact CB-CG 4.32Å; E698-M701 PolarHBondContact O-N 3.11Å
699	E	69.6	Low	86.7	Confident	135 Å²	135	62.7 Å²	62.7	63%	0.631	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.9	-174.8	-70	-177.8	174.4	0	0	113.5	K639	K639-E699 IonicContact NZ-OE1 3.72Å; K639-E699 PolarHBondContact NZ-OE1 2.95Å
700	N	70.7	Confident	86.9	Confident	146 Å²	146	61.4 Å²	61.4	78%	0.781	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	6	-177	-64.6	-26.7	0	0	0	114.1	E698	E698-N700 PolarHBondContact O-N 2.75Å
701	M	77.7	Confident	87	Confident	36 Å²	36	57.5 Å²	57.5	18%	0.177	30%	0.302	C	S	.	.			trans	-83.8	124.5	-178.8	-92.6	-69.4	152.1	0	0	112.4	I668 W669 L696 E698	I668-M701 HydrophobicContact CG2-CE 3.73Å; I668-M701 HydrophobicContact CG2-SD 3.85Å; W669-M701 HydrophobicContact CB-CE 3.82Å; W669-M701 HydrophobicContact CB-CG 4.46Å; W669-M701 HydrophobicContact CB-SD 3.9Å; W669-M701 HydrophobicContact CG-CE 4.16Å; W669-M701 HydrophobicContact CG-CG 4.15Å; W669-M701 HydrophobicContact CG-SD 4.23Å; L696-M701 HydrophobicContact CD1-CB 3.98Å; L696-M701 HydrophobicContact CD1-CG 4.13Å; E698-M701 HydrophobicContact CB-CG 4.32Å; E698-M701 PolarHBondContact O-N 3.11Å
702	E	82.1	Confident	87.1	Confident	149 Å²	149	54.7 Å²	54.7	70%	0.696	29%	0.287	S	S	*	.			trans	-98.2	113.5	175.1	-69.8	-174.4	177.1	0	0	111.6	R663	R663-E702 PolarHBondContact NH2-O 3.36Å
703	F	87.9	Confident	87.2	Confident	21 Å²	21	57.5 Å²	57.5	9%	0.092	30%	0.299	C	S	.	.			trans	-77.5	138.5	171	-54.3	-72.5	0	0	0	111.1	I628 T631 P642 A644 L696	I628-F703 HydrophobicContact CD1-CB 4.19Å; I628-F703 HydrophobicContact CD1-CD1 3.73Å; I628-F703 HydrophobicContact CD1-CG 4.34Å; T631-F703 HydrophobicContact CG2-CB 3.46Å; T631-F703 VanDerWaalsContact CG2-CB 3.46Å; P642-F703 HydrophobicContact CB-CD2 4.17Å; P642-F703 HydrophobicContact CB-CE2 3.92Å; P642-F703 HydrophobicContact CG-CE2 4.31Å; A644-F703 HydrophobicContact CB-CB 4.4Å; A644-F703 HydrophobicContact CB-CD1 3.71Å; A644-F703 HydrophobicContact CB-CD2 4.02Å; A644-F703 HydrophobicContact CB-CE1 3.75Å; A644-F703 HydrophobicContact CB-CE2 4.07Å; A644-F703 HydrophobicContact CB-CG 3.81Å; A644-F703 HydrophobicContact CB-CZ 3.9Å; L696-F703 HydrophobicContact CG-CZ 3.64Å; L696-F703 HydrophobicContact CG-CE1 3.75Å; L696-F703 HydrophobicContact CD2-CE1 4.43Å; L696-F703 HydrophobicContact CD1-CE1 3.58Å; L696-F703 HydrophobicContact CD1-CZ 3.86Å; L696-F703 HydrophobicContact CB-CZ 4.49Å
704	K	88.8	Confident	87.1	Confident	108 Å²	108	60.1 Å²	60.1	47%	0.47	31%	0.306	S	S	.	.			trans	-117.6	149	169.2	-67.7	-176.1	-173.3	179.8	0	110.4	G706 D707	K704-G706 PolarHBondContact O-N 3.39Å; K704-D707 PolarHBondContact N-OD2 3.24Å; K704-D707 WeakPolarHBondContact O-CB 3.48Å; K704-D707 VanDerWaalsContact O-CG 3.27Å; K704-D707 PolarHBondContact O-N 2.89Å
705	V	89.3	Confident	86.9	Confident	103 Å²	103	65 Å²	65	62%	0.624	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	129.7	173.2	179.6	0	0	0	0	108.5	L629	L629-V705 WeakPolarHBondContact O-CG1 3.4Å
706	G	86.6	Confident	86.8	Confident	57 Å²	57	71.8 Å²	71.8	59%	0.588	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	98	-9.1	-175.1	0	0	0	0	0	115	I628 K704	I628-G706 PolarHBondContact O-N 3.2Å; K704-G706 PolarHBondContact O-N 3.39Å
707	D	92.7	Very high	86.7	Confident	5 Å²	5	74.6 Å²	74.6	3%	0.027	37%	0.372	C	S	.	.			trans	-64.4	153.6	172.7	-69.7	-17	0	0	0	111.3	I628 L661 R663 K704	I628-D707 HydrophobicContact CB-CB 4.4Å; I628-D707 HydrophobicContact CD1-CB 3.75Å; I628-D707 HydrophobicContact CG1-CB 4.05Å; I628-D707 PolarHBondContact N-O 3.37Å; L661-D707 HydrophobicContact CD1-CB 3.93Å; R663-D707 VanDerWaalsContact CG-OD1 3.28Å; R663-D707 WeakPolarHBondContact CG-OD1 3.34Å; R663-D707 IonicContact CZ-OD1 2.99Å; R663-D707 IonicContact CZ-OD2 2.84Å; R663-D707 IonicContact NE-OD1 2.68Å; R663-D707 PolarHBondContact NE-OD1 2.86Å; R663-D707 IonicContact NE-OD2 3.68Å; R663-D707 PolarHBondContact NE-OD2 3.2Å; R663-D707 IonicContact NH2-OD1 2.77Å; R663-D707 IonicContact NH2-OD2 3.67Å; R663-D707 PolarHBondContact NH2-OD2 3.13Å; K704-D707 PolarHBondContact N-OD2 3.24Å; K704-D707 WeakPolarHBondContact O-CB 3.48Å; K704-D707 VanDerWaalsContact O-CG 3.27Å; K704-D707 PolarHBondContact O-N 2.89Å
708	R	92.6	Very high	86.5	Confident	130 Å²	130	78.5 Å²	78.5	49%	0.491	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	135.8	178.2	-60.9	-175.2	-177.7	-162.5	9.2	111	E625 A626 T662	E625-R708 WeakPolarHBondContact OE1-CD 3.34Å; E625-R708 IonicContact OE1-CZ 2.75Å; E625-R708 IonicContact OE1-NE 2.74Å; E625-R708 IonicContact OE1-NH1 3.39Å; E625-R708 PolarHBondContact OE1-NH1 2.98Å; A626-R708 CarbonylContact O-C 3.5Å; A626-R708 WeakPolarHBondContact O-CA 3.35Å; T662-R708 PolarHBondContact N-O 3.38Å; T662-R708 PolarHBondContact O-N 3.48Å
709	I	92.8	Very high	86.6	Confident	3 Å²	3	75.4 Å²	75.4	2%	0.015	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.5	175.8	-66.9	172.6	0	0	0	108	E625 A626 I628 F659 L661 L694	E625-I709 WeakPolarHBondContact CA-O 3.48Å; A626-I709 PolarHBondContact N-O 3.34Å; A626-I709 PolarHBondContact O-N 2.84Å; I628-I709 HydrophobicContact CD1-CD1 3.72Å; I628-I709 HydrophobicContact CD1-CG1 4.16Å; I628-I709 HydrophobicContact CG1-CD1 3.86Å; I628-I709 HydrophobicContact CG1-CG1 4.22Å; F659-I709 HydrophobicContact CD1-CG2 3.78Å; L661-I709 HydrophobicContact CD1-CD1 4.13Å; L661-I709 HydrophobicContact CD1-CG1 3.47Å; L661-I709 VanDerWaalsContact CD1-CG1 3.47Å; L694-I709 HydrophobicContact CD1-CD1 3.45Å; L694-I709 VanDerWaalsContact CD1-CD1 3.45Å; L694-I709 HydrophobicContact CD1-CG2 4.23Å
710	V	94.1	Very high	87.3	Confident	23 Å²	23	77.5 Å²	77.5	14%	0.139	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.6	176.7	-178.2	0	0	0	0	108.3	P622 G624 E625 F659 K660	P622-V710 HydrophobicContact CB-CG1 4.32Å; G624-V710 CarbonylContact O-C 3.6Å; G624-V710 WeakPolarHBondContact O-CA 3.49Å; E625-V710 HydrophobicContact CG-CG2 4.37Å; F659-V710 WeakPolarHBondContact CA-O 3.35Å; K660-V710 HydrophobicContact CG-CB 3.82Å; K660-V710 HydrophobicContact CG-CG1 4.47Å; K660-V710 PolarHBondContact N-O 2.78Å; K660-V710 PolarHBondContact O-N 2.98Å
711	C	94.1	Very high	87.9	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	127.1	168.1	-178	0	0	0	0	108.2	V623 G624 L653 F659	V623-C711 PolarHBondContact N-O 2.84Å; G624-C711 PolarHBondContact N-O 2.85Å; G624-C711 PolarHBondContact O-N 3.04Å; L653-C711 HydrophobicContact CD2-CB 3.59Å; F659-C711 HydrophobicContact CD1-CB 3.91Å; F659-C711 HydrophobicContact CE1-CB 3.59Å; F659-C711 HydrophobicContact CZ-CB 4.19Å
712	Y	94.2	Very high	88.4	Confident	6 Å²	6	73 Å²	73	2%	0.024	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	151.1	179.5	67	-84.8	0	0	0	111.4	E620 H621 K658 K660 E714	E620-Y712 HydrophobicContact CB-CD2 3.88Å; E620-Y712 HydrophobicContact CB-CE2 4.45Å; E620-Y712 HydrophobicContact CB-CG 4.45Å; E620-Y712 HydrophobicContact CG-CD2 3.71Å; E620-Y712 HydrophobicContact CG-CE2 3.77Å; H621-Y712 CarbonylContact O-C 3.56Å; H621-Y712 VanDerWaalsContact O-CA 3.27Å; H621-Y712 WeakPolarHBondContact O-CA 3.22Å; H621-Y712 WeakPolarHBondContact O-CB 3.37Å; K658-Y712 HydrophobicContact CB-CD1 4.47Å; K658-Y712 HydrophobicContact CB-CD2 4.34Å; K658-Y712 HydrophobicContact CB-CE1 3.94Å; K658-Y712 HydrophobicContact CB-CE2 3.81Å; K658-Y712 HydrophobicContact CD-CE2 4.29Å; K658-Y712 PolarHBondContact N-O 2.83Å; K658-Y712 WeakPolarHBondContact O-CD1 3.46Å; K658-Y712 PolarHBondContact O-N 3.15Å; K658-Y712 VanDerWaalsContact O-O 3.14Å; K660-Y712 HydrophobicContact CB-CD1 4.3Å; K660-Y712 HydrophobicContact CB-CE1 3.81Å; K660-Y712 HydrophobicContact CD-CD1 3.98Å; K660-Y712 HydrophobicContact CD-CE1 4.01Å; K660-Y712 HydrophobicContact CG-CD1 3.88Å; K660-Y712 HydrophobicContact CG-CE1 3.9Å; Y712-E714 HydrophobicContact CD2-CG 4.12Å; Y712-E714 HydrophobicContact CE2-CG 3.78Å
713	E	93.4	Very high	88.8	Confident	64 Å²	64	66.1 Å²	66.1	30%	0.299	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.3	171.4	178.8	173.5	-130.1	0	0	108.5	H621 V623 K657 K715	H621-E713 PolarHBondContact N-O 2.87Å; H621-E713 PolarHBondContact O-N 2.93Å; V623-E713 HydrophobicContact CG2-CB 3.8Å; K657-E713 HydrophobicContact CD-CB 4.23Å; K657-E713 HydrophobicContact CD-CG 4.36Å; K657-E713 IonicContact NZ-OE1 2.98Å; K657-E713 PolarHBondContact NZ-OE1 3.22Å; E713-K715 HydrophobicContact CG-CG 4.38Å; E713-K715 WeakPolarHBondContact OE2-CE 3.29Å
714	E	90.1	Very high	88.8	Confident	73 Å²	73	70.8 Å²	70.8	34%	0.341	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	113.2	171.2	-74.2	176.5	-170.5	0	0	108.1	V618 K658 Y712	V618-E714 HydrophobicContact CG1-CB 3.6Å; V618-E714 HydrophobicContact CG1-CG 3.6Å; K658-E714 VanDerWaalsContact CD-CD 3.48Å; K658-E714 HydrophobicContact CD-CG 4.26Å; K658-E714 WeakPolarHBondContact CD-OE1 3.41Å; K658-E714 WeakPolarHBondContact CE-OE1 3.17Å; K658-E714 IonicContact NZ-OE1 3.34Å; K658-E714 PolarHBondContact NZ-OE1 3.45Å; K658-E714 IonicContact NZ-OE2 2.79Å; K658-E714 PolarHBondContact NZ-OE2 2.89Å; Y712-E714 HydrophobicContact CD2-CG 4.12Å; Y712-E714 HydrophobicContact CE2-CG 3.78Å
715	K	88.5	Confident	88.3	Confident	102 Å²	102	66.5 Å²	66.5	44%	0.443	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	129.3	168.7	-68.3	-172.2	-170	170.7	0	108.7	E619 H621 E713	E619-K715 PolarHBondContact N-O 3.19Å; E619-K715 PolarHBondContact O-N 2.76Å; H621-K715 VanDerWaalsContact CD2-CD 3.46Å; H621-K715 WeakPolarHBondContact CD2-CD 3.45Å; E713-K715 HydrophobicContact CG-CG 4.38Å; E713-K715 WeakPolarHBondContact OE2-CE 3.29Å
716	Q	86.5	Confident	87.6	Confident	153 Å²	153	63.9 Å²	63.9	72%	0.715	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	118.4	172.4	-68.6	-176.9	-11.3	0	0	108.5	C616	C616-Q716 HydrophobicContact CB-CB 4.21Å
717	I	85.6	Confident	86.7	Confident	75 Å²	75	65.5 Å²	65.5	39%	0.385	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.6	173.1	-58.8	178.3	0	0	0	106.9	A617 E619 A719	A617-I717 PolarHBondContact N-O 2.79Å; A617-I717 PolarHBondContact O-N 3.24Å; E619-I717 HydrophobicContact CB-CD1 3.82Å; E619-I717 WeakPolarHBondContact OE2-CD1 3.49Å; I717-A719 PolarHBondContact O-N 3.3Å
718	Q	80.1	Confident	86.4	Confident	166 Å²	166	68.6 Å²	68.6	78%	0.776	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-67.1	118.1	172.9	-70.8	179.3	-14.7	0	0	108.3
719	A	80.8	Confident	86.1	Confident	28 Å²	28	65.3 Å²	65.3	23%	0.231	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-69.9	140.2	172	0	0	0	0	0	108.7	L614 I717	L614-A719 HydrophobicContact CB-CB 4.3Å; L614-A719 HydrophobicContact CD2-CB 4.39Å; I717-A719 PolarHBondContact O-N 3.3Å
720	K	85.3	Confident	85.7	Confident	180 Å²	180	68.8 Å²	68.8	78%	0.783	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-95.4	149.5	166.4	-66.9	-173.4	176.9	-172.1	0	108.1	S722	K720-S722 PolarHBondContact O-N 3.14Å
721	T	83.3	Confident	85.2	Confident	20 Å²	20	71.5 Å²	71.5	12%	0.123	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-54.9	135.7	171.1	47.4	0	0	0	0	111.1	L610 S611 L614 W723	L610-T721 HydrophobicContact CB-CG2 3.28Å; L610-T721 HydrophobicContact CD1-CG2 4.08Å; L610-T721 HydrophobicContact CG-CG2 4.32Å; S611-T721 PolarHBondContact OG-N 3.29Å; S611-T721 VanDerWaalsContact OG-N 3.12Å; L614-T721 HydrophobicContact CD1-CG2 3.68Å; T721-W723 PolarHBondContact O-N 2.84Å
722	S	87.9	Confident	84.6	Confident	66 Å²	66	75.9 Å²	75.9	46%	0.462	39%	0.391	S	S	.	.			trans	-72	-16.7	169.3	52.4	0	0	0	0	113.4	A540 E543 K720 D724	A540-S722 WeakPolarHBondContact CB-OG 3.31Å; E543-S722 VanDerWaalsContact OE1-CB 3.24Å; E543-S722 WeakPolarHBondContact OE1-CB 3.44Å; E543-S722 PolarHBondContact OE1-OG 2.99Å; E543-S722 PolarHBondContact OE2-N 2.86Å; E543-S722 PolarHBondContact OE2-OG 2.65Å; K720-S722 PolarHBondContact O-N 3.14Å; S722-D724 PolarHBondContact O-N 3.44Å
723	W	90.2	Very high	84	Confident	5 Å²	5	80.6 Å²	80.6	2%	0.019	42%	0.416	C	S	.	.			trans	-63.4	120.2	-179.7	174.9	53.1	0	0	0	113	I534 T537 Y538 A540 V603 L606 Q607 L610 T721 P725	I534-W723 HydrophobicContact CG2-CH2 3.97Å; I534-W723 HydrophobicContact CG2-CZ2 3.8Å; I534-W723 WeakPolarHBondContact O-CZ2 3.27Å; T537-W723 PolarHBondContact O-NE1 3.07Å; T537-W723 PolarHBondContact OG1-NE1 3.2Å; Y538-W723 HydrophobicContact CD2-CB 3.89Å; Y538-W723 AromaticContact CD2-CD1 3.93Å; Y538-W723 AromaticContact CD2-CD2 3.66Å; Y538-W723 HydrophobicContact CD2-CD2 3.66Å; Y538-W723 HydrophobicContact CD2-CE3 4.11Å; Y538-W723 AromaticContact CD2-CG 3.55Å; Y538-W723 HydrophobicContact CD2-CG 3.55Å; Y538-W723 HydrophobicContact CE2-CB 3.82Å; Y538-W723 HydrophobicContact CE2-CD2 4.27Å; Y538-W723 HydrophobicContact CE2-CE3 4.48Å; Y538-W723 AromaticContact CE2-CG 3.99Å; Y538-W723 HydrophobicContact CE2-CG 3.99Å; A540-W723 HydrophobicContact CB-CB 4.24Å; V603-W723 HydrophobicContact CG1-CH2 3.85Å; V603-W723 HydrophobicContact CG1-CZ3 4.18Å; L606-W723 HydrophobicContact CD2-CE3 4.37Å; L606-W723 HydrophobicContact CD2-CH2 4.02Å; L606-W723 HydrophobicContact CD2-CZ3 3.5Å; L606-W723 VanDerWaalsContact CD2-CZ3 3.5Å; Q607-W723 HydrophobicContact CG-CE3 3.62Å; Q607-W723 HydrophobicContact CG-CZ3 3.62Å; Q607-W723 PolarHBondContact NE2-O 2.96Å; L610-W723 HydrophobicContact CD1-CE3 4.07Å; L610-W723 HydrophobicContact CD1-CZ3 4.39Å; T721-W723 PolarHBondContact O-N 2.84Å; W723-P725 HydrophobicContact CH2-CB 4.33Å; W723-P725 HydrophobicContact CZ2-CB 3.75Å
724	D	87.2	Confident	83.3	Confident	119 Å²	119	81.8 Å²	81.8	64%	0.636	42%	0.424	S	S	*	.			trans	-112.4	115.9	168.7	-177.2	-1.3	0	0	0	109	S722 G726	S722-D724 PolarHBondContact O-N 3.44Å; D724-G726 PolarHBondContact O-N 3.29Å; D724-G726 VanDerWaalsContact O-N 3.12Å; D724-G726 PolarHBondContact OD1-N 2.96Å; D724-G726 VanDerWaalsContact OD1-N 3.15Å
725	P	79.7	Confident	82.8	Confident	18 Å²	18	82.5 Å²	82.5	12%	0.117	43%	0.43	C	S	.	.			trans	-68.9	-8.1	-176.2	29.6	-37.4	0	0	0	114	I534 V603 Q607 W723 F727	I534-P725 HydrophobicContact CG2-CB 4.11Å; V603-P725 HydrophobicContact CG1-CB 4.31Å; V603-P725 HydrophobicContact CG1-CG 4Å; Q607-P725 VanDerWaalsContact NE2-CD 3.34Å; W723-P725 HydrophobicContact CH2-CB 4.33Å; W723-P725 HydrophobicContact CZ2-CB 3.75Å; P725-F727 HydrophobicContact CB-CD1 3.92Å; P725-F727 HydrophobicContact CB-CE1 3.52Å; P725-F727 HydrophobicContact CB-CZ 4.07Å; P725-F727 HydrophobicContact CG-CD1 4.34Å; P725-F727 HydrophobicContact CG-CE1 3.93Å; P725-F727 HydrophobicContact CG-CE2 4.47Å; P725-F727 HydrophobicContact CG-CZ 4.01Å
726	G	73.1	Confident	82.3	Confident	49 Å²	49	80.8 Å²	80.8	51%	0.505	43%	0.429	S	S	.	.			trans	81.3	17.3	168.1	0	0	0	0	0	115.8	D724	D724-G726 PolarHBondContact O-N 3.29Å; D724-G726 VanDerWaalsContact O-N 3.12Å; D724-G726 PolarHBondContact OD1-N 2.96Å; D724-G726 VanDerWaalsContact OD1-N 3.15Å
727	F	68.5	Low	82	Confident	91 Å²	91	74.3 Å²	74.3	40%	0.399	40%	0.403	S	S	.	.			trans	-126.6	0	176.4	60.7	-109.3	0	0	0	113.8	H238 A239 A240 I534 Y600 V603 P725	H238-F727 AromaticContact CE1-CD2 3.19Å; H238-F727 WeakPolarHBondContact CE1-CD2 3.38Å; H238-F727 AromaticContact CE1-CE2 3.88Å; H238-F727 AromaticContact CE1-CG 3.4Å; H238-F727 VanDerWaalsContact CE1-CG 3.4Å; H238-F727 WeakPolarHBondContact CE1-CG 3.45Å; H238-F727 AromaticContact NE2-CD2 3.46Å; H238-F727 WeakPolarHBondContact NE2-CD2 3.33Å; H238-F727 AromaticContact NE2-CG 3.97Å; A239-F727 HydrophobicContact CB-CB 3.77Å; A240-F727 HydrophobicContact CB-CD1 4.5Å; I534-F727 HydrophobicContact CB-CE1 4.44Å; I534-F727 HydrophobicContact CD1-CE1 3.7Å; I534-F727 HydrophobicContact CD1-CZ 4.1Å; I534-F727 HydrophobicContact CG1-CD1 4.4Å; I534-F727 HydrophobicContact CG1-CE1 3.69Å; I534-F727 HydrophobicContact CG2-CE1 3.87Å; Y600-F727 HydrophobicContact CD1-CD2 4.11Å; Y600-F727 AromaticContact CD1-CE2 3.51Å; Y600-F727 HydrophobicContact CD1-CE2 3.51Å; Y600-F727 HydrophobicContact CD1-CZ 4.32Å; Y600-F727 HydrophobicContact CE1-CD2 4.36Å; Y600-F727 HydrophobicContact CE1-CE2 4.12Å; V603-F727 HydrophobicContact CB-CZ 4.19Å; V603-F727 HydrophobicContact CG1-CZ 4.02Å; V603-F727 HydrophobicContact CG2-CZ 4.02Å; P725-F727 HydrophobicContact CB-CD1 3.92Å; P725-F727 HydrophobicContact CB-CE1 3.52Å; P725-F727 HydrophobicContact CB-CZ 4.07Å; P725-F727 HydrophobicContact CG-CD1 4.34Å; P725-F727 HydrophobicContact CG-CE1 3.93Å; P725-F727 HydrophobicContact CG-CE2 4.47Å; P725-F727 HydrophobicContact CG-CZ 4.01Å

Retrieved 727 of 727 residues in 1614 ms (Link to these results)

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