A0A093H9I0_STRCA 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 A0A093H9I0, Species STRCA (Struthio camelus australis), Gene n/a, Length 726 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	42.7	Very low	45.5	Very low	241 Å²	241	131.1 Å²	131.1	100%	1.187	68%	0.676	S	S	*	*				0	72.6	0	-60.8	166	173.5	0	0	108.1
2	S	44.2	Very low	45.8	Very low	103 Å²	103	130 Å²	130	72%	0.72	67%	0.671	S	S	*	*				68.3	112	53.8	-163.4	0	0	0	0	114.4	G4	S2-G4 PolarHBondContact O-N 3.07Å; S2-G4 VanDerWaalsContact O-N 3.07Å
3	R	37.2	Very low	46.3	Very low	207 Å²	207	127 Å²	127	78%	0.781	66%	0.662	S	S	*	*	S	Bend	trans	66.7	-17.2	162	-65.3	178.3	175.5	177.5	-2.2	121
4	G	43.1	Very low	46.3	Very low	56 Å²	56	127.6 Å²	127.6	58%	0.577	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-33.6	-179.1	0	0	0	0	0	116.8	S2	S2-G4 PolarHBondContact O-N 3.07Å; S2-G4 VanDerWaalsContact O-N 3.07Å
5	L	46.7	Very low	46.1	Very low	140 Å²	140	126.8 Å²	126.8	73%	0.733	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-27.9	-172.8	-85.7	155.5	0	0	0	114.2	L7 K8	L5-L7 PolarHBondContact O-N 3.22Å; L5-K8 PolarHBondContact O-N 3.49Å
6	I	49.2	Very low	46	Very low	109 Å²	109	128 Å²	128	56%	0.559	66%	0.657	S	S	*	*	H	α-helix	trans	-66.3	-40.8	-177.2	-63.3	170.4	0	0	0	110.6	K8 L9 E10	I6-K8 PolarHBondContact O-N 3.2Å; I6-L9 PolarHBondContact O-N 3.14Å; I6-L9 VanDerWaalsContact O-N 3.14Å; I6-E10 PolarHBondContact O-N 3.17Å
7	L	44.5	Very low	45.7	Very low	106 Å²	106	124.9 Å²	124.9	56%	0.555	65%	0.649	S	S	*	*	H	α-helix	trans	-65.8	-14.8	176.9	-77.9	162.1	0	0	0	114.6	L5 N11	L5-L7 PolarHBondContact O-N 3.22Å; L7-N11 PolarHBondContact O-ND2 2.8Å
8	K	48.7	Very low	45.4	Very low	156 Å²	156	120.9 Å²	120.9	68%	0.678	64%	0.637	S	S	*	*	H	α-helix	trans	-87.9	-25.3	173.5	-77.1	-171.9	174.4	-177.3	0	113.2	L5 I6	L5-K8 PolarHBondContact O-N 3.49Å; I6-K8 PolarHBondContact O-N 3.2Å
9	L	51.2	Low	45.1	Very low	116 Å²	116	118.6 Å²	118.6	61%	0.607	63%	0.631	S	S	*	*	H	α-helix	trans	-82.7	-40	177	-90.8	151.5	0	0	0	112.2	I6 N11 L12 V13	I6-L9 PolarHBondContact O-N 3.14Å; I6-L9 VanDerWaalsContact O-N 3.14Å; L9-N11 VanDerWaalsContact C-N 3.29Å; L9-N11 PolarHBondContact O-N 3.45Å; L9-L12 PolarHBondContact O-N 3.11Å; L9-L12 VanDerWaalsContact O-N 3.11Å; L9-V13 PolarHBondContact O-N 3.36Å
10	E	47.4	Very low	45	Very low	112 Å²	112	123.2 Å²	123.2	52%	0.523	64%	0.639	S	S	.	*	H	α-helix	trans	-60.1	-39.4	175.1	-69.5	179.4	144.3	0	0	112	I6 L12 V13 Q14	I6-E10 PolarHBondContact O-N 3.17Å; E10-L12 PolarHBondContact O-N 3.47Å; E10-V13 PolarHBondContact O-N 3.07Å; E10-Q14 WeakPolarHBondContact O-CB 3.45Å; E10-Q14 WeakPolarHBondContact O-CG 3.4Å; E10-Q14 PolarHBondContact O-N 3.04Å
11	N	46	Very low	44.7	Very low	96 Å²	96	124.9 Å²	124.9	51%	0.513	64%	0.644	S	S	.	*	H	α-helix	trans	-66	-33.1	175.1	-84.3	-60.2	0	0	0	113.4	L7 L9 L15	L7-N11 PolarHBondContact O-ND2 2.8Å; L9-N11 VanDerWaalsContact C-N 3.29Å; L9-N11 PolarHBondContact O-N 3.45Å; N11-L15 WeakPolarHBondContact O-CB 3.33Å; N11-L15 PolarHBondContact O-N 2.95Å
12	L	48.9	Very low	44.3	Very low	118 Å²	118	120.5 Å²	120.5	62%	0.618	62%	0.624	S	S	*	*	H	α-helix	trans	-72.9	-40.1	176.4	-95	161.6	0	0	0	112.2	L9 E10 L15 H16	L9-L12 PolarHBondContact O-N 3.11Å; L9-L12 VanDerWaalsContact O-N 3.11Å; E10-L12 PolarHBondContact O-N 3.47Å; L12-L15 PolarHBondContact O-N 3.02Å; L12-H16 PolarHBondContact O-N 3.37Å
13	V	52	Low	43.9	Very low	91 Å²	91	124 Å²	124	55%	0.552	63%	0.629	S	S	*	*	H	α-helix	trans	-68.7	-38.2	175.9	177.2	0	0	0	0	111.1	L9 E10 H16 C17	L9-V13 PolarHBondContact O-N 3.36Å; E10-V13 PolarHBondContact O-N 3.07Å; V13-H16 PolarHBondContact O-N 3.05Å; V13-C17 WeakPolarHBondContact O-CB 3.46Å; V13-C17 PolarHBondContact O-N 3.06Å
14	Q	46.5	Very low	43.9	Very low	136 Å²	136	119.6 Å²	119.6	64%	0.636	63%	0.625	S	S	*	*	H	α-helix	trans	-65.3	-39.3	172.9	-75.1	-172.4	0.2	0	0	112.7	E10 H16 C17 A18	E10-Q14 WeakPolarHBondContact O-CB 3.45Å; E10-Q14 WeakPolarHBondContact O-CG 3.4Å; E10-Q14 PolarHBondContact O-N 3.04Å; Q14-H16 PolarHBondContact O-N 3.49Å; Q14-C17 PolarHBondContact O-N 3.38Å; Q14-A18 WeakPolarHBondContact O-CB 3.49Å; Q14-A18 PolarHBondContact O-N 3.39Å
15	L	43.9	Very low	43.3	Very low	115 Å²	115	125 Å²	125	60%	0.602	64%	0.64	S	S	*	*	H	α-helix	trans	-61.3	-42.9	173.8	-118.8	140.8	0	0	0	111.8	N11 L12 A18 C19	N11-L15 WeakPolarHBondContact O-CB 3.33Å; N11-L15 PolarHBondContact O-N 2.95Å; L12-L15 PolarHBondContact O-N 3.02Å; L15-A18 PolarHBondContact O-N 3.39Å; L15-C19 PolarHBondContact O-N 3.34Å
16	H	43.6	Very low	42.5	Very low	146 Å²	146	122.8 Å²	122.8	68%	0.676	64%	0.636	S	S	*	*	H	α-helix	trans	-71	-31	-179.5	-145.7	-45.1	0	0	0	113.2	L12 V13 Q14	L12-H16 PolarHBondContact O-N 3.37Å; V13-H16 PolarHBondContact O-N 3.05Å; Q14-H16 PolarHBondContact O-N 3.49Å
17	C	41.1	Very low	41.4	Very low	76 Å²	76	128.8 Å²	128.8	51%	0.514	65%	0.653	S	S	.	*	H	α-helix	trans	-75	-37.8	171.6	-79.3	0	0	0	0	112.8	V13 Q14 R20 Q21	V13-C17 WeakPolarHBondContact O-CB 3.46Å; V13-C17 PolarHBondContact O-N 3.06Å; Q14-C17 PolarHBondContact O-N 3.38Å; C17-R20 WeakPolarHBondContact O-CB 3.48Å; C17-R20 PolarHBondContact O-N 3.23Å; C17-R20 VanDerWaalsContact O-N 3.09Å; C17-Q21 PolarHBondContact O-N 3.25Å
18	A	39.8	Very low	40.5	Very low	52 Å²	52	133.7 Å²	133.7	43%	0.43	67%	0.665	S	S	.	*	H	α-helix	trans	-63.1	-41.7	175.2	0	0	0	0	0	112	Q14 L15 R20 Q21 L22	Q14-A18 WeakPolarHBondContact O-CB 3.49Å; Q14-A18 PolarHBondContact O-N 3.39Å; L15-A18 PolarHBondContact O-N 3.39Å; A18-R20 PolarHBondContact O-N 3.1Å; A18-Q21 PolarHBondContact O-N 2.88Å; A18-Q21 VanDerWaalsContact O-N 3.12Å; A18-L22 PolarHBondContact O-N 3.12Å
19	C	41.1	Very low	39.4	Very low	78 Å²	78	135 Å²	135	53%	0.527	67%	0.67	S	S	.	*	H	α-helix	trans	-63.5	-22.9	172.9	-74.1	0	0	0	0	113.7	L15	L15-C19 PolarHBondContact O-N 3.34Å
20	R	43.1	Very low	38.2	Very low	210 Å²	210	134.6 Å²	134.6	79%	0.792	67%	0.672	S	S	*	*	H	α-helix	trans	-79.9	-22.2	173.9	-116.4	178.9	-178.5	176.2	1.6	113.6	C17 A18	C17-R20 WeakPolarHBondContact O-CB 3.48Å; C17-R20 PolarHBondContact O-N 3.23Å; C17-R20 VanDerWaalsContact O-N 3.09Å; A18-R20 PolarHBondContact O-N 3.1Å
21	Q	37.6	Very low	37.2	Very low	159 Å²	159	138.8 Å²	138.8	74%	0.743	69%	0.685	S	S	*	*	H	α-helix	trans	-90.9	-15.6	178.2	-69.9	-169.3	-15.2	0	0	114.2	C17 A18	C17-Q21 PolarHBondContact O-N 3.25Å; A18-Q21 PolarHBondContact O-N 2.88Å; A18-Q21 VanDerWaalsContact O-N 3.12Å
22	L	35.5	Very low	36.3	Very low	148 Å²	148	145.9 Å²	145.9	78%	0.775	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-1.5	178.5	-77.7	170.4	0	0	0	115.4	A18	A18-L22 PolarHBondContact O-N 3.12Å
23	H	34.2	Very low	35.3	Very low	178 Å²	178	144.3 Å²	144.3	82%	0.824	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	6.2	174.5	-99.5	-66.7	0	0	0	115
24	T	38.4	Very low	34	Very low	113 Å²	113	147.7 Å²	147.7	69%	0.693	72%	0.718	S	S	*	*			trans	-124.4	62.4	176.6	54.3	0	0	0	0	112.7
25	L	29.2	Very low	32.9	Very low	169 Å²	169	152.5 Å²	152.5	89%	0.885	73%	0.73	S	S	*	*			trans	-139.8	142.6	155.3	-102.2	170.5	0	0	0	111.4
26	S	29.6	Very low	32	Very low	94 Å²	94	155.8 Å²	155.8	66%	0.657	74%	0.74	S	S	*	*			trans	-68.8	150.3	-169.6	51.9	0	0	0	0	114.6
27	Y	27.2	Very low	31.3	Very low	235 Å²	235	154.8 Å²	154.8	92%	0.922	75%	0.746	S	S	*	*				-151.2	159.5	123.9	-119.8	-85.1	0	0	0	112.8
28	R	24.8	Very low	30.6	Very low	210 Å²	210	158 Å²	158	79%	0.792	76%	0.763	S	S	*	*			trans	-134.9	138.8	-165	-178.2	-168.9	-166.1	-170.6	7.8	108.2
29	K	26	Very low	29.9	Very low	182 Å²	182	164.4 Å²	164.4	79%	0.791	79%	0.785	S	S	*	*			trans	63.3	158.1	174.8	-73.7	175	173.9	-173.9	0	113.5
30	V	26.8	Very low	29.1	Very low	108 Å²	108	166.2 Å²	166.2	66%	0.655	80%	0.798	S	S	*	*			cis	-141.1	-175.7	-4	-118.2	0	0	0	0	106.8
31	Y	26.8	Very low	28.3	Very low	201 Å²	201	161.6 Å²	161.6	79%	0.788	80%	0.798	S	S	*	*			cis	-148.9	171.9	9	-117.5	-58.9	0	0	0	109.8
32	R	26.2	Very low	27.7	Very low	245 Å²	245	157.8 Å²	157.8	93%	0.925	79%	0.794	S	S	*	*			trans	-127.5	138.3	145	-90	-178.8	171.5	175.1	-3.5	107.2
33	A	27.1	Very low	27.3	Very low	84 Å²	84	161.6 Å²	161.6	69%	0.694	80%	0.799	S	S	*	*			trans	-155.7	142.8	171.8	0	0	0	0	0	106.1
34	Q	25	Very low	27.8	Very low	162 Å²	162	157.8 Å²	157.8	76%	0.757	79%	0.791	S	S	*	*			cis	-142	175.1	-6.6	-101.3	161.4	-5.9	0	0	105.4
35	W	24.4	Very low	27.1	Very low	237 Å²	237	159.2 Å²	159.2	90%	0.898	79%	0.791	S	S	*	*				-170	168.8	74.6	-94.2	73.4	0	0	0	110.4
36	K	25.5	Very low	26.8	Very low	184 Å²	184	161.8 Å²	161.8	80%	0.8	79%	0.789	S	S	*	*			trans	-82.7	156.7	-155.3	-56.3	173.3	-179.8	176.3	0	115.6
37	P	27.7	Very low	26.5	Very low	125 Å²	125	161.5 Å²	161.5	81%	0.812	79%	0.787	S	S	*	*			trans	-84.4	155.1	156.3	35.8	-32.3	0	0	0	111.9
38	V	25.5	Very low	26.4	Very low	144 Å²	144	156.4 Å²	156.4	87%	0.873	78%	0.78	S	S	*	*			trans	-126.4	156.4	169.3	175.5	0	0	0	0	109.1
39	Q	25.2	Very low	26.3	Very low	187 Å²	187	153.7 Å²	153.7	87%	0.874	78%	0.776	S	S	*	*			trans	-79.7	152.4	-160.2	-55.1	165	-47.2	0	0	115.9
40	S	24.8	Very low	26.4	Very low	116 Å²	116	153.3 Å²	153.3	81%	0.811	78%	0.782	S	S	*	*				-178.8	161.4	121.4	66.9	0	0	0	0	108.5
41	S	26.1	Very low	26.4	Very low	113 Å²	113	157.4 Å²	157.4	79%	0.79	79%	0.787	S	S	*	*			cis	-163	157.3	-28.3	45	0	0	0	0	107
42	A	26.1	Very low	26.9	Very low	79 Å²	79	152.7 Å²	152.7	65%	0.653	78%	0.781	S	S	*	*			trans	-74.8	158.5	-177.5	0	0	0	0	0	113.7
43	Y	27	Very low	26.9	Very low	227 Å²	227	148.7 Å²	148.7	89%	0.89	77%	0.772	S	S	*	*				-179.8	163.6	100.1	-96.6	-84	0	0	0	111
44	P	44.9	Very low	26.8	Very low	99 Å²	99	153.2 Å²	153.2	64%	0.643	78%	0.777	S	S	*	*			trans	-121.6	-159.5	-161.4	44.8	-33.2	0	0	0	115.3
45	M	23.3	Very low	26.7	Very low	142 Å²	142	156.7 Å²	156.7	70%	0.7	78%	0.783	S	S	*	*			trans	83.2	148.1	175.3	-68.1	-172.6	-73.1	0	0	115.8
46	W	22.7	Very low	26.8	Very low	224 Å²	224	154.8 Å²	154.8	85%	0.848	78%	0.784	S	S	*	*			cis	-152.8	-175.5	2.4	-127.4	-11.5	0	0	0	113.4
47	S	23.3	Very low	26.7	Very low	88 Å²	88	149.7 Å²	149.7	62%	0.615	78%	0.776	S	S	*	*			trans	-23.6	167.3	164.3	50.5	0	0	0	0	119.1
48	V	25.6	Very low	26.5	Very low	127 Å²	127	149.3 Å²	149.3	77%	0.77	77%	0.768	S	S	*	*				-158.4	153.3	53.7	174.2	0	0	0	0	113.1
49	H	23.1	Very low	26.4	Very low	153 Å²	153	150.3 Å²	150.3	71%	0.708	76%	0.76	S	S	*	*			trans	-44.5	162.1	167.4	-60.1	-67	0	0	0	117.3
50	L	27.2	Very low	26.4	Very low	174 Å²	174	148.1 Å²	148.1	91%	0.911	75%	0.754	S	S	*	*				-152	164.7	117	-106.7	161.8	0	0	0	111.3
51	Y	26.5	Very low	26.5	Very low	195 Å²	195	150.3 Å²	150.3	77%	0.765	76%	0.755	S	S	*	*			trans	-92.6	168.9	-150.8	-109.1	-121.3	0	0	0	115.8
52	P	38.5	Very low	26.2	Very low	102 Å²	102	150.6 Å²	150.6	66%	0.662	76%	0.757	S	S	*	*			trans	-103.5	-166.4	-173.2	42.5	-34	0	0	0	113.1
53	Q	26.2	Very low	26.2	Very low	160 Å²	160	153.6 Å²	153.6	75%	0.748	77%	0.767	S	S	*	*			trans	115.7	146.9	170.9	-69.6	174.4	-3	0	0	112.9
54	F	23.9	Very low	26	Very low	179 Å²	179	147.2 Å²	147.2	79%	0.785	76%	0.761	S	S	*	*			cis	-137	162	4.8	-119.9	-69.6	0	0	0	111.5
55	W	24.1	Very low	24.9	Very low	235 Å²	235	147.8 Å²	147.8	89%	0.89	77%	0.767	S	S	*	*			trans	-78	148.4	172	-90.2	43.4	0	0	0	113.1
56	Q	25	Very low	25.6	Very low	197 Å²	197	146 Å²	146	92%	0.921	77%	0.766	S	S	*	*				-155.7	147.6	126.8	-113.2	171.5	8.1	0	0	112
57	A	24.5	Very low	25.6	Very low	77 Å²	77	145.7 Å²	145.7	64%	0.636	77%	0.765	S	S	*	*			trans	-78.3	172.5	179.2	0	0	0	0	0	110.6
58	D	23.7	Very low	25.7	Very low	117 Å²	117	150.2 Å²	150.2	63%	0.626	77%	0.769	S	S	*	*			cis	-167.8	161.9	35.3	-154.8	6.7	0	0	0	113
59	K	23.5	Very low	25.7	Very low	165 Å²	165	154.4 Å²	154.4	72%	0.717	77%	0.771	S	S	*	*			trans	65.7	127.9	152.6	-82.1	161.5	-171.3	133.8	0	124.6
60	L	24.9	Very low	25.8	Very low	142 Å²	142	156.4 Å²	156.4	74%	0.743	78%	0.781	S	S	*	*			trans	90.6	86.7	140.3	-67.1	168	0	0	0	121.2
61	I	25.9	Very low	25.8	Very low	162 Å²	162	156.4 Å²	156.4	83%	0.831	78%	0.781	S	S	*	*				45.9	102.1	128.8	-52.7	171.4	0	0	0	117
62	S	21.1	Very low	25.8	Very low	118 Å²	118	151.3 Å²	151.3	83%	0.825	78%	0.779	S	S	*	*			trans	-141.3	157.5	150.3	58.3	0	0	0	0	112.4
63	V	24.8	Very low	25.4	Very low	143 Å²	143	153.1 Å²	153.1	87%	0.867	79%	0.788	S	S	*	*			trans	-57	145.1	-172.8	-178.3	0	0	0	0	114.5
64	A	22.5	Very low	25.5	Very low	92 Å²	92	155.4 Å²	155.4	76%	0.76	80%	0.796	S	S	*	*			trans	150.4	130.7	133.4	0	0	0	0	0	115.7
65	S	23.4	Very low	25.7	Very low	111 Å²	111	155 Å²	155	78%	0.776	80%	0.797	S	S	*	*			trans	-59.9	-168.4	162.8	56.1	0	0	0	0	115.6
66	P	37	Very low	25.9	Very low	104 Å²	104	153.3 Å²	153.3	68%	0.675	80%	0.798	S	S	*	*				-134.3	174.3	-52.4	33	-14.7	0	0	0	112.8
67	R	23.4	Very low	26.1	Very low	219 Å²	219	152.7 Å²	152.7	83%	0.826	79%	0.793	S	S	*	*			trans	151	151.3	130.4	-85.4	177.2	174	-177.4	-0.9	116.7
68	Y	24.2	Very low	26.7	Very low	182 Å²	182	158.8 Å²	158.8	71%	0.714	81%	0.805	S	S	*	*			trans	67.3	102.1	157.3	-79.7	-66.9	0	0	0	122.9
69	R	25.9	Very low	27	Very low	215 Å²	215	162.9 Å²	162.9	81%	0.811	82%	0.817	S	S	*	*			trans	27.8	118.2	133.3	-66.4	-179.4	175.6	163.8	-1.3	118.6
70	H	25.3	Very low	27.3	Very low	196 Å²	196	162.2 Å²	162.2	91%	0.907	82%	0.821	S	S	*	*				-132.1	133.6	128.9	-104.1	-81.5	0	0	0	111.9
71	L	28	Very low	27.8	Very low	173 Å²	173	167.4 Å²	167.4	91%	0.906	83%	0.831	S	S	*	*			trans	-78.7	126.5	165.6	-74.5	152.5	0	0	0	108.4
72	A	26.4	Very low	28	Very low	88 Å²	88	168.9 Å²	168.9	73%	0.727	83%	0.831	S	S	*	*			trans	-154.2	106.5	162.6	0	0	0	0	0	111.3
73	T	29.2	Very low	28.5	Very low	141 Å²	141	172.8 Å²	172.8	87%	0.865	83%	0.833	S	S	*	*			trans	25.6	112.6	143.1	52.8	0	0	0	0	118.7
74	K	28.3	Very low	28.8	Very low	208 Å²	208	173.7 Å²	173.7	90%	0.904	83%	0.832	S	S	*	*			trans	-140.2	129	146.3	-117.9	168.6	-173.3	170	0	111.7
75	E	28.6	Very low	29.3	Very low	171 Å²	171	174 Å²	174	80%	0.799	83%	0.827	S	S	*	*			trans	-54.1	141	-167.6	-57.4	155.7	133.6	0	0	114.2	K77	E75-K77 VanDerWaalsContact C-N 3.35Å; E75-K77 PolarHBondContact O-N 2.98Å
76	E	27.7	Very low	30.3	Very low	199 Å²	199	177.2 Å²	177.2	93%	0.93	83%	0.834	S	S	*	*			trans	-67.2	88.3	170.9	-69.2	-170.5	139.3	0	0	111.3	K78	E76-K78 PolarHBondContact O-N 3.14Å
77	K	29.9	Very low	30.6	Very low	183 Å²	183	177.9 Å²	177.9	80%	0.796	84%	0.837	S	S	*	*			trans	-64.2	106.5	162.7	-77.6	-172.4	176	-178.5	0	109.2	E75 K79	E75-K77 VanDerWaalsContact C-N 3.35Å; E75-K77 PolarHBondContact O-N 2.98Å; K77-K79 PolarHBondContact O-N 2.94Å
78	K	36.9	Very low	32.1	Very low	205 Å²	205	176.3 Å²	176.3	89%	0.891	84%	0.836	S	S	*	*			trans	-41.4	105.4	166	-81.6	178.4	173.9	173.4	0	110.6	E76	E76-K78 PolarHBondContact O-N 3.14Å
79	K	30.8	Very low	33.8	Very low	204 Å²	204	168.8 Å²	168.8	89%	0.887	81%	0.814	S	S	*	*			trans	-92	127.5	161.7	-87.7	-178.2	174.2	175.4	0	108.5	K77	K77-K79 PolarHBondContact O-N 2.94Å
80	N	29.7	Very low	36	Very low	150 Å²	150	163.6 Å²	163.6	80%	0.802	80%	0.799	S	S	*	*			trans	-50	139.7	178.8	-74.6	-27	0	0	0	111.8	K82	N80-K82 VanDerWaalsContact C-N 3.26Å; N80-K82 PolarHBondContact O-N 2.71Å
81	R	34.4	Very low	38.5	Very low	252 Å²	252	154.4 Å²	154.4	95%	0.951	76%	0.757	S	S	*	*			trans	-59.8	91.4	159.5	-83.1	-179	166.2	177.8	-5.7	108.4	K83	R81-K83 PolarHBondContact O-N 2.87Å
82	K	30.8	Very low	40.9	Very low	192 Å²	192	152 Å²	152	84%	0.835	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-62.4	124.5	159.7	-74	-172.6	173.7	-173.2	0	106.6	N80 L84	N80-K82 VanDerWaalsContact C-N 3.26Å; N80-K82 PolarHBondContact O-N 2.71Å; K82-L84 PolarHBondContact O-N 2.96Å
83	K	31.1	Very low	43.2	Very low	200 Å²	200	148 Å²	148	87%	0.87	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-56.1	129.4	160.2	-71.9	-178.8	175.6	-178.4	0	106.6	R81	R81-K83 PolarHBondContact O-N 2.87Å
84	L	30.5	Very low	45.2	Very low	162 Å²	162	148.4 Å²	148.4	85%	0.848	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-59.6	127.2	170.7	-79.9	136.7	0	0	0	107.7	K82	K82-L84 PolarHBondContact O-N 2.96Å
85	P	34.4	Very low	46.8	Very low	98 Å²	98	144.4 Å²	144.4	64%	0.636	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-65	143.9	167.2	28.9	-32.4	0	0	0	108.4	T87	P85-T87 VanDerWaalsContact C-N 3.29Å; P85-T87 PolarHBondContact O-N 3.1Å
86	L	42.8	Very low	48.8	Very low	179 Å²	179	144 Å²	144	94%	0.937	67%	0.673	S	S	*	*			trans	-67.1	93.6	168.1	-79.5	92.7	0	0	0	108.4	K88	L86-K88 PolarHBondContact O-N 3.1Å
87	T	45.3	Very low	51.1	Low	118 Å²	118	134.9 Å²	134.9	72%	0.724	63%	0.63	S	S	*	*			trans	-70.1	126.3	170.8	44.2	0	0	0	0	108.9	P85 G89	P85-T87 VanDerWaalsContact C-N 3.29Å; P85-T87 PolarHBondContact O-N 3.1Å; T87-G89 VanDerWaalsContact C-N 3.29Å; T87-G89 PolarHBondContact O-N 3.24Å
88	K	53.1	Low	53.6	Low	186 Å²	186	127.3 Å²	127.3	81%	0.809	60%	0.599	S	S	*	*			trans	-65.1	92.6	165.3	-70.9	-178.8	177.1	179.8	0	107.9	L86	L86-K88 PolarHBondContact O-N 3.1Å
89	G	61.6	Low	55.7	Low	25 Å²	25	117.5 Å²	117.5	26%	0.258	56%	0.557	S	S	.	*			trans	-63.3	144.8	178	0	0	0	0	0	111.5	T87 M147 K148	T87-G89 VanDerWaalsContact C-N 3.29Å; T87-G89 PolarHBondContact O-N 3.24Å; G89-M147 WeakPolarHBondContact O-CB 3.33Å; G89-K148 PolarHBondContact O-N 3.33Å
90	E	71.1	Confident	58.1	Low	105 Å²	105	110.9 Å²	110.9	49%	0.491	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	128.9	161.3	-57	-164	146.9	0	0	107.6	K148 K150	E90-K148 CarbonylContact C-O 3.52Å; E90-K148 WeakPolarHBondContact CA-O 3.36Å; E90-K148 HydrophobicContact CG-CB 4.25Å; E90-K150 VanDerWaalsContact OE2-CE 3.22Å; E90-K150 WeakPolarHBondContact OE2-CE 3.29Å; E90-K150 IonicContact OE2-NZ 2.68Å; E90-K150 PolarHBondContact OE2-NZ 2.94Å
91	V	78.2	Confident	60.5	Low	4 Å²	4	107.7 Å²	107.7	2%	0.024	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129	-179.1	-176.2	0	0	0	0	108.6	I93 L102 A105 M106 V142 M147 K148 Y149 K150	V91-I93 PolarHBondContact O-N 3.09Å; V91-L102 HydrophobicContact CG1-CD1 4.49Å; V91-A105 HydrophobicContact CG1-CB 4.02Å; V91-M106 HydrophobicContact CG1-CG 4.23Å; V91-M106 HydrophobicContact CG2-CG 4Å; V91-V142 HydrophobicContact CB-CG1 4.11Å; V91-V142 HydrophobicContact CB-CG2 4.32Å; V91-V142 HydrophobicContact CG1-CG2 4.27Å; V91-V142 HydrophobicContact CG2-CG1 4.08Å; V91-V142 HydrophobicContact CG2-CG2 4.5Å; V91-M147 HydrophobicContact CG2-CB 4.19Å; V91-M147 HydrophobicContact CG2-CE 4.19Å; V91-M147 HydrophobicContact CG2-SD 3.98Å; V91-K148 PolarHBondContact N-O 3.35Å; V91-Y149 CarbonylContact O-C 3.54Å; V91-Y149 WeakPolarHBondContact O-CA 3.37Å; V91-K150 PolarHBondContact O-N 2.88Å
92	E	77.3	Confident	62.8	Low	123 Å²	123	95.7 Å²	95.7	58%	0.575	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	117.8	173.7	-67.1	-172.8	168	0	0	109.7	K150	E92-K150 CarbonylContact C-O 3.6Å; E92-K150 WeakPolarHBondContact CA-O 3.29Å
93	I	76.3	Confident	65.3	Low	3 Å²	3	86.7 Å²	86.7	2%	0.015	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	122	175.1	-64.9	179.1	0	0	0	108.7	V91 M97 E135 I138 K139 Y149 K150 A152	V91-I93 PolarHBondContact O-N 3.09Å; I93-M97 HydrophobicContact CB-CE 4.43Å; I93-M97 HydrophobicContact CG1-CE 4.48Å; I93-M97 HydrophobicContact CG2-CE 4.42Å; I93-E135 HydrophobicContact CG2-CG 3.92Å; I93-I138 HydrophobicContact CD1-CG2 3.75Å; I93-I138 HydrophobicContact CG1-CG2 3.77Å; I93-I138 HydrophobicContact CG2-CG2 4.04Å; I93-K139 HydrophobicContact CD1-CB 4.46Å; I93-K139 HydrophobicContact CD1-CG 3.76Å; I93-Y149 HydrophobicContact CD1-CD1 4.33Å; I93-Y149 HydrophobicContact CD1-CD2 3.75Å; I93-Y149 HydrophobicContact CD1-CG 3.57Å; I93-Y149 HydrophobicContact CG1-CG 4.43Å; I93-K150 PolarHBondContact N-O 3.25Å; I93-A152 PolarHBondContact O-N 2.95Å
94	R	69.8	Low	67.7	Low	150 Å²	150	85.2 Å²	85.2	57%	0.566	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-98.1	151.9	164.7	-58.1	176.1	-179.3	-178.2	-1.8	109	K96 M97	R94-K96 PolarHBondContact O-N 3.2Å; R94-M97 HydrophobicContact CB-CG 4.15Å
95	Q	63.8	Low	70.1	Confident	123 Å²	123	79.8 Å²	79.8	58%	0.575	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	128.9	170.9	-71.2	178.6	-26.4	0	0	109	E135	Q95-E135 VanDerWaalsContact CG-OE2 3.3Å; Q95-E135 WeakPolarHBondContact CG-OE2 3.45Å; Q95-E135 PolarHBondContact NE2-OE2 3.3Å
96	K	69.4	Low	72.2	Confident	162 Å²	162	75.8 Å²	75.8	70%	0.704	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	62.9	-176.4	-53.5	178.6	-177.4	179.6	0	115.1	R94 I132	R94-K96 PolarHBondContact O-N 3.2Å; K96-I132 HydrophobicContact CB-CG2 3.61Å; K96-I132 HydrophobicContact CG-CG2 4.07Å
97	M	75.8	Confident	73.9	Confident	8 Å²	8	70.6 Å²	70.6	4%	0.039	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	147	164.2	-81.4	-169.9	-69.6	0	0	111.5	I93 R94 E101 L102 L133 I138	I93-M97 HydrophobicContact CB-CE 4.43Å; I93-M97 HydrophobicContact CG1-CE 4.48Å; I93-M97 HydrophobicContact CG2-CE 4.42Å; R94-M97 HydrophobicContact CB-CG 4.15Å; M97-E101 HydrophobicContact CB-CB 4.37Å; M97-E101 HydrophobicContact CG-CB 4.37Å; M97-L102 HydrophobicContact CE-CD1 3.95Å; M97-L133 PolarHBondContact O-N 3.18Å; M97-I138 HydrophobicContact CB-CD1 4.02Å; M97-I138 HydrophobicContact CE-CD1 4.5Å; M97-I138 HydrophobicContact CE-CG2 3.99Å
98	T	83.2	Confident	75.7	Confident	24 Å²	24	68.2 Å²	68.2	15%	0.147	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	165.1	167	69.1	0	0	0	0	111.8	E100 E101 L102 D130 S131 I132	T98-E100 PolarHBondContact O-N 3.16Å; T98-E101 PolarHBondContact O-N 2.84Å; T98-E101 WeakPolarHBondContact OG1-CG 3.01Å; T98-E101 PolarHBondContact OG1-N 2.98Å; T98-L102 WeakPolarHBondContact O-CB 3.08Å; T98-L102 PolarHBondContact O-N 3.14Å; T98-D130 WeakPolarHBondContact CG2-O 3.29Å; T98-S131 VanDerWaalsContact CA-O 3.29Å; T98-S131 WeakPolarHBondContact CA-O 3.48Å; T98-I132 HydrophobicContact CG2-CG1 4.35Å
99	V	80.4	Confident	77.1	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-55.1	-42.8	173.1	-169.4	0	0	0	0	110.7	L102 A103 I110 I113 F114 P129 S131 L133	V99-L102 PolarHBondContact O-N 3.32Å; V99-A103 WeakPolarHBondContact O-CB 3.48Å; V99-A103 PolarHBondContact O-N 3.09Å; V99-I110 HydrophobicContact CG1-CG2 4.02Å; V99-I113 HydrophobicContact CG1-CB 4.18Å; V99-I113 HydrophobicContact CG1-CG2 3.77Å; V99-F114 HydrophobicContact CG1-CZ 4.41Å; V99-P129 WeakPolarHBondContact CB-O 3.38Å; V99-P129 PolarHBondContact N-O 3.48Å; V99-S131 PolarHBondContact N-O 3.26Å; V99-L133 HydrophobicContact CG2-CD1 4.13Å; V99-L133 HydrophobicContact CG2-CD2 4.27Å; V99-L133 HydrophobicContact CG2-CG 4.13Å
100	E	80.6	Confident	77.9	Confident	65 Å²	65	66.8 Å²	66.8	30%	0.304	33%	0.33	S	S	.	.	H	α-helix	trans	-69.4	-39.1	-178.9	-129.4	-156	-148.3	0	0	113.5	T98 A103 R104 I110 P129	T98-E100 PolarHBondContact O-N 3.16Å; E100-A103 PolarHBondContact O-N 3.21Å; E100-R104 WeakPolarHBondContact O-CG 3.21Å; E100-R104 PolarHBondContact O-N 2.97Å; E100-R104 VanDerWaalsContact O-N 3.09Å; E100-R104 IonicContact OE2-CZ 3.57Å; E100-R104 IonicContact OE2-NE 3.52Å; E100-R104 IonicContact OE2-NH2 2.73Å; E100-R104 PolarHBondContact OE2-NH2 2.83Å; E100-I110 HydrophobicContact CG-CD1 3.59Å; E100-I110 HydrophobicContact CG-CG1 4.12Å; E100-P129 PolarHBondContact N-O 3.28Å
101	E	81	Confident	78.3	Confident	82 Å²	82	67.4 Å²	67.4	38%	0.383	34%	0.337	S	S	.	.	H	α-helix	trans	-66.6	-40.2	174.5	-73.8	-173.9	155	0	0	111.7	M97 T98 R104 A105	M97-E101 HydrophobicContact CB-CB 4.37Å; M97-E101 HydrophobicContact CG-CB 4.37Å; T98-E101 PolarHBondContact O-N 2.84Å; T98-E101 WeakPolarHBondContact OG1-CG 3.01Å; T98-E101 PolarHBondContact OG1-N 2.98Å; E101-R104 PolarHBondContact O-N 3.47Å; E101-A105 WeakPolarHBondContact O-CB 3.38Å; E101-A105 PolarHBondContact O-N 3.35Å
102	L	82.6	Confident	78.3	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-64.5	-40.5	175.6	-176.4	58.3	0	0	0	111.5	V91 M97 T98 V99 R104 A105 M106 I113 L133 I138 I141 V142	V91-L102 HydrophobicContact CG1-CD1 4.49Å; M97-L102 HydrophobicContact CE-CD1 3.95Å; T98-L102 WeakPolarHBondContact O-CB 3.08Å; T98-L102 PolarHBondContact O-N 3.14Å; V99-L102 PolarHBondContact O-N 3.32Å; L102-R104 PolarHBondContact O-N 3.13Å; L102-A105 PolarHBondContact O-N 2.79Å; L102-M106 HydrophobicContact CD1-CG 4.08Å; L102-M106 HydrophobicContact CD1-SD 3.77Å; L102-M106 HydrophobicContact CD2-SD 4.27Å; L102-M106 HydrophobicContact CG-CG 4.41Å; L102-M106 HydrophobicContact CG-SD 3.66Å; L102-M106 VanDerWaalsContact O-CB 3.26Å; L102-M106 WeakPolarHBondContact O-CB 3.46Å; L102-M106 VanDerWaalsContact O-CG 3.24Å; L102-M106 WeakPolarHBondContact O-CG 3.36Å; L102-M106 PolarHBondContact O-N 2.93Å; L102-I113 HydrophobicContact CB-CD1 3.86Å; L102-I113 HydrophobicContact CD2-CD1 3.99Å; L102-I113 HydrophobicContact CG-CD1 3.66Å; L102-L133 HydrophobicContact CD2-CD1 3.98Å; L102-I138 HydrophobicContact CD1-CG2 3.7Å; L102-I138 HydrophobicContact CD2-CB 4.42Å; L102-I138 HydrophobicContact CD2-CG1 4.24Å; L102-I138 HydrophobicContact CD2-CG2 4Å; L102-I138 HydrophobicContact CG-CG2 4.48Å; L102-I141 HydrophobicContact CD2-CB 4.45Å; L102-I141 HydrophobicContact CD2-CD1 3.97Å; L102-I141 HydrophobicContact CD2-CG2 4.2Å; L102-V142 HydrophobicContact CD1-CG2 4.07Å
103	A	82.8	Confident	78.3	Confident	3 Å²	3	64 Å²	64	3%	0.025	32%	0.32	C	S	.	.	H	α-helix	trans	-59.4	-47.4	175.3	0	0	0	0	0	111.2	V99 E100 M106 G107 K108 I110 I113	V99-A103 WeakPolarHBondContact O-CB 3.48Å; V99-A103 PolarHBondContact O-N 3.09Å; E100-A103 PolarHBondContact O-N 3.21Å; A103-M106 PolarHBondContact O-N 3.42Å; A103-G107 PolarHBondContact O-N 3.32Å; A103-K108 CarbonylContact C-O 3.55Å; A103-K108 PolarHBondContact O-N 2.81Å; A103-K108 VanDerWaalsContact O-N 3.07Å; A103-K108 VanDerWaalsContact O-O 3.12Å; A103-I110 HydrophobicContact CB-CG1 4.1Å; A103-I113 VanDerWaalsContact CA-CD1 3.46Å; A103-I113 HydrophobicContact CB-CD1 3.78Å
104	R	82.4	Confident	78.3	Confident	169 Å²	169	66.4 Å²	66.4	64%	0.638	33%	0.331	S	S	*	.	H	α-helix	trans	-62.2	-43.9	175.3	-71.8	-173.5	-107.8	155.3	-7.5	112.3	E100 E101 L102 M106 G107	E100-R104 WeakPolarHBondContact O-CG 3.21Å; E100-R104 PolarHBondContact O-N 2.97Å; E100-R104 VanDerWaalsContact O-N 3.09Å; E100-R104 IonicContact OE2-CZ 3.57Å; E100-R104 IonicContact OE2-NE 3.52Å; E100-R104 IonicContact OE2-NH2 2.73Å; E100-R104 PolarHBondContact OE2-NH2 2.83Å; E101-R104 PolarHBondContact O-N 3.47Å; L102-R104 PolarHBondContact O-N 3.13Å; R104-M106 VanDerWaalsContact C-N 3.32Å; R104-M106 PolarHBondContact O-N 2.64Å; R104-G107 PolarHBondContact O-N 2.97Å
105	A	80.8	Confident	78.5	Confident	49 Å²	49	64.7 Å²	64.7	41%	0.405	33%	0.329	S	S	.	.	H	α-helix	trans	-66.4	-31.8	177.3	0	0	0	0	0	113.1	V91 E101 L102	V91-A105 HydrophobicContact CG1-CB 4.02Å; E101-A105 WeakPolarHBondContact O-CB 3.38Å; E101-A105 PolarHBondContact O-N 3.35Å; L102-A105 PolarHBondContact O-N 2.79Å
106	M	77.4	Confident	78.9	Confident	13 Å²	13	59.5 Å²	59.5	6%	0.064	31%	0.307	C	S	.	.	H	α-helix	trans	-80.8	-14.2	174.8	-74.7	173.5	68.2	0	0	113.5	V91 L102 A103 R104 K108 I113 I141 V142 S145 M147	V91-M106 HydrophobicContact CG1-CG 4.23Å; V91-M106 HydrophobicContact CG2-CG 4Å; L102-M106 HydrophobicContact CD1-CG 4.08Å; L102-M106 HydrophobicContact CD1-SD 3.77Å; L102-M106 HydrophobicContact CD2-SD 4.27Å; L102-M106 HydrophobicContact CG-CG 4.41Å; L102-M106 HydrophobicContact CG-SD 3.66Å; L102-M106 VanDerWaalsContact O-CB 3.26Å; L102-M106 WeakPolarHBondContact O-CB 3.46Å; L102-M106 VanDerWaalsContact O-CG 3.24Å; L102-M106 WeakPolarHBondContact O-CG 3.36Å; L102-M106 PolarHBondContact O-N 2.93Å; A103-M106 PolarHBondContact O-N 3.42Å; R104-M106 VanDerWaalsContact C-N 3.32Å; R104-M106 PolarHBondContact O-N 2.64Å; M106-K108 VanDerWaalsContact C-N 3.32Å; M106-K108 HydrophobicContact CB-CG 4.47Å; M106-I113 HydrophobicContact SD-CD1 3.94Å; M106-I113 HydrophobicContact SD-CG1 4.27Å; M106-I141 HydrophobicContact CE-CG2 3.96Å; M106-I141 HydrophobicContact SD-CG2 4.02Å; M106-V142 HydrophobicContact CG-CG2 4.42Å; M106-V142 HydrophobicContact SD-CG2 4.09Å; M106-S145 VanDerWaalsContact CE-CB 3.48Å; M106-S145 WeakPolarHBondContact CE-OG 3.43Å; M106-M147 HydrophobicContact CB-CE 3.81Å; M106-M147 HydrophobicContact CE-CE 3.42Å; M106-M147 VanDerWaalsContact CE-CE 3.42Å; M106-M147 HydrophobicContact CG-CE 3.69Å; M106-M147 HydrophobicContact SD-CE 4.34Å
107	G	79.6	Confident	79	Confident	70 Å²	70	52 Å²	52	72%	0.722	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	33.9	-174.1	0	0	0	0	0	113.2	A103 R104	A103-G107 PolarHBondContact O-N 3.32Å; R104-G107 PolarHBondContact O-N 2.97Å
108	K	82.3	Confident	78.6	Confident	69 Å²	69	56.6 Å²	56.6	30%	0.3	30%	0.299	S	S	.	.	S	Bend	trans	-130.9	161.2	-177	-63.9	-170.4	-176.9	-175.9	0	111.2	A103 M106 H112 S145 M147	A103-K108 CarbonylContact C-O 3.55Å; A103-K108 PolarHBondContact O-N 2.81Å; A103-K108 VanDerWaalsContact O-N 3.07Å; A103-K108 VanDerWaalsContact O-O 3.12Å; M106-K108 VanDerWaalsContact C-N 3.32Å; M106-K108 HydrophobicContact CB-CG 4.47Å; K108-H112 HydrophobicContact CB-CB 4.38Å; K108-H112 HydrophobicContact CD-CB 4.5Å; K108-H112 WeakPolarHBondContact CD-CD2 3.44Å; K108-H112 PolarHBondContact NZ-CD2 2.82Å; K108-H112 PolarHBondContact NZ-NE2 3.48Å; K108-S145 PolarHBondContact NZ-O 2.89Å; K108-M147 HydrophobicContact CD-CE 4.48Å
109	D	82.1	Confident	77.7	Confident	131 Å²	131	64.5 Å²	64.5	70%	0.701	33%	0.328	S	S	*	.			trans	-70.4	151.9	175.5	-60.7	-42.5	0	0	0	111.5	D111 H112	D109-D111 PolarHBondContact O-N 3.48Å; D109-H112 WeakPolarHBondContact O-CB 2.94Å; D109-H112 PolarHBondContact O-N 3.32Å
110	I	79.5	Confident	76.8	Confident	49 Å²	49	65.5 Å²	65.5	25%	0.251	33%	0.334	S	S	.	.	H	α-helix	trans	-58.4	-38.6	-177.2	-51.7	168.6	0	0	0	110.8	V99 E100 A103 H112 I113 F114	V99-I110 HydrophobicContact CG1-CG2 4.02Å; E100-I110 HydrophobicContact CG-CD1 3.59Å; E100-I110 HydrophobicContact CG-CG1 4.12Å; A103-I110 HydrophobicContact CB-CG1 4.1Å; I110-H112 PolarHBondContact O-N 2.9Å; I110-H112 VanDerWaalsContact O-N 3.14Å; I110-I113 PolarHBondContact O-N 3.32Å; I110-F114 HydrophobicContact CG2-CD2 3.94Å; I110-F114 HydrophobicContact CG2-CE2 3.52Å; I110-F114 HydrophobicContact CG2-CZ 4.39Å; I110-F114 PolarHBondContact O-N 3.34Å
111	D	78.5	Confident	75.7	Confident	119 Å²	119	71 Å²	71	64%	0.636	37%	0.365	S	S	*	.	H	α-helix	trans	-52.5	-35.2	175.4	-62.2	-16.7	0	0	0	112.5	D109 I113 F114 E115	D109-D111 PolarHBondContact O-N 3.48Å; D111-I113 VanDerWaalsContact C-N 3.29Å; D111-I113 PolarHBondContact O-N 2.97Å; D111-F114 PolarHBondContact O-N 2.81Å; D111-E115 WeakPolarHBondContact O-CB 3.44Å; D111-E115 WeakPolarHBondContact O-CG 3.2Å; D111-E115 PolarHBondContact O-N 3Å
112	H	78.1	Confident	74.6	Confident	55 Å²	55	69.7 Å²	69.7	26%	0.255	36%	0.36	S	S	.	.	H	α-helix	trans	-70.1	-26.4	178.6	-173.1	68.6	0	0	0	113	K108 D109 I110 E115 A116 S145	K108-H112 HydrophobicContact CB-CB 4.38Å; K108-H112 HydrophobicContact CD-CB 4.5Å; K108-H112 WeakPolarHBondContact CD-CD2 3.44Å; K108-H112 PolarHBondContact NZ-CD2 2.82Å; K108-H112 PolarHBondContact NZ-NE2 3.48Å; D109-H112 WeakPolarHBondContact O-CB 2.94Å; D109-H112 PolarHBondContact O-N 3.32Å; I110-H112 PolarHBondContact O-N 2.9Å; I110-H112 VanDerWaalsContact O-N 3.14Å; H112-E115 IonicContact ND1-OE2 3.31Å; H112-A116 VanDerWaalsContact O-CB 3.29Å; H112-A116 WeakPolarHBondContact O-CB 3.34Å; H112-A116 PolarHBondContact O-N 2.96Å; H112-S145 PolarHBondContact NE2-OG 2.95Å; H112-S145 VanDerWaalsContact NE2-OG 3.1Å
113	I	77.1	Confident	73.3	Confident	0 Å²	0	77 Å²	77	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-77.3	-40.9	174	-63.8	-172	0	0	0	110	V99 L102 A103 M106 I110 D111 A116 L117 I141	V99-I113 HydrophobicContact CG1-CB 4.18Å; V99-I113 HydrophobicContact CG1-CG2 3.77Å; L102-I113 HydrophobicContact CB-CD1 3.86Å; L102-I113 HydrophobicContact CD2-CD1 3.99Å; L102-I113 HydrophobicContact CG-CD1 3.66Å; A103-I113 VanDerWaalsContact CA-CD1 3.46Å; A103-I113 HydrophobicContact CB-CD1 3.78Å; M106-I113 HydrophobicContact SD-CD1 3.94Å; M106-I113 HydrophobicContact SD-CG1 4.27Å; I110-I113 PolarHBondContact O-N 3.32Å; D111-I113 VanDerWaalsContact C-N 3.29Å; D111-I113 PolarHBondContact O-N 2.97Å; I113-A116 PolarHBondContact O-N 3.37Å; I113-L117 HydrophobicContact CG2-CD1 3.97Å; I113-L117 HydrophobicContact CG2-CG 4.42Å; I113-L117 WeakPolarHBondContact O-CB 3.31Å; I113-L117 WeakPolarHBondContact O-CG 3.15Å; I113-L117 PolarHBondContact O-N 2.72Å; I113-I141 HydrophobicContact CG1-CG2 4.42Å; I113-I141 HydrophobicContact CG2-CD1 4.1Å; I113-I141 HydrophobicContact CG2-CG2 4.26Å
114	F	76.4	Confident	72	Confident	53 Å²	53	80.5 Å²	80.5	23%	0.232	41%	0.414	C	S	.	.	H	α-helix	trans	-61.1	-42.9	170.9	-70.1	-59.9	0	0	0	111.8	V99 I110 D111 A116 L117 L118 L127	V99-F114 HydrophobicContact CG1-CZ 4.41Å; I110-F114 HydrophobicContact CG2-CD2 3.94Å; I110-F114 HydrophobicContact CG2-CE2 3.52Å; I110-F114 HydrophobicContact CG2-CZ 4.39Å; I110-F114 PolarHBondContact O-N 3.34Å; D111-F114 PolarHBondContact O-N 2.81Å; F114-A116 PolarHBondContact O-N 2.81Å; F114-L117 PolarHBondContact O-N 3.27Å; F114-L118 VanDerWaalsContact O-CG 3.31Å; F114-L118 WeakPolarHBondContact O-CG 3.42Å; F114-L118 PolarHBondContact O-N 3.24Å; F114-L127 HydrophobicContact CE1-CB 4.41Å
115	E	74.6	Confident	70.7	Confident	114 Å²	114	76.3 Å²	76.3	53%	0.533	42%	0.423	S	S	.	.	H	α-helix	trans	-58.5	-45.1	171.1	-77.5	-176.8	164.2	0	0	112.5	D111 H112 L117 L118 Y119	D111-E115 WeakPolarHBondContact O-CB 3.44Å; D111-E115 WeakPolarHBondContact O-CG 3.2Å; D111-E115 PolarHBondContact O-N 3Å; H112-E115 IonicContact ND1-OE2 3.31Å; E115-L117 VanDerWaalsContact C-N 3.31Å; E115-L117 PolarHBondContact O-N 3.35Å; E115-L118 PolarHBondContact O-N 3.47Å; E115-Y119 WeakPolarHBondContact O-CD2 3.26Å
116	A	72.5	Confident	69.4	Low	14 Å²	14	79 Å²	79	12%	0.116	44%	0.439	C	S	.	.	H	α-helix	trans	-67.1	-33.6	179.5	0	0	0	0	0	112.6	H112 I113 F114 I141	H112-A116 VanDerWaalsContact O-CB 3.29Å; H112-A116 WeakPolarHBondContact O-CB 3.34Å; H112-A116 PolarHBondContact O-N 2.96Å; I113-A116 PolarHBondContact O-N 3.37Å; F114-A116 PolarHBondContact O-N 2.81Å; A116-I141 HydrophobicContact CB-CG2 4.15Å
117	L	71.7	Confident	68.6	Low	4 Å²	4	80.9 Å²	80.9	2%	0.021	45%	0.449	C	S	.	.	H	α-helix	trans	-68.7	-41.9	172.5	-79	166.5	0	0	0	111.4	I113 F114 E115 Y119 T120 F124 I141	I113-L117 HydrophobicContact CG2-CD1 3.97Å; I113-L117 HydrophobicContact CG2-CG 4.42Å; I113-L117 WeakPolarHBondContact O-CB 3.31Å; I113-L117 WeakPolarHBondContact O-CG 3.15Å; I113-L117 PolarHBondContact O-N 2.72Å; F114-L117 PolarHBondContact O-N 3.27Å; E115-L117 VanDerWaalsContact C-N 3.31Å; E115-L117 PolarHBondContact O-N 3.35Å; L117-Y119 PolarHBondContact O-N 3.09Å; L117-T120 WeakPolarHBondContact O-CB 3.48Å; L117-T120 PolarHBondContact O-N 2.85Å; L117-T120 PolarHBondContact O-OG1 3.07Å; L117-F124 HydrophobicContact CB-CE1 3.62Å; L117-F124 HydrophobicContact CB-CZ 3.67Å; L117-F124 WeakPolarHBondContact O-CZ 3.47Å; L117-I141 HydrophobicContact CD1-CD1 4.47Å; L117-I141 HydrophobicContact CD2-CD1 3.85Å; L117-I141 HydrophobicContact CD2-CG1 4.17Å; L117-I141 HydrophobicContact CG-CD1 4Å; L117-I141 HydrophobicContact CG-CG1 4.25Å
118	L	67.1	Low	68	Low	105 Å²	105	84.4 Å²	84.4	55%	0.55	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-15.9	-176.8	-80.6	168.3	0	0	0	114.9	F114 E115 F124	F114-L118 VanDerWaalsContact O-CG 3.31Å; F114-L118 WeakPolarHBondContact O-CG 3.42Å; F114-L118 PolarHBondContact O-N 3.24Å; E115-L118 PolarHBondContact O-N 3.47Å; L118-F124 VanDerWaalsContact CA-CZ 3.49Å; L118-F124 HydrophobicContact CB-CZ 4.49Å; L118-F124 HydrophobicContact CD2-CD1 3.77Å; L118-F124 HydrophobicContact CD2-CD2 3.79Å; L118-F124 HydrophobicContact CD2-CE1 3.99Å; L118-F124 HydrophobicContact CD2-CE2 4.02Å; L118-F124 HydrophobicContact CD2-CG 3.73Å; L118-F124 HydrophobicContact CD2-CZ 4.17Å; L118-F124 HydrophobicContact CG-CD1 4.23Å; L118-F124 HydrophobicContact CG-CE1 4.04Å; L118-F124 HydrophobicContact CG-CZ 4.3Å
119	Y	63.6	Low	67.1	Low	190 Å²	190	83.7 Å²	83.7	75%	0.745	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	21.2	173.2	-60.3	-79.6	0	0	0	114	E115 L117	E115-Y119 WeakPolarHBondContact O-CD2 3.26Å; L117-Y119 PolarHBondContact O-N 3.09Å
120	T	61.9	Low	66.5	Low	22 Å²	22	83.1 Å²	83.1	14%	0.135	45%	0.446	C	S	.	.	S	Bend	trans	-124.3	148.6	172.5	71	0	0	0	0	110.3	L117 I122 L140	L117-T120 WeakPolarHBondContact O-CB 3.48Å; L117-T120 PolarHBondContact O-N 2.85Å; L117-T120 PolarHBondContact O-OG1 3.07Å; T120-I122 PolarHBondContact O-N 2.85Å; T120-L140 HydrophobicContact CG2-CD2 3.72Å; T120-L140 HydrophobicContact CG2-CG 4.42Å
121	D	57	Low	66.3	Low	179 Å²	179	82 Å²	82	96%	0.957	44%	0.443	S	S	*	.	S	Bend	trans	-76.2	54.1	-169.9	-52	-62.3	0	0	0	114.2
122	I	59	Low	66.3	Low	55 Å²	55	81.3 Å²	81.3	28%	0.282	44%	0.438	S	S	.	.	S	Bend	trans	-122.8	140	-175.3	-52.9	176.1	0	0	0	109.5	T120 F124 Y137	T120-I122 PolarHBondContact O-N 2.85Å; I122-F124 WeakPolarHBondContact O-CD2 3.5Å; I122-F124 WeakPolarHBondContact O-CE2 3.4Å; I122-F124 PolarHBondContact O-N 2.87Å; I122-Y137 HydrophobicContact CD1-CD1 3.67Å; I122-Y137 HydrophobicContact CD1-CE1 3.46Å; I122-Y137 VanDerWaalsContact CD1-CE1 3.46Å; I122-Y137 HydrophobicContact CD1-CG 4.41Å; I122-Y137 HydrophobicContact CG1-CE1 4.47Å
123	D	55.2	Low	66.1	Low	155 Å²	155	79 Å²	79	83%	0.829	43%	0.428	S	S	*	.			trans	-72.1	117.7	178.2	-89	-44.1	0	0	0	112.4	G125	D123-G125 PolarHBondContact O-N 2.87Å; D123-G125 VanDerWaalsContact O-N 3.1Å
124	F	55.8	Low	66.1	Low	76 Å²	76	84.2 Å²	84.2	33%	0.333	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-73.8	4.2	-173.5	-82.2	-84.1	0	0	0	116.1	L117 L118 I122 S126	L117-F124 HydrophobicContact CB-CE1 3.62Å; L117-F124 HydrophobicContact CB-CZ 3.67Å; L117-F124 WeakPolarHBondContact O-CZ 3.47Å; L118-F124 VanDerWaalsContact CA-CZ 3.49Å; L118-F124 HydrophobicContact CB-CZ 4.49Å; L118-F124 HydrophobicContact CD2-CD1 3.77Å; L118-F124 HydrophobicContact CD2-CD2 3.79Å; L118-F124 HydrophobicContact CD2-CE1 3.99Å; L118-F124 HydrophobicContact CD2-CE2 4.02Å; L118-F124 HydrophobicContact CD2-CG 3.73Å; L118-F124 HydrophobicContact CD2-CZ 4.17Å; L118-F124 HydrophobicContact CG-CD1 4.23Å; L118-F124 HydrophobicContact CG-CE1 4.04Å; L118-F124 HydrophobicContact CG-CZ 4.3Å; I122-F124 WeakPolarHBondContact O-CD2 3.5Å; I122-F124 WeakPolarHBondContact O-CE2 3.4Å; I122-F124 PolarHBondContact O-N 2.87Å; F124-S126 PolarHBondContact O-N 3.44Å
125	G	54.3	Low	66	Low	80 Å²	80	84.1 Å²	84.1	83%	0.825	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-73	-12.9	-162.1	0	0	0	0	0	117.3	D123	D123-G125 PolarHBondContact O-N 2.87Å; D123-G125 VanDerWaalsContact O-N 3.1Å
126	S	54.6	Low	66.1	Low	105 Å²	105	84 Å²	84	73%	0.734	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-148.6	15.3	-164.3	64.2	0	0	0	0	117.1	F124 E128	F124-S126 PolarHBondContact O-N 3.44Å; S126-E128 PolarHBondContact O-N 3.21Å
127	L	60.1	Low	66.3	Low	54 Å²	54	88.2 Å²	88.2	28%	0.283	47%	0.473	S	S	.	.			trans	-90.3	103.1	-179.3	-71.3	169.2	0	0	0	112	F114 S131	F114-L127 HydrophobicContact CE1-CB 4.41Å; L127-S131 WeakPolarHBondContact CD2-OG 3.47Å
128	E	66.1	Low	66.6	Low	144 Å²	144	88 Å²	88	67%	0.673	47%	0.472	S	S	*	.			trans	-79.9	159	168.8	-64.8	-172.2	160.7	0	0	111.6	S126 D130 S131	S126-E128 PolarHBondContact O-N 3.21Å; E128-D130 PolarHBondContact O-N 3.06Å; E128-D130 VanDerWaalsContact O-N 3.13Å; E128-S131 VanDerWaalsContact O-CB 3.26Å; E128-S131 WeakPolarHBondContact O-CB 3.35Å; E128-S131 PolarHBondContact O-N 3.42Å; E128-S131 PolarHBondContact O-OG 2.95Å
129	P	64.6	Low	67.3	Low	53 Å²	53	84.8 Å²	84.8	34%	0.344	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-27.8	-177.5	-26.4	35.9	0	0	0	115.2	V99 E100 S131	V99-P129 WeakPolarHBondContact CB-O 3.38Å; V99-P129 PolarHBondContact N-O 3.48Å; E100-P129 PolarHBondContact N-O 3.28Å; P129-S131 VanDerWaalsContact C-N 3.33Å
130	D	70.1	Confident	68	Low	119 Å²	119	79 Å²	79	64%	0.636	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-0.7	178.9	-64.1	-31	0	0	0	113.2	T98 E128 I132	T98-D130 WeakPolarHBondContact CG2-O 3.29Å; E128-D130 PolarHBondContact O-N 3.06Å; E128-D130 VanDerWaalsContact O-N 3.13Å; D130-I132 PolarHBondContact O-N 3.46Å
131	S	75.3	Confident	68.8	Low	27 Å²	27	78.2 Å²	78.2	19%	0.189	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-64.9	134.2	176.8	61.1	0	0	0	0	111.5	T98 V99 L127 E128 P129	T98-S131 VanDerWaalsContact CA-O 3.29Å; T98-S131 WeakPolarHBondContact CA-O 3.48Å; V99-S131 PolarHBondContact N-O 3.26Å; L127-S131 WeakPolarHBondContact CD2-OG 3.47Å; E128-S131 VanDerWaalsContact O-CB 3.26Å; E128-S131 WeakPolarHBondContact O-CB 3.35Å; E128-S131 PolarHBondContact O-N 3.42Å; E128-S131 PolarHBondContact O-OG 2.95Å; P129-S131 VanDerWaalsContact C-N 3.33Å
132	I	76.6	Confident	70	Confident	103 Å²	103	69.7 Å²	69.7	53%	0.528	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	127.6	178.4	-61.6	173.8	0	0	0	108.6	K96 T98 D130	K96-I132 HydrophobicContact CB-CG2 3.61Å; K96-I132 HydrophobicContact CG-CG2 4.07Å; T98-I132 HydrophobicContact CG2-CG1 4.35Å; D130-I132 PolarHBondContact O-N 3.46Å
133	L	75.2	Confident	71	Confident	8 Å²	8	73 Å²	73	4%	0.042	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	139.3	175.9	-63.2	175.9	0	0	0	111.1	M97 V99 L102 I138 I141	M97-L133 PolarHBondContact O-N 3.18Å; V99-L133 HydrophobicContact CG2-CD1 4.13Å; V99-L133 HydrophobicContact CG2-CD2 4.27Å; V99-L133 HydrophobicContact CG2-CG 4.13Å; L102-L133 HydrophobicContact CD2-CD1 3.98Å; L133-I138 HydrophobicContact CB-CD1 4.13Å; L133-I138 HydrophobicContact CB-CG1 3.73Å; L133-I138 HydrophobicContact CD1-CG1 4.45Å; L133-I138 WeakPolarHBondContact O-CD1 3.28Å; L133-I141 HydrophobicContact CD1-CD1 3.88Å
134	D	75.8	Confident	72.1	Confident	109 Å²	109	72 Å²	72	58%	0.583	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-66.7	150.7	171	-67.2	-49.5	0	0	0	112.1	D136 Y137 I138	D134-D136 PolarHBondContact O-N 2.91Å; D134-D136 VanDerWaalsContact O-N 3.08Å; D134-Y137 HydrophobicContact CB-CD2 3.68Å; D134-Y137 HydrophobicContact CB-CE2 3.93Å; D134-Y137 PolarHBondContact O-N 3.33Å; D134-Y137 VanDerWaalsContact O-N 3.07Å; D134-I138 WeakPolarHBondContact O-CG1 3.48Å; D134-I138 PolarHBondContact O-N 3.23Å; D134-I138 VanDerWaalsContact O-N 3.09Å
135	E	74.7	Confident	73	Confident	50 Å²	50	69.4 Å²	69.4	23%	0.234	38%	0.376	C	S	.	.	H	α-helix	trans	-57	-32.1	-172.3	-150.7	-164.4	114.6	0	0	112.8	I93 Q95 K139	I93-E135 HydrophobicContact CG2-CG 3.92Å; Q95-E135 VanDerWaalsContact CG-OE2 3.3Å; Q95-E135 WeakPolarHBondContact CG-OE2 3.45Å; Q95-E135 PolarHBondContact NE2-OE2 3.3Å; E135-K139 WeakPolarHBondContact O-CD 3.34Å; E135-K139 WeakPolarHBondContact O-CG 3.31Å; E135-K139 PolarHBondContact O-N 3.46Å; E135-K139 WeakPolarHBondContact OE1-CE 3.36Å; E135-K139 IonicContact OE1-NZ 3.66Å; E135-K139 PolarHBondContact OE1-NZ 2.86Å
136	D	76.4	Confident	74	Confident	113 Å²	113	68 Å²	68	60%	0.604	36%	0.361	S	S	*	.	H	α-helix	trans	-77.1	-33.5	-179.2	-67.8	-24.2	0	0	0	113.2	D134 K139 L140	D134-D136 PolarHBondContact O-N 2.91Å; D134-D136 VanDerWaalsContact O-N 3.08Å; D136-K139 PolarHBondContact O-N 3.41Å; D136-K139 IonicContact OD1-NZ 3.47Å; D136-K139 PolarHBondContact OD1-NZ 3.3Å; D136-L140 WeakPolarHBondContact O-CB 3.44Å; D136-L140 PolarHBondContact O-N 3.14Å
137	Y	77.9	Confident	75.3	Confident	101 Å²	101	64.2 Å²	64.2	40%	0.396	33%	0.332	S	S	.	.	H	α-helix	trans	-67.2	-43.1	169.9	-56.7	-51.9	0	0	0	110.7	I122 D134 K139 L140 I141	I122-Y137 HydrophobicContact CD1-CD1 3.67Å; I122-Y137 HydrophobicContact CD1-CE1 3.46Å; I122-Y137 VanDerWaalsContact CD1-CE1 3.46Å; I122-Y137 HydrophobicContact CD1-CG 4.41Å; I122-Y137 HydrophobicContact CG1-CE1 4.47Å; D134-Y137 HydrophobicContact CB-CD2 3.68Å; D134-Y137 HydrophobicContact CB-CE2 3.93Å; D134-Y137 PolarHBondContact O-N 3.33Å; D134-Y137 VanDerWaalsContact O-N 3.07Å; Y137-K139 PolarHBondContact O-N 3.29Å; Y137-L140 PolarHBondContact O-N 3.01Å; Y137-L140 VanDerWaalsContact O-N 3.09Å; Y137-I141 WeakPolarHBondContact O-CD1 3.46Å; Y137-I141 VanDerWaalsContact O-CG1 3.26Å; Y137-I141 WeakPolarHBondContact O-CG1 3.43Å; Y137-I141 PolarHBondContact O-N 2.99Å
138	I	78	Confident	76.1	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-57.6	-47.5	175.3	-60.7	168.9	0	0	0	110.6	I93 M97 L102 L133 D134 L140 I141 V142	I93-I138 HydrophobicContact CD1-CG2 3.75Å; I93-I138 HydrophobicContact CG1-CG2 3.77Å; I93-I138 HydrophobicContact CG2-CG2 4.04Å; M97-I138 HydrophobicContact CB-CD1 4.02Å; M97-I138 HydrophobicContact CE-CD1 4.5Å; M97-I138 HydrophobicContact CE-CG2 3.99Å; L102-I138 HydrophobicContact CD1-CG2 3.7Å; L102-I138 HydrophobicContact CD2-CB 4.42Å; L102-I138 HydrophobicContact CD2-CG1 4.24Å; L102-I138 HydrophobicContact CD2-CG2 4Å; L102-I138 HydrophobicContact CG-CG2 4.48Å; L133-I138 HydrophobicContact CB-CD1 4.13Å; L133-I138 HydrophobicContact CB-CG1 3.73Å; L133-I138 HydrophobicContact CD1-CG1 4.45Å; L133-I138 WeakPolarHBondContact O-CD1 3.28Å; D134-I138 WeakPolarHBondContact O-CG1 3.48Å; D134-I138 PolarHBondContact O-N 3.23Å; D134-I138 VanDerWaalsContact O-N 3.09Å; I138-L140 VanDerWaalsContact C-N 3.31Å; I138-L140 PolarHBondContact O-N 2.89Å; I138-I141 PolarHBondContact O-N 2.83Å; I138-V142 HydrophobicContact CG2-CG2 4.48Å; I138-V142 VanDerWaalsContact O-CG2 3.31Å; I138-V142 WeakPolarHBondContact O-CG2 3.46Å; I138-V142 PolarHBondContact O-N 3.12Å
139	K	80.2	Confident	76.8	Confident	37 Å²	37	65.6 Å²	65.6	16%	0.161	33%	0.332	C	S	.	.	H	α-helix	trans	-58.8	-40.6	175.1	-71.1	163.8	-159.2	154.5	0	112.2	I93 E135 D136 Y137 K143 Y149	I93-K139 HydrophobicContact CD1-CB 4.46Å; I93-K139 HydrophobicContact CD1-CG 3.76Å; E135-K139 WeakPolarHBondContact O-CD 3.34Å; E135-K139 WeakPolarHBondContact O-CG 3.31Å; E135-K139 PolarHBondContact O-N 3.46Å; E135-K139 WeakPolarHBondContact OE1-CE 3.36Å; E135-K139 IonicContact OE1-NZ 3.66Å; E135-K139 PolarHBondContact OE1-NZ 2.86Å; D136-K139 PolarHBondContact O-N 3.41Å; D136-K139 IonicContact OD1-NZ 3.47Å; D136-K139 PolarHBondContact OD1-NZ 3.3Å; Y137-K139 PolarHBondContact O-N 3.29Å; K139-K143 WeakPolarHBondContact O-CB 3.29Å; K139-K143 VanDerWaalsContact O-CG 3.24Å; K139-K143 WeakPolarHBondContact O-CG 3.35Å; K139-K143 PolarHBondContact O-N 2.83Å; K139-Y149 HydrophobicContact CB-CE1 4.25Å; K139-Y149 HydrophobicContact CD-CE2 4.26Å; K139-Y149 HydrophobicContact CG-CD2 4.27Å; K139-Y149 HydrophobicContact CG-CE1 4.18Å; K139-Y149 HydrophobicContact CG-CE2 3.89Å
140	L	78.3	Confident	77.3	Confident	70 Å²	70	68.6 Å²	68.6	37%	0.366	34%	0.34	S	S	.	.	H	α-helix	trans	-68.4	-46	-178.5	-173.4	60.5	0	0	0	111.8	T120 D136 Y137 I138 K143 K144	T120-L140 HydrophobicContact CG2-CD2 3.72Å; T120-L140 HydrophobicContact CG2-CG 4.42Å; D136-L140 WeakPolarHBondContact O-CB 3.44Å; D136-L140 PolarHBondContact O-N 3.14Å; Y137-L140 PolarHBondContact O-N 3.01Å; Y137-L140 VanDerWaalsContact O-N 3.09Å; I138-L140 VanDerWaalsContact C-N 3.31Å; I138-L140 PolarHBondContact O-N 2.89Å; L140-K143 PolarHBondContact O-N 2.81Å; L140-K144 HydrophobicContact CD1-CG 4.41Å; L140-K144 WeakPolarHBondContact O-CB 3.47Å; L140-K144 VanDerWaalsContact O-CG 3.29Å; L140-K144 WeakPolarHBondContact O-CG 3.22Å; L140-K144 PolarHBondContact O-N 2.99Å
141	I	79.6	Confident	77	Confident	4 Å²	4	66.7 Å²	66.7	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-57.8	-52.3	175.2	-65.7	157.7	0	0	0	110.2	L102 M106 I113 A116 L117 L133 Y137 I138 K143 K144 S145	L102-I141 HydrophobicContact CD2-CB 4.45Å; L102-I141 HydrophobicContact CD2-CD1 3.97Å; L102-I141 HydrophobicContact CD2-CG2 4.2Å; M106-I141 HydrophobicContact CE-CG2 3.96Å; M106-I141 HydrophobicContact SD-CG2 4.02Å; I113-I141 HydrophobicContact CG1-CG2 4.42Å; I113-I141 HydrophobicContact CG2-CD1 4.1Å; I113-I141 HydrophobicContact CG2-CG2 4.26Å; A116-I141 HydrophobicContact CB-CG2 4.15Å; L117-I141 HydrophobicContact CD1-CD1 4.47Å; L117-I141 HydrophobicContact CD2-CD1 3.85Å; L117-I141 HydrophobicContact CD2-CG1 4.17Å; L117-I141 HydrophobicContact CG-CD1 4Å; L117-I141 HydrophobicContact CG-CG1 4.25Å; L133-I141 HydrophobicContact CD1-CD1 3.88Å; Y137-I141 WeakPolarHBondContact O-CD1 3.46Å; Y137-I141 VanDerWaalsContact O-CG1 3.26Å; Y137-I141 WeakPolarHBondContact O-CG1 3.43Å; Y137-I141 PolarHBondContact O-N 2.99Å; I138-I141 PolarHBondContact O-N 2.83Å; I141-K143 VanDerWaalsContact C-N 3.34Å; I141-K143 PolarHBondContact O-N 3.06Å; I141-K144 PolarHBondContact O-N 2.96Å; I141-S145 WeakPolarHBondContact O-CB 3.45Å; I141-S145 PolarHBondContact O-N 2.73Å; I141-S145 PolarHBondContact O-OG 3.46Å
142	V	81.6	Confident	76.4	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.3	-42.7	-178.9	173.9	0	0	0	0	111.5	V91 L102 M106 I138 G146 M147	V91-V142 HydrophobicContact CB-CG1 4.11Å; V91-V142 HydrophobicContact CB-CG2 4.32Å; V91-V142 HydrophobicContact CG1-CG2 4.27Å; V91-V142 HydrophobicContact CG2-CG1 4.08Å; V91-V142 HydrophobicContact CG2-CG2 4.5Å; L102-V142 HydrophobicContact CD1-CG2 4.07Å; M106-V142 HydrophobicContact CG-CG2 4.42Å; M106-V142 HydrophobicContact SD-CG2 4.09Å; I138-V142 HydrophobicContact CG2-CG2 4.48Å; I138-V142 VanDerWaalsContact O-CG2 3.31Å; I138-V142 WeakPolarHBondContact O-CG2 3.46Å; I138-V142 PolarHBondContact O-N 3.12Å; V142-G146 PolarHBondContact O-N 2.86Å; V142-M147 HydrophobicContact CG1-CB 3.86Å; V142-M147 PolarHBondContact O-N 2.83Å
143	K	81.1	Confident	75.4	Confident	124 Å²	124	71.7 Å²	71.7	54%	0.539	36%	0.357	S	S	.	.	H	α-helix	trans	-60.7	-48.8	173.7	-77	176.6	-172	179.6	0	112.1	K139 L140 I141 S145 G146 Y149	K139-K143 WeakPolarHBondContact O-CB 3.29Å; K139-K143 VanDerWaalsContact O-CG 3.24Å; K139-K143 WeakPolarHBondContact O-CG 3.35Å; K139-K143 PolarHBondContact O-N 2.83Å; L140-K143 PolarHBondContact O-N 2.81Å; I141-K143 VanDerWaalsContact C-N 3.34Å; I141-K143 PolarHBondContact O-N 3.06Å; K143-S145 VanDerWaalsContact C-N 3.35Å; K143-S145 PolarHBondContact O-N 2.8Å; K143-G146 PolarHBondContact O-N 3.21Å; K143-Y149 HydrophobicContact CG-CE1 4.27Å
144	K	77.3	Confident	74.3	Confident	136 Å²	136	77 Å²	77	59%	0.591	39%	0.385	S	S	*	.	H	α-helix	trans	-64.5	-37.8	-178.6	-75.8	-82.8	-173.9	157.5	0	112	L140 I141 G146	L140-K144 HydrophobicContact CD1-CG 4.41Å; L140-K144 WeakPolarHBondContact O-CB 3.47Å; L140-K144 VanDerWaalsContact O-CG 3.29Å; L140-K144 WeakPolarHBondContact O-CG 3.22Å; L140-K144 PolarHBondContact O-N 2.99Å; I141-K144 PolarHBondContact O-N 2.96Å; K144-G146 PolarHBondContact O-N 2.91Å; K144-G146 VanDerWaalsContact O-N 3.15Å
145	S	76.2	Confident	72.9	Confident	21 Å²	21	81.3 Å²	81.3	15%	0.147	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	3	172.2	-69.2	0	0	0	0	114.8	M106 K108 H112 I141 K143	M106-S145 VanDerWaalsContact CE-CB 3.48Å; M106-S145 WeakPolarHBondContact CE-OG 3.43Å; K108-S145 PolarHBondContact NZ-O 2.89Å; H112-S145 PolarHBondContact NE2-OG 2.95Å; H112-S145 VanDerWaalsContact NE2-OG 3.1Å; I141-S145 WeakPolarHBondContact O-CB 3.45Å; I141-S145 PolarHBondContact O-N 2.73Å; I141-S145 PolarHBondContact O-OG 3.46Å; K143-S145 VanDerWaalsContact C-N 3.35Å; K143-S145 PolarHBondContact O-N 2.8Å
146	G	75	Confident	71.7	Confident	50 Å²	50	86.8 Å²	86.8	52%	0.515	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	14	173.8	0	0	0	0	0	115.3	V142 K143 K144	V142-G146 PolarHBondContact O-N 2.86Å; K143-G146 PolarHBondContact O-N 3.21Å; K144-G146 PolarHBondContact O-N 2.91Å; K144-G146 VanDerWaalsContact O-N 3.15Å
147	M	80.6	Confident	70.6	Confident	25 Å²	25	90.4 Å²	90.4	12%	0.123	44%	0.437	C	S	.	.			trans	-105.2	158.4	-177.5	-72.4	-178.6	-65.9	0	0	111.5	G89 V91 M106 K108 V142	G89-M147 WeakPolarHBondContact O-CB 3.33Å; V91-M147 HydrophobicContact CG2-CB 4.19Å; V91-M147 HydrophobicContact CG2-CE 4.19Å; V91-M147 HydrophobicContact CG2-SD 3.98Å; M106-M147 HydrophobicContact CB-CE 3.81Å; M106-M147 HydrophobicContact CE-CE 3.42Å; M106-M147 VanDerWaalsContact CE-CE 3.42Å; M106-M147 HydrophobicContact CG-CE 3.69Å; M106-M147 HydrophobicContact SD-CE 4.34Å; K108-M147 HydrophobicContact CD-CE 4.48Å; V142-M147 HydrophobicContact CG1-CB 3.86Å; V142-M147 PolarHBondContact O-N 2.83Å
148	K	77.3	Confident	69.8	Low	141 Å²	141	94.4 Å²	94.4	61%	0.613	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	156.7	172.2	-70.1	-176	176.7	-175.7	0	109.3	G89 E90 V91	G89-K148 PolarHBondContact O-N 3.33Å; E90-K148 CarbonylContact C-O 3.52Å; E90-K148 WeakPolarHBondContact CA-O 3.36Å; E90-K148 HydrophobicContact CG-CB 4.25Å; V91-K148 PolarHBondContact N-O 3.35Å
149	Y	80	Confident	69.4	Low	86 Å²	86	103.3 Å²	103.3	34%	0.337	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	151.7	172.2	62.6	-85.9	0	0	0	112.6	V91 I93 K139 K143	V91-Y149 CarbonylContact O-C 3.54Å; V91-Y149 WeakPolarHBondContact O-CA 3.37Å; I93-Y149 HydrophobicContact CD1-CD1 4.33Å; I93-Y149 HydrophobicContact CD1-CD2 3.75Å; I93-Y149 HydrophobicContact CD1-CG 3.57Å; I93-Y149 HydrophobicContact CG1-CG 4.43Å; K139-Y149 HydrophobicContact CB-CE1 4.25Å; K139-Y149 HydrophobicContact CD-CE2 4.26Å; K139-Y149 HydrophobicContact CG-CD2 4.27Å; K139-Y149 HydrophobicContact CG-CE1 4.18Å; K139-Y149 HydrophobicContact CG-CE2 3.89Å; K143-Y149 HydrophobicContact CG-CE1 4.27Å
150	K	76.8	Confident	69.2	Low	116 Å²	116	107.1 Å²	107.1	50%	0.504	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127	162.4	-81.5	169.7	171.1	155.8	0	107.8	E90 V91 E92 I93 A152	E90-K150 VanDerWaalsContact OE2-CE 3.22Å; E90-K150 WeakPolarHBondContact OE2-CE 3.29Å; E90-K150 IonicContact OE2-NZ 2.68Å; E90-K150 PolarHBondContact OE2-NZ 2.94Å; V91-K150 PolarHBondContact O-N 2.88Å; E92-K150 CarbonylContact C-O 3.6Å; E92-K150 WeakPolarHBondContact CA-O 3.29Å; I93-K150 PolarHBondContact N-O 3.25Å; K150-A152 PolarHBondContact O-N 3.42Å
151	S	63.8	Low	69.4	Low	80 Å²	80	111.8 Å²	111.8	56%	0.559	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	111.9	171	42.6	0	0	0	0	109.2	K153	S151-K153 PolarHBondContact O-N 2.96Å; S151-K153 VanDerWaalsContact O-N 3.16Å
152	A	61.3	Low	69.9	Low	38 Å²	38	116.8 Å²	116.8	31%	0.314	56%	0.562	S	S	.	*			trans	-76.6	99.4	166.6	0	0	0	0	0	107.1	I93 K150 L154	I93-A152 PolarHBondContact O-N 2.95Å; K150-A152 PolarHBondContact O-N 3.42Å; A152-L154 PolarHBondContact O-N 3.42Å; A152-L154 VanDerWaalsContact O-N 3.13Å
153	K	55.8	Low	70.1	Confident	197 Å²	197	118.6 Å²	118.6	86%	0.857	57%	0.573	S	S	*	*			trans	-57	121.3	160.7	-72.6	-168.5	176.5	-169.1	0	106.3	S151 K155	S151-K153 PolarHBondContact O-N 2.96Å; S151-K153 VanDerWaalsContact O-N 3.16Å; K153-K155 PolarHBondContact O-N 3.27Å
154	L	51.9	Low	70.6	Confident	118 Å²	118	114.6 Å²	114.6	62%	0.618	56%	0.558	S	S	*	*			trans	-50	127.4	164	-77.7	155.3	0	0	0	106.4	A152 E156	A152-L154 PolarHBondContact O-N 3.42Å; A152-L154 VanDerWaalsContact O-N 3.13Å; L154-E156 PolarHBondContact O-N 2.93Å
155	K	47	Very low	71.2	Confident	201 Å²	201	109 Å²	109	87%	0.874	54%	0.536	S	S	*	.			trans	-64.7	102	155.4	-80.2	-175.9	175.6	-177.9	0	103.8	K153 E157	K153-K155 PolarHBondContact O-N 3.27Å; K155-E157 PolarHBondContact O-N 3.23Å
156	E	49.9	Very low	71.9	Confident	165 Å²	165	113.3 Å²	113.3	77%	0.771	56%	0.562	S	S	*	*			trans	-45.8	126.6	158.2	-70	165.6	173.5	0	0	106	L154 K158	L154-E156 PolarHBondContact O-N 2.93Å; E156-K158 PolarHBondContact O-N 3.36Å
157	E	52	Low	72.5	Confident	188 Å²	188	114.9 Å²	114.9	88%	0.879	55%	0.554	S	S	*	*			trans	-65	92.2	172.6	-70.2	-173.3	152.4	0	0	106	K155 E159	K155-E157 PolarHBondContact O-N 3.23Å; E157-E159 PolarHBondContact O-N 3.36Å
158	K	61.3	Low	72.9	Confident	186 Å²	186	119.2 Å²	119.2	81%	0.809	57%	0.569	S	S	*	*			trans	-60	106.3	171.9	-74.9	-165	169.8	-157.6	0	106.3	E156 K160	E156-K158 PolarHBondContact O-N 3.36Å; K158-K160 PolarHBondContact O-N 2.89Å; K158-K160 VanDerWaalsContact O-N 3.08Å
159	E	70.2	Confident	73.4	Confident	186 Å²	186	117.3 Å²	117.3	87%	0.869	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-46.1	119.7	162.8	-66	-177.6	167.6	0	0	106.6	E157 E161	E157-E159 PolarHBondContact O-N 3.36Å; E159-E161 PolarHBondContact O-N 2.89Å
160	K	76.9	Confident	73.7	Confident	117 Å²	117	119.4 Å²	119.4	51%	0.509	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-66.7	124.7	179.5	-72.9	-177.3	-172.6	171	0	107.1	K158 W446 Y449	K158-K160 PolarHBondContact O-N 2.89Å; K158-K160 VanDerWaalsContact O-N 3.08Å; K160-W446 HydrophobicContact CB-CE3 4.46Å; K160-W446 HydrophobicContact CB-CZ3 3.68Å; K160-W446 WeakPolarHBondContact O-CH2 3.42Å; K160-W446 WeakPolarHBondContact O-CZ3 3.46Å; K160-Y449 HydrophobicContact CD-CD1 3.91Å; K160-Y449 HydrophobicContact CD-CE1 3.74Å; K160-Y449 HydrophobicContact CD-CG 4.39Å; K160-Y449 VanDerWaalsContact NZ-CG 3.28Å
161	E	82.6	Confident	74.2	Confident	169 Å²	169	115 Å²	115	79%	0.79	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-57.3	141	175	-66.4	170.3	-161.6	0	0	110	E159 T163 W446	E159-E161 PolarHBondContact O-N 2.89Å; E161-T163 PolarHBondContact O-N 2.65Å; E161-T163 VanDerWaalsContact O-N 3.1Å; E161-W446 WeakPolarHBondContact O-CZ3 3.08Å
162	N	88.8	Confident	75.4	Confident	109 Å²	109	116.9 Å²	116.9	58%	0.583	59%	0.585	S	S	*	*			trans	-71.8	106.1	179.3	-177.8	-9.3	0	0	0	109.7	D164 W446	N162-D164 WeakPolarHBondContact OD1-CB 3.36Å; N162-D164 PolarHBondContact OD1-N 2.68Å; N162-D164 VanDerWaalsContact OD1-N 3.09Å; N162-W446 HydrophobicContact CB-CH2 4.26Å; N162-W446 HydrophobicContact CB-CZ2 3.82Å; N162-W446 PolarHBondContact OD1-NE1 3.1Å; N162-W446 VanDerWaalsContact OD1-NE1 3.09Å
163	T	87.6	Confident	76.6	Confident	38 Å²	38	120.4 Å²	120.4	23%	0.233	60%	0.604	C	S	.	*			trans	-102.3	24.5	-179.1	58.4	0	0	0	0	113.5	E161 R439 V443	E161-T163 PolarHBondContact O-N 2.65Å; E161-T163 VanDerWaalsContact O-N 3.1Å; T163-R439 VanDerWaalsContact C-NH2 3.32Å; T163-R439 VanDerWaalsContact O-CZ 3.25Å; T163-R439 PolarHBondContact O-NH2 2.77Å; T163-V443 VanDerWaalsContact O-CG2 3.3Å; T163-V443 WeakPolarHBondContact O-CG2 2.86Å
164	D	91.4	Very high	78.1	Confident	40 Å²	40	115.8 Å²	115.8	21%	0.214	60%	0.603	C	S	.	*			trans	-67	164	178.1	-144.1	-33.7	0	0	0	113	N162 R439 V443 R447	N162-D164 WeakPolarHBondContact OD1-CB 3.36Å; N162-D164 PolarHBondContact OD1-N 2.68Å; N162-D164 VanDerWaalsContact OD1-N 3.09Å; D164-R439 PolarHBondContact O-NH2 2.94Å; D164-R439 VanDerWaalsContact O-NH2 3.07Å; D164-V443 WeakPolarHBondContact OD1-CG1 3.45Å; D164-R447 IonicContact OD1-CZ 3.95Å; D164-R447 IonicContact OD1-NE 2.73Å; D164-R447 PolarHBondContact OD1-NE 3.09Å; D164-R447 IonicContact OD1-NH2 2.85Å; D164-R447 PolarHBondContact OD1-NH2 2.78Å; D164-R447 IonicContact OD2-NE 3.79Å; D164-R447 PolarHBondContact OD2-NE 3.2Å
165	A	89.2	Confident	79.9	Confident	17 Å²	17	112.9 Å²	112.9	14%	0.14	59%	0.59	C	S	.	*			trans	-92.9	122.7	160.9	0	0	0	0	0	107.7	L432 V434 V443 R447	A165-L432 HydrophobicContact CB-CB 4.25Å; A165-L432 HydrophobicContact CB-CD1 3.85Å; A165-L432 VanDerWaalsContact O-CD1 3.24Å; A165-L432 WeakPolarHBondContact O-CD1 3.48Å; A165-V434 HydrophobicContact CB-CG1 4.14Å; A165-V443 HydrophobicContact CB-CG1 4.08Å; A165-V443 HydrophobicContact CB-CG2 4.03Å; A165-R447 PolarHBondContact O-NH2 3.42Å
166	V	91.1	Very high	81.9	Confident	113 Å²	113	106.2 Å²	106.2	69%	0.685	56%	0.563	S	S	*	*			trans	-112.4	147.4	-177.5	-175	0	0	0	0	108.9
167	K	88.2	Confident	83.9	Confident	83 Å²	83	101.2 Å²	101.2	36%	0.361	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-50.6	141.6	170.6	-69.8	-164.5	176.6	-146.8	0	111.3	E356 E430	K167-E356 WeakPolarHBondContact CD-OE1 3.17Å; K167-E356 WeakPolarHBondContact CE-OE1 3.36Å; K167-E356 WeakPolarHBondContact CG-OE1 3.45Å; K167-E356 IonicContact NZ-OE1 2.84Å; K167-E356 PolarHBondContact NZ-OE1 2.98Å; K167-E430 WeakPolarHBondContact CE-OE1 3.43Å; K167-E430 WeakPolarHBondContact CE-OE2 3.36Å; K167-E430 IonicContact NZ-OE1 2.66Å; K167-E430 PolarHBondContact NZ-OE1 2.85Å; K167-E430 IonicContact NZ-OE2 2.75Å
168	R	87.4	Confident	85.7	Confident	115 Å²	115	97.9 Å²	97.9	43%	0.434	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-73.6	150.5	176.4	-73.7	176.8	163.6	-148	-11.8	109.8	L354 R378	R168-L354 VanDerWaalsContact NH2-CG 3.33Å; R168-R378 VanDerWaalsContact CB-NH1 3.3Å
169	P	89.1	Confident	87.1	Confident	102 Å²	102	91.6 Å²	91.6	66%	0.662	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-57.1	158.8	166.5	26.6	-34.6	0	0	0	110.7	A171 R378	P169-A171 PolarHBondContact O-N 3.15Å; P169-R378 PolarHBondContact O-NH1 3.44Å
170	P	85.8	Confident	88.1	Confident	129 Å²	129	84.1 Å²	84.1	84%	0.838	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-51.8	140	175.4	22.4	-33.9	0	0	0	110.5
171	A	86.4	Confident	88.9	Confident	25 Å²	25	78.8 Å²	78.8	21%	0.207	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-70.8	149.9	-177.2	0	0	0	0	0	111.5	P169 L176 D350	P169-A171 PolarHBondContact O-N 3.15Å; A171-L176 HydrophobicContact CB-CD2 4.05Å; A171-D350 HydrophobicContact CB-CB 3.72Å
172	D	88.7	Confident	89.5	Confident	118 Å²	118	70.9 Å²	70.9	63%	0.631	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-59.3	138.2	174.4	-66	-55.7	0	0	0	110.7	A174 V175	D172-A174 PolarHBondContact O-N 2.96Å; D172-V175 HydrophobicContact CB-CG2 4.48Å; D172-V175 PolarHBondContact O-N 3.18Å
173	P	86.7	Confident	89.9	Confident	112 Å²	112	65.7 Å²	65.7	73%	0.727	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.9	-174.3	24.3	-34.5	0	0	0	113.9
174	A	88.3	Confident	90.2	Very high	100 Å²	100	63.9 Å²	63.9	83%	0.826	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-18.7	175.1	0	0	0	0	0	114.4	D172	D172-A174 PolarHBondContact O-N 2.96Å
175	V	89.5	Confident	90.4	Very high	57 Å²	57	62 Å²	62	35%	0.345	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-11.9	-179.3	-172.2	0	0	0	0	111.5	D172 T177 D350 T352	D172-V175 HydrophobicContact CB-CG2 4.48Å; D172-V175 PolarHBondContact O-N 3.18Å; V175-T177 PolarHBondContact O-N 2.65Å; V175-D350 HydrophobicContact CG1-CB 4.3Å; V175-D350 WeakPolarHBondContact CG1-OD1 3.47Å; V175-T352 WeakPolarHBondContact CG1-OG1 3.29Å
176	L	89.6	Confident	90.6	Very high	61 Å²	61	61.2 Å²	61.2	32%	0.319	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	118.3	-179.4	-73.2	-174.9	0	0	0	111.9	A171 K348	A171-L176 HydrophobicContact CB-CD2 4.05Å; L176-K348 HydrophobicContact CB-CB 3.98Å; L176-K348 HydrophobicContact CB-CD 4.28Å; L176-K348 HydrophobicContact CB-CG 4.21Å; L176-K348 HydrophobicContact CD1-CB 4.11Å; L176-K348 HydrophobicContact CD1-CD 4.23Å; L176-K348 HydrophobicContact CD2-CB 4.25Å; L176-K348 HydrophobicContact CG-CB 4.34Å
177	T	90.4	Very high	90.6	Very high	61 Å²	61	55.8 Å²	55.8	37%	0.374	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	147	173.5	52.1	0	0	0	0	110.8	V175 K348 A349	V175-T177 PolarHBondContact O-N 2.65Å; T177-K348 CarbonylContact O-C 3.51Å; T177-K348 WeakPolarHBondContact O-CA 3.47Å; T177-A349 PolarHBondContact N-O 3.43Å; T177-A349 PolarHBondContact O-N 3.03Å; T177-A349 PolarHBondContact OG1-O 2.88Å
178	P	90.4	Very high	90.8	Very high	117 Å²	117	54 Å²	54	76%	0.76	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	141.6	173.9	28.2	-35	0	0	0	110.3	L347	P178-L347 WeakPolarHBondContact CA-O 3.2Å
179	R	91.3	Very high	90.8	Very high	55 Å²	55	50 Å²	50	21%	0.208	31%	0.311	C	S	.	.			trans	-129.9	157.5	179.8	67.4	157.4	173.5	92.2	-4.2	111.5	D253 L347 A349 P412	R179-D253 IonicContact CZ-OD1 2.7Å; R179-D253 IonicContact CZ-OD2 3.76Å; R179-D253 IonicContact NH1-OD1 3.56Å; R179-D253 PolarHBondContact NH1-OD1 2.86Å; R179-D253 IonicContact NH1-OD2 2.76Å; R179-D253 PolarHBondContact NH1-OD2 3.43Å; R179-D253 IonicContact NH2-OD1 3.92Å; R179-D253 PolarHBondContact NH2-OD1 2.82Å; R179-D253 IonicContact NH2-OD2 3.92Å; R179-L347 PolarHBondContact N-O 3.38Å; R179-L347 VanDerWaalsContact N-O 3.14Å; R179-A349 HydrophobicContact CB-CB 4.34Å; R179-A349 HydrophobicContact CG-CB 4.13Å; R179-P412 HydrophobicContact CB-CB 4.4Å
180	P	90.9	Very high	90.7	Very high	28 Å²	28	50.9 Å²	50.9	18%	0.182	31%	0.31	C	S	.	.			trans	-60.6	146.8	171.6	26.2	-35	0	0	0	111.4	K229	P180-K229 HydrophobicContact CB-CB 4.18Å; P180-K229 WeakPolarHBondContact CB-O 3.38Å
181	A	93.9	Very high	91	Very high	5 Å²	5	44.7 Å²	44.7	4%	0.041	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	141.2	171.5	0	0	0	0	0	110.7	V183 T231 A342 L347	A181-V183 HydrophobicContact CB-CG2 4.12Å; A181-T231 PolarHBondContact O-N 3.08Å; A181-A342 HydrophobicContact CB-CB 3.84Å; A181-L347 HydrophobicContact CB-CD1 3.61Å
182	V	95.4	Very high	91.1	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.024	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.5	169.9	-160.9	0	0	0	0	107.9	T231 L233 T252 D253 I254 I375	V182-T231 CarbonylContact C-O 3.6Å; V182-T231 WeakPolarHBondContact CA-O 3.03Å; V182-T231 HydrophobicContact CG1-CG2 3.9Å; V182-L233 HydrophobicContact CG1-CD1 4.24Å; V182-L233 HydrophobicContact CG1-CD2 4.3Å; V182-L233 HydrophobicContact CG1-CG 4.13Å; V182-T252 HydrophobicContact CB-CG2 4.05Å; V182-T252 HydrophobicContact CG1-CG2 3.67Å; V182-T252 VanDerWaalsContact O-CB 3.26Å; V182-T252 WeakPolarHBondContact O-CB 3.3Å; V182-T252 WeakPolarHBondContact O-CG2 3.36Å; V182-D253 PolarHBondContact N-OD2 2.6Å; V182-D253 PolarHBondContact O-N 3.09Å; V182-I254 PolarHBondContact O-N 3.46Å; V182-I375 HydrophobicContact CG1-CD1 3.78Å; V182-I375 HydrophobicContact CG1-CG2 4.48Å; V182-I375 HydrophobicContact CG2-CG2 4.2Å
183	V	95.8	Very high	91.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	118.4	-165.1	-175.6	0	0	0	0	110.3	A181 I230 T231 F232 L233 I254 I256 T338	A181-V183 HydrophobicContact CB-CG2 4.12Å; V183-I230 HydrophobicContact CB-CG2 4.13Å; V183-I230 HydrophobicContact CG2-CG2 3.47Å; V183-I230 VanDerWaalsContact CG2-CG2 3.47Å; V183-T231 PolarHBondContact N-O 3.07Å; V183-F232 HydrophobicContact CB-CD1 4.02Å; V183-F232 HydrophobicContact CB-CE1 4.11Å; V183-F232 HydrophobicContact CG1-CD1 4.11Å; V183-F232 HydrophobicContact CG1-CE1 3.93Å; V183-F232 CarbonylContact O-C 3.58Å; V183-F232 WeakPolarHBondContact O-CA 3.41Å; V183-L233 PolarHBondContact O-N 2.96Å; V183-I254 VanDerWaalsContact CA-O 3.3Å; V183-I254 WeakPolarHBondContact CA-O 3.38Å; V183-I254 HydrophobicContact CG1-CB 4.46Å; V183-I254 HydrophobicContact CG1-CG2 4.38Å; V183-I254 HydrophobicContact CG2-CB 4.29Å; V183-I256 HydrophobicContact CG1-CD1 3.73Å; V183-I256 HydrophobicContact CG1-CG1 3.71Å; V183-T338 HydrophobicContact CG1-CG2 4.31Å; V183-T338 HydrophobicContact CG2-CG2 3.8Å
184	T	95.3	Very high	91.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	137.5	175.6	-72.2	0	0	0	0	110.5	L186 T235 G248 T252 I254 V255 I256	T184-L186 HydrophobicContact CG2-CD2 3.45Å; T184-L186 VanDerWaalsContact CG2-CD2 3.45Å; T184-L186 HydrophobicContact CG2-CG 3.82Å; T184-T235 HydrophobicContact CG2-CG2 3.65Å; T184-G248 PolarHBondContact OG1-O 3.43Å; T184-G248 VanDerWaalsContact OG1-O 3.11Å; T184-T252 WeakPolarHBondContact OG1-CG2 3.44Å; T184-T252 PolarHBondContact OG1-OG1 3.44Å; T184-I254 PolarHBondContact N-O 3.4Å; T184-I254 VanDerWaalsContact N-O 3.09Å; T184-V255 WeakPolarHBondContact O-CA 3.42Å; T184-I256 PolarHBondContact O-N 3.01Å
185	V	94.7	Very high	91.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	114.8	172.3	-179.4	0	0	0	0	109	K193 L197 F232 L233 T235 I256 V258	V185-K193 HydrophobicContact CG1-CB 3.9Å; V185-K193 HydrophobicContact CG1-CD 4.23Å; V185-K193 HydrophobicContact CG1-CG 3.92Å; V185-L197 HydrophobicContact CB-CD1 4.19Å; V185-L197 HydrophobicContact CG2-CD1 4.1Å; V185-L197 HydrophobicContact CG2-CD2 3.69Å; V185-L197 HydrophobicContact CG2-CG 4.22Å; V185-F232 HydrophobicContact CG2-CD1 4.12Å; V185-L233 PolarHBondContact N-O 2.88Å; V185-T235 PolarHBondContact O-OG1 2.91Å; V185-I256 WeakPolarHBondContact CA-O 3.46Å; V185-I256 HydrophobicContact CG2-CB 4.41Å; V185-V258 HydrophobicContact CG1-CG2 3.54Å
186	L	94.1	Very high	91.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	171.7	-179.9	-61.3	-173.5	0	0	0	111.9	T184 T235 R245 V255 I256 L257 V258	T184-L186 HydrophobicContact CG2-CD2 3.45Å; T184-L186 VanDerWaalsContact CG2-CD2 3.45Å; T184-L186 HydrophobicContact CG2-CG 3.82Å; L186-T235 HydrophobicContact CD2-CG2 4.46Å; L186-T235 WeakPolarHBondContact CD2-OG1 3.44Å; L186-R245 HydrophobicContact CD2-CB 4.23Å; L186-R245 HydrophobicContact CD2-CG 4.05Å; L186-V255 HydrophobicContact CB-CG1 4.23Å; L186-V255 HydrophobicContact CD1-CG1 3.69Å; L186-V255 HydrophobicContact CD1-CG2 4.33Å; L186-V255 HydrophobicContact CG-CG1 3.88Å; L186-I256 PolarHBondContact N-O 3.48Å; L186-L257 HydrophobicContact CB-CD1 4.29Å; L186-V258 PolarHBondContact O-N 3.49Å
187	G	91.8	Very high	91.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.158	C	C	.	.			trans	132.6	171.7	178.2	0	0	0	0	0	113.7	K193 S272	G187-K193 PolarHBondContact O-NZ 2.97Å; G187-S272 PolarHBondContact N-OG 3.28Å
188	H	91.4	Very high	91.2	Very high	45 Å²	45	25.1 Å²	25.1	21%	0.208	14%	0.144	C	C	.	.			trans	-62.9	163.9	-178.3	-170	73.9	0	0	0	113.6	H191 K193 M266 Q268	H188-H191 AromaticContact CD2-NE2 3.98Å; H188-K193 PolarHBondContact O-NZ 3.33Å; H188-M266 HydrophobicContact CB-CB 4.35Å; H188-M266 PolarHBondContact CD2-SD 3.1Å; H188-M266 PolarHBondContact NE2-SD 3.43Å; H188-Q268 HydrophobicContact CB-CB 4.27Å; H188-Q268 PolarHBondContact CE1-OE1 3.09Å; H188-Q268 VanDerWaalsContact ND1-CD 3.27Å; H188-Q268 PolarHBondContact ND1-OE1 3.35Å
189	V	87.6	Confident	91.1	Very high	30 Å²	30	21.6 Å²	21.6	18%	0.182	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	149.7	167.5	174.2	0	0	0	0	110.3	H191 H238	V189-H191 PolarHBondContact O-CD2 3.41Å; V189-H191 PolarHBondContact O-N 3.36Å; V189-H238 HydrophobicContact CG2-CB 3.97Å
190	D	86.9	Confident	90.8	Very high	121 Å²	121	20.7 Å²	20.7	65%	0.647	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	6.7	178.5	-59.4	-16.7	0	0	0	118	G192 K289	D190-G192 PolarHBondContact O-N 3.09Å; D190-K289 WeakPolarHBondContact O-CE 3.23Å; D190-K289 PolarHBondContact O-NZ 3.2Å; D190-K289 VanDerWaalsContact O-NZ 3.12Å
191	H	92.2	Very high	90.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	-70.5	-2.4	167.8	-75.9	-161.4	0	0	0	113.5	H188 V189 V258 V259 A260 D263 N288	H188-H191 AromaticContact CD2-NE2 3.98Å; V189-H191 PolarHBondContact O-CD2 3.41Å; V189-H191 PolarHBondContact O-N 3.36Å; H191-V258 HydrophobicContact CB-CG1 4.29Å; H191-V258 PolarHBondContact ND1-O 3.37Å; H191-V258 VanDerWaalsContact O-CG1 3.29Å; H191-V258 WeakPolarHBondContact O-CG1 3.34Å; H191-V259 WeakPolarHBondContact ND1-CA 3.25Å; H191-A260 HydrophobicContact CB-CB 4.39Å; H191-A260 PolarHBondContact ND1-N 2.81Å; H191-D263 IonicContact CD2-OD2 3.56Å; H191-D263 IonicContact NE2-OD2 2.62Å; H191-N288 PolarHBondContact O-ND2 3.49Å
192	G	88.9	Confident	89.7	Confident	14 Å²	14	32.2 Å²	32.2	14%	0.144	17%	0.166	C	C	.	.			trans	82.5	27.6	172.5	0	0	0	0	0	115.8	D190 T195 L196	D190-G192 PolarHBondContact O-N 3.09Å; G192-T195 WeakPolarHBondContact O-CB 3.37Å; G192-T195 PolarHBondContact O-N 2.9Å; G192-L196 WeakPolarHBondContact O-CB 3.41Å; G192-L196 PolarHBondContact O-N 3.49Å
193	K	90.5	Very high	89	Confident	11 Å²	11	34.6 Å²	34.6	5%	0.048	18%	0.18	C	C	.	.	H	α-helix	trans	-53.3	-58.5	175.1	-63.7	-173	-64.8	-75.3	0	112.3	V185 G187 H188 T195 L196 L197 T235 V258	V185-K193 HydrophobicContact CG1-CB 3.9Å; V185-K193 HydrophobicContact CG1-CD 4.23Å; V185-K193 HydrophobicContact CG1-CG 3.92Å; G187-K193 PolarHBondContact O-NZ 2.97Å; H188-K193 PolarHBondContact O-NZ 3.33Å; K193-T195 PolarHBondContact O-N 3.46Å; K193-L196 WeakPolarHBondContact O-CB 3.41Å; K193-L196 PolarHBondContact O-N 3.39Å; K193-L196 VanDerWaalsContact O-N 3.14Å; K193-L197 WeakPolarHBondContact O-CG 3.31Å; K193-L197 PolarHBondContact O-N 3.07Å; K193-L197 VanDerWaalsContact O-N 3.09Å; K193-T235 VanDerWaalsContact CE-O 3.26Å; K193-T235 WeakPolarHBondContact CE-O 3.47Å; K193-V258 HydrophobicContact CG-CB 4.1Å; K193-V258 HydrophobicContact CG-CG2 4.19Å
194	T	88.3	Confident	87.9	Confident	22 Å²	22	42.4 Å²	42.4	14%	0.135	22%	0.217	C	C	.	.	H	α-helix	trans	-59.1	-37.5	178.8	-31.1	0	0	0	0	111.3	L197 D198 A206 T214	T194-L197 PolarHBondContact O-N 2.99Å; T194-D198 WeakPolarHBondContact O-CB 3.4Å; T194-D198 PolarHBondContact O-N 3.02Å; T194-A206 HydrophobicContact CG2-CB 3.85Å; T194-T214 VanDerWaalsContact CG2-OG1 3.22Å; T194-T214 WeakPolarHBondContact CG2-OG1 3.47Å; T194-T214 PolarHBondContact OG1-OG1 3.03Å
195	T	89.9	Confident	87	Confident	59 Å²	59	44.8 Å²	44.8	36%	0.362	23%	0.231	S	C	.	.	H	α-helix	trans	-65.9	-41.2	177	-42.3	0	0	0	0	112.7	G192 K193 L197 S199 A325	G192-T195 WeakPolarHBondContact O-CB 3.37Å; G192-T195 PolarHBondContact O-N 2.9Å; K193-T195 PolarHBondContact O-N 3.46Å; T195-L197 VanDerWaalsContact C-N 3.31Å; T195-S199 WeakPolarHBondContact O-CB 3.39Å; T195-S199 PolarHBondContact O-N 2.91Å; T195-A325 HydrophobicContact CG2-CB 4.16Å
196	L	90.4	Very high	85.9	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.6	-46.2	174	178.6	164.7	0	0	0	109.7	G192 K193 S199 L200 V258 I323 A325 L331 L334	G192-L196 WeakPolarHBondContact O-CB 3.41Å; G192-L196 PolarHBondContact O-N 3.49Å; K193-L196 WeakPolarHBondContact O-CB 3.41Å; K193-L196 PolarHBondContact O-N 3.39Å; K193-L196 VanDerWaalsContact O-N 3.14Å; L196-S199 WeakPolarHBondContact O-CB 3.16Å; L196-S199 PolarHBondContact O-N 2.86Å; L196-L200 HydrophobicContact CD2-CD1 3.67Å; L196-L200 HydrophobicContact CD2-CG 4.34Å; L196-L200 WeakPolarHBondContact O-CG 3.18Å; L196-L200 PolarHBondContact O-N 2.88Å; L196-V258 HydrophobicContact CD1-CG2 3.95Å; L196-I323 HydrophobicContact CD1-CD1 3.49Å; L196-I323 VanDerWaalsContact CD1-CD1 3.49Å; L196-I323 HydrophobicContact CG-CD1 4.3Å; L196-A325 HydrophobicContact CB-CB 4.08Å; L196-L331 HydrophobicContact CG-CD2 4.37Å; L196-L334 HydrophobicContact CD1-CD2 3.98Å
197	L	88.6	Confident	84.9	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-70	-40	-178.6	-65.9	176.6	0	0	0	112.8	V185 K193 T194 T195 S199 L200 R201 F220 F232 D234	V185-L197 HydrophobicContact CB-CD1 4.19Å; V185-L197 HydrophobicContact CG2-CD1 4.1Å; V185-L197 HydrophobicContact CG2-CD2 3.69Å; V185-L197 HydrophobicContact CG2-CG 4.22Å; K193-L197 WeakPolarHBondContact O-CG 3.31Å; K193-L197 PolarHBondContact O-N 3.07Å; K193-L197 VanDerWaalsContact O-N 3.09Å; T194-L197 PolarHBondContact O-N 2.99Å; T195-L197 VanDerWaalsContact C-N 3.31Å; L197-S199 VanDerWaalsContact C-N 3.31Å; L197-S199 PolarHBondContact O-N 3.1Å; L197-L200 HydrophobicContact CD2-CD1 4.32Å; L197-L200 PolarHBondContact O-N 3.49Å; L197-R201 WeakPolarHBondContact O-CB 3.26Å; L197-R201 WeakPolarHBondContact O-CG 3.41Å; L197-R201 PolarHBondContact O-N 3.48Å; L197-F220 HydrophobicContact CB-CE1 4.34Å; L197-F220 HydrophobicContact CB-CZ 3.7Å; L197-F220 HydrophobicContact CD1-CE1 4.1Å; L197-F220 HydrophobicContact CD1-CZ 3.93Å; L197-F220 HydrophobicContact CD2-CE1 4.49Å; L197-F220 HydrophobicContact CD2-CE2 4.31Å; L197-F220 HydrophobicContact CD2-CZ 3.55Å; L197-F220 HydrophobicContact CG-CZ 3.89Å; L197-F232 HydrophobicContact CD2-CB 4.1Å; L197-F232 HydrophobicContact CD2-CD1 3.9Å; L197-F232 HydrophobicContact CD2-CG 4.04Å; L197-D234 HydrophobicContact CD1-CB 3.58Å
198	D	87.6	Confident	84.1	Confident	14 Å²	14	58.5 Å²	58.5	8%	0.075	32%	0.317	C	S	.	.	H	α-helix	trans	-59.3	-41.5	171.3	-97.4	-27.1	0	0	0	112.4	T194 R201 K202 T203 Q204 V205 A206	T194-D198 WeakPolarHBondContact O-CB 3.4Å; T194-D198 PolarHBondContact O-N 3.02Å; D198-R201 PolarHBondContact O-N 3.49Å; D198-K202 WeakPolarHBondContact O-CA 3.26Å; D198-K202 PolarHBondContact O-N 3.31Å; D198-T203 WeakPolarHBondContact CB-O 3.24Å; D198-T203 PolarHBondContact O-N 3.36Å; D198-T203 PolarHBondContact OD1-OG1 2.95Å; D198-Q204 PolarHBondContact OD1-N 2.87Å; D198-Q204 WeakPolarHBondContact OD2-CA 3.29Å; D198-V205 WeakPolarHBondContact OD1-CB 3.41Å; D198-V205 PolarHBondContact OD1-N 3.17Å; D198-V205 PolarHBondContact OD2-N 3.32Å; D198-A206 WeakPolarHBondContact OD2-CB 3.23Å; D198-A206 PolarHBondContact OD2-N 3.39Å
199	S	87.5	Confident	83.4	Confident	44 Å²	44	58.4 Å²	58.4	31%	0.308	32%	0.317	S	S	.	.	H	α-helix	trans	-64.6	-42.2	177.4	-155.6	0	0	0	0	111.8	T195 L196 L197 K202 A325 L331	T195-S199 WeakPolarHBondContact O-CB 3.39Å; T195-S199 PolarHBondContact O-N 2.91Å; L196-S199 WeakPolarHBondContact O-CB 3.16Å; L196-S199 PolarHBondContact O-N 2.86Å; L197-S199 VanDerWaalsContact C-N 3.31Å; L197-S199 PolarHBondContact O-N 3.1Å; S199-K202 PolarHBondContact O-N 3.15Å; S199-A325 PolarHBondContact OG-O 3.2Å; S199-L331 VanDerWaalsContact OG-CD1 3.26Å; S199-L331 WeakPolarHBondContact OG-CD1 3.37Å
200	L	85.2	Confident	82.4	Confident	35 Å²	35	59 Å²	59	18%	0.183	32%	0.324	C	S	.	.	H	α-helix	trans	-64.9	-40.2	173.3	-70.8	177.4	0	0	0	112.9	L196 L197 V222 F232 L331	L196-L200 HydrophobicContact CD2-CD1 3.67Å; L196-L200 HydrophobicContact CD2-CG 4.34Å; L196-L200 WeakPolarHBondContact O-CG 3.18Å; L196-L200 PolarHBondContact O-N 2.88Å; L197-L200 HydrophobicContact CD2-CD1 4.32Å; L197-L200 PolarHBondContact O-N 3.49Å; L200-V222 HydrophobicContact CB-CG2 4.36Å; L200-F232 HydrophobicContact CD1-CE1 4.31Å; L200-F232 HydrophobicContact CD1-CE2 4.1Å; L200-F232 HydrophobicContact CD1-CZ 3.88Å; L200-L331 HydrophobicContact CD2-CB 4.3Å
201	R	81.3	Confident	81.4	Confident	79 Å²	79	55.9 Å²	55.9	30%	0.298	32%	0.321	S	S	.	.	H	α-helix	trans	-79.2	-18.1	-179.8	-67	173.9	83.4	-173.8	6.3	113.8	L197 D198 T203 F220 V222 E402	L197-R201 WeakPolarHBondContact O-CB 3.26Å; L197-R201 WeakPolarHBondContact O-CG 3.41Å; L197-R201 PolarHBondContact O-N 3.48Å; D198-R201 PolarHBondContact O-N 3.49Å; R201-T203 VanDerWaalsContact C-N 3.26Å; R201-T203 HydrophobicContact CB-CG2 4.02Å; R201-T203 VanDerWaalsContact CB-OG1 3.3Å; R201-T203 WeakPolarHBondContact CB-OG1 3.46Å; R201-F220 VanDerWaalsContact CD-CD2 3.45Å; R201-F220 VanDerWaalsContact CD-CE2 3.41Å; R201-F220 HydrophobicContact CG-CD2 3.54Å; R201-F220 HydrophobicContact CG-CE2 3.41Å; R201-F220 VanDerWaalsContact CG-CE2 3.41Å; R201-F220 HydrophobicContact CG-CG 4.36Å; R201-F220 HydrophobicContact CG-CZ 4.14Å; R201-V222 HydrophobicContact CG-CG2 4.4Å; R201-E402 IonicContact CZ-OE1 3.02Å; R201-E402 IonicContact NE-OE1 2.77Å; R201-E402 IonicContact NH2-OE1 2.69Å; R201-E402 PolarHBondContact NH2-OE1 3.45Å
202	K	81.3	Confident	80.6	Confident	197 Å²	197	58.1 Å²	58.1	86%	0.857	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	37.6	-166.7	-54.1	174.6	-176.4	172.8	0	112	D198 S199	D198-K202 WeakPolarHBondContact O-CA 3.26Å; D198-K202 PolarHBondContact O-N 3.31Å; S199-K202 PolarHBondContact O-N 3.15Å
203	T	79	Confident	80	Confident	53 Å²	53	59.1 Å²	59.1	33%	0.325	35%	0.346	S	S	.	.			trans	-115.1	176.2	176.7	56.3	0	0	0	0	111.2	D198 R201	D198-T203 WeakPolarHBondContact CB-O 3.24Å; D198-T203 PolarHBondContact O-N 3.36Å; D198-T203 PolarHBondContact OD1-OG1 2.95Å; R201-T203 VanDerWaalsContact C-N 3.26Å; R201-T203 HydrophobicContact CB-CG2 4.02Å; R201-T203 VanDerWaalsContact CB-OG1 3.3Å; R201-T203 WeakPolarHBondContact CB-OG1 3.46Å
204	Q	74.5	Confident	79.6	Confident	165 Å²	165	59.3 Å²	59.3	77%	0.771	35%	0.348	S	S	*	.			trans	-136.7	63.2	174.8	-67.9	-173.7	-20.7	0	0	110	D198	D198-Q204 PolarHBondContact OD1-N 2.87Å; D198-Q204 WeakPolarHBondContact OD2-CA 3.29Å
205	V	75.9	Confident	79.3	Confident	49 Å²	49	58.5 Å²	58.5	30%	0.297	34%	0.343	S	S	.	.			trans	-70.7	-42.3	176	179.9	0	0	0	0	110.8	D198 A207 M208 E209	D198-V205 WeakPolarHBondContact OD1-CB 3.41Å; D198-V205 PolarHBondContact OD1-N 3.17Å; D198-V205 PolarHBondContact OD2-N 3.32Å; V205-A207 PolarHBondContact O-N 3.29Å; V205-A207 VanDerWaalsContact O-N 3.11Å; V205-M208 WeakPolarHBondContact O-CA 3.26Å; V205-M208 WeakPolarHBondContact O-CB 3.47Å; V205-M208 PolarHBondContact O-N 3.07Å; V205-E209 HydrophobicContact CG1-CG 3.97Å; V205-E209 PolarHBondContact O-N 2.89Å
206	A	70.3	Confident	79	Confident	26 Å²	26	57.9 Å²	57.9	22%	0.215	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-30.8	-178.3	0	0	0	0	0	113.5	T194 D198 M208	T194-A206 HydrophobicContact CG2-CB 3.85Å; D198-A206 WeakPolarHBondContact OD2-CB 3.23Å; D198-A206 PolarHBondContact OD2-N 3.39Å; A206-M208 VanDerWaalsContact C-N 3.34Å
207	A	73	Confident	78.9	Confident	91 Å²	91	58.1 Å²	58.1	75%	0.752	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-13.7	176.1	0	0	0	0	0	113.9	V205	V205-A207 PolarHBondContact O-N 3.29Å; V205-A207 VanDerWaalsContact O-N 3.11Å
208	M	75.9	Confident	78.8	Confident	172 Å²	172	59.5 Å²	59.5	85%	0.847	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-19.1	-178.5	-169.5	170.3	177.8	0	0	112.7	V205 A206	V205-M208 WeakPolarHBondContact O-CA 3.26Å; V205-M208 WeakPolarHBondContact O-CB 3.47Å; V205-M208 PolarHBondContact O-N 3.07Å; A206-M208 VanDerWaalsContact C-N 3.34Å
209	E	75.8	Confident	78.9	Confident	43 Å²	43	59.4 Å²	59.4	20%	0.201	35%	0.353	C	S	.	.	S	Bend	trans	-68.9	142.8	177.5	-70.7	-169.6	130.2	0	0	113.1	V205 G211 G212 T214	V205-E209 HydrophobicContact CG1-CG 3.97Å; V205-E209 PolarHBondContact O-N 2.89Å; E209-G211 PolarHBondContact O-N 2.84Å; E209-G212 PolarHBondContact O-N 3Å; E209-G212 VanDerWaalsContact O-N 3.08Å; E209-T214 WeakPolarHBondContact OE2-CA 3.37Å; E209-T214 WeakPolarHBondContact OE2-CB 3.48Å; E209-T214 PolarHBondContact OE2-N 2.78Å; E209-T214 PolarHBondContact OE2-OG1 2.91Å
210	A	68	Low	78.9	Confident	41 Å²	41	57.5 Å²	57.5	34%	0.339	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-67.3	120	-179.5	0	0	0	0	0	110.7	G212 Q215 N597	A210-G212 VanDerWaalsContact C-N 3.27Å; A210-G212 PolarHBondContact O-N 2.81Å; A210-Q215 PolarHBondContact O-NE2 2.68Å; A210-N597 HydrophobicContact CB-CB 3.78Å
211	G	65.3	Low	79.1	Confident	56 Å²	56	57.1 Å²	57.1	58%	0.577	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	77.7	5.7	-175.7	0	0	0	0	0	114.7	E209 I213	E209-G211 PolarHBondContact O-N 2.84Å; G211-I213 PolarHBondContact O-N 2.78Å
212	G	74.5	Confident	79.4	Confident	47 Å²	47	53.9 Å²	53.9	49%	0.485	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	69	17.4	-177.4	0	0	0	0	0	114.2	E209 A210	E209-G212 PolarHBondContact O-N 3Å; E209-G212 VanDerWaalsContact O-N 3.08Å; A210-G212 VanDerWaalsContact C-N 3.27Å; A210-G212 PolarHBondContact O-N 2.81Å
213	I	78	Confident	79.6	Confident	35 Å²	35	49.9 Å²	49.9	18%	0.179	31%	0.31	C	S	.	.			trans	-120.9	136.9	-177.6	55.4	166.2	0	0	0	111.5	G211 Q215 I598 Y600	G211-I213 PolarHBondContact O-N 2.78Å; I213-Q215 HydrophobicContact CD1-CG 3.89Å; I213-Q215 HydrophobicContact CG1-CG 3.95Å; I213-Q215 PolarHBondContact O-N 2.8Å; I213-I598 HydrophobicContact CD1-CG2 4.33Å; I213-Y600 HydrophobicContact CD1-CE2 3.91Å
214	T	81.5	Confident	79.8	Confident	15 Å²	15	48.4 Å²	48.4	9%	0.092	30%	0.3	C	S	.	.			trans	-76.7	120.9	174	-49.8	0	0	0	0	109.7	T194 E209 P236	T194-T214 VanDerWaalsContact CG2-OG1 3.22Å; T194-T214 WeakPolarHBondContact CG2-OG1 3.47Å; T194-T214 PolarHBondContact OG1-OG1 3.03Å; E209-T214 WeakPolarHBondContact OE2-CA 3.37Å; E209-T214 WeakPolarHBondContact OE2-CB 3.48Å; E209-T214 PolarHBondContact OE2-N 2.78Å; E209-T214 PolarHBondContact OE2-OG1 2.91Å; T214-P236 VanDerWaalsContact O-CB 3.22Å; T214-P236 WeakPolarHBondContact O-CB 3.3Å; T214-P236 WeakPolarHBondContact O-CG 3.17Å
215	Q	82.3	Confident	80.1	Confident	5 Å²	5	45.8 Å²	45.8	2%	0.023	30%	0.297	C	S	.	.			trans	-121.3	3.6	-173.9	-65.8	178.4	86.9	0	0	113	A210 I213 F241 F574 N597	A210-Q215 PolarHBondContact O-NE2 2.68Å; I213-Q215 HydrophobicContact CD1-CG 3.89Å; I213-Q215 HydrophobicContact CG1-CG 3.95Å; I213-Q215 PolarHBondContact O-N 2.8Å; Q215-F241 HydrophobicContact CB-CZ 4.25Å; Q215-F241 HydrophobicContact CG-CE2 4.41Å; Q215-F241 HydrophobicContact CG-CZ 4.29Å; Q215-F574 HydrophobicContact CB-CZ 4.35Å; Q215-F574 VanDerWaalsContact OE1-CZ 3.24Å; Q215-N597 PolarHBondContact NE2-O 2.85Å
216	H	83.9	Confident	80.2	Confident	47 Å²	47	47.6 Å²	47.6	22%	0.218	31%	0.308	C	S	.	.	S	Bend	trans	-130.9	155.8	-177	-58.8	-69.1	0	0	0	109.9	G218 E361 D523 V524	H216-G218 PolarHBondContact O-N 2.78Å; H216-E361 WeakPolarHBondContact CB-OE1 3.37Å; H216-E361 IonicContact CG-OE1 2.75Å; H216-E361 IonicContact ND1-OE1 3.98Å; H216-D523 IonicContact CE1-OD1 3.65Å; H216-D523 IonicContact CE1-OD2 2.6Å; H216-D523 PolarHBondContact CE1-OD2 2.98Å; H216-D523 IonicContact ND1-OD2 2.67Å; H216-D523 IonicContact NE2-OD2 3.76Å; H216-V524 WeakPolarHBondContact ND1-CG2 3.43Å
217	I	87.3	Confident	80.8	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.026	33%	0.328	C	S	.	.			trans	-87.9	106.8	171.3	-50.4	179.3	0	0	0	108.6	D234 M244 I360 E361	I217-D234 WeakPolarHBondContact CA-O 3.2Å; I217-D234 WeakPolarHBondContact CG2-O 3.14Å; I217-M244 HydrophobicContact CD1-CB 3.72Å; I217-M244 HydrophobicContact CD1-CG 4.01Å; I217-M244 HydrophobicContact CD1-SD 4.5Å; I217-M244 HydrophobicContact CG1-CB 3.94Å; I217-M244 HydrophobicContact CG1-CG 4.09Å; I217-M244 HydrophobicContact CG1-SD 3.92Å; I217-I360 HydrophobicContact CB-CG2 3.77Å; I217-I360 HydrophobicContact CD1-CG2 4.36Å; I217-I360 HydrophobicContact CG2-CG2 3.4Å; I217-E361 PolarHBondContact N-OE1 2.88Å
218	G	86.1	Confident	81.3	Confident	30 Å²	30	48.2 Å²	48.2	31%	0.309	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	132.4	175.4	0	0	0	0	0	111.4	H216 L233 D234	H216-G218 PolarHBondContact O-N 2.78Å; G218-L233 CarbonylContact O-C 3.54Å; G218-L233 WeakPolarHBondContact O-CA 3.41Å; G218-D234 PolarHBondContact N-O 2.85Å; G218-D234 PolarHBondContact O-N 3.18Å
219	A	90.1	Very high	81.9	Confident	13 Å²	13	44.6 Å²	44.6	11%	0.107	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.8	170.5	0	0	0	0	0	110	F232 L233 T373 P415	A219-F232 WeakPolarHBondContact CA-O 3.24Å; A219-L233 HydrophobicContact CB-CD2 3.45Å; A219-L233 VanDerWaalsContact CB-CD2 3.45Å; A219-T373 HydrophobicContact CB-CG2 4.29Å; A219-P415 HydrophobicContact CB-CB 3.62Å; A219-P415 HydrophobicContact CB-CG 4.28Å
220	F	88.5	Confident	82.6	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.018	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	159.1	-178.7	59.1	-89.5	0	0	0	113.6	L197 R201 V222 T231 F232 D234 E402	L197-F220 HydrophobicContact CB-CE1 4.34Å; L197-F220 HydrophobicContact CB-CZ 3.7Å; L197-F220 HydrophobicContact CD1-CE1 4.1Å; L197-F220 HydrophobicContact CD1-CZ 3.93Å; L197-F220 HydrophobicContact CD2-CE1 4.49Å; L197-F220 HydrophobicContact CD2-CE2 4.31Å; L197-F220 HydrophobicContact CD2-CZ 3.55Å; L197-F220 HydrophobicContact CG-CZ 3.89Å; R201-F220 VanDerWaalsContact CD-CD2 3.45Å; R201-F220 VanDerWaalsContact CD-CE2 3.41Å; R201-F220 HydrophobicContact CG-CD2 3.54Å; R201-F220 HydrophobicContact CG-CE2 3.41Å; R201-F220 VanDerWaalsContact CG-CE2 3.41Å; R201-F220 HydrophobicContact CG-CG 4.36Å; R201-F220 HydrophobicContact CG-CZ 4.14Å; F220-V222 HydrophobicContact CD2-CG2 3.86Å; F220-V222 HydrophobicContact CE2-CG2 3.66Å; F220-T231 CarbonylContact O-C 3.51Å; F220-T231 WeakPolarHBondContact O-CA 3.43Å; F220-F232 HydrophobicContact CD2-CB 4.16Å; F220-F232 HydrophobicContact CE1-CB 4Å; F220-F232 HydrophobicContact CE2-CB 3.51Å; F220-F232 HydrophobicContact CE2-CD2 4.09Å; F220-F232 HydrophobicContact CE2-CG 4.11Å; F220-F232 HydrophobicContact CZ-CB 3.41Å; F220-F232 VanDerWaalsContact CZ-CB 3.41Å; F220-F232 HydrophobicContact CZ-CG 4.24Å; F220-F232 PolarHBondContact N-O 2.77Å; F220-F232 PolarHBondContact O-N 3.21Å; F220-D234 HydrophobicContact CE1-CB 4.38Å; F220-E402 WeakPolarHBondContact CA-OE2 3.34Å; F220-E402 VanDerWaalsContact CB-OE1 3.31Å; F220-E402 WeakPolarHBondContact CB-OE1 3.35Å; F220-E402 WeakPolarHBondContact CB-OE2 3.48Å
221	L	88.8	Confident	83.8	Confident	26 Å²	26	40.8 Å²	40.8	14%	0.136	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	102.7	-170.5	-173	67.9	0	0	0	112.2	H223 K229 T231 E402	L221-H223 PolarHBondContact O-ND1 2.95Å; L221-K229 HydrophobicContact CD1-CB 4.1Å; L221-T231 WeakPolarHBondContact CD1-OG1 3.45Å; L221-E402 PolarHBondContact N-OE2 3.31Å
222	V	87.3	Confident	85.2	Confident	11 Å²	11	38.4 Å²	38.4	7%	0.067	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	134.6	174.7	177.2	0	0	0	0	110	L200 R201 F220 L224 K229 I230 F232	L200-V222 HydrophobicContact CB-CG2 4.36Å; R201-V222 HydrophobicContact CG-CG2 4.4Å; F220-V222 HydrophobicContact CD2-CG2 3.86Å; F220-V222 HydrophobicContact CE2-CG2 3.66Å; V222-L224 HydrophobicContact CG1-CD2 4.26Å; V222-K229 WeakPolarHBondContact O-CA 3.37Å; V222-I230 PolarHBondContact N-O 3.34Å; V222-I230 PolarHBondContact O-N 2.76Å; V222-F232 HydrophobicContact CB-CD2 3.91Å; V222-F232 HydrophobicContact CB-CE2 3.83Å; V222-F232 HydrophobicContact CG1-CE2 4.4Å; V222-F232 HydrophobicContact CG2-CD2 3.53Å; V222-F232 HydrophobicContact CG2-CE2 3.8Å
223	H	86.3	Confident	86	Confident	114 Å²	114	36.1 Å²	36.1	53%	0.528	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.2	173.6	-67.8	68.7	0	0	0	108.8	L221 K229	L221-H223 PolarHBondContact O-ND1 2.95Å; H223-K229 WeakPolarHBondContact NE2-CE 3.47Å
224	L	83.1	Confident	86.7	Confident	21 Å²	21	35.1 Å²	35.1	11%	0.11	21%	0.208	C	C	.	.			trans	-80.2	153.8	179.1	-65	-177.7	0	0	0	111.5	V222 T226 G227 E228 I230 A335 V339	V222-L224 HydrophobicContact CG1-CD2 4.26Å; L224-T226 WeakPolarHBondContact CB-OG1 3.44Å; L224-T226 PolarHBondContact O-N 2.73Å; L224-T226 VanDerWaalsContact O-N 3.14Å; L224-G227 PolarHBondContact O-N 2.99Å; L224-E228 HydrophobicContact CD1-CB 4.44Å; L224-E228 PolarHBondContact N-O 3.02Å; L224-I230 HydrophobicContact CD1-CD1 3.83Å; L224-I230 HydrophobicContact CD1-CG1 4.45Å; L224-I230 HydrophobicContact CG-CD1 4.47Å; L224-A335 HydrophobicContact CD1-CB 4.07Å; L224-A335 HydrophobicContact CD2-CB 3.7Å; L224-V339 HydrophobicContact CD1-CG2 3.59Å
225	P	79.2	Confident	87	Confident	111 Å²	111	34.4 Å²	34.4	72%	0.721	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.9	172.1	-25.1	34.8	0	0	0	114.2	G227 M332	P225-G227 PolarHBondContact O-N 3.19Å; P225-M332 HydrophobicContact CG-CE 3.97Å; P225-M332 HydrophobicContact CG-SD 4.3Å
226	T	79.2	Confident	87.2	Confident	86 Å²	86	34.2 Å²	34.2	53%	0.528	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.3	174.2	56	0	0	0	0	113.4	L224 E228	L224-T226 WeakPolarHBondContact CB-OG1 3.44Å; L224-T226 PolarHBondContact O-N 2.73Å; L224-T226 VanDerWaalsContact O-N 3.14Å; T226-E228 PolarHBondContact OG1-OE1 3.06Å
227	G	82.4	Confident	87	Confident	61 Å²	61	32.3 Å²	32.3	63%	0.629	20%	0.196	S	C	*	.	S	Bend	trans	97.8	-7.7	-176.2	0	0	0	0	0	114	L224 P225	L224-G227 PolarHBondContact O-N 2.99Å; P225-G227 PolarHBondContact O-N 3.19Å
228	E	83.6	Confident	86.7	Confident	70 Å²	70	32.6 Å²	32.6	33%	0.327	20%	0.198	S	C	.	.			trans	-76.1	163.6	178.4	-72.1	175.7	-107.8	0	0	113.5	L224 T226 V339	L224-E228 HydrophobicContact CD1-CB 4.44Å; L224-E228 PolarHBondContact N-O 3.02Å; T226-E228 PolarHBondContact OG1-OE1 3.06Å; E228-V339 WeakPolarHBondContact OE1-CG1 3.27Å; E228-V339 WeakPolarHBondContact OE2-CG1 3.37Å; E228-V339 VanDerWaalsContact OE2-CG2 3.24Å; E228-V339 WeakPolarHBondContact OE2-CG2 3.45Å
229	K	88.6	Confident	86.5	Confident	96 Å²	96	32.6 Å²	32.6	42%	0.417	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.9	-175.2	-62.2	-176.7	-177	-172.8	0	109.6	P180 L221 V222 H223	P180-K229 HydrophobicContact CB-CB 4.18Å; P180-K229 WeakPolarHBondContact CB-O 3.38Å; L221-K229 HydrophobicContact CD1-CB 4.1Å; V222-K229 WeakPolarHBondContact O-CA 3.37Å; H223-K229 WeakPolarHBondContact NE2-CE 3.47Å
230	I	91.5	Very high	86	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	129.1	177	-57.4	179	0	0	0	107.9	V183 V222 L224 F232 T338 V339	V183-I230 HydrophobicContact CB-CG2 4.13Å; V183-I230 HydrophobicContact CG2-CG2 3.47Å; V183-I230 VanDerWaalsContact CG2-CG2 3.47Å; V222-I230 PolarHBondContact N-O 3.34Å; V222-I230 PolarHBondContact O-N 2.76Å; L224-I230 HydrophobicContact CD1-CD1 3.83Å; L224-I230 HydrophobicContact CD1-CG1 4.45Å; L224-I230 HydrophobicContact CG-CD1 4.47Å; I230-F232 HydrophobicContact CB-CD2 4.28Å; I230-F232 HydrophobicContact CB-CE2 3.75Å; I230-F232 HydrophobicContact CB-CZ 4.27Å; I230-F232 HydrophobicContact CD1-CZ 4.48Å; I230-F232 HydrophobicContact CG2-CD2 3.88Å; I230-F232 HydrophobicContact CG2-CE1 4.19Å; I230-F232 HydrophobicContact CG2-CE2 3.49Å; I230-F232 VanDerWaalsContact CG2-CE2 3.49Å; I230-F232 HydrophobicContact CG2-CG 4.41Å; I230-F232 HydrophobicContact CG2-CZ 3.67Å; I230-T338 HydrophobicContact CD1-CG2 4.08Å; I230-V339 HydrophobicContact CD1-CG2 4.16Å
231	T	93.2	Very high	86	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.9	172.6	-64.9	0	0	0	0	108.4	A181 V182 V183 F220 L221 L233 G413 P415	A181-T231 PolarHBondContact O-N 3.08Å; V182-T231 CarbonylContact C-O 3.6Å; V182-T231 WeakPolarHBondContact CA-O 3.03Å; V182-T231 HydrophobicContact CG1-CG2 3.9Å; V183-T231 PolarHBondContact N-O 3.07Å; F220-T231 CarbonylContact O-C 3.51Å; F220-T231 WeakPolarHBondContact O-CA 3.43Å; L221-T231 WeakPolarHBondContact CD1-OG1 3.45Å; T231-L233 HydrophobicContact CG2-CD2 4.36Å; T231-G413 WeakPolarHBondContact CB-O 3.47Å; T231-G413 PolarHBondContact OG1-O 3.48Å; T231-P415 HydrophobicContact CG2-CB 4.37Å; T231-P415 HydrophobicContact CG2-CG 3.93Å
232	F	93.3	Very high	86	Confident	5 Å²	5	33.4 Å²	33.4	2%	0.022	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	139.2	177.1	-74.7	-83.1	0	0	0	111.2	V183 V185 L197 L200 A219 F220 V222 I230 I256	V183-F232 HydrophobicContact CB-CD1 4.02Å; V183-F232 HydrophobicContact CB-CE1 4.11Å; V183-F232 HydrophobicContact CG1-CD1 4.11Å; V183-F232 HydrophobicContact CG1-CE1 3.93Å; V183-F232 CarbonylContact O-C 3.58Å; V183-F232 WeakPolarHBondContact O-CA 3.41Å; V185-F232 HydrophobicContact CG2-CD1 4.12Å; L197-F232 HydrophobicContact CD2-CB 4.1Å; L197-F232 HydrophobicContact CD2-CD1 3.9Å; L197-F232 HydrophobicContact CD2-CG 4.04Å; L200-F232 HydrophobicContact CD1-CE1 4.31Å; L200-F232 HydrophobicContact CD1-CE2 4.1Å; L200-F232 HydrophobicContact CD1-CZ 3.88Å; A219-F232 WeakPolarHBondContact CA-O 3.24Å; F220-F232 HydrophobicContact CD2-CB 4.16Å; F220-F232 HydrophobicContact CE1-CB 4Å; F220-F232 HydrophobicContact CE2-CB 3.51Å; F220-F232 HydrophobicContact CE2-CD2 4.09Å; F220-F232 HydrophobicContact CE2-CG 4.11Å; F220-F232 HydrophobicContact CZ-CB 3.41Å; F220-F232 VanDerWaalsContact CZ-CB 3.41Å; F220-F232 HydrophobicContact CZ-CG 4.24Å; F220-F232 PolarHBondContact N-O 2.77Å; F220-F232 PolarHBondContact O-N 3.21Å; V222-F232 HydrophobicContact CB-CD2 3.91Å; V222-F232 HydrophobicContact CB-CE2 3.83Å; V222-F232 HydrophobicContact CG1-CE2 4.4Å; V222-F232 HydrophobicContact CG2-CD2 3.53Å; V222-F232 HydrophobicContact CG2-CE2 3.8Å; I230-F232 HydrophobicContact CB-CD2 4.28Å; I230-F232 HydrophobicContact CB-CE2 3.75Å; I230-F232 HydrophobicContact CB-CZ 4.27Å; I230-F232 HydrophobicContact CD1-CZ 4.48Å; I230-F232 HydrophobicContact CG2-CD2 3.88Å; I230-F232 HydrophobicContact CG2-CE1 4.19Å; I230-F232 HydrophobicContact CG2-CE2 3.49Å; I230-F232 VanDerWaalsContact CG2-CE2 3.49Å; I230-F232 HydrophobicContact CG2-CG 4.41Å; I230-F232 HydrophobicContact CG2-CZ 3.67Å; F232-I256 HydrophobicContact CE1-CD1 3.91Å
233	L	92.9	Very high	86	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	116.1	168.5	-49.5	-171.7	0	0	0	109.7	V182 V183 V185 G218 A219 T231 T252 I360 I375	V182-L233 HydrophobicContact CG1-CD1 4.24Å; V182-L233 HydrophobicContact CG1-CD2 4.3Å; V182-L233 HydrophobicContact CG1-CG 4.13Å; V183-L233 PolarHBondContact O-N 2.96Å; V185-L233 PolarHBondContact N-O 2.88Å; G218-L233 CarbonylContact O-C 3.54Å; G218-L233 WeakPolarHBondContact O-CA 3.41Å; A219-L233 HydrophobicContact CB-CD2 3.45Å; A219-L233 VanDerWaalsContact CB-CD2 3.45Å; T231-L233 HydrophobicContact CG2-CD2 4.36Å; L233-T252 HydrophobicContact CD1-CG2 3.55Å; L233-T252 HydrophobicContact CG-CG2 4.04Å; L233-I360 HydrophobicContact CD1-CD1 4.49Å; L233-I375 HydrophobicContact CD1-CD1 3.74Å; L233-I375 HydrophobicContact CD2-CD1 3.47Å; L233-I375 VanDerWaalsContact CD2-CD1 3.47Å; L233-I375 HydrophobicContact CG-CD1 4.16Å
234	D	91.2	Very high	86.2	Confident	13 Å²	13	29 Å²	29	7%	0.07	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	132	168.9	-157.7	-11	0	0	0	109.2	L197 I217 G218 F220	L197-D234 HydrophobicContact CD1-CB 3.58Å; I217-D234 WeakPolarHBondContact CA-O 3.2Å; I217-D234 WeakPolarHBondContact CG2-O 3.14Å; G218-D234 PolarHBondContact N-O 2.85Å; G218-D234 PolarHBondContact O-N 3.18Å; F220-D234 HydrophobicContact CE1-CB 4.38Å
235	T	89	Confident	86.6	Confident	1 Å²	1	28 Å²	28	1%	0.006	18%	0.181	C	C	.	.			trans	-128.1	138.6	179.6	65	0	0	0	0	111.5	T184 V185 L186 K193 G237	T184-T235 HydrophobicContact CG2-CG2 3.65Å; V185-T235 PolarHBondContact O-OG1 2.91Å; L186-T235 HydrophobicContact CD2-CG2 4.46Å; L186-T235 WeakPolarHBondContact CD2-OG1 3.44Å; K193-T235 VanDerWaalsContact CE-O 3.26Å; K193-T235 WeakPolarHBondContact CE-O 3.47Å; T235-G237 PolarHBondContact O-N 3.49Å
236	P	86.4	Confident	87.2	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	16%	0.162	C	C	.	.			trans	-58.6	130.7	174.9	-29.7	39.2	0	0	0	112.8	T214 F241 M244 R245	T214-P236 VanDerWaalsContact O-CB 3.22Å; T214-P236 WeakPolarHBondContact O-CB 3.3Å; T214-P236 WeakPolarHBondContact O-CG 3.17Å; P236-F241 HydrophobicContact CB-CB 3.67Å; P236-F241 HydrophobicContact CB-CD1 4.5Å; P236-F241 HydrophobicContact CB-CD2 3.36Å; P236-F241 HydrophobicContact CB-CE2 4.1Å; P236-F241 HydrophobicContact CB-CG 3.61Å; P236-F241 HydrophobicContact CG-CB 4.3Å; P236-F241 HydrophobicContact CG-CD2 4.21Å; P236-F241 HydrophobicContact CG-CG 4.15Å; P236-M244 HydrophobicContact CG-SD 3.71Å; P236-R245 PolarHBondContact O-NH1 2.77Å
237	G	79.3	Confident	87.7	Confident	8 Å²	8	21.6 Å²	21.6	8%	0.082	14%	0.141	C	C	.	.			trans	-72.2	-28.2	178.7	0	0	0	0	0	114.4	T235 R245 Q268	T235-G237 PolarHBondContact O-N 3.49Å; G237-R245 PolarHBondContact O-NH1 3.48Å; G237-Q268 PolarHBondContact O-OE1 2.9Å
238	H	81.6	Confident	88.1	Confident	11 Å²	11	18.7 Å²	18.7	5%	0.051	11%	0.112	C	C	.	.	S	Bend	trans	-69.7	143.2	-167.1	179.5	-115	0	0	0	113.5	V189 A240 F241 R245 Y600 F726	V189-H238 HydrophobicContact CG2-CB 3.97Å; H238-A240 VanDerWaalsContact C-N 3.29Å; H238-A240 WeakPolarHBondContact ND1-CB 3.24Å; H238-A240 PolarHBondContact ND1-N 3.33Å; H238-A240 PolarHBondContact O-N 3.35Å; H238-A240 VanDerWaalsContact O-N 3.16Å; H238-F241 HydrophobicContact CB-CD2 3.98Å; H238-F241 HydrophobicContact CB-CE2 4.32Å; H238-F241 PolarHBondContact O-N 2.98Å; H238-R245 PolarHBondContact O-NH1 3.01Å; H238-R245 PolarHBondContact O-NH2 3.07Å; H238-Y600 AromaticContact CD2-CE1 3.76Å; H238-Y600 AromaticContact CD2-CZ 3.71Å; H238-Y600 PolarHBondContact CD2-OH 3.04Å; H238-Y600 AromaticContact CE1-CE1 3.43Å; H238-Y600 VanDerWaalsContact CE1-CE1 3.43Å; H238-Y600 WeakPolarHBondContact CE1-CE1 3.46Å; H238-Y600 AromaticContact CE1-CZ 3.87Å; H238-Y600 AromaticContact CG-CZ 3.82Å; H238-Y600 AromaticContact ND1-CE1 3.95Å; H238-Y600 AromaticContact ND1-CZ 3.93Å; H238-Y600 AromaticContact NE2-CE1 3.31Å; H238-Y600 VanDerWaalsContact NE2-CE1 3.31Å; H238-Y600 WeakPolarHBondContact NE2-CE1 3.49Å; H238-Y600 AromaticContact NE2-CZ 3.77Å; H238-Y600 PolarHBondContact NE2-OH 2.83Å; H238-F726 AromaticContact CE1-CD2 3.38Å; H238-F726 WeakPolarHBondContact CE1-CD2 3.34Å; H238-F726 AromaticContact CE1-CE2 3.97Å; H238-F726 AromaticContact CE1-CG 3.45Å; H238-F726 VanDerWaalsContact CE1-CG 3.45Å; H238-F726 WeakPolarHBondContact CE1-CG 2.85Å; H238-F726 WeakPolarHBondContact NE2-CB 3.38Å; H238-F726 AromaticContact NE2-CD2 3.47Å; H238-F726 WeakPolarHBondContact NE2-CD2 3.21Å; H238-F726 AromaticContact NE2-CG 3.57Å
239	A	80.4	Confident	88.5	Confident	30 Å²	30	15.4 Å²	15.4	25%	0.248	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-46.1	-47.4	-176	0	0	0	0	0	113.3	F241 S242 R245 F726	A239-F241 PolarHBondContact O-N 3.17Å; A239-S242 PolarHBondContact O-N 3.11Å; A239-R245 PolarHBondContact O-NH2 3.04Å; A239-F726 HydrophobicContact CB-CB 3.88Å
240	A	81.4	Confident	88.5	Confident	14 Å²	14	14.7 Å²	14.7	12%	0.116	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-49.6	-26.2	177.1	0	0	0	0	0	115.9	H238 I534 I599	H238-A240 VanDerWaalsContact C-N 3.29Å; H238-A240 WeakPolarHBondContact ND1-CB 3.24Å; H238-A240 PolarHBondContact ND1-N 3.33Å; H238-A240 PolarHBondContact O-N 3.35Å; H238-A240 VanDerWaalsContact O-N 3.16Å; A240-I534 HydrophobicContact CB-CD1 3.72Å; A240-I534 HydrophobicContact CB-CG1 4.15Å; A240-I599 HydrophobicContact CB-CD1 4.24Å
241	F	87.8	Confident	88.6	Confident	2 Å²	2	15 Å²	15	1%	0.009	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-97.4	25.3	-178.4	-57.6	-66.9	0	0	0	113.1	Q215 P236 H238 A239 A243 M244 R245 A530 I599	Q215-F241 HydrophobicContact CB-CZ 4.25Å; Q215-F241 HydrophobicContact CG-CE2 4.41Å; Q215-F241 HydrophobicContact CG-CZ 4.29Å; P236-F241 HydrophobicContact CB-CB 3.67Å; P236-F241 HydrophobicContact CB-CD1 4.5Å; P236-F241 HydrophobicContact CB-CD2 3.36Å; P236-F241 HydrophobicContact CB-CE2 4.1Å; P236-F241 HydrophobicContact CB-CG 3.61Å; P236-F241 HydrophobicContact CG-CB 4.3Å; P236-F241 HydrophobicContact CG-CD2 4.21Å; P236-F241 HydrophobicContact CG-CG 4.15Å; H238-F241 HydrophobicContact CB-CD2 3.98Å; H238-F241 HydrophobicContact CB-CE2 4.32Å; H238-F241 PolarHBondContact O-N 2.98Å; A239-F241 PolarHBondContact O-N 3.17Å; F241-A243 VanDerWaalsContact C-N 3.29Å; F241-A243 PolarHBondContact O-N 3.33Å; F241-M244 HydrophobicContact CB-CB 4.21Å; F241-M244 HydrophobicContact CB-CG 4.27Å; F241-M244 HydrophobicContact CB-SD 4.09Å; F241-M244 HydrophobicContact CD1-CE 3.57Å; F241-M244 HydrophobicContact CD1-CG 4.38Å; F241-M244 HydrophobicContact CD1-SD 3.63Å; F241-M244 HydrophobicContact CE1-CE 3.88Å; F241-M244 HydrophobicContact CE1-SD 4.39Å; F241-M244 HydrophobicContact CG-SD 4.11Å; F241-M244 WeakPolarHBondContact O-CA 3.4Å; F241-M244 VanDerWaalsContact O-CB 3.31Å; F241-M244 WeakPolarHBondContact O-CB 3.36Å; F241-M244 PolarHBondContact O-N 3.48Å; F241-R245 PolarHBondContact O-N 2.85Å; F241-R245 VanDerWaalsContact O-N 3.13Å; F241-A530 HydrophobicContact CD1-CB 3.52Å; F241-A530 HydrophobicContact CE1-CB 3.65Å; F241-I599 HydrophobicContact CE1-CD1 4Å; F241-I599 HydrophobicContact CE2-CG2 4.23Å; F241-I599 HydrophobicContact CZ-CB 4.39Å; F241-I599 HydrophobicContact CZ-CD1 3.82Å; F241-I599 HydrophobicContact CZ-CG2 4.15Å
242	S	88	Confident	88.6	Confident	44 Å²	44	15.5 Å²	15.5	31%	0.308	11%	0.108	S	C	.	.	H	α-helix	trans	-51	-45.2	176.6	-173.7	0	0	0	0	113.1	A239 M244 R245 A246 E271	A239-S242 PolarHBondContact O-N 3.11Å; S242-M244 VanDerWaalsContact C-N 3.26Å; S242-M244 PolarHBondContact O-N 2.73Å; S242-R245 PolarHBondContact O-N 3.3Å; S242-R245 VanDerWaalsContact O-N 3.1Å; S242-A246 PolarHBondContact O-N 3.45Å; S242-E271 WeakPolarHBondContact CB-OE1 3.36Å; S242-E271 PolarHBondContact OG-OE1 3.07Å
243	A	88.1	Confident	88.7	Confident	29 Å²	29	16.5 Å²	16.5	24%	0.24	11%	0.114	C	C	.	.	H	α-helix	trans	-59.3	-33.9	175.7	0	0	0	0	0	113.2	F241 R247	F241-A243 VanDerWaalsContact C-N 3.29Å; F241-A243 PolarHBondContact O-N 3.33Å; A243-R247 WeakPolarHBondContact O-CB 3.46Å; A243-R247 PolarHBondContact O-N 3.27Å
244	M	90.1	Very high	88.9	Confident	2 Å²	2	16.5 Å²	16.5	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-70.1	-40.9	174.7	-66.3	-170.9	-177.6	0	0	112.3	I217 P236 F241 S242 R247 G248 G526	I217-M244 HydrophobicContact CD1-CB 3.72Å; I217-M244 HydrophobicContact CD1-CG 4.01Å; I217-M244 HydrophobicContact CD1-SD 4.5Å; I217-M244 HydrophobicContact CG1-CB 3.94Å; I217-M244 HydrophobicContact CG1-CG 4.09Å; I217-M244 HydrophobicContact CG1-SD 3.92Å; P236-M244 HydrophobicContact CG-SD 3.71Å; F241-M244 HydrophobicContact CB-CB 4.21Å; F241-M244 HydrophobicContact CB-CG 4.27Å; F241-M244 HydrophobicContact CB-SD 4.09Å; F241-M244 HydrophobicContact CD1-CE 3.57Å; F241-M244 HydrophobicContact CD1-CG 4.38Å; F241-M244 HydrophobicContact CD1-SD 3.63Å; F241-M244 HydrophobicContact CE1-CE 3.88Å; F241-M244 HydrophobicContact CE1-SD 4.39Å; F241-M244 HydrophobicContact CG-SD 4.11Å; F241-M244 WeakPolarHBondContact O-CA 3.4Å; F241-M244 VanDerWaalsContact O-CB 3.31Å; F241-M244 WeakPolarHBondContact O-CB 3.36Å; F241-M244 PolarHBondContact O-N 3.48Å; S242-M244 VanDerWaalsContact C-N 3.26Å; S242-M244 PolarHBondContact O-N 2.73Å; M244-R247 PolarHBondContact O-N 2.85Å; M244-G248 PolarHBondContact O-N 2.83Å; M244-G526 VanDerWaalsContact CE-O 3.27Å; M244-G526 WeakPolarHBondContact CE-O 3.33Å
245	R	92	Very high	89.1	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.8	-45.5	175.3	-74.9	-172.7	-69.3	-74	4.1	111.5	L186 P236 G237 H238 A239 F241 S242 R247 G248 T249 E271	L186-R245 HydrophobicContact CD2-CB 4.23Å; L186-R245 HydrophobicContact CD2-CG 4.05Å; P236-R245 PolarHBondContact O-NH1 2.77Å; G237-R245 PolarHBondContact O-NH1 3.48Å; H238-R245 PolarHBondContact O-NH1 3.01Å; H238-R245 PolarHBondContact O-NH2 3.07Å; A239-R245 PolarHBondContact O-NH2 3.04Å; F241-R245 PolarHBondContact O-N 2.85Å; F241-R245 VanDerWaalsContact O-N 3.13Å; S242-R245 PolarHBondContact O-N 3.3Å; S242-R245 VanDerWaalsContact O-N 3.1Å; R245-R247 PolarHBondContact O-N 2.8Å; R245-G248 PolarHBondContact O-N 3.2Å; R245-T249 WeakPolarHBondContact O-CB 3.17Å; R245-T249 PolarHBondContact O-N 3.46Å; R245-T249 PolarHBondContact O-OG1 2.81Å; R245-E271 IonicContact CZ-OE1 2.75Å; R245-E271 IonicContact CZ-OE2 3.46Å; R245-E271 IonicContact NE-OE1 3.96Å; R245-E271 PolarHBondContact NE-OE1 3.33Å; R245-E271 IonicContact NE-OE2 3.39Å; R245-E271 VanDerWaalsContact NH2-CD 3.26Å; R245-E271 IonicContact NH2-OE1 3.41Å; R245-E271 PolarHBondContact NH2-OE1 3.35Å; R245-E271 IonicContact NH2-OE2 2.67Å; R245-E271 PolarHBondContact NH2-OE2 2.82Å
246	A	90.6	Very high	89.5	Confident	39 Å²	39	15.9 Å²	15.9	32%	0.322	11%	0.111	S	C	.	.	H	α-helix	trans	-57.6	-48.3	175.2	0	0	0	0	0	111.5	S242 T249 S250	S242-A246 PolarHBondContact O-N 3.45Å; A246-T249 PolarHBondContact O-N 3.05Å; A246-S250 PolarHBondContact O-N 3.05Å; A246-S250 PolarHBondContact O-OG 2.67Å
247	R	90.6	Very high	89.9	Confident	25 Å²	25	15.9 Å²	15.9	9%	0.094	11%	0.111	C	C	.	.	H	α-helix	trans	-60	-48.9	177.1	-176.6	-179.4	-64.9	130.9	6.7	112.3	A243 M244 R245 T249 S250 I360 A427 E529	A243-R247 WeakPolarHBondContact O-CB 3.46Å; A243-R247 PolarHBondContact O-N 3.27Å; M244-R247 PolarHBondContact O-N 2.85Å; R245-R247 PolarHBondContact O-N 2.8Å; R247-T249 VanDerWaalsContact C-N 3.33Å; R247-T249 PolarHBondContact O-N 2.72Å; R247-S250 PolarHBondContact O-N 2.69Å; R247-S250 PolarHBondContact O-OG 3.2Å; R247-I360 WeakPolarHBondContact CD-O 3.43Å; R247-A427 VanDerWaalsContact CZ-C 3.48Å; R247-A427 VanDerWaalsContact CZ-O 3.23Å; R247-A427 PolarHBondContact NE-O 3.34Å; R247-A427 PolarHBondContact NH2-O 3.24Å; R247-E529 IonicContact CZ-OE2 3.87Å; R247-E529 IonicContact NH1-OE2 3.65Å; R247-E529 PolarHBondContact NH1-OE2 2.76Å; R247-E529 VanDerWaalsContact NH2-CD 3.3Å; R247-E529 IonicContact NH2-OE1 3.43Å; R247-E529 PolarHBondContact NH2-OE1 3.5Å; R247-E529 VanDerWaalsContact NH2-OE1 3.07Å; R247-E529 IonicContact NH2-OE2 2.64Å; R247-E529 PolarHBondContact NH2-OE2 2.89Å
248	G	90.4	Very high	90.7	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-56.7	-47.6	177.1	0	0	0	0	0	112	T184 M244 R245 S250 V251 T252	T184-G248 PolarHBondContact OG1-O 3.43Å; T184-G248 VanDerWaalsContact OG1-O 3.11Å; M244-G248 PolarHBondContact O-N 2.83Å; R245-G248 PolarHBondContact O-N 3.2Å; G248-S250 PolarHBondContact O-N 2.9Å; G248-V251 PolarHBondContact O-N 2.9Å; G248-T252 PolarHBondContact O-OG1 2.64Å; G248-T252 VanDerWaalsContact O-OG1 3.06Å
249	T	91.3	Very high	91.4	Very high	1 Å²	1	15 Å²	15	1%	0.006	10%	0.104	C	C	.	.	H	α-helix	trans	-61.3	-41.7	179	-48.5	0	0	0	0	112.2	R245 A246 R247 V251 T252 V255 H275 A279 V281	R245-T249 WeakPolarHBondContact O-CB 3.17Å; R245-T249 PolarHBondContact O-N 3.46Å; R245-T249 PolarHBondContact O-OG1 2.81Å; A246-T249 PolarHBondContact O-N 3.05Å; R247-T249 VanDerWaalsContact C-N 3.33Å; R247-T249 PolarHBondContact O-N 2.72Å; T249-V251 PolarHBondContact O-N 2.94Å; T249-V251 VanDerWaalsContact O-N 3.15Å; T249-T252 PolarHBondContact O-N 3Å; T249-T252 PolarHBondContact O-OG1 2.95Å; T249-V255 HydrophobicContact CG2-CG2 4Å; T249-H275 HydrophobicContact CG2-CB 4.47Å; T249-A279 HydrophobicContact CG2-CB 3.72Å; T249-V281 HydrophobicContact CG2-CG2 4.4Å
250	S	90.3	Very high	92.2	Very high	80 Å²	80	13.6 Å²	13.6	56%	0.559	9%	0.092	S	C	*	.	H	α-helix	trans	-66.1	-14.7	-179.2	66.4	0	0	0	0	115.9	A246 R247 G248	A246-S250 PolarHBondContact O-N 3.05Å; A246-S250 PolarHBondContact O-OG 2.67Å; R247-S250 PolarHBondContact O-N 2.69Å; R247-S250 PolarHBondContact O-OG 3.2Å; G248-S250 PolarHBondContact O-N 2.9Å
251	V	91.9	Very high	92.9	Very high	11 Å²	11	13 Å²	13	7%	0.067	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-1.6	-178.5	-170.7	0	0	0	0	111.7	G248 T249 T358 I360 I375	G248-V251 PolarHBondContact O-N 2.9Å; T249-V251 PolarHBondContact O-N 2.94Å; T249-V251 VanDerWaalsContact O-N 3.15Å; V251-T358 HydrophobicContact CG2-CG2 3.7Å; V251-I360 HydrophobicContact CB-CD1 4.25Å; V251-I360 HydrophobicContact CG1-CD1 4.07Å; V251-I360 HydrophobicContact CG2-CD1 4.09Å; V251-I375 HydrophobicContact CG1-CB 4.15Å; V251-I375 HydrophobicContact CG1-CD1 3.96Å; V251-I375 HydrophobicContact CG1-CG2 4.4Å
252	T	94.6	Very high	93.1	Very high	10 Å²	10	15 Å²	15	6%	0.061	10%	0.097	C	C	.	.			trans	-110.3	152.1	-172	45.2	0	0	0	0	115.1	V182 T184 L233 G248 T249	V182-T252 HydrophobicContact CB-CG2 4.05Å; V182-T252 HydrophobicContact CG1-CG2 3.67Å; V182-T252 VanDerWaalsContact O-CB 3.26Å; V182-T252 WeakPolarHBondContact O-CB 3.3Å; V182-T252 WeakPolarHBondContact O-CG2 3.36Å; T184-T252 WeakPolarHBondContact OG1-CG2 3.44Å; T184-T252 PolarHBondContact OG1-OG1 3.44Å; L233-T252 HydrophobicContact CD1-CG2 3.55Å; L233-T252 HydrophobicContact CG-CG2 4.04Å; G248-T252 PolarHBondContact O-OG1 2.64Å; G248-T252 VanDerWaalsContact O-OG1 3.06Å; T249-T252 PolarHBondContact O-N 3Å; T249-T252 PolarHBondContact O-OG1 2.95Å
253	D	95.5	Very high	93.4	Very high	27 Å²	27	15.3 Å²	15.3	14%	0.144	10%	0.095	C	C	.	.	S	Bend	trans	-89	-27.3	-179.7	-51.4	-63.1	0	0	0	111.9	R179 V182 P282 L347	R179-D253 IonicContact CZ-OD1 2.7Å; R179-D253 IonicContact CZ-OD2 3.76Å; R179-D253 IonicContact NH1-OD1 3.56Å; R179-D253 PolarHBondContact NH1-OD1 2.86Å; R179-D253 IonicContact NH1-OD2 2.76Å; R179-D253 PolarHBondContact NH1-OD2 3.43Å; R179-D253 IonicContact NH2-OD1 3.92Å; R179-D253 PolarHBondContact NH2-OD1 2.82Å; R179-D253 IonicContact NH2-OD2 3.92Å; V182-D253 PolarHBondContact N-OD2 2.6Å; V182-D253 PolarHBondContact O-N 3.09Å; D253-P282 WeakPolarHBondContact O-CD 3.43Å; D253-P282 WeakPolarHBondContact O-CG 3.33Å; D253-L347 HydrophobicContact CB-CD1 3.73Å; D253-L347 HydrophobicContact CB-CD2 3.95Å
254	I	95.9	Very high	93.7	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	141.7	-176.4	-60.3	170.3	0	0	0	108.6	V182 V183 T184 I284 T338 L341 A342 L345	V182-I254 PolarHBondContact O-N 3.46Å; V183-I254 VanDerWaalsContact CA-O 3.3Å; V183-I254 WeakPolarHBondContact CA-O 3.38Å; V183-I254 HydrophobicContact CG1-CB 4.46Å; V183-I254 HydrophobicContact CG1-CG2 4.38Å; V183-I254 HydrophobicContact CG2-CB 4.29Å; T184-I254 PolarHBondContact N-O 3.4Å; T184-I254 VanDerWaalsContact N-O 3.09Å; I254-I284 HydrophobicContact CG2-CD1 4Å; I254-I284 HydrophobicContact CG2-CG1 4.19Å; I254-T338 HydrophobicContact CD1-CG2 4.22Å; I254-L341 HydrophobicContact CB-CD2 4.45Å; I254-L341 HydrophobicContact CD1-CB 4.06Å; I254-L341 HydrophobicContact CD1-CD2 3.95Å; I254-L341 HydrophobicContact CD1-CG 3.9Å; I254-L341 HydrophobicContact CG1-CD2 3.9Å; I254-L341 HydrophobicContact CG1-CG 4.17Å; I254-L341 HydrophobicContact CG2-CD2 3.75Å; I254-A342 HydrophobicContact CD1-CB 3.99Å; I254-L345 HydrophobicContact CD1-CD1 4.27Å; I254-L345 HydrophobicContact CG1-CD1 3.87Å
255	V	96.4	Very high	93.9	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131.1	169.3	167.5	0	0	0	0	110.2	T184 L186 T249 A276 V281 P282 L283 I284	T184-V255 WeakPolarHBondContact O-CA 3.42Å; L186-V255 HydrophobicContact CB-CG1 4.23Å; L186-V255 HydrophobicContact CD1-CG1 3.69Å; L186-V255 HydrophobicContact CD1-CG2 4.33Å; L186-V255 HydrophobicContact CG-CG1 3.88Å; T249-V255 HydrophobicContact CG2-CG2 4Å; V255-A276 HydrophobicContact CB-CB 4.44Å; V255-A276 HydrophobicContact CG1-CB 4.45Å; V255-A276 HydrophobicContact CG2-CB 4.21Å; V255-V281 HydrophobicContact CG2-CB 4.37Å; V255-V281 HydrophobicContact CG2-CG1 3.88Å; V255-P282 PolarHBondContact N-O 3.45Å; V255-L283 HydrophobicContact CG1-CD1 4.38Å; V255-L283 HydrophobicContact CG1-CG 4.45Å; V255-L283 CarbonylContact O-C 3.54Å; V255-L283 WeakPolarHBondContact O-CA 3.21Å; V255-I284 PolarHBondContact O-N 3.21Å
256	I	96.4	Very high	93.9	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	113.8	164.2	-62.6	177.1	0	0	0	108.3	V183 T184 V185 L186 F232 V258 I284 A286 L334	V183-I256 HydrophobicContact CG1-CD1 3.73Å; V183-I256 HydrophobicContact CG1-CG1 3.71Å; T184-I256 PolarHBondContact O-N 3.01Å; V185-I256 WeakPolarHBondContact CA-O 3.46Å; V185-I256 HydrophobicContact CG2-CB 4.41Å; L186-I256 PolarHBondContact N-O 3.48Å; F232-I256 HydrophobicContact CE1-CD1 3.91Å; I256-V258 HydrophobicContact CG2-CG2 4.2Å; I256-I284 CarbonylContact C-O 3.58Å; I256-I284 WeakPolarHBondContact CA-O 3.34Å; I256-I284 HydrophobicContact CG1-CB 4.42Å; I256-A286 HydrophobicContact CG2-CB 3.7Å; I256-L334 HydrophobicContact CD1-CD1 4.39Å; I256-L334 HydrophobicContact CD1-CD2 4.43Å; I256-L334 HydrophobicContact CD1-CG 4.39Å; I256-L334 HydrophobicContact CG2-CD1 4.43Å; I256-L334 HydrophobicContact CG2-CD2 4.45Å
257	L	96.1	Very high	93.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	113.1	174.4	-173.9	70.8	0	0	0	109.8	L186 V259 T269 I273 L283 I284 L285 A286 L304	L186-L257 HydrophobicContact CB-CD1 4.29Å; L257-V259 HydrophobicContact CD2-CG2 4.06Å; L257-V259 HydrophobicContact CG-CG2 3.98Å; L257-T269 HydrophobicContact CD1-CG2 4Å; L257-T269 HydrophobicContact CD2-CG2 3.95Å; L257-T269 HydrophobicContact CG-CG2 4.19Å; L257-I273 HydrophobicContact CD2-CD1 3.99Å; L257-I273 HydrophobicContact CD2-CG1 3.69Å; L257-L283 HydrophobicContact CB-CD1 4.05Å; L257-L283 HydrophobicContact CB-CD2 3.93Å; L257-L283 HydrophobicContact CB-CG 4.08Å; L257-L283 HydrophobicContact CD2-CD1 4.23Å; L257-L283 HydrophobicContact CD2-CD2 4.33Å; L257-I284 PolarHBondContact N-O 2.89Å; L257-L285 HydrophobicContact CD2-CD1 4.38Å; L257-A286 PolarHBondContact O-N 2.99Å; L257-L304 HydrophobicContact CD2-CD2 4.28Å
258	V	95.9	Very high	93.9	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	115	179.1	-171.7	0	0	0	0	110.2	V185 L186 H191 K193 L196 I256 A286 N288	V185-V258 HydrophobicContact CG1-CG2 3.54Å; L186-V258 PolarHBondContact O-N 3.49Å; H191-V258 HydrophobicContact CB-CG1 4.29Å; H191-V258 PolarHBondContact ND1-O 3.37Å; H191-V258 VanDerWaalsContact O-CG1 3.29Å; H191-V258 WeakPolarHBondContact O-CG1 3.34Å; K193-V258 HydrophobicContact CG-CB 4.1Å; K193-V258 HydrophobicContact CG-CG2 4.19Å; L196-V258 HydrophobicContact CD1-CG2 3.95Å; I256-V258 HydrophobicContact CG2-CG2 4.2Å; V258-A286 WeakPolarHBondContact CA-O 3.32Å; V258-A286 HydrophobicContact CG2-CB 4.37Å; V258-N288 HydrophobicContact CG1-CB 3.84Å
259	V	96.3	Very high	94	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126.4	178.4	-169.3	0	0	0	0	109.5	H191 L257 G264 T269 L285 A286 I287 N288 V300	H191-V259 WeakPolarHBondContact ND1-CA 3.25Å; L257-V259 HydrophobicContact CD2-CG2 4.06Å; L257-V259 HydrophobicContact CG-CG2 3.98Å; V259-G264 VanDerWaalsContact CG1-O 3.24Å; V259-G264 WeakPolarHBondContact CG1-O 3.28Å; V259-T269 HydrophobicContact CG2-CG2 3.73Å; V259-L285 HydrophobicContact CB-CD1 4.25Å; V259-L285 HydrophobicContact CG2-CD1 3.7Å; V259-A286 PolarHBondContact N-O 2.92Å; V259-I287 CarbonylContact O-C 3.54Å; V259-I287 VanDerWaalsContact O-CA 3.32Å; V259-I287 WeakPolarHBondContact O-CA 3.17Å; V259-N288 PolarHBondContact O-N 3.19Å; V259-V300 HydrophobicContact CB-CG1 3.9Å; V259-V300 HydrophobicContact CG1-CG1 3.6Å; V259-V300 HydrophobicContact CG1-CG2 4.33Å
260	A	96.1	Very high	94.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	134.4	177.6	0	0	0	0	0	111.4	H191 E262 D263 G264 K289	H191-A260 HydrophobicContact CB-CB 4.39Å; H191-A260 PolarHBondContact ND1-N 2.81Å; A260-E262 VanDerWaalsContact C-N 3.26Å; A260-E262 PolarHBondContact O-N 3.2Å; A260-D263 HydrophobicContact CB-CB 4.01Å; A260-D263 WeakPolarHBondContact CB-OD2 3.19Å; A260-D263 PolarHBondContact O-N 2.97Å; A260-G264 PolarHBondContact O-N 2.87Å; A260-K289 HydrophobicContact CB-CD 3.69Å; A260-K289 HydrophobicContact CB-CG 4.12Å
261	A	95.7	Very high	94.1	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.008	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-18.7	-176.3	0	0	0	0	0	114.7	I287 N288 A295 D296	A261-I287 HydrophobicContact CB-CG2 3.82Å; A261-N288 WeakPolarHBondContact CB-O 3.5Å; A261-N288 PolarHBondContact N-O 3.08Å; A261-A295 HydrophobicContact CB-CB 3.58Å; A261-D296 PolarHBondContact O-N 3.46Å
262	E	93.8	Very high	94.2	Very high	46 Å²	46	24.3 Å²	24.3	22%	0.215	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-39.3	173.8	68.6	-171.7	154.8	0	0	111.7	A260 K289 K292 R299	A260-E262 VanDerWaalsContact C-N 3.26Å; A260-E262 PolarHBondContact O-N 3.2Å; E262-K289 HydrophobicContact CG-CD 4.2Å; E262-K289 WeakPolarHBondContact OE1-CD 3.43Å; E262-K289 WeakPolarHBondContact OE1-CE 3.42Å; E262-K289 IonicContact OE1-NZ 2.65Å; E262-K289 PolarHBondContact OE1-NZ 2.95Å; E262-K292 IonicContact OE1-NZ 3.22Å; E262-K292 PolarHBondContact OE1-NZ 2.9Å; E262-K292 WeakPolarHBondContact OE2-CD 3.37Å; E262-K292 WeakPolarHBondContact OE2-CE 3.26Å; E262-K292 IonicContact OE2-NZ 2.68Å; E262-K292 PolarHBondContact OE2-NZ 3.38Å; E262-R299 PolarHBondContact O-NH1 3.3Å
263	D	93.9	Very high	94.1	Very high	50 Å²	50	24 Å²	24	27%	0.267	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-49.6	-169.2	-65	-54.4	0	0	0	111.1	H191 A260 M266 K289 R299	H191-D263 IonicContact CD2-OD2 3.56Å; H191-D263 IonicContact NE2-OD2 2.62Å; A260-D263 HydrophobicContact CB-CB 4.01Å; A260-D263 WeakPolarHBondContact CB-OD2 3.19Å; A260-D263 PolarHBondContact O-N 2.97Å; D263-M266 HydrophobicContact CB-CE 3.67Å; D263-M266 HydrophobicContact CB-SD 4.26Å; D263-K289 IonicContact OD2-NZ 2.72Å; D263-K289 PolarHBondContact OD2-NZ 3.38Å; D263-R299 PolarHBondContact O-NH2 2.91Å; D263-R299 VanDerWaalsContact O-NH2 3.17Å
264	G	93.6	Very high	94	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.01	14%	0.135	C	C	.	.			trans	89.1	-160.9	-172.9	0	0	0	0	0	113.5	V259 A260 M266 E303	V259-G264 VanDerWaalsContact CG1-O 3.24Å; V259-G264 WeakPolarHBondContact CG1-O 3.28Å; A260-G264 PolarHBondContact O-N 2.87Å; G264-M266 PolarHBondContact O-N 2.99Å; G264-E303 VanDerWaalsContact CA-OE2 3.26Å; G264-E303 WeakPolarHBondContact CA-OE2 3.33Å
265	V	94.5	Very high	93.9	Very high	27 Å²	27	28.7 Å²	28.7	16%	0.164	14%	0.142	C	C	.	.	S	Bend	trans	-79	120.3	177.6	-177.2	0	0	0	0	110	T269 V270 E303 L304	V265-T269 HydrophobicContact CG1-CG2 4.22Å; V265-V270 HydrophobicContact CG1-CG2 3.81Å; V265-E303 HydrophobicContact CB-CB 4.14Å; V265-E303 HydrophobicContact CG2-CB 3.63Å; V265-E303 PolarHBondContact N-OE2 2.97Å; V265-L304 HydrophobicContact CG2-CD2 3.65Å; V265-L304 HydrophobicContact CG2-CG 3.69Å
266	M	93.2	Very high	93.7	Very high	61 Å²	61	28.8 Å²	28.8	30%	0.3	14%	0.143	S	C	.	.			trans	-116.2	166.8	178.1	-68.5	-178.5	166.4	0	0	111.5	H188 D263 G264 Q268 T269 V270	H188-M266 HydrophobicContact CB-CB 4.35Å; H188-M266 PolarHBondContact CD2-SD 3.1Å; H188-M266 PolarHBondContact NE2-SD 3.43Å; D263-M266 HydrophobicContact CB-CE 3.67Å; D263-M266 HydrophobicContact CB-SD 4.26Å; G264-M266 PolarHBondContact O-N 2.99Å; M266-Q268 PolarHBondContact O-N 3.46Å; M266-T269 VanDerWaalsContact O-CA 3.29Å; M266-T269 WeakPolarHBondContact O-CA 2.82Å; M266-T269 WeakPolarHBondContact O-CB 3.44Å; M266-T269 PolarHBondContact O-N 3.3Å; M266-V270 PolarHBondContact O-N 3Å
267	E	89.6	Confident	93.5	Very high	171 Å²	171	33.1 Å²	33.1	80%	0.799	16%	0.163	S	C	*	.	H	α-helix	trans	-52.2	-47.3	-173.6	-173.5	168.5	-157.2	0	0	114.3	T269 V270 E271	E267-T269 PolarHBondContact O-N 3.35Å; E267-V270 WeakPolarHBondContact O-CB 3.25Å; E267-V270 PolarHBondContact O-N 3.07Å; E267-V270 VanDerWaalsContact O-N 3.07Å; E267-E271 PolarHBondContact O-N 3.13Å
268	Q	90.4	Very high	93.4	Very high	20 Å²	20	38.7 Å²	38.7	9%	0.093	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-22.5	175.5	-63.6	165.7	1.4	0	0	113.2	H188 G237 M266 S272	H188-Q268 HydrophobicContact CB-CB 4.27Å; H188-Q268 PolarHBondContact CE1-OE1 3.09Å; H188-Q268 VanDerWaalsContact ND1-CD 3.27Å; H188-Q268 PolarHBondContact ND1-OE1 3.35Å; G237-Q268 PolarHBondContact O-OE1 2.9Å; M266-Q268 PolarHBondContact O-N 3.46Å; Q268-S272 WeakPolarHBondContact O-CB 3.44Å; Q268-S272 PolarHBondContact O-N 2.9Å; Q268-S272 PolarHBondContact O-OG 3.11Å
269	T	92.9	Very high	93.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-73.6	-42.9	172	-51.8	0	0	0	0	109.9	L257 V259 V265 M266 E267 S272 I273	L257-T269 HydrophobicContact CD1-CG2 4Å; L257-T269 HydrophobicContact CD2-CG2 3.95Å; L257-T269 HydrophobicContact CG-CG2 4.19Å; V259-T269 HydrophobicContact CG2-CG2 3.73Å; V265-T269 HydrophobicContact CG1-CG2 4.22Å; M266-T269 VanDerWaalsContact O-CA 3.29Å; M266-T269 WeakPolarHBondContact O-CA 2.82Å; M266-T269 WeakPolarHBondContact O-CB 3.44Å; M266-T269 PolarHBondContact O-N 3.3Å; E267-T269 PolarHBondContact O-N 3.35Å; T269-S272 WeakPolarHBondContact O-CB 3.23Å; T269-S272 PolarHBondContact O-N 2.82Å; T269-I273 HydrophobicContact CG2-CD1 4.43Å; T269-I273 WeakPolarHBondContact O-CG1 3.41Å; T269-I273 PolarHBondContact O-N 3.47Å
270	V	93.3	Very high	93	Very high	50 Å²	50	44.2 Å²	44.2	30%	0.303	25%	0.245	S	C	.	.	H	α-helix	trans	-61.9	-44.2	173.6	-176.4	0	0	0	0	110.9	V265 M266 E267 S272 I273 Q274 H307	V265-V270 HydrophobicContact CG1-CG2 3.81Å; M266-V270 PolarHBondContact O-N 3Å; E267-V270 WeakPolarHBondContact O-CB 3.25Å; E267-V270 PolarHBondContact O-N 3.07Å; E267-V270 VanDerWaalsContact O-N 3.07Å; V270-S272 VanDerWaalsContact C-N 3.31Å; V270-S272 PolarHBondContact O-N 2.84Å; V270-I273 WeakPolarHBondContact O-CB 3.47Å; V270-I273 PolarHBondContact O-N 3.2Å; V270-Q274 PolarHBondContact O-N 2.86Å; V270-H307 VanDerWaalsContact CG2-CE1 3.49Å; V270-H307 WeakPolarHBondContact CG2-CE1 3.33Å
271	E	91.2	Very high	93	Very high	46 Å²	46	45.2 Å²	45.2	22%	0.215	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-41	174.6	-162.9	-149.7	138.1	0	0	111.7	S242 R245 E267 I273 Q274 H275	S242-E271 WeakPolarHBondContact CB-OE1 3.36Å; S242-E271 PolarHBondContact OG-OE1 3.07Å; R245-E271 IonicContact CZ-OE1 2.75Å; R245-E271 IonicContact CZ-OE2 3.46Å; R245-E271 IonicContact NE-OE1 3.96Å; R245-E271 PolarHBondContact NE-OE1 3.33Å; R245-E271 IonicContact NE-OE2 3.39Å; R245-E271 VanDerWaalsContact NH2-CD 3.26Å; R245-E271 IonicContact NH2-OE1 3.41Å; R245-E271 PolarHBondContact NH2-OE1 3.35Å; R245-E271 IonicContact NH2-OE2 2.67Å; R245-E271 PolarHBondContact NH2-OE2 2.82Å; E267-E271 PolarHBondContact O-N 3.13Å; E271-I273 PolarHBondContact O-N 2.88Å; E271-Q274 PolarHBondContact O-N 3.45Å; E271-H275 PolarHBondContact O-CD2 2.86Å; E271-H275 PolarHBondContact O-N 3.5Å; E271-H275 IonicContact OE1-CD2 2.69Å; E271-H275 IonicContact OE1-CE1 2.88Å; E271-H275 IonicContact OE1-NE2 3.86Å; E271-H275 PolarHBondContact OE1-NE2 3.24Å
272	S	93	Very high	92.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63	-39.7	175.6	-64.2	0	0	0	0	112.8	G187 Q268 T269 V270 H275 A276	G187-S272 PolarHBondContact N-OG 3.28Å; Q268-S272 WeakPolarHBondContact O-CB 3.44Å; Q268-S272 PolarHBondContact O-N 2.9Å; Q268-S272 PolarHBondContact O-OG 3.11Å; T269-S272 WeakPolarHBondContact O-CB 3.23Å; T269-S272 PolarHBondContact O-N 2.82Å; V270-S272 VanDerWaalsContact C-N 3.31Å; V270-S272 PolarHBondContact O-N 2.84Å; S272-H275 PolarHBondContact O-N 3.02Å; S272-A276 PolarHBondContact O-N 3.24Å
273	I	93.4	Very high	93	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-45	173.3	-67.9	161.9	0	0	0	110	L257 T269 V270 E271 H275 A276 Q277 L304 H307 V309	L257-I273 HydrophobicContact CD2-CD1 3.99Å; L257-I273 HydrophobicContact CD2-CG1 3.69Å; T269-I273 HydrophobicContact CG2-CD1 4.43Å; T269-I273 WeakPolarHBondContact O-CG1 3.41Å; T269-I273 PolarHBondContact O-N 3.47Å; V270-I273 WeakPolarHBondContact O-CB 3.47Å; V270-I273 PolarHBondContact O-N 3.2Å; E271-I273 PolarHBondContact O-N 2.88Å; I273-H275 PolarHBondContact O-N 2.93Å; I273-A276 PolarHBondContact O-N 2.92Å; I273-Q277 HydrophobicContact CG2-CG 4.25Å; I273-Q277 WeakPolarHBondContact O-CB 3.41Å; I273-Q277 WeakPolarHBondContact O-CG 3.25Å; I273-Q277 PolarHBondContact O-N 2.84Å; I273-L304 HydrophobicContact CD1-CD2 3.68Å; I273-H307 HydrophobicContact CD1-CB 4.24Å; I273-V309 HydrophobicContact CD1-CG2 3.98Å; I273-V309 HydrophobicContact CG1-CG2 4.1Å; I273-V309 HydrophobicContact CG2-CG2 3.69Å
274	Q	93.4	Very high	93.1	Very high	93 Å²	93	43.9 Å²	43.9	44%	0.435	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-40.2	179.1	-168.3	66.6	62.5	0	0	112.2	V270 E271 N278	V270-Q274 PolarHBondContact O-N 2.86Å; E271-Q274 PolarHBondContact O-N 3.45Å; Q274-N278 PolarHBondContact NE2-OD1 2.83Å; Q274-N278 WeakPolarHBondContact O-CB 3.34Å; Q274-N278 PolarHBondContact O-N 2.84Å; Q274-N278 PolarHBondContact O-ND2 3.09Å; Q274-N278 PolarHBondContact O-OD1 2.89Å
275	H	93	Very high	93.2	Very high	31 Å²	31	43.9 Å²	43.9	14%	0.144	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-45.9	174.2	-71.3	-55.7	0	0	0	111.8	T249 E271 S272 I273 N278 A279	T249-H275 HydrophobicContact CG2-CB 4.47Å; E271-H275 PolarHBondContact O-CD2 2.86Å; E271-H275 PolarHBondContact O-N 3.5Å; E271-H275 IonicContact OE1-CD2 2.69Å; E271-H275 IonicContact OE1-CE1 2.88Å; E271-H275 IonicContact OE1-NE2 3.86Å; E271-H275 PolarHBondContact OE1-NE2 3.24Å; S272-H275 PolarHBondContact O-N 3.02Å; I273-H275 PolarHBondContact O-N 2.93Å; H275-N278 PolarHBondContact O-N 3.06Å; H275-A279 WeakPolarHBondContact O-CB 3.44Å; H275-A279 PolarHBondContact O-N 3.07Å
276	A	93	Very high	93.3	Very high	3 Å²	3	42.6 Å²	42.6	3%	0.025	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-45.4	178.2	0	0	0	0	0	112.2	V255 S272 I273 A279 G280 V281 L283	V255-A276 HydrophobicContact CB-CB 4.44Å; V255-A276 HydrophobicContact CG1-CB 4.45Å; V255-A276 HydrophobicContact CG2-CB 4.21Å; S272-A276 PolarHBondContact O-N 3.24Å; I273-A276 PolarHBondContact O-N 2.92Å; A276-A279 PolarHBondContact O-N 2.85Å; A276-G280 PolarHBondContact O-N 2.75Å; A276-V281 PolarHBondContact O-N 3.26Å; A276-L283 HydrophobicContact CB-CD1 4.18Å
277	Q	91.8	Very high	93.5	Very high	91 Å²	91	39.7 Å²	39.7	43%	0.425	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-44.7	176.1	-72.5	176.4	-9.8	0	0	112.2	I273 A279 G280	I273-Q277 HydrophobicContact CG2-CG 4.25Å; I273-Q277 WeakPolarHBondContact O-CB 3.41Å; I273-Q277 WeakPolarHBondContact O-CG 3.25Å; I273-Q277 PolarHBondContact O-N 2.84Å; Q277-A279 VanDerWaalsContact C-N 3.29Å; Q277-A279 PolarHBondContact O-N 2.6Å; Q277-G280 PolarHBondContact O-N 2.86Å; Q277-G280 VanDerWaalsContact O-N 3.11Å
278	N	93.1	Very high	93.8	Very high	118 Å²	118	31.8 Å²	31.8	63%	0.631	19%	0.188	S	C	*	.	H	α-helix	trans	-63.6	-34.1	178.3	-73.4	-10.5	0	0	0	112.7	Q274 H275	Q274-N278 PolarHBondContact NE2-OD1 2.83Å; Q274-N278 WeakPolarHBondContact O-CB 3.34Å; Q274-N278 PolarHBondContact O-N 2.84Å; Q274-N278 PolarHBondContact O-ND2 3.09Å; Q274-N278 PolarHBondContact O-OD1 2.89Å; H275-N278 PolarHBondContact O-N 3.06Å
279	A	92.6	Very high	94	Very high	49 Å²	49	32.3 Å²	32.3	41%	0.405	19%	0.19	S	C	.	.	H	α-helix	trans	-82.1	-13.6	175.9	0	0	0	0	0	113.3	T249 H275 A276 Q277 V281	T249-A279 HydrophobicContact CG2-CB 3.72Å; H275-A279 WeakPolarHBondContact O-CB 3.44Å; H275-A279 PolarHBondContact O-N 3.07Å; A276-A279 PolarHBondContact O-N 2.85Å; Q277-A279 VanDerWaalsContact C-N 3.29Å; Q277-A279 PolarHBondContact O-N 2.6Å; A279-V281 VanDerWaalsContact C-N 3.33Å; A279-V281 HydrophobicContact CB-CG2 3.71Å
280	G	92.6	Very high	94	Very high	66 Å²	66	34.1 Å²	34.1	68%	0.68	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	70	26.4	-175.5	0	0	0	0	0	113.9	A276 Q277	A276-G280 PolarHBondContact O-N 2.75Å; Q277-G280 PolarHBondContact O-N 2.86Å; Q277-G280 VanDerWaalsContact O-N 3.11Å
281	V	94.6	Very high	94	Very high	22 Å²	22	34.2 Å²	34.2	13%	0.133	20%	0.202	C	C	.	.			trans	-94.9	129.4	-173.9	-178.2	0	0	0	0	110.3	T249 V255 A276 A279	T249-V281 HydrophobicContact CG2-CG2 4.4Å; V255-V281 HydrophobicContact CG2-CB 4.37Å; V255-V281 HydrophobicContact CG2-CG1 3.88Å; A276-V281 PolarHBondContact O-N 3.26Å; A279-V281 VanDerWaalsContact C-N 3.33Å; A279-V281 HydrophobicContact CB-CG2 3.71Å
282	P	94.9	Very high	94	Very high	46 Å²	46	36.1 Å²	36.1	30%	0.299	21%	0.209	S	C	.	.			trans	-66.4	148.3	179.5	28.2	-36.1	0	0	0	112.2	D253 V255 L341 L345	D253-P282 WeakPolarHBondContact O-CD 3.43Å; D253-P282 WeakPolarHBondContact O-CG 3.33Å; V255-P282 PolarHBondContact N-O 3.45Å; P282-L341 HydrophobicContact CB-CD1 4.49Å; P282-L341 HydrophobicContact CB-CD2 4.22Å; P282-L341 HydrophobicContact CG-CD2 4.38Å; P282-L345 HydrophobicContact CG-CD1 3.84Å; P282-L345 HydrophobicContact CG-CD2 4.25Å
283	L	94.4	Very high	93.9	Very high	22 Å²	22	42.5 Å²	42.5	12%	0.115	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134	-167.1	-172.4	148.8	0	0	0	111.5	V255 L257 A276 V309 V318	V255-L283 HydrophobicContact CG1-CD1 4.38Å; V255-L283 HydrophobicContact CG1-CG 4.45Å; V255-L283 CarbonylContact O-C 3.54Å; V255-L283 WeakPolarHBondContact O-CA 3.21Å; L257-L283 HydrophobicContact CB-CD1 4.05Å; L257-L283 HydrophobicContact CB-CD2 3.93Å; L257-L283 HydrophobicContact CB-CG 4.08Å; L257-L283 HydrophobicContact CD2-CD1 4.23Å; L257-L283 HydrophobicContact CD2-CD2 4.33Å; A276-L283 HydrophobicContact CB-CD1 4.18Å; L283-V309 HydrophobicContact CD2-CG1 4.24Å; L283-V318 HydrophobicContact CD2-CG1 3.79Å
284	I	96.2	Very high	93.9	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.8	168.2	-60.9	178	0	0	0	108	I254 V255 I256 L257 Q319 L334 L341	I254-I284 HydrophobicContact CG2-CD1 4Å; I254-I284 HydrophobicContact CG2-CG1 4.19Å; V255-I284 PolarHBondContact O-N 3.21Å; I256-I284 CarbonylContact C-O 3.58Å; I256-I284 WeakPolarHBondContact CA-O 3.34Å; I256-I284 HydrophobicContact CG1-CB 4.42Å; L257-I284 PolarHBondContact N-O 2.89Å; I284-Q319 HydrophobicContact CG2-CB 4.4Å; I284-L334 HydrophobicContact CG2-CD1 3.75Å; I284-L341 HydrophobicContact CD1-CB 4.29Å; I284-L341 HydrophobicContact CD1-CD2 3.74Å; I284-L341 HydrophobicContact CG1-CD2 3.65Å
285	L	96.5	Very high	93.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	119.8	176.7	175.6	66.2	0	0	0	110.5	L257 V259 I287 K301 L304 V318 Q319 A320 V321	L257-L285 HydrophobicContact CD2-CD1 4.38Å; V259-L285 HydrophobicContact CB-CD1 4.25Å; V259-L285 HydrophobicContact CG2-CD1 3.7Å; L285-I287 HydrophobicContact CD1-CG1 4.33Å; L285-I287 HydrophobicContact CD2-CD1 3.92Å; L285-I287 HydrophobicContact CD2-CG1 3.89Å; L285-I287 HydrophobicContact CG-CD1 4.43Å; L285-I287 HydrophobicContact CG-CG1 3.85Å; L285-K301 HydrophobicContact CD2-CG 4.45Å; L285-L304 HydrophobicContact CD1-CD1 3.49Å; L285-L304 VanDerWaalsContact CD1-CD1 3.49Å; L285-L304 HydrophobicContact CD2-CD1 3.34Å; L285-L304 HydrophobicContact CG-CD1 4.02Å; L285-V318 HydrophobicContact CB-CG1 4.03Å; L285-Q319 PolarHBondContact N-O 3.38Å; L285-A320 HydrophobicContact CB-CB 4.38Å; L285-A320 HydrophobicContact CD2-CB 3.97Å; L285-A320 WeakPolarHBondContact O-CA 2.77Å; L285-V321 PolarHBondContact O-N 3.26Å
286	A	96.8	Very high	94	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	103.5	172.6	0	0	0	0	0	110.1	I256 L257 V258 V259 N288 I323 L334	I256-A286 HydrophobicContact CG2-CB 3.7Å; L257-A286 PolarHBondContact O-N 2.99Å; V258-A286 WeakPolarHBondContact CA-O 3.32Å; V258-A286 HydrophobicContact CG2-CB 4.37Å; V259-A286 PolarHBondContact N-O 2.92Å; A286-N288 PolarHBondContact O-N 3.1Å; A286-I323 HydrophobicContact CB-CD1 4Å; A286-L334 HydrophobicContact CB-CD1 4.14Å; A286-L334 HydrophobicContact CB-CD2 4.06Å
287	I	96.6	Very high	94.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	104.8	179.1	-55.5	-178.9	0	0	0	108.7	V259 A261 L285 C290 P297 V300 K301 V321 I323	V259-I287 CarbonylContact O-C 3.54Å; V259-I287 VanDerWaalsContact O-CA 3.32Å; V259-I287 WeakPolarHBondContact O-CA 3.17Å; A261-I287 HydrophobicContact CB-CG2 3.82Å; L285-I287 HydrophobicContact CD1-CG1 4.33Å; L285-I287 HydrophobicContact CD2-CD1 3.92Å; L285-I287 HydrophobicContact CD2-CG1 3.89Å; L285-I287 HydrophobicContact CG-CD1 4.43Å; L285-I287 HydrophobicContact CG-CG1 3.85Å; I287-C290 PolarHBondContact O-SG 2.66Å; I287-P297 HydrophobicContact CD1-CB 4.05Å; I287-P297 HydrophobicContact CG2-CB 4.03Å; I287-P297 HydrophobicContact CG2-CG 4.31Å; I287-V300 HydrophobicContact CD1-CB 4.21Å; I287-V300 HydrophobicContact CD1-CG1 4.14Å; I287-V300 HydrophobicContact CG1-CG1 4.18Å; I287-V300 HydrophobicContact CG2-CG2 4.32Å; I287-K301 HydrophobicContact CD1-CD 4.41Å; I287-K301 HydrophobicContact CD1-CG 3.87Å; I287-V321 PolarHBondContact N-O 3.31Å; I287-I323 WeakPolarHBondContact O-CG1 3.48Å; I287-I323 PolarHBondContact O-N 2.83Å
288	N	95.6	Very high	94.2	Very high	5 Å²	5	51 Å²	51	3%	0.027	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	170.5	-172.3	-163.4	17.3	0	0	0	113.1	H191 V258 V259 A261 A286 C290 I323 A325	H191-N288 PolarHBondContact O-ND2 3.49Å; V258-N288 HydrophobicContact CG1-CB 3.84Å; V259-N288 PolarHBondContact O-N 3.19Å; A261-N288 WeakPolarHBondContact CB-O 3.5Å; A261-N288 PolarHBondContact N-O 3.08Å; A286-N288 PolarHBondContact O-N 3.1Å; N288-C290 VanDerWaalsContact C-N 3.25Å; N288-C290 PolarHBondContact O-N 3.18Å; N288-I323 WeakPolarHBondContact CA-O 3.36Å; N288-I323 HydrophobicContact CB-CD1 4.25Å; N288-I323 HydrophobicContact CB-CG1 4.07Å; N288-A325 WeakPolarHBondContact OD1-CB 3.26Å; N288-A325 PolarHBondContact OD1-N 3.34Å
289	K	94.9	Very high	94.3	Very high	31 Å²	31	50.2 Å²	50.2	14%	0.135	29%	0.287	C	S	.	.			trans	63	24.9	-177.7	-45	-177.2	-169	163.6	0	114	D190 A260 E262 D263 D291 K292	D190-K289 WeakPolarHBondContact O-CE 3.23Å; D190-K289 PolarHBondContact O-NZ 3.2Å; D190-K289 VanDerWaalsContact O-NZ 3.12Å; A260-K289 HydrophobicContact CB-CD 3.69Å; A260-K289 HydrophobicContact CB-CG 4.12Å; E262-K289 HydrophobicContact CG-CD 4.2Å; E262-K289 WeakPolarHBondContact OE1-CD 3.43Å; E262-K289 WeakPolarHBondContact OE1-CE 3.42Å; E262-K289 IonicContact OE1-NZ 2.65Å; E262-K289 PolarHBondContact OE1-NZ 2.95Å; D263-K289 IonicContact OD2-NZ 2.72Å; D263-K289 PolarHBondContact OD2-NZ 3.38Å; K289-D291 WeakPolarHBondContact CA-OD1 3.49Å; K289-D291 PolarHBondContact O-N 3.03Å; K289-K292 HydrophobicContact CB-CD 4.35Å; K289-K292 PolarHBondContact O-N 2.86Å; K289-K292 VanDerWaalsContact O-N 3.08Å
290	C	93.3	Very high	94.4	Very high	39 Å²	39	47.9 Å²	47.9	26%	0.264	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-7.4	177.7	-66	0	0	0	0	114.1	I287 N288 K292 I323	I287-C290 PolarHBondContact O-SG 2.66Å; N288-C290 VanDerWaalsContact C-N 3.25Å; N288-C290 PolarHBondContact O-N 3.18Å; C290-K292 VanDerWaalsContact C-N 3.35Å; C290-I323 WeakPolarHBondContact CB-O 3.21Å; C290-I323 PolarHBondContact N-O 3.16Å; C290-I323 PolarHBondContact SG-O 2.92Å
291	D	93.2	Very high	94.5	Very high	52 Å²	52	45.2 Å²	45.2	28%	0.278	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-13.8	172.8	55.4	-70.7	0	0	0	114.8	K289 S324 K327	K289-D291 WeakPolarHBondContact CA-OD1 3.49Å; K289-D291 PolarHBondContact O-N 3.03Å; D291-S324 VanDerWaalsContact OD1-CB 3.32Å; D291-S324 WeakPolarHBondContact OD1-CB 3.23Å; D291-S324 PolarHBondContact OD1-OG 3.48Å; D291-K327 HydrophobicContact CB-CD 3.84Å; D291-K327 HydrophobicContact CB-CG 4.37Å; D291-K327 VanDerWaalsContact CB-NZ 3.32Å
292	K	92	Very high	94.4	Very high	86 Å²	86	49.4 Å²	49.4	37%	0.374	25%	0.254	S	S	.	.	S	Bend	trans	-80.3	146.6	178.1	-72	-173.1	167.4	-172.5	0	111.8	E262 K289 C290 E294 A295	E262-K292 IonicContact OE1-NZ 3.22Å; E262-K292 PolarHBondContact OE1-NZ 2.9Å; E262-K292 WeakPolarHBondContact OE2-CD 3.37Å; E262-K292 WeakPolarHBondContact OE2-CE 3.26Å; E262-K292 IonicContact OE2-NZ 2.68Å; E262-K292 PolarHBondContact OE2-NZ 3.38Å; K289-K292 HydrophobicContact CB-CD 4.35Å; K289-K292 PolarHBondContact O-N 2.86Å; K289-K292 VanDerWaalsContact O-N 3.08Å; C290-K292 VanDerWaalsContact C-N 3.35Å; K292-E294 PolarHBondContact O-N 3.39Å; K292-A295 VanDerWaalsContact O-CB 3.28Å; K292-A295 WeakPolarHBondContact O-CB 3.25Å; K292-A295 PolarHBondContact O-N 2.97Å
293	P	90.9	Very high	94.4	Very high	133 Å²	133	49.8 Å²	49.8	86%	0.864	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-18	179.3	29.9	-36.2	0	0	0	113.8
294	E	93.1	Very high	94.3	Very high	154 Å²	154	48.7 Å²	48.7	72%	0.72	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	4.8	179.4	-65.7	172.8	-164.5	0	0	112.7	K292 D296	K292-E294 PolarHBondContact O-N 3.39Å; E294-D296 PolarHBondContact O-N 2.62Å
295	A	93.9	Very high	94.1	Very high	27 Å²	27	51.8 Å²	51.8	22%	0.223	26%	0.262	C	S	.	.			trans	-70.4	121	-179.1	0	0	0	0	0	112.1	A261 K292	A261-A295 HydrophobicContact CB-CB 3.58Å; K292-A295 VanDerWaalsContact O-CB 3.28Å; K292-A295 WeakPolarHBondContact O-CB 3.25Å; K292-A295 PolarHBondContact O-N 2.97Å
296	D	94.9	Very high	93.9	Very high	71 Å²	71	55.5 Å²	55.5	38%	0.38	29%	0.293	S	S	.	.			trans	-122	88.7	172.9	-174	-11.6	0	0	0	111.4	A261 E294 E298 R299 V300	A261-D296 PolarHBondContact O-N 3.46Å; E294-D296 PolarHBondContact O-N 2.62Å; D296-E298 PolarHBondContact O-N 3.39Å; D296-E298 WeakPolarHBondContact OD1-CA 3.32Å; D296-E298 WeakPolarHBondContact OD1-CB 3.31Å; D296-E298 PolarHBondContact OD1-N 3.02Å; D296-R299 HydrophobicContact CB-CB 3.95Å; D296-R299 VanDerWaalsContact CG-CB 3.44Å; D296-R299 PolarHBondContact O-N 3.38Å; D296-R299 PolarHBondContact OD1-N 2.83Å; D296-R299 WeakPolarHBondContact OD2-CB 3.26Å; D296-V300 PolarHBondContact O-N 3.11Å
297	P	94.5	Very high	93.6	Very high	27 Å²	27	58.6 Å²	58.6	18%	0.175	31%	0.307	C	S	.	.	H	α-helix	trans	-63.1	-25.6	175.2	-24	35.4	0	0	0	114.3	I287 K301	I287-P297 HydrophobicContact CD1-CB 4.05Å; I287-P297 HydrophobicContact CG2-CB 4.03Å; I287-P297 HydrophobicContact CG2-CG 4.31Å; P297-K301 WeakPolarHBondContact O-CG 3.12Å; P297-K301 PolarHBondContact O-N 2.87Å
298	E	93.5	Very high	93.2	Very high	122 Å²	122	65 Å²	65	57%	0.57	34%	0.341	S	S	*	.	H	α-helix	trans	-72.4	-38.3	178	-67.4	-168.4	-167.3	0	0	111.5	D296 K301 K302	D296-E298 PolarHBondContact O-N 3.39Å; D296-E298 WeakPolarHBondContact OD1-CA 3.32Å; D296-E298 WeakPolarHBondContact OD1-CB 3.31Å; D296-E298 PolarHBondContact OD1-N 3.02Å; E298-K301 PolarHBondContact O-N 2.84Å; E298-K302 WeakPolarHBondContact O-CD 3.49Å; E298-K302 VanDerWaalsContact O-CG 3.25Å; E298-K302 WeakPolarHBondContact O-CG 3.41Å; E298-K302 PolarHBondContact O-N 2.85Å; E298-K302 IonicContact OE2-NZ 2.67Å; E298-K302 PolarHBondContact OE2-NZ 3.34Å
299	R	94.8	Very high	93.1	Very high	101 Å²	101	65 Å²	65	38%	0.381	34%	0.342	S	S	.	.	H	α-helix	trans	-58	-48.6	173.8	174.8	179.3	166	-129.6	-24.2	110.8	E262 D263 D296 K301 K302 E303	E262-R299 PolarHBondContact O-NH1 3.3Å; D263-R299 PolarHBondContact O-NH2 2.91Å; D263-R299 VanDerWaalsContact O-NH2 3.17Å; D296-R299 HydrophobicContact CB-CB 3.95Å; D296-R299 VanDerWaalsContact CG-CB 3.44Å; D296-R299 PolarHBondContact O-N 3.38Å; D296-R299 PolarHBondContact OD1-N 2.83Å; D296-R299 WeakPolarHBondContact OD2-CB 3.26Å; R299-K301 VanDerWaalsContact C-N 3.34Å; R299-K301 PolarHBondContact O-N 3.23Å; R299-K302 PolarHBondContact O-N 3.28Å; R299-K302 VanDerWaalsContact O-N 3.14Å; R299-E303 HydrophobicContact CG-CG 4.4Å; R299-E303 WeakPolarHBondContact CG-OE1 3.47Å; R299-E303 IonicContact CZ-OE1 2.7Å; R299-E303 IonicContact NE-OE1 3.75Å; R299-E303 PolarHBondContact NE-OE1 3.46Å; R299-E303 IonicContact NH2-OE1 2.57Å; R299-E303 PolarHBondContact NH2-OE1 3.33Å; R299-E303 IonicContact NH2-OE2 3.85Å; R299-E303 WeakPolarHBondContact O-CG 3.33Å; R299-E303 PolarHBondContact O-N 2.86Å
300	V	95.1	Very high	93	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-55	-49	177.6	177.1	0	0	0	0	111.3	V259 I287 D296 K302 E303 L304	V259-V300 HydrophobicContact CB-CG1 3.9Å; V259-V300 HydrophobicContact CG1-CG1 3.6Å; V259-V300 HydrophobicContact CG1-CG2 4.33Å; I287-V300 HydrophobicContact CD1-CB 4.21Å; I287-V300 HydrophobicContact CD1-CG1 4.14Å; I287-V300 HydrophobicContact CG1-CG1 4.18Å; I287-V300 HydrophobicContact CG2-CG2 4.32Å; D296-V300 PolarHBondContact O-N 3.11Å; V300-K302 VanDerWaalsContact C-N 3.34Å; V300-K302 PolarHBondContact O-N 2.97Å; V300-E303 PolarHBondContact O-N 2.84Å; V300-L304 HydrophobicContact CG1-CD1 3.95Å; V300-L304 WeakPolarHBondContact O-CG 3.02Å; V300-L304 PolarHBondContact O-N 3.07Å
301	K	93.9	Very high	93	Very high	11 Å²	11	65.3 Å²	65.3	5%	0.048	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-39.6	179	-66.5	168.9	174.8	176.5	0	112.2	L285 I287 P297 E298 R299 L304 L305 E313 F314	L285-K301 HydrophobicContact CD2-CG 4.45Å; I287-K301 HydrophobicContact CD1-CD 4.41Å; I287-K301 HydrophobicContact CD1-CG 3.87Å; P297-K301 WeakPolarHBondContact O-CG 3.12Å; P297-K301 PolarHBondContact O-N 2.87Å; E298-K301 PolarHBondContact O-N 2.84Å; R299-K301 VanDerWaalsContact C-N 3.34Å; R299-K301 PolarHBondContact O-N 3.23Å; K301-L304 PolarHBondContact O-N 2.85Å; K301-L305 PolarHBondContact O-N 2.59Å; K301-E313 IonicContact NZ-OE1 3.82Å; K301-E313 PolarHBondContact NZ-OE1 2.89Å; K301-E313 IonicContact NZ-OE2 2.75Å; K301-E313 PolarHBondContact NZ-OE2 3.05Å; K301-F314 HydrophobicContact CB-CE2 4.02Å
302	K	93.2	Very high	92.9	Very high	110 Å²	110	67.9 Å²	67.9	48%	0.478	35%	0.352	S	S	.	.	H	α-helix	trans	-67.4	-38.3	177.2	-70.4	161.2	-167.7	157.7	0	112.4	E298 R299 V300	E298-K302 WeakPolarHBondContact O-CD 3.49Å; E298-K302 VanDerWaalsContact O-CG 3.25Å; E298-K302 WeakPolarHBondContact O-CG 3.41Å; E298-K302 PolarHBondContact O-N 2.85Å; E298-K302 IonicContact OE2-NZ 2.67Å; E298-K302 PolarHBondContact OE2-NZ 3.34Å; R299-K302 PolarHBondContact O-N 3.28Å; R299-K302 VanDerWaalsContact O-N 3.14Å; V300-K302 VanDerWaalsContact C-N 3.34Å; V300-K302 PolarHBondContact O-N 2.97Å
303	E	94.3	Very high	92.7	Very high	53 Å²	53	70.1 Å²	70.1	25%	0.248	36%	0.363	C	S	.	.	H	α-helix	trans	-66.6	-39.4	175.3	-72.6	174.3	177.3	0	0	111.5	G264 V265 R299 V300 L305 A306 H307	G264-E303 VanDerWaalsContact CA-OE2 3.26Å; G264-E303 WeakPolarHBondContact CA-OE2 3.33Å; V265-E303 HydrophobicContact CB-CB 4.14Å; V265-E303 HydrophobicContact CG2-CB 3.63Å; V265-E303 PolarHBondContact N-OE2 2.97Å; R299-E303 HydrophobicContact CG-CG 4.4Å; R299-E303 WeakPolarHBondContact CG-OE1 3.47Å; R299-E303 IonicContact CZ-OE1 2.7Å; R299-E303 IonicContact NE-OE1 3.75Å; R299-E303 PolarHBondContact NE-OE1 3.46Å; R299-E303 IonicContact NH2-OE1 2.57Å; R299-E303 PolarHBondContact NH2-OE1 3.33Å; R299-E303 IonicContact NH2-OE2 3.85Å; R299-E303 WeakPolarHBondContact O-CG 3.33Å; R299-E303 PolarHBondContact O-N 2.86Å; V300-E303 PolarHBondContact O-N 2.84Å; E303-L305 VanDerWaalsContact C-N 3.31Å; E303-L305 PolarHBondContact O-N 3.3Å; E303-A306 WeakPolarHBondContact O-CB 3.12Å; E303-A306 PolarHBondContact O-N 2.89Å; E303-A306 VanDerWaalsContact O-N 3.08Å; E303-H307 PolarHBondContact O-CD2 3.25Å
304	L	93.6	Very high	92.7	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-65.9	-27.8	178.2	-74.4	169.6	0	0	0	114.3	L257 V265 I273 L285 V300 K301 A306 H307 V309	L257-L304 HydrophobicContact CD2-CD2 4.28Å; V265-L304 HydrophobicContact CG2-CD2 3.65Å; V265-L304 HydrophobicContact CG2-CG 3.69Å; I273-L304 HydrophobicContact CD1-CD2 3.68Å; L285-L304 HydrophobicContact CD1-CD1 3.49Å; L285-L304 VanDerWaalsContact CD1-CD1 3.49Å; L285-L304 HydrophobicContact CD2-CD1 3.34Å; L285-L304 HydrophobicContact CG-CD1 4.02Å; V300-L304 HydrophobicContact CG1-CD1 3.95Å; V300-L304 WeakPolarHBondContact O-CG 3.02Å; V300-L304 PolarHBondContact O-N 3.07Å; K301-L304 PolarHBondContact O-N 2.85Å; L304-A306 PolarHBondContact O-N 3.02Å; L304-H307 CarbonylContact O-C 3.59Å; L304-H307 PolarHBondContact O-N 3.25Å; L304-V309 CarbonylContact C-O 3.53Å; L304-V309 HydrophobicContact CB-CB 4.12Å; L304-V309 HydrophobicContact CB-CG1 4.29Å; L304-V309 HydrophobicContact CD2-CB 4.35Å; L304-V309 HydrophobicContact CD2-CG1 4.39Å; L304-V309 PolarHBondContact O-N 2.9Å
305	L	92	Very high	92.5	Very high	65 Å²	65	64.6 Å²	64.6	34%	0.34	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-60.8	-24.8	171.5	-68	173.5	0	0	0	112.9	K301 E303 H307 I310 F314	K301-L305 PolarHBondContact O-N 2.59Å; E303-L305 VanDerWaalsContact C-N 3.31Å; E303-L305 PolarHBondContact O-N 3.3Å; L305-H307 PolarHBondContact O-N 3Å; L305-I310 HydrophobicContact CD2-CB 4.21Å; L305-I310 HydrophobicContact CD2-CG1 4.13Å; L305-I310 HydrophobicContact CD2-CG2 3.95Å; L305-F314 HydrophobicContact CD1-CD1 4.4Å; L305-F314 HydrophobicContact CD1-CD2 4.26Å; L305-F314 HydrophobicContact CD1-CE2 4.39Å; L305-F314 HydrophobicContact CD1-CG 4.28Å; L305-F314 HydrophobicContact CD2-CB 4.44Å; L305-F314 HydrophobicContact CD2-CD2 4.37Å; L305-F314 HydrophobicContact CD2-CG 4.45Å
306	A	91.1	Very high	92.4	Very high	78 Å²	78	64 Å²	64	65%	0.645	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-78	-7.9	175.4	0	0	0	0	0	113.5	E303 L304	E303-A306 WeakPolarHBondContact O-CB 3.12Å; E303-A306 PolarHBondContact O-N 2.89Å; E303-A306 VanDerWaalsContact O-N 3.08Å; L304-A306 PolarHBondContact O-N 3.02Å
307	H	91.3	Very high	92.1	Very high	65 Å²	65	68.3 Å²	68.3	30%	0.301	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-118.1	24.6	-179.6	-62.9	-72.5	0	0	0	112.3	V270 I273 E303 L304 L305 V309	V270-H307 VanDerWaalsContact CG2-CE1 3.49Å; V270-H307 WeakPolarHBondContact CG2-CE1 3.33Å; I273-H307 HydrophobicContact CD1-CB 4.24Å; E303-H307 PolarHBondContact O-CD2 3.25Å; L304-H307 CarbonylContact O-C 3.59Å; L304-H307 PolarHBondContact O-N 3.25Å; L305-H307 PolarHBondContact O-N 3Å; H307-V309 PolarHBondContact O-N 2.77Å; H307-V309 VanDerWaalsContact O-N 3.16Å
308	D	89.3	Confident	92.1	Very high	134 Å²	134	68 Å²	68	72%	0.717	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	21	-179.2	-59.1	-45.3	0	0	0	115
309	V	92.1	Very high	92.1	Very high	7 Å²	7	64.6 Å²	64.6	4%	0.042	35%	0.345	C	S	.	.			trans	-100.2	91.1	175.7	178	0	0	0	0	109.3	I273 L283 L304 H307 V318	I273-V309 HydrophobicContact CD1-CG2 3.98Å; I273-V309 HydrophobicContact CG1-CG2 4.1Å; I273-V309 HydrophobicContact CG2-CG2 3.69Å; L283-V309 HydrophobicContact CD2-CG1 4.24Å; L304-V309 CarbonylContact C-O 3.53Å; L304-V309 HydrophobicContact CB-CB 4.12Å; L304-V309 HydrophobicContact CB-CG1 4.29Å; L304-V309 HydrophobicContact CD2-CB 4.35Å; L304-V309 HydrophobicContact CD2-CG1 4.39Å; L304-V309 PolarHBondContact O-N 2.9Å; H307-V309 PolarHBondContact O-N 2.77Å; H307-V309 VanDerWaalsContact O-N 3.16Å; V309-V318 HydrophobicContact CG1-CB 4.42Å; V309-V318 HydrophobicContact CG1-CG1 4.06Å; V309-V318 HydrophobicContact CG1-CG2 4.11Å
310	I	93.8	Very high	92.1	Very high	76 Å²	76	61 Å²	61	39%	0.39	34%	0.337	S	S	.	.			trans	-92.3	115.9	-175.4	-49	176.7	0	0	0	110.7	L305 F314 G316 V318	L305-I310 HydrophobicContact CD2-CB 4.21Å; L305-I310 HydrophobicContact CD2-CG1 4.13Å; L305-I310 HydrophobicContact CD2-CG2 3.95Å; I310-F314 HydrophobicContact CG2-CB 4.01Å; I310-G316 CarbonylContact O-C 3.46Å; I310-G316 WeakPolarHBondContact O-CA 3.45Å; I310-V318 WeakPolarHBondContact O-CB 3.36Å; I310-V318 PolarHBondContact O-N 2.86Å
311	C	92.8	Very high	92.2	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-74.5	154.5	178.6	-56	0	0	0	0	112.5	E313 F314 G315 G316 V318 A320	C311-E313 PolarHBondContact O-N 3.41Å; C311-E313 VanDerWaalsContact O-N 3.15Å; C311-F314 HydrophobicContact CB-CD2 4.18Å; C311-F314 PolarHBondContact O-N 3.34Å; C311-G315 PolarHBondContact O-N 2.74Å; C311-G316 PolarHBondContact O-N 3.37Å; C311-V318 CarbonylContact C-O 3.49Å; C311-V318 VanDerWaalsContact CA-O 3.25Å; C311-V318 WeakPolarHBondContact CA-O 3.16Å; C311-A320 HydrophobicContact CB-CB 4.24Å
312	E	90.1	Very high	92.3	Very high	105 Å²	105	63.7 Å²	63.7	49%	0.491	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-50.5	-38.4	177.7	-75.4	-176.4	157.8	0	0	114	F314 G315 G316 V318 Q319	E312-F314 PolarHBondContact O-N 2.68Å; E312-F314 VanDerWaalsContact O-N 3.16Å; E312-G315 PolarHBondContact O-N 2.82Å; E312-G316 VanDerWaalsContact CA-O 3.3Å; E312-G316 WeakPolarHBondContact CA-O 3.44Å; E312-V318 PolarHBondContact N-O 3.29Å; E312-Q319 HydrophobicContact CG-CG 4.16Å; E312-Q319 WeakPolarHBondContact OE1-CG 3.22Å; E312-Q319 PolarHBondContact OE1-NE2 2.88Å
313	E	88.8	Confident	92.4	Very high	133 Å²	133	58.6 Å²	58.6	62%	0.621	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-60.8	-23.6	177.5	-69.6	171.4	-171.8	0	0	113.8	K301 C311	K301-E313 IonicContact NZ-OE1 3.82Å; K301-E313 PolarHBondContact NZ-OE1 2.89Å; K301-E313 IonicContact NZ-OE2 2.75Å; K301-E313 PolarHBondContact NZ-OE2 3.05Å; C311-E313 PolarHBondContact O-N 3.41Å; C311-E313 VanDerWaalsContact O-N 3.15Å
314	F	90.3	Very high	92.4	Very high	100 Å²	100	56 Å²	56	44%	0.439	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-101	7.1	175.5	-59.5	-73.5	0	0	0	112.7	K301 L305 I310 C311 E312	K301-F314 HydrophobicContact CB-CE2 4.02Å; L305-F314 HydrophobicContact CD1-CD1 4.4Å; L305-F314 HydrophobicContact CD1-CD2 4.26Å; L305-F314 HydrophobicContact CD1-CE2 4.39Å; L305-F314 HydrophobicContact CD1-CG 4.28Å; L305-F314 HydrophobicContact CD2-CB 4.44Å; L305-F314 HydrophobicContact CD2-CD2 4.37Å; L305-F314 HydrophobicContact CD2-CG 4.45Å; I310-F314 HydrophobicContact CG2-CB 4.01Å; C311-F314 HydrophobicContact CB-CD2 4.18Å; C311-F314 PolarHBondContact O-N 3.34Å; E312-F314 PolarHBondContact O-N 2.68Å; E312-F314 VanDerWaalsContact O-N 3.16Å
315	G	89.5	Confident	92.4	Very high	72 Å²	72	56.2 Å²	56.2	74%	0.742	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	22	-180	0	0	0	0	0	115	C311 E312	C311-G315 PolarHBondContact O-N 2.74Å; E312-G315 PolarHBondContact O-N 2.82Å
316	G	91.1	Very high	92.2	Very high	15 Å²	15	59.7 Å²	59.7	16%	0.155	34%	0.338	C	S	.	.	S	Bend	trans	-98.1	-176.5	169.8	0	0	0	0	0	113.3	I310 C311 E312	I310-G316 CarbonylContact O-C 3.46Å; I310-G316 WeakPolarHBondContact O-CA 3.45Å; C311-G316 PolarHBondContact O-N 3.37Å; E312-G316 VanDerWaalsContact CA-O 3.3Å; E312-G316 WeakPolarHBondContact CA-O 3.44Å
317	D	89.4	Confident	92.2	Very high	160 Å²	160	61.4 Å²	61.4	86%	0.856	33%	0.331	S	S	*	.	S	Bend	trans	-95.3	-3.7	-174.7	-53.3	-49.2	0	0	0	113.8	Q319	D317-Q319 PolarHBondContact O-N 3.48Å
318	V	93.9	Very high	92	Very high	22 Å²	22	60 Å²	60	13%	0.133	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-87.7	114.4	-174.3	177.6	0	0	0	0	111.1	L283 L285 V309 I310 C311 E312 A320	L283-V318 HydrophobicContact CD2-CG1 3.79Å; L285-V318 HydrophobicContact CB-CG1 4.03Å; V309-V318 HydrophobicContact CG1-CB 4.42Å; V309-V318 HydrophobicContact CG1-CG1 4.06Å; V309-V318 HydrophobicContact CG1-CG2 4.11Å; I310-V318 WeakPolarHBondContact O-CB 3.36Å; I310-V318 PolarHBondContact O-N 2.86Å; C311-V318 CarbonylContact C-O 3.49Å; C311-V318 VanDerWaalsContact CA-O 3.25Å; C311-V318 WeakPolarHBondContact CA-O 3.16Å; E312-V318 PolarHBondContact N-O 3.29Å; V318-A320 PolarHBondContact O-N 3.29Å
319	Q	94	Very high	92.1	Very high	49 Å²	49	57.8 Å²	57.8	23%	0.229	32%	0.319	C	S	.	.			trans	-69.6	128	173.7	-79.8	175.1	3.6	0	0	111.2	I284 L285 E312 D317	I284-Q319 HydrophobicContact CG2-CB 4.4Å; L285-Q319 PolarHBondContact N-O 3.38Å; E312-Q319 HydrophobicContact CG-CG 4.16Å; E312-Q319 WeakPolarHBondContact OE1-CG 3.22Å; E312-Q319 PolarHBondContact OE1-NE2 2.88Å; D317-Q319 PolarHBondContact O-N 3.48Å
320	A	95.3	Very high	92.1	Very high	25 Å²	25	61.5 Å²	61.5	21%	0.207	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	108.9	-178.6	0	0	0	0	0	111.1	L285 C311 V318	L285-A320 HydrophobicContact CB-CB 4.38Å; L285-A320 HydrophobicContact CD2-CB 3.97Å; L285-A320 WeakPolarHBondContact O-CA 2.77Å; C311-A320 HydrophobicContact CB-CB 4.24Å; V318-A320 PolarHBondContact O-N 3.29Å
321	V	95.9	Very high	91.8	Very high	12 Å²	12	58.6 Å²	58.6	7%	0.073	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	119.4	-178.3	-170.2	0	0	0	0	110.3	L285 I287 I323 V333 L334 A337	L285-V321 PolarHBondContact O-N 3.26Å; I287-V321 PolarHBondContact N-O 3.31Å; V321-I323 HydrophobicContact CG1-CG2 3.86Å; V321-V333 HydrophobicContact CG1-CB 4.15Å; V321-V333 HydrophobicContact CG1-CG1 3.99Å; V321-L334 HydrophobicContact CB-CD1 4.23Å; V321-L334 HydrophobicContact CG1-CB 4.19Å; V321-L334 HydrophobicContact CG2-CD1 4.23Å; V321-A337 HydrophobicContact CG2-CB 4.18Å
322	N	95.9	Very high	91.5	Very high	57 Å²	57	62.8 Å²	62.8	31%	0.305	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	122	174	-63.4	-5.4	0	0	0	109.6	N330	N322-N330 WeakPolarHBondContact O-CB 3.42Å; N322-N330 PolarHBondContact O-ND2 3.43Å
323	I	95.9	Very high	91.5	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.01	34%	0.342	C	S	.	.			trans	-130.8	160.8	-175.7	64.8	169	0	0	0	112.8	L196 A286 I287 N288 C290 V321 N330 L331 L334	L196-I323 HydrophobicContact CD1-CD1 3.49Å; L196-I323 VanDerWaalsContact CD1-CD1 3.49Å; L196-I323 HydrophobicContact CG-CD1 4.3Å; A286-I323 HydrophobicContact CB-CD1 4Å; I287-I323 WeakPolarHBondContact O-CG1 3.48Å; I287-I323 PolarHBondContact O-N 2.83Å; N288-I323 WeakPolarHBondContact CA-O 3.36Å; N288-I323 HydrophobicContact CB-CD1 4.25Å; N288-I323 HydrophobicContact CB-CG1 4.07Å; C290-I323 WeakPolarHBondContact CB-O 3.21Å; C290-I323 PolarHBondContact N-O 3.16Å; C290-I323 PolarHBondContact SG-O 2.92Å; V321-I323 HydrophobicContact CG1-CG2 3.86Å; I323-N330 HydrophobicContact CG2-CB 4.08Å; I323-L331 HydrophobicContact CB-CD2 4.43Å; I323-L331 HydrophobicContact CD1-CD2 4.25Å; I323-L334 HydrophobicContact CD1-CD2 4.24Å; I323-L334 HydrophobicContact CG2-CB 4.35Å
324	S	95.3	Very high	91.7	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-126	104.5	159	176.1	0	0	0	0	109.2	D291 L326 K327 G328 E329	D291-S324 VanDerWaalsContact OD1-CB 3.32Å; D291-S324 WeakPolarHBondContact OD1-CB 3.23Å; D291-S324 PolarHBondContact OD1-OG 3.48Å; S324-L326 PolarHBondContact O-N 3.27Å; S324-K327 PolarHBondContact O-N 2.85Å; S324-K327 PolarHBondContact OG-N 2.92Å; S324-G328 WeakPolarHBondContact O-CA 3.42Å; S324-G328 PolarHBondContact O-N 3.32Å; S324-E329 PolarHBondContact N-O 2.93Å; S324-E329 PolarHBondContact O-N 2.89Å; S324-E329 VanDerWaalsContact O-N 3.13Å
325	A	91.6	Very high	91.6	Very high	3 Å²	3	50.5 Å²	50.5	3%	0.025	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-35.5	178.8	0	0	0	0	0	112.9	T195 L196 S199 N288	T195-A325 HydrophobicContact CG2-CB 4.16Å; L196-A325 HydrophobicContact CB-CB 4.08Å; S199-A325 PolarHBondContact OG-O 3.2Å; N288-A325 WeakPolarHBondContact OD1-CB 3.26Å; N288-A325 PolarHBondContact OD1-N 3.34Å
326	L	89.1	Confident	91.5	Very high	138 Å²	138	52.2 Å²	52.2	72%	0.723	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-40.5	-177.7	-176	148.2	0	0	0	112.6	S324	S324-L326 PolarHBondContact O-N 3.27Å
327	K	89.9	Confident	91.6	Very high	115 Å²	115	52.1 Å²	52.1	50%	0.5	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-15.9	176.4	-65.4	-175.6	-177.1	163.1	0	113.7	D291 S324 E329	D291-K327 HydrophobicContact CB-CD 3.84Å; D291-K327 HydrophobicContact CB-CG 4.37Å; D291-K327 VanDerWaalsContact CB-NZ 3.32Å; S324-K327 PolarHBondContact O-N 2.85Å; S324-K327 PolarHBondContact OG-N 2.92Å; K327-E329 VanDerWaalsContact C-N 3.33Å; K327-E329 HydrophobicContact CB-CG 3.85Å; K327-E329 HydrophobicContact CD-CG 4.38Å; K327-E329 WeakPolarHBondContact CD-OE1 3.39Å; K327-E329 IonicContact NZ-OE1 3.87Å
328	G	88	Confident	91.7	Very high	35 Å²	35	44.6 Å²	44.6	36%	0.361	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	16.5	-172.3	0	0	0	0	0	114.1	S324	S324-G328 WeakPolarHBondContact O-CA 3.42Å; S324-G328 PolarHBondContact O-N 3.32Å
329	E	91.5	Very high	91.6	Very high	87 Å²	87	44.2 Å²	44.2	41%	0.407	24%	0.239	S	C	.	.	B	Isolated β-bridge	trans	-73.4	134.5	-178.7	-66.7	170.8	179.5	0	0	110.6	S324 K327 L331	S324-E329 PolarHBondContact N-O 2.93Å; S324-E329 PolarHBondContact O-N 2.89Å; S324-E329 VanDerWaalsContact O-N 3.13Å; K327-E329 VanDerWaalsContact C-N 3.33Å; K327-E329 HydrophobicContact CB-CG 3.85Å; K327-E329 HydrophobicContact CD-CG 4.38Å; K327-E329 WeakPolarHBondContact CD-OE1 3.39Å; K327-E329 IonicContact NZ-OE1 3.87Å; E329-L331 PolarHBondContact O-N 2.93Å; E329-L331 VanDerWaalsContact O-N 3.08Å
330	N	91.1	Very high	91.5	Very high	86 Å²	86	44.1 Å²	44.1	46%	0.46	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	10.8	178.8	-62.3	-17.7	0	0	0	117.4	N322 I323 M332 V333 L334	N322-N330 WeakPolarHBondContact O-CB 3.42Å; N322-N330 PolarHBondContact O-ND2 3.43Å; I323-N330 HydrophobicContact CG2-CB 4.08Å; N330-M332 PolarHBondContact O-N 2.77Å; N330-V333 HydrophobicContact CB-CB 4.42Å; N330-V333 HydrophobicContact CB-CG2 4.39Å; N330-V333 WeakPolarHBondContact O-CB 3.47Å; N330-V333 PolarHBondContact O-N 2.99Å; N330-L334 PolarHBondContact O-N 2.94Å
331	L	88.3	Confident	91.4	Very high	15 Å²	15	43.9 Å²	43.9	8%	0.079	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-32.9	174.7	-63	-175.9	0	0	0	113.1	L196 S199 L200 I323 E329 L334 A335	L196-L331 HydrophobicContact CG-CD2 4.37Å; S199-L331 VanDerWaalsContact OG-CD1 3.26Å; S199-L331 WeakPolarHBondContact OG-CD1 3.37Å; L200-L331 HydrophobicContact CD2-CB 4.3Å; I323-L331 HydrophobicContact CB-CD2 4.43Å; I323-L331 HydrophobicContact CD1-CD2 4.25Å; E329-L331 PolarHBondContact O-N 2.93Å; E329-L331 VanDerWaalsContact O-N 3.08Å; L331-L334 PolarHBondContact O-N 3.07Å; L331-A335 PolarHBondContact O-N 2.92Å
332	M	85.5	Confident	91.2	Very high	87 Å²	87	44.1 Å²	44.1	43%	0.429	25%	0.245	S	C	.	.	H	α-helix	trans	-65.7	-39.2	173.3	-69.6	-59	-51.4	0	0	112.1	P225 N330 A335 E336	P225-M332 HydrophobicContact CG-CE 3.97Å; P225-M332 HydrophobicContact CG-SD 4.3Å; N330-M332 PolarHBondContact O-N 2.77Å; M332-A335 WeakPolarHBondContact O-CB 3.47Å; M332-A335 PolarHBondContact O-N 3.28Å; M332-E336 WeakPolarHBondContact O-CB 3.45Å; M332-E336 WeakPolarHBondContact O-CG 3.33Å; M332-E336 PolarHBondContact O-N 3.15Å
333	V	91.4	Very high	90.9	Very high	70 Å²	70	48 Å²	48	42%	0.424	26%	0.261	S	S	.	.	H	α-helix	trans	-66.5	-39.6	177.5	-176.2	0	0	0	0	110.6	V321 N330 A335 E336 A337	V321-V333 HydrophobicContact CG1-CB 4.15Å; V321-V333 HydrophobicContact CG1-CG1 3.99Å; N330-V333 HydrophobicContact CB-CB 4.42Å; N330-V333 HydrophobicContact CB-CG2 4.39Å; N330-V333 WeakPolarHBondContact O-CB 3.47Å; N330-V333 PolarHBondContact O-N 2.99Å; V333-A335 VanDerWaalsContact C-N 3.34Å; V333-E336 PolarHBondContact O-N 3.08Å; V333-A337 WeakPolarHBondContact O-CB 3.43Å; V333-A337 PolarHBondContact O-N 3.46Å
334	L	92.6	Very high	90.7	Very high	5 Å²	5	54.6 Å²	54.6	3%	0.026	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-39.4	173.7	-179.7	64.7	0	0	0	111.9	L196 I256 I284 A286 V321 I323 N330 L331 T338	L196-L334 HydrophobicContact CD1-CD2 3.98Å; I256-L334 HydrophobicContact CD1-CD1 4.39Å; I256-L334 HydrophobicContact CD1-CD2 4.43Å; I256-L334 HydrophobicContact CD1-CG 4.39Å; I256-L334 HydrophobicContact CG2-CD1 4.43Å; I256-L334 HydrophobicContact CG2-CD2 4.45Å; I284-L334 HydrophobicContact CG2-CD1 3.75Å; A286-L334 HydrophobicContact CB-CD1 4.14Å; A286-L334 HydrophobicContact CB-CD2 4.06Å; V321-L334 HydrophobicContact CB-CD1 4.23Å; V321-L334 HydrophobicContact CG1-CB 4.19Å; V321-L334 HydrophobicContact CG2-CD1 4.23Å; I323-L334 HydrophobicContact CD1-CD2 4.24Å; I323-L334 HydrophobicContact CG2-CB 4.35Å; N330-L334 PolarHBondContact O-N 2.94Å; L331-L334 PolarHBondContact O-N 3.07Å; L334-T338 WeakPolarHBondContact O-CB 3.31Å; L334-T338 PolarHBondContact O-N 3.29Å; L334-T338 PolarHBondContact O-OG1 3.03Å
335	A	88.6	Confident	90.6	Very high	6 Å²	6	57.9 Å²	57.9	5%	0.05	31%	0.31	C	S	.	.	H	α-helix	trans	-65.4	-45.6	174.8	0	0	0	0	0	111.8	L224 L331 M332 V333 A337 T338 V339	L224-A335 HydrophobicContact CD1-CB 4.07Å; L224-A335 HydrophobicContact CD2-CB 3.7Å; L331-A335 PolarHBondContact O-N 2.92Å; M332-A335 WeakPolarHBondContact O-CB 3.47Å; M332-A335 PolarHBondContact O-N 3.28Å; V333-A335 VanDerWaalsContact C-N 3.34Å; A335-A337 PolarHBondContact O-N 3.37Å; A335-T338 WeakPolarHBondContact O-CB 3.3Å; A335-T338 PolarHBondContact O-N 3.46Å; A335-V339 WeakPolarHBondContact O-CG2 3.32Å; A335-V339 PolarHBondContact O-N 3.08Å
336	E	87.6	Confident	90.5	Very high	108 Å²	108	63.8 Å²	63.8	51%	0.505	34%	0.338	S	S	.	.	H	α-helix	trans	-62.2	-39.9	176.6	-73.6	167	-166.3	0	0	112.2	M332 V333 V339 A340	M332-E336 WeakPolarHBondContact O-CB 3.45Å; M332-E336 WeakPolarHBondContact O-CG 3.33Å; M332-E336 PolarHBondContact O-N 3.15Å; V333-E336 PolarHBondContact O-N 3.08Å; E336-V339 PolarHBondContact O-N 3.18Å; E336-A340 WeakPolarHBondContact O-CB 3.28Å; E336-A340 PolarHBondContact O-N 3.16Å
337	A	92.3	Very high	90.7	Very high	13 Å²	13	58.5 Å²	58.5	11%	0.107	31%	0.31	C	S	.	.	H	α-helix	trans	-60.9	-44.2	171.4	0	0	0	0	0	112.2	V321 V333 A335 V339 A340 L341	V321-A337 HydrophobicContact CG2-CB 4.18Å; V333-A337 WeakPolarHBondContact O-CB 3.43Å; V333-A337 PolarHBondContact O-N 3.46Å; A335-A337 PolarHBondContact O-N 3.37Å; A337-V339 VanDerWaalsContact C-N 3.33Å; A337-V339 PolarHBondContact O-N 2.99Å; A337-A340 PolarHBondContact O-N 3.23Å; A337-L341 PolarHBondContact O-N 3.23Å
338	T	92.7	Very high	90.7	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.006	31%	0.306	C	S	.	.	H	α-helix	trans	-63.6	-39.2	177.2	-52.5	0	0	0	0	111.9	V183 I230 I254 L334 A335 A342	V183-T338 HydrophobicContact CG1-CG2 4.31Å; V183-T338 HydrophobicContact CG2-CG2 3.8Å; I230-T338 HydrophobicContact CD1-CG2 4.08Å; I254-T338 HydrophobicContact CD1-CG2 4.22Å; L334-T338 WeakPolarHBondContact O-CB 3.31Å; L334-T338 PolarHBondContact O-N 3.29Å; L334-T338 PolarHBondContact O-OG1 3.03Å; A335-T338 WeakPolarHBondContact O-CB 3.3Å; A335-T338 PolarHBondContact O-N 3.46Å; T338-A342 WeakPolarHBondContact O-CB 3.04Å; T338-A342 PolarHBondContact O-N 2.95Å
339	V	91.3	Very high	90.9	Very high	15 Å²	15	56.3 Å²	56.3	9%	0.091	29%	0.292	C	S	.	.	H	α-helix	trans	-63.1	-52	173.2	162.8	0	0	0	0	111.1	L224 E228 I230 A335 E336 A337 L341 A342 E343	L224-V339 HydrophobicContact CD1-CG2 3.59Å; E228-V339 WeakPolarHBondContact OE1-CG1 3.27Å; E228-V339 WeakPolarHBondContact OE2-CG1 3.37Å; E228-V339 VanDerWaalsContact OE2-CG2 3.24Å; E228-V339 WeakPolarHBondContact OE2-CG2 3.45Å; I230-V339 HydrophobicContact CD1-CG2 4.16Å; A335-V339 WeakPolarHBondContact O-CG2 3.32Å; A335-V339 PolarHBondContact O-N 3.08Å; E336-V339 PolarHBondContact O-N 3.18Å; A337-V339 VanDerWaalsContact C-N 3.33Å; A337-V339 PolarHBondContact O-N 2.99Å; V339-L341 VanDerWaalsContact C-N 3.28Å; V339-L341 PolarHBondContact O-N 2.89Å; V339-A342 WeakPolarHBondContact O-CA 3.45Å; V339-A342 WeakPolarHBondContact O-CB 3.16Å; V339-A342 PolarHBondContact O-N 3.22Å; V339-E343 HydrophobicContact CG1-CG 4.47Å; V339-E343 PolarHBondContact O-N 3.07Å
340	A	91.6	Very high	90.9	Very high	47 Å²	47	52.4 Å²	52.4	39%	0.388	27%	0.274	S	S	.	.	H	α-helix	trans	-58.7	-40	-178.6	0	0	0	0	0	112.1	E336 A337 M344	E336-A340 WeakPolarHBondContact O-CB 3.28Å; E336-A340 PolarHBondContact O-N 3.16Å; A337-A340 PolarHBondContact O-N 3.23Å; A340-M344 WeakPolarHBondContact O-CB 3.35Å; A340-M344 PolarHBondContact O-N 3.42Å
341	L	93.1	Very high	90.9	Very high	20 Å²	20	49.5 Å²	49.5	11%	0.105	26%	0.262	C	S	.	.	H	α-helix	trans	-66.4	-40.9	173.8	-176.2	61.3	0	0	0	112	I254 P282 I284 A337 V339 E343 M344 L345	I254-L341 HydrophobicContact CB-CD2 4.45Å; I254-L341 HydrophobicContact CD1-CB 4.06Å; I254-L341 HydrophobicContact CD1-CD2 3.95Å; I254-L341 HydrophobicContact CD1-CG 3.9Å; I254-L341 HydrophobicContact CG1-CD2 3.9Å; I254-L341 HydrophobicContact CG1-CG 4.17Å; I254-L341 HydrophobicContact CG2-CD2 3.75Å; P282-L341 HydrophobicContact CB-CD1 4.49Å; P282-L341 HydrophobicContact CB-CD2 4.22Å; P282-L341 HydrophobicContact CG-CD2 4.38Å; I284-L341 HydrophobicContact CD1-CB 4.29Å; I284-L341 HydrophobicContact CD1-CD2 3.74Å; I284-L341 HydrophobicContact CG1-CD2 3.65Å; A337-L341 PolarHBondContact O-N 3.23Å; V339-L341 VanDerWaalsContact C-N 3.28Å; V339-L341 PolarHBondContact O-N 2.89Å; L341-E343 PolarHBondContact O-N 2.91Å; L341-M344 HydrophobicContact CD1-CE 3.7Å; L341-M344 PolarHBondContact O-N 3.06Å; L341-L345 HydrophobicContact CG-CD1 4.26Å; L341-L345 VanDerWaalsContact O-CG 3.27Å; L341-L345 WeakPolarHBondContact O-CG 3.43Å; L341-L345 PolarHBondContact O-N 3.24Å
342	A	91.8	Very high	90.9	Very high	17 Å²	17	54.5 Å²	54.5	14%	0.14	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-36.7	176.8	0	0	0	0	0	113.1	A181 I254 T338 V339 E346 L347	A181-A342 HydrophobicContact CB-CB 3.84Å; I254-A342 HydrophobicContact CD1-CB 3.99Å; T338-A342 WeakPolarHBondContact O-CB 3.04Å; T338-A342 PolarHBondContact O-N 2.95Å; V339-A342 WeakPolarHBondContact O-CA 3.45Å; V339-A342 WeakPolarHBondContact O-CB 3.16Å; V339-A342 PolarHBondContact O-N 3.22Å; A342-E346 PolarHBondContact O-N 3.21Å; A342-L347 HydrophobicContact CB-CD1 4.04Å
343	E	90	Very high	91	Very high	137 Å²	137	51.2 Å²	51.2	64%	0.64	28%	0.281	S	S	*	.	H	α-helix	trans	-65.8	-43.6	172.3	-69.6	-166.9	138.2	0	0	111.4	V339 L341 L345 E346	V339-E343 HydrophobicContact CG1-CG 4.47Å; V339-E343 PolarHBondContact O-N 3.07Å; L341-E343 PolarHBondContact O-N 2.91Å; E343-L345 VanDerWaalsContact C-N 3.27Å; E343-L345 PolarHBondContact O-N 2.97Å; E343-E346 PolarHBondContact O-N 3.11Å
344	M	91.9	Very high	91	Very high	142 Å²	142	50.2 Å²	50.2	70%	0.7	27%	0.274	S	S	*	.	H	α-helix	trans	-61.4	-33.9	177.3	-169.1	-172.2	81.7	0	0	112.9	A340 L341 E346	A340-M344 WeakPolarHBondContact O-CB 3.35Å; A340-M344 PolarHBondContact O-N 3.42Å; L341-M344 HydrophobicContact CD1-CE 3.7Å; L341-M344 PolarHBondContact O-N 3.06Å; M344-E346 PolarHBondContact O-N 3.5Å
345	L	91.7	Very high	91.2	Very high	68 Å²	68	50.1 Å²	50.1	36%	0.356	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-5.8	175.7	-66.8	168.7	0	0	0	113.7	I254 P282 L341 E343 L347	I254-L345 HydrophobicContact CD1-CD1 4.27Å; I254-L345 HydrophobicContact CG1-CD1 3.87Å; P282-L345 HydrophobicContact CG-CD1 3.84Å; P282-L345 HydrophobicContact CG-CD2 4.25Å; L341-L345 HydrophobicContact CG-CD1 4.26Å; L341-L345 VanDerWaalsContact O-CG 3.27Å; L341-L345 WeakPolarHBondContact O-CG 3.43Å; L341-L345 PolarHBondContact O-N 3.24Å; E343-L345 VanDerWaalsContact C-N 3.27Å; E343-L345 PolarHBondContact O-N 2.97Å; L345-L347 VanDerWaalsContact C-N 3.3Å; L345-L347 HydrophobicContact CB-CD2 3.77Å; L345-L347 HydrophobicContact CB-CG 3.99Å; L345-L347 HydrophobicContact CD1-CD2 4.38Å; L345-L347 PolarHBondContact O-N 3.41Å
346	E	91.1	Very high	91.5	Very high	128 Å²	128	50.9 Å²	50.9	60%	0.598	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.6	46.8	-175.2	-62.3	-163.9	165.4	0	0	114	A342 E343 M344 K348	A342-E346 PolarHBondContact O-N 3.21Å; E343-E346 PolarHBondContact O-N 3.11Å; M344-E346 PolarHBondContact O-N 3.5Å; E346-K348 VanDerWaalsContact O-CD 3.3Å; E346-K348 WeakPolarHBondContact O-CD 3.43Å; E346-K348 WeakPolarHBondContact O-CG 3.3Å; E346-K348 PolarHBondContact O-N 3.01Å; E346-K348 IonicContact OE2-NZ 3.55Å; E346-K348 PolarHBondContact OE2-NZ 3.39Å
347	L	91.7	Very high	91.8	Very high	26 Å²	26	45.8 Å²	45.8	14%	0.136	25%	0.252	C	S	.	.			trans	-57.3	113.5	-170.7	-63.2	-179.4	0	0	0	113.5	P178 R179 A181 D253 A342 L345	P178-L347 WeakPolarHBondContact CA-O 3.2Å; R179-L347 PolarHBondContact N-O 3.38Å; R179-L347 VanDerWaalsContact N-O 3.14Å; A181-L347 HydrophobicContact CB-CD1 3.61Å; D253-L347 HydrophobicContact CB-CD1 3.73Å; D253-L347 HydrophobicContact CB-CD2 3.95Å; A342-L347 HydrophobicContact CB-CD1 4.04Å; L345-L347 VanDerWaalsContact C-N 3.3Å; L345-L347 HydrophobicContact CB-CD2 3.77Å; L345-L347 HydrophobicContact CB-CG 3.99Å; L345-L347 HydrophobicContact CD1-CD2 4.38Å; L345-L347 PolarHBondContact O-N 3.41Å
348	K	90.7	Very high	92	Very high	96 Å²	96	45.6 Å²	45.6	42%	0.417	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.5	-172.5	-79.7	155.8	-168.3	168.7	0	112	L176 T177 E346	L176-K348 HydrophobicContact CB-CB 3.98Å; L176-K348 HydrophobicContact CB-CD 4.28Å; L176-K348 HydrophobicContact CB-CG 4.21Å; L176-K348 HydrophobicContact CD1-CB 4.11Å; L176-K348 HydrophobicContact CD1-CD 4.23Å; L176-K348 HydrophobicContact CD2-CB 4.25Å; L176-K348 HydrophobicContact CG-CB 4.34Å; T177-K348 CarbonylContact O-C 3.51Å; T177-K348 WeakPolarHBondContact O-CA 3.47Å; E346-K348 VanDerWaalsContact O-CD 3.3Å; E346-K348 WeakPolarHBondContact O-CD 3.43Å; E346-K348 WeakPolarHBondContact O-CG 3.3Å; E346-K348 PolarHBondContact O-N 3.01Å; E346-K348 IonicContact OE2-NZ 3.55Å; E346-K348 PolarHBondContact OE2-NZ 3.39Å
349	A	91.6	Very high	92.1	Very high	8 Å²	8	45.6 Å²	45.6	7%	0.066	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	152.7	169.1	0	0	0	0	0	112.2	T177 R179 A351 P412	T177-A349 PolarHBondContact N-O 3.43Å; T177-A349 PolarHBondContact O-N 3.03Å; T177-A349 PolarHBondContact OG1-O 2.88Å; R179-A349 HydrophobicContact CB-CB 4.34Å; R179-A349 HydrophobicContact CG-CB 4.13Å; A349-A351 PolarHBondContact O-N 3.33Å; A349-P412 HydrophobicContact CB-CB 3.59Å; A349-P412 HydrophobicContact CB-CG 3.9Å
350	D	93.1	Very high	92.2	Very high	6 Å²	6	44.9 Å²	44.9	3%	0.032	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	112.1	168.2	158.8	28.3	0	0	0	109.2	A171 V175 T352 G353 R378 G379	A171-D350 HydrophobicContact CB-CB 3.72Å; V175-D350 HydrophobicContact CG1-CB 4.3Å; V175-D350 WeakPolarHBondContact CG1-OD1 3.47Å; D350-T352 WeakPolarHBondContact OD1-CA 3.39Å; D350-T352 PolarHBondContact OD1-N 2.59Å; D350-T352 PolarHBondContact OD1-OG1 3.16Å; D350-G353 PolarHBondContact OD1-N 3.31Å; D350-G353 WeakPolarHBondContact OD2-CA 3.46Å; D350-G353 PolarHBondContact OD2-N 3.38Å; D350-R378 HydrophobicContact CB-CG 4.06Å; D350-R378 WeakPolarHBondContact O-CG 3.39Å; D350-R378 IonicContact OD2-CZ 3.47Å; D350-R378 VanDerWaalsContact OD2-CZ 3.25Å; D350-R378 IonicContact OD2-NE 2.79Å; D350-R378 PolarHBondContact OD2-NE 2.79Å; D350-R378 IonicContact OD2-NH2 3.19Å; D350-R378 PolarHBondContact OD2-NH2 2.76Å; D350-G379 PolarHBondContact O-N 3.33Å
351	A	89.9	Confident	92.2	Very high	25 Å²	25	43.2 Å²	43.2	21%	0.207	23%	0.229	C	C	.	.	S	Bend	trans	-85.3	-9.9	177.4	0	0	0	0	0	113.8	A349 T380	A349-A351 PolarHBondContact O-N 3.33Å; A351-T380 PolarHBondContact O-N 3.32Å; A351-T380 PolarHBondContact O-OG1 3.41Å
352	T	89	Confident	92.2	Very high	119 Å²	119	42.3 Å²	42.3	73%	0.73	22%	0.224	S	C	*	.	S	Bend	trans	-99.5	-26.4	-170.3	64.2	0	0	0	0	114.1	V175 D350	V175-T352 WeakPolarHBondContact CG1-OG1 3.29Å; D350-T352 WeakPolarHBondContact OD1-CA 3.39Å; D350-T352 PolarHBondContact OD1-N 2.59Å; D350-T352 PolarHBondContact OD1-OG1 3.16Å
353	G	87.8	Confident	92.2	Very high	18 Å²	18	45.2 Å²	45.2	19%	0.186	23%	0.232	C	C	.	.	S	Bend	trans	-68.3	177.5	178	0	0	0	0	0	114.2	D350 G379	D350-G353 PolarHBondContact OD1-N 3.31Å; D350-G353 WeakPolarHBondContact OD2-CA 3.46Å; D350-G353 PolarHBondContact OD2-N 3.38Å; G353-G379 VanDerWaalsContact O-CA 3.23Å; G353-G379 WeakPolarHBondContact O-CA 3.38Å
354	L	91.8	Very high	92.3	Very high	50 Å²	50	43.9 Å²	43.9	26%	0.262	22%	0.224	S	C	.	.			trans	-60.2	152.4	168.7	-67.5	-175.7	0	0	0	110.7	R168 E433	R168-L354 VanDerWaalsContact NH2-CG 3.33Å; L354-E433 WeakPolarHBondContact CA-OE2 3.49Å; L354-E433 HydrophobicContact CB-CB 4.24Å; L354-E433 HydrophobicContact CD2-CG 4.05Å; L354-E433 WeakPolarHBondContact CD2-OE2 3.38Å
355	V	95.2	Very high	92.1	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.018	21%	0.208	C	C	.	.			trans	-69.4	130.8	-178.9	179	0	0	0	0	112.1	I376 R378 L381 E433	V355-I376 HydrophobicContact CG1-CD1 4.02Å; V355-I376 HydrophobicContact CG1-CG2 4.2Å; V355-R378 WeakPolarHBondContact CA-O 3.1Å; V355-L381 HydrophobicContact CB-CD1 4.33Å; V355-L381 HydrophobicContact CG1-CB 4.29Å; V355-L381 HydrophobicContact CG1-CD1 4.22Å; V355-L381 VanDerWaalsContact CG2-CA 3.46Å; V355-L381 HydrophobicContact CG2-CB 3.78Å; V355-L381 HydrophobicContact CG2-CD1 3.84Å; V355-L381 HydrophobicContact CG2-CG 4.44Å; V355-E433 HydrophobicContact CB-CB 3.95Å; V355-E433 WeakPolarHBondContact CG2-OE2 3.31Å; V355-E433 PolarHBondContact N-OE2 3.29Å; V355-E433 PolarHBondContact O-N 2.91Å
356	E	95.2	Very high	91.7	Very high	22 Å²	22	44.1 Å²	44.1	10%	0.103	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.1	161.5	-175.4	175.4	171.4	0	0	107.9	K167 Q377 R378 I431 L432	K167-E356 WeakPolarHBondContact CD-OE1 3.17Å; K167-E356 WeakPolarHBondContact CE-OE1 3.36Å; K167-E356 WeakPolarHBondContact CG-OE1 3.45Å; K167-E356 IonicContact NZ-OE1 2.84Å; K167-E356 PolarHBondContact NZ-OE1 2.98Å; E356-Q377 PolarHBondContact O-N 2.82Å; E356-R378 HydrophobicContact CB-CB 4.06Å; E356-R378 PolarHBondContact N-O 3.47Å; E356-R378 PolarHBondContact O-N 2.98Å; E356-I431 WeakPolarHBondContact CA-O 3.4Å; E356-L432 HydrophobicContact CB-CD2 4.4Å; E356-L432 HydrophobicContact CG-CD2 3.96Å
357	G	94.7	Very high	91.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.9	-177.4	177.9	0	0	0	0	0	112.2	I375 I431	G357-I375 CarbonylContact C-O 3.54Å; G357-I375 WeakPolarHBondContact CA-O 3.49Å; G357-I431 PolarHBondContact N-O 3.11Å; G357-I431 PolarHBondContact O-N 3.46Å
358	T	95.1	Very high	91.1	Very high	10 Å²	10	43.7 Å²	43.7	6%	0.061	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	136.3	-178.8	-47.7	0	0	0	0	110.3	V251 I360 A374 I375 Q377	V251-T358 HydrophobicContact CG2-CG2 3.7Å; T358-I360 PolarHBondContact O-N 2.93Å; T358-A374 VanDerWaalsContact O-CA 3.27Å; T358-A374 WeakPolarHBondContact O-CA 3.49Å; T358-A374 WeakPolarHBondContact O-CB 3.27Å; T358-I375 PolarHBondContact N-O 3.43Å; T358-I375 PolarHBondContact O-N 3.45Å; T358-Q377 PolarHBondContact OG1-NE2 3.33Å
359	V	95.6	Very high	91.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	120.7	170.8	-179.5	0	0	0	0	108.6	S362 T372 A389 P425 G428 D429 I431	V359-S362 VanDerWaalsContact CG1-OG 3.29Å; V359-S362 WeakPolarHBondContact CG1-OG 3.22Å; V359-T372 HydrophobicContact CG1-CG2 4.38Å; V359-A389 HydrophobicContact CG2-CB 4.35Å; V359-P425 HydrophobicContact CG2-CB 4.47Å; V359-P425 HydrophobicContact CG2-CG 4.16Å; V359-G428 VanDerWaalsContact O-CA 3.31Å; V359-G428 WeakPolarHBondContact O-CA 3.36Å; V359-G428 PolarHBondContact O-N 2.88Å; V359-D429 HydrophobicContact CG2-CB 4.23Å; V359-D429 WeakPolarHBondContact CG2-O 3.4Å; V359-D429 PolarHBondContact N-O 3.48Å; V359-I431 HydrophobicContact CG2-CD1 3.78Å; V359-I431 HydrophobicContact CG2-CG1 3.7Å
360	I	93.2	Very high	91.2	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	-49	174.6	-58.6	-54.6	0	0	0	110.1	I217 L233 R247 V251 T358 T373 I375	I217-I360 HydrophobicContact CB-CG2 3.77Å; I217-I360 HydrophobicContact CD1-CG2 4.36Å; I217-I360 HydrophobicContact CG2-CG2 3.4Å; L233-I360 HydrophobicContact CD1-CD1 4.49Å; R247-I360 WeakPolarHBondContact CD-O 3.43Å; V251-I360 HydrophobicContact CB-CD1 4.25Å; V251-I360 HydrophobicContact CG1-CD1 4.07Å; V251-I360 HydrophobicContact CG2-CD1 4.09Å; T358-I360 PolarHBondContact O-N 2.93Å; I360-T373 PolarHBondContact N-O 2.83Å; I360-I375 HydrophobicContact CD1-CD1 3.61Å; I360-I375 HydrophobicContact CD1-CG1 3.97Å; I360-I375 HydrophobicContact CG1-CD1 3.76Å; I360-I375 HydrophobicContact CG1-CG1 3.7Å
361	E	92.2	Very high	91.2	Very high	12 Å²	12	41.3 Å²	41.3	6%	0.056	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	143	-176.8	-169	-177.1	-110.6	0	0	110.3	H216 I217 T372 T373 V524	H216-E361 WeakPolarHBondContact CB-OE1 3.37Å; H216-E361 IonicContact CG-OE1 2.75Å; H216-E361 IonicContact ND1-OE1 3.98Å; I217-E361 PolarHBondContact N-OE1 2.88Å; E361-T372 CarbonylContact O-C 3.53Å; E361-T372 WeakPolarHBondContact O-CA 3.42Å; E361-T373 PolarHBondContact N-O 3.38Å; E361-T373 PolarHBondContact O-N 2.86Å; E361-V524 HydrophobicContact CG-CB 3.79Å; E361-V524 HydrophobicContact CG-CG1 4.07Å; E361-V524 HydrophobicContact CG-CG2 4.31Å
362	S	93.3	Very high	91.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.3	177.8	-56.7	0	0	0	0	111.1	V359 P425 V524 D525	V359-S362 VanDerWaalsContact CG1-OG 3.29Å; V359-S362 WeakPolarHBondContact CG1-OG 3.22Å; S362-P425 WeakPolarHBondContact CB-O 3.38Å; S362-P425 PolarHBondContact OG-O 3.09Å; S362-V524 CarbonylContact O-C 3.55Å; S362-V524 VanDerWaalsContact O-CA 3.28Å; S362-V524 WeakPolarHBondContact O-CA 3.49Å; S362-D525 PolarHBondContact O-N 2.78Å
363	R	92.2	Very high	91.7	Very high	79 Å²	79	35.4 Å²	35.4	30%	0.298	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	164.7	179.8	67	179.2	173.4	-118.5	-0.6	113.3	V371 E417 V524	R363-V371 HydrophobicContact CG-CB 4.04Å; R363-V371 HydrophobicContact CG-CG1 4.07Å; R363-V371 PolarHBondContact N-O 3.33Å; R363-V371 PolarHBondContact O-N 2.92Å; R363-V371 VanDerWaalsContact O-O 3.12Å; R363-E417 IonicContact CZ-OE1 2.75Å; R363-E417 IonicContact NE-OE1 2.72Å; R363-E417 VanDerWaalsContact NH2-CD 3.26Å; R363-E417 IonicContact NH2-OE1 3.56Å; R363-E417 PolarHBondContact NH2-OE1 3.36Å; R363-E417 IonicContact NH2-OE2 2.83Å; R363-V524 HydrophobicContact CB-CG1 4.16Å
364	K	91.3	Very high	92	Very high	108 Å²	108	34.6 Å²	34.6	47%	0.47	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	115.2	173.1	-65.8	-174.8	-164.4	153.2	0	111.5	V424 M553	K364-V424 HydrophobicContact CD-CG2 4.11Å; K364-V424 VanDerWaalsContact CE-CG2 3.48Å; K364-V424 HydrophobicContact CG-CG2 3.6Å; K364-M553 HydrophobicContact CD-CB 4.38Å; K364-M553 WeakPolarHBondContact CD-O 3.27Å; K364-M553 HydrophobicContact CG-CB 4.29Å; K364-M553 PolarHBondContact NZ-O 3.22Å
365	D	88.4	Confident	92.2	Very high	70 Å²	70	32.2 Å²	32.2	37%	0.374	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	142.9	176.1	178.6	-56.5	0	0	0	110.4	G367 K368 G369	D365-G367 PolarHBondContact OD1-N 3.43Å; D365-K368 HydrophobicContact CB-CB 3.79Å; D365-K368 PolarHBondContact OD1-N 3.41Å; D365-G369 PolarHBondContact N-O 2.92Å; D365-G369 WeakPolarHBondContact O-CA 3.46Å; D365-G369 PolarHBondContact O-N 2.87Å
366	K	83	Confident	92.2	Very high	145 Å²	145	32.1 Å²	32.1	63%	0.63	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-32.7	-176.7	-77.6	172.9	166.9	164.4	0	114.5	D555 N579	K366-D555 WeakPolarHBondContact CE-OD2 3.39Å; K366-D555 IonicContact NZ-OD2 3.85Å; K366-D555 PolarHBondContact NZ-OD2 3.28Å; K366-N579 PolarHBondContact NZ-OD1 3.49Å
367	G	84.8	Confident	92	Very high	76 Å²	76	34 Å²	34	78%	0.784	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-38.2	178.9	0	0	0	0	0	112.5	D365	D365-G367 PolarHBondContact OD1-N 3.43Å
368	K	85.8	Confident	91.9	Very high	70 Å²	70	35.7 Å²	35.7	30%	0.304	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-29.1	-179.7	-80.2	179.9	161.4	179.2	0	113.1	D365 V371 E417 M419	D365-K368 HydrophobicContact CB-CB 3.79Å; D365-K368 PolarHBondContact OD1-N 3.41Å; K368-V371 HydrophobicContact CB-CG2 3.81Å; K368-V371 HydrophobicContact CD-CG2 4.32Å; K368-E417 IonicContact NZ-OE1 2.74Å; K368-E417 PolarHBondContact NZ-OE1 3.47Å; K368-E417 IonicContact NZ-OE2 2.77Å; K368-E417 PolarHBondContact NZ-OE2 3.33Å; K368-M419 VanDerWaalsContact CA-CE 3.44Å; K368-M419 HydrophobicContact CB-CE 3.29Å; K368-M419 HydrophobicContact CB-SD 4.19Å; K368-M419 HydrophobicContact CD-CE 4.26Å; K368-M419 HydrophobicContact CD-SD 4.06Å; K368-M419 HydrophobicContact CG-CE 3.55Å; K368-M419 HydrophobicContact CG-SD 3.88Å; K368-M419 WeakPolarHBondContact O-CE 3.46Å
369	G	90.1	Very high	91.8	Very high	25 Å²	25	35.2 Å²	35.2	26%	0.258	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	86.5	-151.9	-174.2	0	0	0	0	0	112.6	D365	D365-G369 PolarHBondContact N-O 2.92Å; D365-G369 WeakPolarHBondContact O-CA 3.46Å; D365-G369 PolarHBondContact O-N 2.87Å
370	P	93	Very high	91.7	Very high	34 Å²	34	36.6 Å²	36.6	22%	0.221	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	129.7	174.1	31	-35.3	0	0	0	110.8	W421 V424	P370-W421 HydrophobicContact CB-CB 4.01Å; P370-W421 HydrophobicContact CG-CB 3.88Å; P370-W421 WeakPolarHBondContact CG-O 3.3Å; P370-V424 HydrophobicContact CB-CG2 3.63Å
371	V	93.9	Very high	91.9	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.9	-169.2	166.3	0	0	0	0	109.2	R363 K368 E417 M419	R363-V371 HydrophobicContact CG-CB 4.04Å; R363-V371 HydrophobicContact CG-CG1 4.07Å; R363-V371 PolarHBondContact N-O 3.33Å; R363-V371 PolarHBondContact O-N 2.92Å; R363-V371 VanDerWaalsContact O-O 3.12Å; K368-V371 HydrophobicContact CB-CG2 3.81Å; K368-V371 HydrophobicContact CD-CG2 4.32Å; V371-E417 HydrophobicContact CG1-CG 3.43Å; V371-E417 VanDerWaalsContact CG1-CG 3.43Å; V371-E417 WeakPolarHBondContact CG1-OE1 3.35Å; V371-M419 HydrophobicContact CG2-CE 4.36Å; V371-M419 HydrophobicContact CG2-CG 4.31Å
372	T	94.9	Very high	92	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	132.3	177.1	59.6	0	0	0	0	111.1	V359 E361 E417 I418 W421 P425	V359-T372 HydrophobicContact CG1-CG2 4.38Å; E361-T372 CarbonylContact O-C 3.53Å; E361-T372 WeakPolarHBondContact O-CA 3.42Å; T372-E417 CarbonylContact O-C 3.57Å; T372-E417 WeakPolarHBondContact O-CA 3.38Å; T372-I418 PolarHBondContact N-O 3.07Å; T372-I418 PolarHBondContact O-N 3.5Å; T372-W421 HydrophobicContact CG2-CD2 4.39Å; T372-W421 HydrophobicContact CG2-CG 4.38Å; T372-W421 HydrophobicContact CG2-CZ2 4.44Å; T372-W421 VanDerWaalsContact CG2-NE1 3.27Å; T372-W421 PolarHBondContact OG1-NE1 2.8Å; T372-P425 HydrophobicContact CG2-CG 3.44Å; T372-P425 VanDerWaalsContact CG2-CG 3.44Å
373	T	94.1	Very high	92	Very high	20 Å²	20	48 Å²	48	12%	0.123	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	123.9	162.8	-51.5	0	0	0	0	107.7	A219 I360 E361	A219-T373 HydrophobicContact CB-CG2 4.29Å; I360-T373 PolarHBondContact N-O 2.83Å; E361-T373 PolarHBondContact N-O 3.38Å; E361-T373 PolarHBondContact O-N 2.86Å
374	A	95	Very high	92.1	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	153.2	-177.7	0	0	0	0	0	111.8	T358 P415 V416 I418 I431	T358-A374 VanDerWaalsContact O-CA 3.27Å; T358-A374 WeakPolarHBondContact O-CA 3.49Å; T358-A374 WeakPolarHBondContact O-CB 3.27Å; A374-P415 CarbonylContact O-C 3.56Å; A374-P415 WeakPolarHBondContact O-CA 3.35Å; A374-V416 PolarHBondContact N-O 3.26Å; A374-V416 PolarHBondContact O-N 3.17Å; A374-I418 HydrophobicContact CB-CD1 3.79Å; A374-I418 HydrophobicContact CB-CG1 4.46Å; A374-I431 HydrophobicContact CB-CD1 3.42Å; A374-I431 VanDerWaalsContact CB-CD1 3.42Å
375	I	95	Very high	92.3	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129	172.4	-60.4	174.4	0	0	0	108.2	V182 L233 V251 G357 T358 I360 P415	V182-I375 HydrophobicContact CG1-CD1 3.78Å; V182-I375 HydrophobicContact CG1-CG2 4.48Å; V182-I375 HydrophobicContact CG2-CG2 4.2Å; L233-I375 HydrophobicContact CD1-CD1 3.74Å; L233-I375 HydrophobicContact CD2-CD1 3.47Å; L233-I375 VanDerWaalsContact CD2-CD1 3.47Å; L233-I375 HydrophobicContact CG-CD1 4.16Å; V251-I375 HydrophobicContact CG1-CB 4.15Å; V251-I375 HydrophobicContact CG1-CD1 3.96Å; V251-I375 HydrophobicContact CG1-CG2 4.4Å; G357-I375 CarbonylContact C-O 3.54Å; G357-I375 WeakPolarHBondContact CA-O 3.49Å; T358-I375 PolarHBondContact N-O 3.43Å; T358-I375 PolarHBondContact O-N 3.45Å; I360-I375 HydrophobicContact CD1-CD1 3.61Å; I360-I375 HydrophobicContact CD1-CG1 3.97Å; I360-I375 HydrophobicContact CG1-CD1 3.76Å; I360-I375 HydrophobicContact CG1-CG1 3.7Å; I375-P415 HydrophobicContact CG1-CB 4.44Å
376	I	95.1	Very high	92.7	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	118.7	177.6	-51.9	-52.2	0	0	0	108.4	V355 R378 G379 L381 A410 P412 G413 V416	V355-I376 HydrophobicContact CG1-CD1 4.02Å; V355-I376 HydrophobicContact CG1-CG2 4.2Å; I376-R378 WeakPolarHBondContact CG2-O 3.32Å; I376-G379 WeakPolarHBondContact CG2-O 3.46Å; I376-L381 HydrophobicContact CD1-CB 4.02Å; I376-L381 HydrophobicContact CD1-CD2 3.9Å; I376-L381 HydrophobicContact CG1-CB 4.36Å; I376-A410 HydrophobicContact CG1-CB 4.29Å; I376-P412 CarbonylContact O-C 3.53Å; I376-P412 WeakPolarHBondContact O-CA 3.29Å; I376-G413 PolarHBondContact O-N 2.96Å; I376-V416 HydrophobicContact CD1-CG1 3.91Å; I376-V416 HydrophobicContact CG1-CG1 4.04Å
377	Q	92.1	Very high	93.3	Very high	60 Å²	60	32.4 Å²	32.4	28%	0.28	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	-35.9	177.2	-69.3	179.5	-27	0	0	111.3	E356 T358	E356-Q377 PolarHBondContact O-N 2.82Å; T358-Q377 PolarHBondContact OG1-NE2 3.33Å
378	R	91.9	Very high	93.9	Very high	36 Å²	36	28.8 Å²	28.8	14%	0.136	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	155.3	-177.6	-176.4	-176.1	173.6	167.3	3.3	110.3	R168 P169 D350 V355 E356 I376	R168-R378 VanDerWaalsContact CB-NH1 3.3Å; P169-R378 PolarHBondContact O-NH1 3.44Å; D350-R378 HydrophobicContact CB-CG 4.06Å; D350-R378 WeakPolarHBondContact O-CG 3.39Å; D350-R378 IonicContact OD2-CZ 3.47Å; D350-R378 VanDerWaalsContact OD2-CZ 3.25Å; D350-R378 IonicContact OD2-NE 2.79Å; D350-R378 PolarHBondContact OD2-NE 2.79Å; D350-R378 IonicContact OD2-NH2 3.19Å; D350-R378 PolarHBondContact OD2-NH2 2.76Å; V355-R378 WeakPolarHBondContact CA-O 3.1Å; E356-R378 HydrophobicContact CB-CB 4.06Å; E356-R378 PolarHBondContact N-O 3.47Å; E356-R378 PolarHBondContact O-N 2.98Å; I376-R378 WeakPolarHBondContact CG2-O 3.32Å
379	G	93.2	Very high	94.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	78.2	170.2	179.1	0	0	0	0	0	112.8	D350 G353 I376 P412	D350-G379 PolarHBondContact O-N 3.33Å; G353-G379 VanDerWaalsContact O-CA 3.23Å; G353-G379 WeakPolarHBondContact O-CA 3.38Å; I376-G379 WeakPolarHBondContact CG2-O 3.46Å; G379-P412 VanDerWaalsContact O-CD 3.26Å; G379-P412 WeakPolarHBondContact O-CD 3.37Å; G379-P412 WeakPolarHBondContact O-CG 3.47Å
380	T	94.3	Very high	94.5	Very high	29 Å²	29	25 Å²	25	18%	0.178	13%	0.13	C	C	.	.			trans	-108.8	108.4	173.8	-61.7	0	0	0	0	109.1	A351 R382 A409 A410	A351-T380 PolarHBondContact O-N 3.32Å; A351-T380 PolarHBondContact O-OG1 3.41Å; T380-R382 HydrophobicContact CG2-CG 4.31Å; T380-R382 PolarHBondContact O-N 2.74Å; T380-A409 HydrophobicContact CG2-CB 3.96Å; T380-A410 CarbonylContact C-O 3.46Å; T380-A410 WeakPolarHBondContact CA-O 3.31Å
381	L	95.8	Very high	94.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	130.3	177.9	-174.8	65.8	0	0	0	110.5	V355 I376 C385 L387 V396 M399 A409 A410 V416 I418	V355-L381 HydrophobicContact CB-CD1 4.33Å; V355-L381 HydrophobicContact CG1-CB 4.29Å; V355-L381 HydrophobicContact CG1-CD1 4.22Å; V355-L381 VanDerWaalsContact CG2-CA 3.46Å; V355-L381 HydrophobicContact CG2-CB 3.78Å; V355-L381 HydrophobicContact CG2-CD1 3.84Å; V355-L381 HydrophobicContact CG2-CG 4.44Å; I376-L381 HydrophobicContact CD1-CB 4.02Å; I376-L381 HydrophobicContact CD1-CD2 3.9Å; I376-L381 HydrophobicContact CG1-CB 4.36Å; L381-C385 HydrophobicContact CD1-CB 3.82Å; L381-L387 HydrophobicContact CD1-CD1 4.01Å; L381-L387 HydrophobicContact CD1-CD2 3.83Å; L381-L387 HydrophobicContact CD1-CG 4.35Å; L381-L387 HydrophobicContact CD2-CD1 4.44Å; L381-V396 HydrophobicContact CD1-CG2 4.19Å; L381-M399 HydrophobicContact CB-SD 4.29Å; L381-M399 HydrophobicContact CD2-SD 3.56Å; L381-M399 VanDerWaalsContact CD2-SD 3.56Å; L381-M399 HydrophobicContact CG-SD 3.57Å; L381-M399 VanDerWaalsContact CG-SD 3.57Å; L381-A409 CarbonylContact O-C 3.51Å; L381-A409 WeakPolarHBondContact O-CA 3.34Å; L381-A410 HydrophobicContact CB-CB 4.45Å; L381-A410 PolarHBondContact N-O 2.84Å; L381-A410 PolarHBondContact O-N 3.38Å; L381-V416 HydrophobicContact CD2-CG1 4.25Å; L381-I418 HydrophobicContact CD2-CD1 3.58Å; L381-I418 HydrophobicContact CD2-CG1 3.93Å
382	R	94.9	Very high	94.5	Very high	141 Å²	141	28.3 Å²	28.3	53%	0.532	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	157.7	-179.3	-63	179.3	-174.6	-83.3	-2.6	111.1	T380 G384 C385 A409	T380-R382 HydrophobicContact CG2-CG 4.31Å; T380-R382 PolarHBondContact O-N 2.74Å; R382-G384 PolarHBondContact O-N 3.38Å; R382-C385 PolarHBondContact N-SG 2.65Å; R382-C385 WeakPolarHBondContact O-CB 3.35Å; R382-C385 PolarHBondContact O-N 3.09Å; R382-C385 PolarHBondContact O-SG 3.1Å; R382-A409 HydrophobicContact CG-CB 4.3Å
383	K	94.3	Very high	94.6	Very high	113 Å²	113	29 Å²	29	49%	0.491	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	129.2	168.9	177.6	167.6	172.6	157.7	0	110.6	R397	K383-R397 WeakPolarHBondContact CD-O 3.45Å; K383-R397 WeakPolarHBondContact CE-O 3.26Å; K383-R397 PolarHBondContact NZ-O 3.45Å
384	G	92.9	Very high	94.7	Very high	37 Å²	37	28.1 Å²	28.1	38%	0.381	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.8	-14.7	-178.2	0	0	0	0	0	115.2	R382 V396	R382-G384 PolarHBondContact O-N 3.38Å; G384-V396 WeakPolarHBondContact CA-O 3.36Å; G384-V396 PolarHBondContact N-O 3.39Å
385	C	95.1	Very high	94.8	Very high	18 Å²	18	32.2 Å²	32.2	12%	0.122	16%	0.157	C	C	.	.			trans	-55.6	152	173.6	-67	0	0	0	0	111.9	L381 R382 V396 E433	L381-C385 HydrophobicContact CD1-CB 3.82Å; R382-C385 PolarHBondContact N-SG 2.65Å; R382-C385 WeakPolarHBondContact O-CB 3.35Å; R382-C385 PolarHBondContact O-N 3.09Å; R382-C385 PolarHBondContact O-SG 3.1Å; C385-V396 HydrophobicContact CB-CG2 4.31Å; C385-V396 PolarHBondContact O-N 3.09Å; C385-E433 VanDerWaalsContact CB-OE1 3.28Å; C385-E433 WeakPolarHBondContact CB-OE1 3.21Å; C385-E433 PolarHBondContact SG-OE1 2.72Å
386	I	97.1	Very high	94.8	Very high	19 Å²	19	32.3 Å²	32.3	10%	0.097	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	118.2	-177.1	-56.1	167.8	0	0	0	107.5	W393 A394 K395 E433 V434 E437 A440	I386-W393 HydrophobicContact CG2-CE3 4.3Å; I386-A394 WeakPolarHBondContact CA-O 3.43Å; I386-K395 HydrophobicContact CG1-CG 4.49Å; I386-E433 WeakPolarHBondContact O-CA 3.41Å; I386-V434 HydrophobicContact CB-CG2 4.26Å; I386-V434 HydrophobicContact CG2-CG2 3.76Å; I386-V434 PolarHBondContact O-N 3.48Å; I386-E437 HydrophobicContact CD1-CG 3.7Å; I386-E437 HydrophobicContact CG1-CG 4.39Å; I386-A440 HydrophobicContact CG2-CB 3.92Å
387	L	97.1	Very high	94.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	145.6	-171	-55	177	0	0	0	110.2	L381 W393 A394 V396 I418 W421 I431 E433	L381-L387 HydrophobicContact CD1-CD1 4.01Å; L381-L387 HydrophobicContact CD1-CD2 3.83Å; L381-L387 HydrophobicContact CD1-CG 4.35Å; L381-L387 HydrophobicContact CD2-CD1 4.44Å; L387-W393 CarbonylContact O-C 3.59Å; L387-W393 WeakPolarHBondContact O-CA 3.34Å; L387-W393 VanDerWaalsContact O-CB 3.31Å; L387-W393 WeakPolarHBondContact O-CB 3.2Å; L387-A394 HydrophobicContact CB-CB 4.4Å; L387-A394 PolarHBondContact N-O 2.96Å; L387-A394 PolarHBondContact O-N 2.75Å; L387-V396 HydrophobicContact CD1-CG2 3.57Å; L387-V396 HydrophobicContact CG-CG2 3.97Å; L387-I418 HydrophobicContact CD1-CD1 4.01Å; L387-I418 HydrophobicContact CD1-CG2 4.09Å; L387-W421 HydrophobicContact CB-CH2 4.16Å; L387-I431 HydrophobicContact CB-CG2 3.93Å; L387-I431 HydrophobicContact CD1-CG2 3.89Å; L387-I431 HydrophobicContact CD2-CG2 3.98Å; L387-I431 HydrophobicContact CG-CG2 4.15Å; L387-E433 HydrophobicContact CD2-CB 3.88Å; L387-E433 HydrophobicContact CD2-CG 4.38Å
388	V	97	Very high	94.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.4	169	-175.9	0	0	0	0	107.9	T392 W393 I431 L432 V434 A440 V443 V444	V388-T392 WeakPolarHBondContact CG1-O 3.36Å; V388-W393 HydrophobicContact CG2-CB 4.35Å; V388-I431 WeakPolarHBondContact O-CA 3.26Å; V388-L432 PolarHBondContact N-O 3.04Å; V388-L432 PolarHBondContact O-N 3.38Å; V388-V434 HydrophobicContact CG2-CG1 4.01Å; V388-V434 HydrophobicContact CG2-CG2 3.94Å; V388-A440 HydrophobicContact CG2-CB 3.89Å; V388-V443 HydrophobicContact CG1-CB 4.48Å; V388-V443 HydrophobicContact CG1-CG1 3.83Å; V388-V444 HydrophobicContact CG1-CG2 4.07Å
389	A	95.8	Very high	94.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	128.2	172.8	0	0	0	0	0	109.6	V359 K391 T392 W421 P425 D429 E430 I431	V359-A389 HydrophobicContact CG2-CB 4.35Å; A389-K391 PolarHBondContact O-N 3.26Å; A389-K391 VanDerWaalsContact O-N 3.13Å; A389-T392 PolarHBondContact N-O 3.07Å; A389-T392 PolarHBondContact O-N 2.98Å; A389-T392 VanDerWaalsContact O-O 3.1Å; A389-T392 PolarHBondContact O-OG1 3.35Å; A389-W421 HydrophobicContact CB-CH2 3.4Å; A389-W421 HydrophobicContact CB-CZ2 4.38Å; A389-W421 HydrophobicContact CB-CZ3 3.67Å; A389-P425 HydrophobicContact CB-CB 3.8Å; A389-P425 HydrophobicContact CB-CG 4.34Å; A389-D429 HydrophobicContact CB-CB 4.14Å; A389-E430 WeakPolarHBondContact CA-O 3.27Å; A389-I431 HydrophobicContact CB-CG1 4.16Å
390	G	93.3	Very high	94.9	Very high	14 Å²	14	42.1 Å²	42.1	14%	0.144	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	-117.7	-171.2	0	0	0	0	0	111.7	D429 R447	G390-D429 VanDerWaalsContact CA-OD2 3.31Å; G390-D429 WeakPolarHBondContact CA-OD2 3.36Å; G390-D429 PolarHBondContact N-OD2 3.47Å; G390-R447 WeakPolarHBondContact O-CD 3.35Å; G390-R447 PolarHBondContact O-NH1 3.29Å
391	K	92.1	Very high	94.7	Very high	94 Å²	94	42.2 Å²	42.2	41%	0.409	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	8.8	-179	-56.6	170.9	-163.2	173.6	0	113.4	A389 V444 E451	A389-K391 PolarHBondContact O-N 3.26Å; A389-K391 VanDerWaalsContact O-N 3.13Å; K391-V444 WeakPolarHBondContact O-CG1 3.47Å; K391-E451 WeakPolarHBondContact CE-OE2 3.48Å; K391-E451 IonicContact NZ-OE1 2.77Å; K391-E451 PolarHBondContact NZ-OE1 2.88Å; K391-E451 IonicContact NZ-OE2 2.7Å; K391-E451 PolarHBondContact NZ-OE2 3.3Å
392	T	94.8	Very high	94	Very high	11 Å²	11	45.4 Å²	45.4	7%	0.067	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	166.1	-171.2	77.1	0	0	0	0	111.2	V388 A389 E423	V388-T392 WeakPolarHBondContact CG1-O 3.36Å; A389-T392 PolarHBondContact N-O 3.07Å; A389-T392 PolarHBondContact O-N 2.98Å; A389-T392 VanDerWaalsContact O-O 3.1Å; A389-T392 PolarHBondContact O-OG1 3.35Å; T392-E423 HydrophobicContact CG2-CB 3.74Å
393	W	96.3	Very high	93.4	Very high	16 Å²	16	43.1 Å²	43.1	6%	0.061	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	157.3	173.8	72.1	-85.3	0	0	0	111.8	I386 L387 V388 K395 K422 E437 A440 H441 V444	I386-W393 HydrophobicContact CG2-CE3 4.3Å; L387-W393 CarbonylContact O-C 3.59Å; L387-W393 WeakPolarHBondContact O-CA 3.34Å; L387-W393 VanDerWaalsContact O-CB 3.31Å; L387-W393 WeakPolarHBondContact O-CB 3.2Å; V388-W393 HydrophobicContact CG2-CB 4.35Å; W393-K395 HydrophobicContact CZ3-CB 4.25Å; W393-K422 HydrophobicContact CD2-CG 4.13Å; W393-K422 HydrophobicContact CG-CG 4.46Å; W393-K422 VanDerWaalsContact CH2-CE 3.49Å; W393-K422 HydrophobicContact CZ2-CD 4.31Å; W393-K422 HydrophobicContact CZ2-CG 4.05Å; W393-K422 PolarHBondContact O-N 3.25Å; W393-E437 HydrophobicContact CH2-CB 4.28Å; W393-E437 HydrophobicContact CH2-CG 4.16Å; W393-E437 HydrophobicContact CZ3-CB 4.39Å; W393-E437 HydrophobicContact CZ3-CG 4.01Å; W393-A440 HydrophobicContact CB-CB 4.06Å; W393-A440 HydrophobicContact CD2-CB 4.26Å; W393-A440 HydrophobicContact CE3-CB 4.33Å; W393-A440 HydrophobicContact CG-CB 4.17Å; W393-H441 AromaticContact CE2-CE1 3.74Å; W393-H441 AromaticContact CE2-NE2 3.78Å; W393-H441 AromaticContact CZ2-CE1 3.68Å; W393-H441 AromaticContact CZ2-NE2 3.33Å; W393-H441 VanDerWaalsContact CZ2-NE2 3.33Å; W393-H441 WeakPolarHBondContact CZ2-NE2 2.9Å; W393-H441 AromaticContact NE1-CE1 3.34Å; W393-H441 PolarHBondContact NE1-CE1 3.03Å; W393-H441 VanDerWaalsContact NE1-CE1 3.34Å; W393-H441 AromaticContact NE1-ND1 3.7Å; W393-H441 AromaticContact NE1-NE2 3.87Å; W393-V444 HydrophobicContact CB-CG2 4.33Å
394	A	96.4	Very high	93	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	152.4	176.2	0	0	0	0	0	111.6	I386 L387 G420 W421	I386-A394 WeakPolarHBondContact CA-O 3.43Å; L387-A394 HydrophobicContact CB-CB 4.4Å; L387-A394 PolarHBondContact N-O 2.96Å; L387-A394 PolarHBondContact O-N 2.75Å; A394-G420 WeakPolarHBondContact CA-O 3.4Å; A394-W421 HydrophobicContact CB-CB 4.41Å; A394-W421 HydrophobicContact CB-CD2 3.52Å; A394-W421 HydrophobicContact CB-CE3 3.63Å; A394-W421 HydrophobicContact CB-CG 3.92Å; A394-W421 HydrophobicContact CB-CH2 4.16Å; A394-W421 HydrophobicContact CB-CZ2 4.13Å; A394-W421 HydrophobicContact CB-CZ3 3.94Å
395	K	96.4	Very high	92.8	Very high	87 Å²	87	46.2 Å²	46.2	38%	0.378	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	116.5	155	-174.9	175.7	-160.5	159	0	107.6	I386 W393 R397 G420 E437	I386-K395 HydrophobicContact CG1-CG 4.49Å; W393-K395 HydrophobicContact CZ3-CB 4.25Å; K395-R397 PolarHBondContact O-N 2.92Å; K395-G420 PolarHBondContact N-O 3.38Å; K395-E437 WeakPolarHBondContact CD-OE1 3.25Å; K395-E437 WeakPolarHBondContact CE-OE1 3.49Å; K395-E437 IonicContact NZ-OE1 3.66Å; K395-E437 PolarHBondContact NZ-OE1 2.99Å
396	V	96.1	Very high	92.7	Very high	2 Å²	2	49 Å²	49	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	106.7	-173	-178.9	0	0	0	0	110.2	L381 G384 C385 L387 M399 I418 M419	L381-V396 HydrophobicContact CD1-CG2 4.19Å; G384-V396 WeakPolarHBondContact CA-O 3.36Å; G384-V396 PolarHBondContact N-O 3.39Å; C385-V396 HydrophobicContact CB-CG2 4.31Å; C385-V396 PolarHBondContact O-N 3.09Å; L387-V396 HydrophobicContact CD1-CG2 3.57Å; L387-V396 HydrophobicContact CG-CG2 3.97Å; V396-M399 HydrophobicContact CG1-CG 3.44Å; V396-M399 VanDerWaalsContact CG1-CG 3.44Å; V396-M399 HydrophobicContact CG1-SD 3.89Å; V396-I418 HydrophobicContact CG1-CG2 4.48Å; V396-I418 HydrophobicContact CG2-CG2 3.94Å; V396-M419 WeakPolarHBondContact CA-O 3.37Å
397	R	92.7	Very high	92.5	Very high	161 Å²	161	50.4 Å²	50.4	61%	0.608	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	-43.5	179.6	-67.9	-178.5	174.7	-173.9	-4.6	111.7	K383 K395 M419	K383-R397 WeakPolarHBondContact CD-O 3.45Å; K383-R397 WeakPolarHBondContact CE-O 3.26Å; K383-R397 PolarHBondContact NZ-O 3.45Å; K395-R397 PolarHBondContact O-N 2.92Å; R397-M419 PolarHBondContact N-O 2.96Å
398	F	93.2	Very high	92.3	Very high	102 Å²	102	56.7 Å²	56.7	45%	0.447	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	154	-179.3	-62.3	-80.2	0	0	0	108.1	F400 M419	F398-F400 HydrophobicContact CB-CD2 4.32Å; F398-F400 HydrophobicContact CB-CE2 3.55Å; F398-F400 HydrophobicContact CB-CZ 4.17Å; F398-F400 HydrophobicContact CG-CE2 4.36Å; F398-M419 HydrophobicContact CB-CB 4.39Å; F398-M419 HydrophobicContact CB-SD 4.27Å; F398-M419 WeakPolarHBondContact O-CB 3.3Å; F398-M419 PolarHBondContact O-N 3.22Å; F398-M419 VanDerWaalsContact O-N 3.14Å
399	M	94.8	Very high	92.1	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	140.7	171.8	-63.4	-178.9	-57.4	0	0	107.1	L381 V396 A406 V407 D408 V416 E417	L381-M399 HydrophobicContact CB-SD 4.29Å; L381-M399 HydrophobicContact CD2-SD 3.56Å; L381-M399 VanDerWaalsContact CD2-SD 3.56Å; L381-M399 HydrophobicContact CG-SD 3.57Å; L381-M399 VanDerWaalsContact CG-SD 3.57Å; V396-M399 HydrophobicContact CG1-CG 3.44Å; V396-M399 VanDerWaalsContact CG1-CG 3.44Å; V396-M399 HydrophobicContact CG1-SD 3.89Å; M399-A406 WeakPolarHBondContact O-CA 3.45Å; M399-V407 WeakPolarHBondContact CE-O 3.11Å; M399-V407 PolarHBondContact O-N 2.91Å; M399-D408 VanDerWaalsContact CE-C 3.45Å; M399-D408 VanDerWaalsContact CE-O 3.26Å; M399-D408 WeakPolarHBondContact CE-O 3.29Å; M399-V416 HydrophobicContact CB-CG2 3.67Å; M399-V416 HydrophobicContact CG-CG2 4.13Å; M399-V416 HydrophobicContact SD-CG2 4.3Å; M399-E417 WeakPolarHBondContact CA-O 3.39Å
400	F	92.9	Very high	92	Very high	38 Å²	38	58.8 Å²	58.8	17%	0.167	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	145.6	177.6	-65	-91.2	0	0	0	110.8	F398 G404 R405 A406 E417 M419	F398-F400 HydrophobicContact CB-CD2 4.32Å; F398-F400 HydrophobicContact CB-CE2 3.55Å; F398-F400 HydrophobicContact CB-CZ 4.17Å; F398-F400 HydrophobicContact CG-CE2 4.36Å; F400-G404 WeakPolarHBondContact CD1-O 3.38Å; F400-R405 CarbonylContact C-O 3.56Å; F400-R405 VanDerWaalsContact CA-O 3.26Å; F400-R405 WeakPolarHBondContact CA-O 3.25Å; F400-A406 HydrophobicContact CD1-CB 4.25Å; F400-A406 HydrophobicContact CE1-CB 3.98Å; F400-E417 HydrophobicContact CB-CB 4.11Å; F400-E417 WeakPolarHBondContact CB-OE2 3.48Å; F400-E417 PolarHBondContact N-O 3.5Å; F400-E417 WeakPolarHBondContact O-CB 3.45Å; F400-E417 PolarHBondContact O-N 3.23Å; F400-M419 HydrophobicContact CD2-CG 4.32Å; F400-M419 HydrophobicContact CD2-SD 3.77Å; F400-M419 HydrophobicContact CE2-CG 4.39Å; F400-M419 HydrophobicContact CE2-SD 3.39Å; F400-M419 WeakPolarHBondContact CE2-SD 3.31Å
401	D	89.6	Confident	91.9	Very high	31 Å²	31	60.3 Å²	60.3	17%	0.166	31%	0.312	C	S	.	.			trans	-74.3	165.3	166.2	-179.2	37.3	0	0	0	110.6	N403 G404 R405 V407	D401-N403 PolarHBondContact O-N 2.9Å; D401-N403 PolarHBondContact OD2-ND2 3.14Å; D401-G404 PolarHBondContact O-N 3.03Å; D401-R405 HydrophobicContact CB-CB 4.36Å; D401-R405 PolarHBondContact N-O 3.16Å; D401-V407 HydrophobicContact CB-CG2 3.83Å
402	E	81.4	Confident	92	Very high	68 Å²	68	56.1 Å²	56.1	32%	0.318	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-33.8	175.3	73	-174.7	-106.6	0	0	112.5	R201 F220 L221 G404	R201-E402 IonicContact CZ-OE1 3.02Å; R201-E402 IonicContact NE-OE1 2.77Å; R201-E402 IonicContact NH2-OE1 2.69Å; R201-E402 PolarHBondContact NH2-OE1 3.45Å; F220-E402 WeakPolarHBondContact CA-OE2 3.34Å; F220-E402 VanDerWaalsContact CB-OE1 3.31Å; F220-E402 WeakPolarHBondContact CB-OE1 3.35Å; F220-E402 WeakPolarHBondContact CB-OE2 3.48Å; L221-E402 PolarHBondContact N-OE2 3.31Å; E402-G404 PolarHBondContact O-N 3.34Å
403	N	83	Confident	91.8	Very high	92 Å²	92	55.6 Å²	55.6	49%	0.492	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	8.4	-177	-66	-73.4	0	0	0	113	D401 R405	D401-N403 PolarHBondContact O-N 2.9Å; D401-N403 PolarHBondContact OD2-ND2 3.14Å; N403-R405 HydrophobicContact CB-CG 4.13Å; N403-R405 PolarHBondContact O-N 3.42Å
404	G	84.4	Confident	91.5	Very high	45 Å²	45	56.5 Å²	56.5	46%	0.464	30%	0.297	S	S	.	.	S	Bend	trans	68.4	14.7	-175.7	0	0	0	0	0	114.3	F400 D401 E402	F400-G404 WeakPolarHBondContact CD1-O 3.38Å; D401-G404 PolarHBondContact O-N 3.03Å; E402-G404 PolarHBondContact O-N 3.34Å
405	R	89.8	Confident	91.4	Very high	171 Å²	171	56.8 Å²	56.8	65%	0.645	30%	0.299	S	S	*	.			trans	-83.5	136	177	-60.7	178.6	-172.5	167.3	5.9	109.5	F400 D401 N403	F400-R405 CarbonylContact C-O 3.56Å; F400-R405 VanDerWaalsContact CA-O 3.26Å; F400-R405 WeakPolarHBondContact CA-O 3.25Å; D401-R405 HydrophobicContact CB-CB 4.36Å; D401-R405 PolarHBondContact N-O 3.16Å; N403-R405 HydrophobicContact CB-CG 4.13Å; N403-R405 PolarHBondContact O-N 3.42Å
406	A	93	Very high	91.3	Very high	76 Å²	76	52.8 Å²	52.8	63%	0.628	28%	0.282	S	S	*	.	B	Isolated β-bridge	trans	-69.8	137.9	176.8	0	0	0	0	0	110.9	M399 F400	M399-A406 WeakPolarHBondContact O-CA 3.45Å; F400-A406 HydrophobicContact CD1-CB 4.25Å; F400-A406 HydrophobicContact CE1-CB 3.98Å
407	V	93.1	Very high	91.3	Very high	48 Å²	48	53.4 Å²	53.4	29%	0.291	28%	0.284	S	S	.	.			trans	-123.4	133.8	-179.4	-179.1	0	0	0	0	109.4	M399 D401 A409	M399-V407 WeakPolarHBondContact CE-O 3.11Å; M399-V407 PolarHBondContact O-N 2.91Å; D401-V407 HydrophobicContact CB-CG2 3.83Å; V407-A409 WeakPolarHBondContact CG1-O 3.41Å
408	D	91.6	Very high	91.4	Very high	133 Å²	133	45.7 Å²	45.7	71%	0.711	26%	0.255	S	S	*	.	S	Bend	trans	-87.4	-28.1	-179.4	-70.8	-46.2	0	0	0	113.5	M399	M399-D408 VanDerWaalsContact CE-C 3.45Å; M399-D408 VanDerWaalsContact CE-O 3.26Å; M399-D408 WeakPolarHBondContact CE-O 3.29Å
409	A	93.3	Very high	91.5	Very high	42 Å²	42	41.6 Å²	41.6	35%	0.347	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	134.6	177.4	0	0	0	0	0	111.9	T380 L381 R382 V407	T380-A409 HydrophobicContact CG2-CB 3.96Å; L381-A409 CarbonylContact O-C 3.51Å; L381-A409 WeakPolarHBondContact O-CA 3.34Å; R382-A409 HydrophobicContact CG-CB 4.3Å; V407-A409 WeakPolarHBondContact CG1-O 3.41Å
410	A	93.1	Very high	91.4	Very high	2 Å²	2	42.2 Å²	42.2	2%	0.017	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.2	173.4	0	0	0	0	0	110.1	I376 T380 L381 V416	I376-A410 HydrophobicContact CG1-CB 4.29Å; T380-A410 CarbonylContact C-O 3.46Å; T380-A410 WeakPolarHBondContact CA-O 3.31Å; L381-A410 HydrophobicContact CB-CB 4.45Å; L381-A410 PolarHBondContact N-O 2.84Å; L381-A410 PolarHBondContact O-N 3.38Å; A410-V416 HydrophobicContact CB-CB 4.19Å; A410-V416 HydrophobicContact CB-CG1 4.24Å; A410-V416 HydrophobicContact CB-CG2 4.34Å
411	S	92.6	Very high	91.5	Very high	46 Å²	46	40.9 Å²	40.9	32%	0.322	24%	0.238	S	C	.	.			trans	-90.1	168.1	177.5	61	0	0	0	0	111.7	I414	S411-I414 WeakPolarHBondContact O-CB 3.43Å; S411-I414 PolarHBondContact O-N 2.83Å; S411-I414 WeakPolarHBondContact OG-CD1 3.2Å
412	P	93.8	Very high	91.7	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.032	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	143.7	174.4	-28	37.7	0	0	0	113.2	R179 A349 I376 G379 I414	R179-P412 HydrophobicContact CB-CB 4.4Å; A349-P412 HydrophobicContact CB-CB 3.59Å; A349-P412 HydrophobicContact CB-CG 3.9Å; I376-P412 CarbonylContact O-C 3.53Å; I376-P412 WeakPolarHBondContact O-CA 3.29Å; G379-P412 VanDerWaalsContact O-CD 3.26Å; G379-P412 WeakPolarHBondContact O-CD 3.37Å; G379-P412 WeakPolarHBondContact O-CG 3.47Å; P412-I414 VanDerWaalsContact C-N 3.26Å; P412-I414 PolarHBondContact O-N 2.75Å
413	G	90.3	Very high	92.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	-9.8	-176.8	0	0	0	0	0	115.6	T231 I376	T231-G413 WeakPolarHBondContact CB-O 3.47Å; T231-G413 PolarHBondContact OG1-O 3.48Å; I376-G413 PolarHBondContact O-N 2.96Å
414	I	90.8	Very high	92.6	Very high	36 Å²	36	45.5 Å²	45.5	19%	0.185	26%	0.256	C	S	.	.			trans	-87.6	133	178.7	-61.2	-173.7	0	0	0	110.6	S411 P412	S411-I414 WeakPolarHBondContact O-CB 3.43Å; S411-I414 PolarHBondContact O-N 2.83Å; S411-I414 WeakPolarHBondContact OG-CD1 3.2Å; P412-I414 VanDerWaalsContact C-N 3.26Å; P412-I414 PolarHBondContact O-N 2.75Å
415	P	93.9	Very high	93.1	Very high	6 Å²	6	43.4 Å²	43.4	4%	0.039	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	142.8	172.6	33.3	-33.9	0	0	0	111	A219 T231 A374 I375	A219-P415 HydrophobicContact CB-CB 3.62Å; A219-P415 HydrophobicContact CB-CG 4.28Å; T231-P415 HydrophobicContact CG2-CB 4.37Å; T231-P415 HydrophobicContact CG2-CG 3.93Å; A374-P415 CarbonylContact O-C 3.56Å; A374-P415 WeakPolarHBondContact O-CA 3.35Å; I375-P415 HydrophobicContact CG1-CB 4.44Å
416	V	94.8	Very high	93.2	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.018	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	135.1	-176.6	60.9	0	0	0	0	112.5	A374 I376 L381 M399 A410 I418	A374-V416 PolarHBondContact N-O 3.26Å; A374-V416 PolarHBondContact O-N 3.17Å; I376-V416 HydrophobicContact CD1-CG1 3.91Å; I376-V416 HydrophobicContact CG1-CG1 4.04Å; L381-V416 HydrophobicContact CD2-CG1 4.25Å; M399-V416 HydrophobicContact CB-CG2 3.67Å; M399-V416 HydrophobicContact CG-CG2 4.13Å; M399-V416 HydrophobicContact SD-CG2 4.3Å; A410-V416 HydrophobicContact CB-CB 4.19Å; A410-V416 HydrophobicContact CB-CG1 4.24Å; A410-V416 HydrophobicContact CB-CG2 4.34Å; V416-I418 HydrophobicContact CG1-CD1 4.23Å; V416-I418 HydrophobicContact CG1-CG1 3.94Å; V416-I418 HydrophobicContact CG2-CG1 4.47Å; V416-I418 PolarHBondContact O-N 3.22Å
417	E	94.7	Very high	93.1	Very high	14 Å²	14	35.2 Å²	35.2	7%	0.065	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	104.6	171.4	-176.8	-171.5	-165.5	0	0	109.2	R363 K368 V371 T372 M399 F400	R363-E417 IonicContact CZ-OE1 2.75Å; R363-E417 IonicContact NE-OE1 2.72Å; R363-E417 VanDerWaalsContact NH2-CD 3.26Å; R363-E417 IonicContact NH2-OE1 3.56Å; R363-E417 PolarHBondContact NH2-OE1 3.36Å; R363-E417 IonicContact NH2-OE2 2.83Å; K368-E417 IonicContact NZ-OE1 2.74Å; K368-E417 PolarHBondContact NZ-OE1 3.47Å; K368-E417 IonicContact NZ-OE2 2.77Å; K368-E417 PolarHBondContact NZ-OE2 3.33Å; V371-E417 HydrophobicContact CG1-CG 3.43Å; V371-E417 VanDerWaalsContact CG1-CG 3.43Å; V371-E417 WeakPolarHBondContact CG1-OE1 3.35Å; T372-E417 CarbonylContact O-C 3.57Å; T372-E417 WeakPolarHBondContact O-CA 3.38Å; M399-E417 WeakPolarHBondContact CA-O 3.39Å; F400-E417 HydrophobicContact CB-CB 4.11Å; F400-E417 WeakPolarHBondContact CB-OE2 3.48Å; F400-E417 PolarHBondContact N-O 3.5Å; F400-E417 WeakPolarHBondContact O-CB 3.45Å; F400-E417 PolarHBondContact O-N 3.23Å
418	I	95.4	Very high	93	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	135.8	-176.1	-54.5	175.6	0	0	0	110.7	T372 A374 L381 L387 V396 V416 I431	T372-I418 PolarHBondContact N-O 3.07Å; T372-I418 PolarHBondContact O-N 3.5Å; A374-I418 HydrophobicContact CB-CD1 3.79Å; A374-I418 HydrophobicContact CB-CG1 4.46Å; L381-I418 HydrophobicContact CD2-CD1 3.58Å; L381-I418 HydrophobicContact CD2-CG1 3.93Å; L387-I418 HydrophobicContact CD1-CD1 4.01Å; L387-I418 HydrophobicContact CD1-CG2 4.09Å; V396-I418 HydrophobicContact CG1-CG2 4.48Å; V396-I418 HydrophobicContact CG2-CG2 3.94Å; V416-I418 HydrophobicContact CG1-CD1 4.23Å; V416-I418 HydrophobicContact CG1-CG1 3.94Å; V416-I418 HydrophobicContact CG2-CG1 4.47Å; V416-I418 PolarHBondContact O-N 3.22Å; I418-I431 HydrophobicContact CD1-CD1 4.1Å
419	M	94.6	Very high	93.1	Very high	16 Å²	16	29.9 Å²	29.9	8%	0.079	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	141.2	179.2	-60.2	-163.4	57.8	0	0	113.8	K368 V371 V396 R397 F398 F400	K368-M419 VanDerWaalsContact CA-CE 3.44Å; K368-M419 HydrophobicContact CB-CE 3.29Å; K368-M419 HydrophobicContact CB-SD 4.19Å; K368-M419 HydrophobicContact CD-CE 4.26Å; K368-M419 HydrophobicContact CD-SD 4.06Å; K368-M419 HydrophobicContact CG-CE 3.55Å; K368-M419 HydrophobicContact CG-SD 3.88Å; K368-M419 WeakPolarHBondContact O-CE 3.46Å; V371-M419 HydrophobicContact CG2-CE 4.36Å; V371-M419 HydrophobicContact CG2-CG 4.31Å; V396-M419 WeakPolarHBondContact CA-O 3.37Å; R397-M419 PolarHBondContact N-O 2.96Å; F398-M419 HydrophobicContact CB-CB 4.39Å; F398-M419 HydrophobicContact CB-SD 4.27Å; F398-M419 WeakPolarHBondContact O-CB 3.3Å; F398-M419 PolarHBondContact O-N 3.22Å; F398-M419 VanDerWaalsContact O-N 3.14Å; F400-M419 HydrophobicContact CD2-CG 4.32Å; F400-M419 HydrophobicContact CD2-SD 3.77Å; F400-M419 HydrophobicContact CE2-CG 4.39Å; F400-M419 HydrophobicContact CE2-SD 3.39Å; F400-M419 WeakPolarHBondContact CE2-SD 3.31Å
420	G	93.3	Very high	93.1	Very high	14 Å²	14	32.1 Å²	32.1	14%	0.144	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	119.5	13.9	174.1	0	0	0	0	0	115.2	A394 K395	A394-G420 WeakPolarHBondContact CA-O 3.4Å; K395-G420 PolarHBondContact N-O 3.38Å
421	W	95.4	Very high	93.3	Very high	10 Å²	10	32 Å²	32	4%	0.038	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	148.1	167.5	-65.4	100.9	0	0	0	112.2	P370 T372 L387 A389 A394 E423 P425	P370-W421 HydrophobicContact CB-CB 4.01Å; P370-W421 HydrophobicContact CG-CB 3.88Å; P370-W421 WeakPolarHBondContact CG-O 3.3Å; T372-W421 HydrophobicContact CG2-CD2 4.39Å; T372-W421 HydrophobicContact CG2-CG 4.38Å; T372-W421 HydrophobicContact CG2-CZ2 4.44Å; T372-W421 VanDerWaalsContact CG2-NE1 3.27Å; T372-W421 PolarHBondContact OG1-NE1 2.8Å; L387-W421 HydrophobicContact CB-CH2 4.16Å; A389-W421 HydrophobicContact CB-CH2 3.4Å; A389-W421 HydrophobicContact CB-CZ2 4.38Å; A389-W421 HydrophobicContact CB-CZ3 3.67Å; A394-W421 HydrophobicContact CB-CB 4.41Å; A394-W421 HydrophobicContact CB-CD2 3.52Å; A394-W421 HydrophobicContact CB-CE3 3.63Å; A394-W421 HydrophobicContact CB-CG 3.92Å; A394-W421 HydrophobicContact CB-CH2 4.16Å; A394-W421 HydrophobicContact CB-CZ2 4.13Å; A394-W421 HydrophobicContact CB-CZ3 3.94Å; W421-E423 WeakPolarHBondContact CB-O 3.36Å; W421-P425 HydrophobicContact CD2-CG 4.02Å; W421-P425 HydrophobicContact CE3-CG 4Å; W421-P425 HydrophobicContact CH2-CG 4.29Å; W421-P425 HydrophobicContact CZ2-CG 4.25Å; W421-P425 HydrophobicContact CZ3-CB 4.48Å; W421-P425 HydrophobicContact CZ3-CG 4.15Å
422	K	93.4	Very high	93.5	Very high	125 Å²	125	30.5 Å²	30.5	54%	0.543	17%	0.166	S	C	.	.	S	Bend	trans	-82	-47.2	171	-64.1	-60.1	-173.1	172	0	111.8	W393	W393-K422 HydrophobicContact CD2-CG 4.13Å; W393-K422 HydrophobicContact CG-CG 4.46Å; W393-K422 VanDerWaalsContact CH2-CE 3.49Å; W393-K422 HydrophobicContact CZ2-CD 4.31Å; W393-K422 HydrophobicContact CZ2-CG 4.05Å; W393-K422 PolarHBondContact O-N 3.25Å
423	E	92	Very high	93.6	Very high	140 Å²	140	31.9 Å²	31.9	65%	0.654	17%	0.172	S	C	*	.	S	Bend	trans	-130.2	159.5	175.1	-70.8	176.2	-164.3	0	0	107.1	T392 W421	T392-E423 HydrophobicContact CG2-CB 3.74Å; W421-E423 WeakPolarHBondContact CB-O 3.36Å
424	V	91.2	Very high	93.9	Very high	24 Å²	24	32.5 Å²	32.5	15%	0.145	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-79.6	123.3	-175.9	-172.2	0	0	0	0	109	K364 P370 M553	K364-V424 HydrophobicContact CD-CG2 4.11Å; K364-V424 VanDerWaalsContact CE-CG2 3.48Å; K364-V424 HydrophobicContact CG-CG2 3.6Å; P370-V424 HydrophobicContact CB-CG2 3.63Å; V424-M553 HydrophobicContact CB-CE 3.8Å; V424-M553 HydrophobicContact CB-SD 4.39Å; V424-M553 HydrophobicContact CG1-CE 3.51Å; V424-M553 HydrophobicContact CG1-SD 3.65Å; V424-M553 HydrophobicContact CG2-CE 4.48Å
425	P	94.3	Very high	94	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.006	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-71.5	156.9	173.1	30.6	-34.2	0	0	0	110.6	V359 S362 T372 A389 W421 D429	V359-P425 HydrophobicContact CG2-CB 4.47Å; V359-P425 HydrophobicContact CG2-CG 4.16Å; S362-P425 WeakPolarHBondContact CB-O 3.38Å; S362-P425 PolarHBondContact OG-O 3.09Å; T372-P425 HydrophobicContact CG2-CG 3.44Å; T372-P425 VanDerWaalsContact CG2-CG 3.44Å; A389-P425 HydrophobicContact CB-CB 3.8Å; A389-P425 HydrophobicContact CB-CG 4.34Å; W421-P425 HydrophobicContact CD2-CG 4.02Å; W421-P425 HydrophobicContact CE3-CG 4Å; W421-P425 HydrophobicContact CH2-CG 4.29Å; W421-P425 HydrophobicContact CZ2-CG 4.25Å; W421-P425 HydrophobicContact CZ3-CB 4.48Å; W421-P425 HydrophobicContact CZ3-CG 4.15Å; P425-D429 HydrophobicContact CB-CB 4.45Å
426	S	92.3	Very high	94	Very high	66 Å²	66	40.9 Å²	40.9	46%	0.462	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-71.7	144.8	177.1	-74.3	0	0	0	0	110.6	G428 D429 D525	S426-G428 PolarHBondContact O-N 2.87Å; S426-D429 PolarHBondContact N-OD2 2.7Å; S426-D429 WeakPolarHBondContact O-CB 3.48Å; S426-D429 PolarHBondContact O-N 3.18Å; S426-D525 WeakPolarHBondContact CA-OD2 3.22Å
427	A	91.4	Very high	94	Very high	8 Å²	8	44.2 Å²	44.2	7%	0.066	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	135.3	175.1	0	0	0	0	0	110.3	R247 D525	R247-A427 VanDerWaalsContact CZ-C 3.48Å; R247-A427 VanDerWaalsContact CZ-O 3.23Å; R247-A427 PolarHBondContact NE-O 3.34Å; R247-A427 PolarHBondContact NH2-O 3.24Å; A427-D525 HydrophobicContact CB-CB 4.13Å; A427-D525 PolarHBondContact N-OD2 3.4Å
428	G	90.9	Very high	94	Very high	31 Å²	31	50.9 Å²	50.9	32%	0.32	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	-9.4	-168.4	0	0	0	0	0	114.5	V359 S426	V359-G428 VanDerWaalsContact O-CA 3.31Å; V359-G428 WeakPolarHBondContact O-CA 3.36Å; V359-G428 PolarHBondContact O-N 2.88Å; S426-G428 PolarHBondContact O-N 2.87Å
429	D	93.3	Very high	94	Very high	39 Å²	39	54.5 Å²	54.5	21%	0.209	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-59.8	139.5	174.5	-83.5	-23.7	0	0	0	111.2	V359 A389 G390 P425 S426	V359-D429 HydrophobicContact CG2-CB 4.23Å; V359-D429 WeakPolarHBondContact CG2-O 3.4Å; V359-D429 PolarHBondContact N-O 3.48Å; A389-D429 HydrophobicContact CB-CB 4.14Å; G390-D429 VanDerWaalsContact CA-OD2 3.31Å; G390-D429 WeakPolarHBondContact CA-OD2 3.36Å; G390-D429 PolarHBondContact N-OD2 3.47Å; P425-D429 HydrophobicContact CB-CB 4.45Å; S426-D429 PolarHBondContact N-OD2 2.7Å; S426-D429 WeakPolarHBondContact O-CB 3.48Å; S426-D429 PolarHBondContact O-N 3.18Å
430	E	94.2	Very high	94	Very high	88 Å²	88	53.8 Å²	53.8	41%	0.411	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	133	172.1	-56.8	-173.7	146.1	0	0	110.6	K167 A389	K167-E430 WeakPolarHBondContact CE-OE1 3.43Å; K167-E430 WeakPolarHBondContact CE-OE2 3.36Å; K167-E430 IonicContact NZ-OE1 2.66Å; K167-E430 PolarHBondContact NZ-OE1 2.85Å; K167-E430 IonicContact NZ-OE2 2.75Å; A389-E430 WeakPolarHBondContact CA-O 3.27Å
431	I	96.7	Very high	94	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.8	178.3	-52.2	-176.8	0	0	0	108.2	E356 G357 V359 A374 L387 V388 A389 I418	E356-I431 WeakPolarHBondContact CA-O 3.4Å; G357-I431 PolarHBondContact N-O 3.11Å; G357-I431 PolarHBondContact O-N 3.46Å; V359-I431 HydrophobicContact CG2-CD1 3.78Å; V359-I431 HydrophobicContact CG2-CG1 3.7Å; A374-I431 HydrophobicContact CB-CD1 3.42Å; A374-I431 VanDerWaalsContact CB-CD1 3.42Å; L387-I431 HydrophobicContact CB-CG2 3.93Å; L387-I431 HydrophobicContact CD1-CG2 3.89Å; L387-I431 HydrophobicContact CD2-CG2 3.98Å; L387-I431 HydrophobicContact CG-CG2 4.15Å; V388-I431 WeakPolarHBondContact O-CA 3.26Å; A389-I431 HydrophobicContact CB-CG1 4.16Å; I418-I431 HydrophobicContact CD1-CD1 4.1Å
432	L	96.4	Very high	94	Very high	14 Å²	14	61.7 Å²	61.7	7%	0.073	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.2	173	-62.1	176.3	0	0	0	110.1	A165 E356 V388	A165-L432 HydrophobicContact CB-CB 4.25Å; A165-L432 HydrophobicContact CB-CD1 3.85Å; A165-L432 VanDerWaalsContact O-CD1 3.24Å; A165-L432 WeakPolarHBondContact O-CD1 3.48Å; E356-L432 HydrophobicContact CB-CD2 4.4Å; E356-L432 HydrophobicContact CG-CD2 3.96Å; V388-L432 PolarHBondContact N-O 3.04Å; V388-L432 PolarHBondContact O-N 3.38Å
433	E	96.4	Very high	94	Very high	34 Å²	34	55.7 Å²	55.7	16%	0.159	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	141.4	171.6	178.9	176.3	-150.3	0	0	112	L354 V355 C385 I386 L387	L354-E433 WeakPolarHBondContact CA-OE2 3.49Å; L354-E433 HydrophobicContact CB-CB 4.24Å; L354-E433 HydrophobicContact CD2-CG 4.05Å; L354-E433 WeakPolarHBondContact CD2-OE2 3.38Å; V355-E433 HydrophobicContact CB-CB 3.95Å; V355-E433 WeakPolarHBondContact CG2-OE2 3.31Å; V355-E433 PolarHBondContact N-OE2 3.29Å; V355-E433 PolarHBondContact O-N 2.91Å; C385-E433 VanDerWaalsContact CB-OE1 3.28Å; C385-E433 WeakPolarHBondContact CB-OE1 3.21Å; C385-E433 PolarHBondContact SG-OE1 2.72Å; I386-E433 WeakPolarHBondContact O-CA 3.41Å; L387-E433 HydrophobicContact CD2-CB 3.88Å; L387-E433 HydrophobicContact CD2-CG 4.38Å
434	V	95.5	Very high	94.2	Very high	12 Å²	12	49.9 Å²	49.9	7%	0.073	26%	0.256	C	S	.	.			trans	-129.3	153.2	177.9	-62.4	0	0	0	0	111.5	A165 I386 V388 S436 R439 A440	A165-V434 HydrophobicContact CB-CG1 4.14Å; I386-V434 HydrophobicContact CB-CG2 4.26Å; I386-V434 HydrophobicContact CG2-CG2 3.76Å; I386-V434 PolarHBondContact O-N 3.48Å; V388-V434 HydrophobicContact CG2-CG1 4.01Å; V388-V434 HydrophobicContact CG2-CG2 3.94Å; V434-S436 VanDerWaalsContact C-N 3.33Å; V434-S436 PolarHBondContact O-N 2.95Å; V434-R439 HydrophobicContact CB-CB 4.49Å; V434-R439 HydrophobicContact CB-CG 4.19Å; V434-R439 HydrophobicContact CG1-CG 4.4Å; V434-A440 HydrophobicContact CG2-CB 3.79Å
435	E	92.8	Very high	94.3	Very high	176 Å²	176	51.7 Å²	51.7	82%	0.822	27%	0.274	S	S	*	.	S	Bend	trans	-67.1	-28.1	-171.4	-59.7	172	179.3	0	0	114.4
436	S	95.1	Very high	94.3	Very high	43 Å²	43	53.5 Å²	53.5	30%	0.301	28%	0.281	S	S	.	.			trans	-151.4	157.5	-172.6	73.3	0	0	0	0	113.7	V434 Q438 R439 A440	V434-S436 VanDerWaalsContact C-N 3.33Å; V434-S436 PolarHBondContact O-N 2.95Å; S436-Q438 PolarHBondContact O-N 2.71Å; S436-R439 PolarHBondContact O-N 3.31Å; S436-R439 PolarHBondContact OG-N 3.04Å; S436-R439 VanDerWaalsContact OG-N 3.13Å; S436-A440 PolarHBondContact O-N 3.01Å
437	E	94.6	Very high	94.4	Very high	73 Å²	73	52.7 Å²	52.7	34%	0.341	27%	0.268	S	S	.	.	H	α-helix	trans	-64.6	-31.1	176.6	-61	-176.5	-156.2	0	0	111.2	I386 W393 K395 A440 H441	I386-E437 HydrophobicContact CD1-CG 3.7Å; I386-E437 HydrophobicContact CG1-CG 4.39Å; W393-E437 HydrophobicContact CH2-CB 4.28Å; W393-E437 HydrophobicContact CH2-CG 4.16Å; W393-E437 HydrophobicContact CZ3-CB 4.39Å; W393-E437 HydrophobicContact CZ3-CG 4.01Å; K395-E437 WeakPolarHBondContact CD-OE1 3.25Å; K395-E437 WeakPolarHBondContact CE-OE1 3.49Å; K395-E437 IonicContact NZ-OE1 3.66Å; K395-E437 PolarHBondContact NZ-OE1 2.99Å; E437-A440 PolarHBondContact O-N 2.93Å; E437-H441 PolarHBondContact O-CD2 3.49Å; E437-H441 PolarHBondContact O-N 3.16Å
438	Q	94.8	Very high	94.6	Very high	154 Å²	154	54.8 Å²	54.8	72%	0.72	28%	0.278	S	S	*	.	H	α-helix	trans	-63.3	-46.7	173.6	-68.6	178.9	-14.4	0	0	110.8	S436 A440 H441 E442	S436-Q438 PolarHBondContact O-N 2.71Å; Q438-A440 PolarHBondContact O-N 2.95Å; Q438-H441 WeakPolarHBondContact O-CB 3.14Å; Q438-H441 PolarHBondContact O-N 2.77Å; Q438-E442 PolarHBondContact O-N 2.82Å
439	R	94.5	Very high	94.7	Very high	76 Å²	76	56.7 Å²	56.7	29%	0.287	28%	0.276	S	S	.	.	H	α-helix	trans	-63.3	-40.4	176	-175.2	55.6	-179.6	-171.8	-0.8	112.1	T163 D164 V434 S436 H441 E442 V443	T163-R439 VanDerWaalsContact C-NH2 3.32Å; T163-R439 VanDerWaalsContact O-CZ 3.25Å; T163-R439 PolarHBondContact O-NH2 2.77Å; D164-R439 PolarHBondContact O-NH2 2.94Å; D164-R439 VanDerWaalsContact O-NH2 3.07Å; V434-R439 HydrophobicContact CB-CB 4.49Å; V434-R439 HydrophobicContact CB-CG 4.19Å; V434-R439 HydrophobicContact CG1-CG 4.4Å; S436-R439 PolarHBondContact O-N 3.31Å; S436-R439 PolarHBondContact OG-N 3.04Å; S436-R439 VanDerWaalsContact OG-N 3.13Å; R439-H441 VanDerWaalsContact C-N 3.29Å; R439-H441 PolarHBondContact O-N 3Å; R439-E442 VanDerWaalsContact CD-OE2 3.24Å; R439-E442 WeakPolarHBondContact CD-OE2 3.49Å; R439-E442 IonicContact CZ-OE2 2.85Å; R439-E442 IonicContact NE-OE2 2.59Å; R439-E442 IonicContact NH1-OE2 2.86Å; R439-E442 PolarHBondContact NH1-OE2 3.45Å; R439-E442 PolarHBondContact O-N 3.19Å; R439-V443 HydrophobicContact CG-CG2 4.42Å; R439-V443 VanDerWaalsContact O-CG2 3.29Å; R439-V443 WeakPolarHBondContact O-CG2 3.31Å; R439-V443 PolarHBondContact O-N 2.81Å
440	A	94.6	Very high	94.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-57.2	-43	173.9	0	0	0	0	0	112.1	I386 V388 W393 V434 S436 E437 Q438 V443 V444	I386-A440 HydrophobicContact CG2-CB 3.92Å; V388-A440 HydrophobicContact CG2-CB 3.89Å; W393-A440 HydrophobicContact CB-CB 4.06Å; W393-A440 HydrophobicContact CD2-CB 4.26Å; W393-A440 HydrophobicContact CE3-CB 4.33Å; W393-A440 HydrophobicContact CG-CB 4.17Å; V434-A440 HydrophobicContact CG2-CB 3.79Å; S436-A440 PolarHBondContact O-N 3.01Å; E437-A440 PolarHBondContact O-N 2.93Å; Q438-A440 PolarHBondContact O-N 2.95Å; A440-V443 PolarHBondContact O-N 3.37Å; A440-V444 WeakPolarHBondContact O-CB 3.5Å; A440-V444 WeakPolarHBondContact O-CG2 3.28Å; A440-V444 PolarHBondContact O-N 2.98Å
441	H	94.6	Very high	94.6	Very high	101 Å²	101	56.6 Å²	56.6	47%	0.468	28%	0.277	S	S	.	.	H	α-helix	trans	-66.4	-38.2	176.2	-80.6	-64.8	0	0	0	113.5	W393 E437 Q438 R439 A445	W393-H441 AromaticContact CE2-CE1 3.74Å; W393-H441 AromaticContact CE2-NE2 3.78Å; W393-H441 AromaticContact CZ2-CE1 3.68Å; W393-H441 AromaticContact CZ2-NE2 3.33Å; W393-H441 VanDerWaalsContact CZ2-NE2 3.33Å; W393-H441 WeakPolarHBondContact CZ2-NE2 2.9Å; W393-H441 AromaticContact NE1-CE1 3.34Å; W393-H441 PolarHBondContact NE1-CE1 3.03Å; W393-H441 VanDerWaalsContact NE1-CE1 3.34Å; W393-H441 AromaticContact NE1-ND1 3.7Å; W393-H441 AromaticContact NE1-NE2 3.87Å; E437-H441 PolarHBondContact O-CD2 3.49Å; E437-H441 PolarHBondContact O-N 3.16Å; Q438-H441 WeakPolarHBondContact O-CB 3.14Å; Q438-H441 PolarHBondContact O-N 2.77Å; R439-H441 VanDerWaalsContact C-N 3.29Å; R439-H441 PolarHBondContact O-N 3Å; H441-A445 WeakPolarHBondContact O-CB 3.24Å; H441-A445 PolarHBondContact O-N 3.28Å
442	E	94.3	Very high	94.4	Very high	89 Å²	89	62.1 Å²	62.1	42%	0.416	30%	0.303	S	S	.	.	H	α-helix	trans	-61.1	-48.2	173.4	-71.3	172	-177.5	0	0	111.8	Q438 R439 A445 W446	Q438-E442 PolarHBondContact O-N 2.82Å; R439-E442 VanDerWaalsContact CD-OE2 3.24Å; R439-E442 WeakPolarHBondContact CD-OE2 3.49Å; R439-E442 IonicContact CZ-OE2 2.85Å; R439-E442 IonicContact NE-OE2 2.59Å; R439-E442 IonicContact NH1-OE2 2.86Å; R439-E442 PolarHBondContact NH1-OE2 3.45Å; R439-E442 PolarHBondContact O-N 3.19Å; E442-A445 PolarHBondContact O-N 3.48Å; E442-W446 WeakPolarHBondContact O-CB 3.31Å; E442-W446 PolarHBondContact O-N 3.36Å
443	V	95	Very high	94.2	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.4	-48.3	-180	176.3	0	0	0	0	110.7	T163 D164 A165 V388 R439 A440 A445 W446 R447	T163-V443 VanDerWaalsContact O-CG2 3.3Å; T163-V443 WeakPolarHBondContact O-CG2 2.86Å; D164-V443 WeakPolarHBondContact OD1-CG1 3.45Å; A165-V443 HydrophobicContact CB-CG1 4.08Å; A165-V443 HydrophobicContact CB-CG2 4.03Å; V388-V443 HydrophobicContact CG1-CB 4.48Å; V388-V443 HydrophobicContact CG1-CG1 3.83Å; R439-V443 HydrophobicContact CG-CG2 4.42Å; R439-V443 VanDerWaalsContact O-CG2 3.29Å; R439-V443 WeakPolarHBondContact O-CG2 3.31Å; R439-V443 PolarHBondContact O-N 2.81Å; A440-V443 PolarHBondContact O-N 3.37Å; V443-A445 PolarHBondContact O-N 3.41Å; V443-W446 WeakPolarHBondContact O-CB 3.49Å; V443-W446 PolarHBondContact O-N 3.49Å; V443-R447 WeakPolarHBondContact O-CG 3.18Å; V443-R447 PolarHBondContact O-N 3.13Å
444	V	95	Very high	94.1	Very high	17 Å²	17	69 Å²	69	10%	0.103	34%	0.335	C	S	.	.	H	α-helix	trans	-63.9	-41.2	177.9	166.8	0	0	0	0	111.7	V388 K391 W393 A440 W446 N448	V388-V444 HydrophobicContact CG1-CG2 4.07Å; K391-V444 WeakPolarHBondContact O-CG1 3.47Å; W393-V444 HydrophobicContact CB-CG2 4.33Å; A440-V444 WeakPolarHBondContact O-CB 3.5Å; A440-V444 WeakPolarHBondContact O-CG2 3.28Å; A440-V444 PolarHBondContact O-N 2.98Å; V444-W446 VanDerWaalsContact C-N 3.31Å; V444-W446 PolarHBondContact O-N 2.98Å; V444-N448 WeakPolarHBondContact CG1-ND2 3.42Å; V444-N448 WeakPolarHBondContact O-CB 3.11Å; V444-N448 VanDerWaalsContact O-CG 3.28Å; V444-N448 PolarHBondContact O-N 2.85Å; V444-N448 PolarHBondContact O-ND2 3.42Å; V444-N448 VanDerWaalsContact O-ND2 3.15Å
445	A	94.1	Very high	94	Very high	62 Å²	62	73.9 Å²	73.9	51%	0.512	36%	0.355	S	S	.	.	H	α-helix	trans	-65.9	-34.3	176.7	0	0	0	0	0	112.5	H441 E442 V443 Y449	H441-A445 WeakPolarHBondContact O-CB 3.24Å; H441-A445 PolarHBondContact O-N 3.28Å; E442-A445 PolarHBondContact O-N 3.48Å; V443-A445 PolarHBondContact O-N 3.41Å; A445-Y449 VanDerWaalsContact O-CB 3.31Å; A445-Y449 WeakPolarHBondContact O-CB 3.3Å; A445-Y449 PolarHBondContact O-N 3.06Å; A445-Y449 VanDerWaalsContact O-N 3.07Å
446	W	94.8	Very high	94.1	Very high	40 Å²	40	70.8 Å²	70.8	15%	0.152	34%	0.342	C	S	.	.	H	α-helix	trans	-66.1	-53.5	173.6	175.3	-103.7	0	0	0	111.9	K160 E161 N162 E442 V443 V444 N448 Y449 V450	K160-W446 HydrophobicContact CB-CE3 4.46Å; K160-W446 HydrophobicContact CB-CZ3 3.68Å; K160-W446 WeakPolarHBondContact O-CH2 3.42Å; K160-W446 WeakPolarHBondContact O-CZ3 3.46Å; E161-W446 WeakPolarHBondContact O-CZ3 3.08Å; N162-W446 HydrophobicContact CB-CH2 4.26Å; N162-W446 HydrophobicContact CB-CZ2 3.82Å; N162-W446 PolarHBondContact OD1-NE1 3.1Å; N162-W446 VanDerWaalsContact OD1-NE1 3.09Å; E442-W446 WeakPolarHBondContact O-CB 3.31Å; E442-W446 PolarHBondContact O-N 3.36Å; V443-W446 WeakPolarHBondContact O-CB 3.49Å; V443-W446 PolarHBondContact O-N 3.49Å; V444-W446 VanDerWaalsContact C-N 3.31Å; V444-W446 PolarHBondContact O-N 2.98Å; W446-N448 VanDerWaalsContact C-N 3.33Å; W446-N448 PolarHBondContact O-N 3.39Å; W446-Y449 HydrophobicContact CE3-CD1 4.27Å; W446-Y449 HydrophobicContact CZ3-CD1 4.18Å; W446-Y449 HydrophobicContact CZ3-CE1 4.37Å; W446-Y449 WeakPolarHBondContact O-CA 3.29Å; W446-Y449 WeakPolarHBondContact O-CB 3.39Å; W446-Y449 PolarHBondContact O-N 2.97Å; W446-V450 HydrophobicContact CD2-CG2 4.27Å; W446-V450 HydrophobicContact CZ2-CG2 3.96Å; W446-V450 WeakPolarHBondContact O-CG2 3.49Å; W446-V450 PolarHBondContact O-N 3.25Å
447	R	94.5	Very high	94.1	Very high	49 Å²	49	75.2 Å²	75.2	19%	0.185	36%	0.356	C	S	.	.	H	α-helix	trans	-57.7	-44.1	178.9	-68.9	176.8	-177.7	-169.5	-3.8	112.3	D164 A165 G390 V443 Y449 V450 E451	D164-R447 IonicContact OD1-CZ 3.95Å; D164-R447 IonicContact OD1-NE 2.73Å; D164-R447 PolarHBondContact OD1-NE 3.09Å; D164-R447 IonicContact OD1-NH2 2.85Å; D164-R447 PolarHBondContact OD1-NH2 2.78Å; D164-R447 IonicContact OD2-NE 3.79Å; D164-R447 PolarHBondContact OD2-NE 3.2Å; A165-R447 PolarHBondContact O-NH2 3.42Å; G390-R447 WeakPolarHBondContact O-CD 3.35Å; G390-R447 PolarHBondContact O-NH1 3.29Å; V443-R447 WeakPolarHBondContact O-CG 3.18Å; V443-R447 PolarHBondContact O-N 3.13Å; R447-Y449 VanDerWaalsContact C-N 3.31Å; R447-Y449 PolarHBondContact O-N 3.26Å; R447-V450 PolarHBondContact O-N 2.94Å; R447-E451 PolarHBondContact O-N 2.93Å; R447-E451 VanDerWaalsContact O-N 3.07Å
448	N	93.8	Very high	94.1	Very high	51 Å²	51	78.6 Å²	78.6	27%	0.273	37%	0.365	S	S	.	.	H	α-helix	trans	-64	-33.4	174.5	-73.7	-29.4	0	0	0	113	V444 W446 Q452	V444-N448 WeakPolarHBondContact CG1-ND2 3.42Å; V444-N448 WeakPolarHBondContact O-CB 3.11Å; V444-N448 VanDerWaalsContact O-CG 3.28Å; V444-N448 PolarHBondContact O-N 2.85Å; V444-N448 PolarHBondContact O-ND2 3.42Å; V444-N448 VanDerWaalsContact O-ND2 3.15Å; W446-N448 VanDerWaalsContact C-N 3.33Å; W446-N448 PolarHBondContact O-N 3.39Å; N448-Q452 WeakPolarHBondContact O-CB 3.24Å; N448-Q452 WeakPolarHBondContact O-CG 3.5Å; N448-Q452 PolarHBondContact O-N 2.97Å; N448-Q452 VanDerWaalsContact O-N 3.15Å
449	Y	93.6	Very high	94	Very high	71 Å²	71	74.9 Å²	74.9	28%	0.278	35%	0.351	S	S	.	.	H	α-helix	trans	-70.1	-43.2	175	169.1	-110	0	0	0	111.9	K160 A445 W446 R447 Q452 Q453	K160-Y449 HydrophobicContact CD-CD1 3.91Å; K160-Y449 HydrophobicContact CD-CE1 3.74Å; K160-Y449 HydrophobicContact CD-CG 4.39Å; K160-Y449 VanDerWaalsContact NZ-CG 3.28Å; A445-Y449 VanDerWaalsContact O-CB 3.31Å; A445-Y449 WeakPolarHBondContact O-CB 3.3Å; A445-Y449 PolarHBondContact O-N 3.06Å; A445-Y449 VanDerWaalsContact O-N 3.07Å; W446-Y449 HydrophobicContact CE3-CD1 4.27Å; W446-Y449 HydrophobicContact CZ3-CD1 4.18Å; W446-Y449 HydrophobicContact CZ3-CE1 4.37Å; W446-Y449 WeakPolarHBondContact O-CA 3.29Å; W446-Y449 WeakPolarHBondContact O-CB 3.39Å; W446-Y449 PolarHBondContact O-N 2.97Å; R447-Y449 VanDerWaalsContact C-N 3.31Å; R447-Y449 PolarHBondContact O-N 3.26Å; Y449-Q452 PolarHBondContact O-N 3.2Å; Y449-Q453 HydrophobicContact CD2-CG 4.24Å; Y449-Q453 HydrophobicContact CE1-CG 4.23Å; Y449-Q453 HydrophobicContact CE2-CG 3.7Å; Y449-Q453 WeakPolarHBondContact O-CG 3.4Å; Y449-Q453 PolarHBondContact O-N 2.74Å
450	V	93.1	Very high	94.1	Very high	49 Å²	49	75.6 Å²	75.6	30%	0.297	36%	0.36	S	S	.	.	H	α-helix	trans	-59.3	-51.8	176.7	174.2	0	0	0	0	110.6	W446 R447 Q452 Q453 E454	W446-V450 HydrophobicContact CD2-CG2 4.27Å; W446-V450 HydrophobicContact CZ2-CG2 3.96Å; W446-V450 WeakPolarHBondContact O-CG2 3.49Å; W446-V450 PolarHBondContact O-N 3.25Å; R447-V450 PolarHBondContact O-N 2.94Å; V450-Q452 VanDerWaalsContact C-N 3.29Å; V450-Q452 PolarHBondContact O-N 3.39Å; V450-Q453 PolarHBondContact O-N 3.1Å; V450-E454 PolarHBondContact O-N 3.18Å
451	E	91.9	Very high	94.1	Very high	76 Å²	76	80.6 Å²	80.6	36%	0.355	38%	0.383	S	S	.	.	H	α-helix	trans	-57.3	-41.8	176.7	175	176.2	-135.9	0	0	112	K391 R447 Q453 E454 K455	K391-E451 WeakPolarHBondContact CE-OE2 3.48Å; K391-E451 IonicContact NZ-OE1 2.77Å; K391-E451 PolarHBondContact NZ-OE1 2.88Å; K391-E451 IonicContact NZ-OE2 2.7Å; K391-E451 PolarHBondContact NZ-OE2 3.3Å; R447-E451 PolarHBondContact O-N 2.93Å; R447-E451 VanDerWaalsContact O-N 3.07Å; E451-Q453 VanDerWaalsContact C-N 3.32Å; E451-Q453 PolarHBondContact O-N 3.36Å; E451-E454 PolarHBondContact O-N 2.97Å; E451-K455 WeakPolarHBondContact O-CB 3.34Å; E451-K455 PolarHBondContact O-N 3.21Å
452	Q	93	Very high	94.1	Very high	118 Å²	118	82 Å²	82	55%	0.551	39%	0.388	S	S	*	.	H	α-helix	trans	-62.6	-38	177.1	-77	171.8	16	0	0	112	N448 Y449 V450 M456	N448-Q452 WeakPolarHBondContact O-CB 3.24Å; N448-Q452 WeakPolarHBondContact O-CG 3.5Å; N448-Q452 PolarHBondContact O-N 2.97Å; N448-Q452 VanDerWaalsContact O-N 3.15Å; Y449-Q452 PolarHBondContact O-N 3.2Å; V450-Q452 VanDerWaalsContact C-N 3.29Å; V450-Q452 PolarHBondContact O-N 3.39Å; Q452-M456 VanDerWaalsContact O-CB 3.27Å; Q452-M456 WeakPolarHBondContact O-CB 3.18Å; Q452-M456 WeakPolarHBondContact O-CG 3.44Å; Q452-M456 PolarHBondContact O-N 2.96Å
453	Q	92.2	Very high	94.1	Very high	80 Å²	80	81.9 Å²	81.9	37%	0.374	39%	0.389	S	S	.	.	H	α-helix	trans	-67.9	-43.9	174.6	-65.2	-46.9	-80.1	0	0	112.1	Y449 V450 E451 K455 M456 K457	Y449-Q453 HydrophobicContact CD2-CG 4.24Å; Y449-Q453 HydrophobicContact CE1-CG 4.23Å; Y449-Q453 HydrophobicContact CE2-CG 3.7Å; Y449-Q453 WeakPolarHBondContact O-CG 3.4Å; Y449-Q453 PolarHBondContact O-N 2.74Å; V450-Q453 PolarHBondContact O-N 3.1Å; E451-Q453 VanDerWaalsContact C-N 3.32Å; E451-Q453 PolarHBondContact O-N 3.36Å; Q453-K455 VanDerWaalsContact C-N 3.34Å; Q453-K455 PolarHBondContact O-N 2.85Å; Q453-M456 PolarHBondContact O-N 3.07Å; Q453-K457 WeakPolarHBondContact O-CB 3.06Å; Q453-K457 PolarHBondContact O-N 3.45Å
454	E	94	Very high	94.2	Very high	111 Å²	111	87.6 Å²	87.6	52%	0.519	42%	0.416	S	S	.	.	H	α-helix	trans	-63.4	-39.4	177	-69.6	179.6	169.2	0	0	112.5	V450 E451 R458	V450-E454 PolarHBondContact O-N 3.18Å; E451-E454 PolarHBondContact O-N 2.97Å; E454-R458 WeakPolarHBondContact O-CG 3.46Å; E454-R458 PolarHBondContact O-N 3.11Å; E454-R458 VanDerWaalsContact O-N 3.1Å; E454-R458 PolarHBondContact O-NE 2.93Å
455	K	94.4	Very high	94.2	Very high	115 Å²	115	89 Å²	89	50%	0.5	43%	0.429	S	S	.	.	H	α-helix	trans	-65.4	-49.2	172.7	-178	174.2	179.1	174.4	0	111	E451 Q453 K457 R458 D459	E451-K455 WeakPolarHBondContact O-CB 3.34Å; E451-K455 PolarHBondContact O-N 3.21Å; Q453-K455 VanDerWaalsContact C-N 3.34Å; Q453-K455 PolarHBondContact O-N 2.85Å; K455-K457 PolarHBondContact O-N 3.24Å; K455-R458 PolarHBondContact O-N 3.47Å; K455-D459 WeakPolarHBondContact CE-OD2 3.44Å; K455-D459 WeakPolarHBondContact O-CB 3.06Å; K455-D459 VanDerWaalsContact O-CG 3.26Å; K455-D459 PolarHBondContact O-N 2.94Å
456	M	94.3	Very high	94.2	Very high	112 Å²	112	90.4 Å²	90.4	55%	0.552	42%	0.424	S	S	*	.	H	α-helix	trans	-57.1	-37	176.9	-78.8	173.5	58.9	0	0	112.3	Q452 Q453 L460	Q452-M456 VanDerWaalsContact O-CB 3.27Å; Q452-M456 WeakPolarHBondContact O-CB 3.18Å; Q452-M456 WeakPolarHBondContact O-CG 3.44Å; Q452-M456 PolarHBondContact O-N 2.96Å; Q453-M456 PolarHBondContact O-N 3.07Å; M456-L460 WeakPolarHBondContact O-CB 3.43Å; M456-L460 PolarHBondContact O-N 3.02Å
457	K	95	Very high	94.2	Very high	135 Å²	135	93.5 Å²	93.5	59%	0.587	44%	0.44	S	S	*	.	H	α-helix	trans	-65.4	-50	175.6	-175.1	-176.8	172.8	-169.5	0	111.8	Q453 K455 L460 E461	Q453-K457 WeakPolarHBondContact O-CB 3.06Å; Q453-K457 PolarHBondContact O-N 3.45Å; K455-K457 PolarHBondContact O-N 3.24Å; K457-L460 PolarHBondContact O-N 2.88Å; K457-E461 WeakPolarHBondContact CE-OE1 3.3Å; K457-E461 WeakPolarHBondContact O-CG 3.39Å; K457-E461 PolarHBondContact O-N 2.72Å
458	R	94.1	Very high	94.2	Very high	145 Å²	145	97.8 Å²	97.8	55%	0.547	46%	0.46	S	S	.	.	H	α-helix	trans	-60.7	-44.6	176.1	-73.6	179.1	-74.1	150.8	-12.6	112.2	E454 K455 L460 E461 F462	E454-R458 WeakPolarHBondContact O-CG 3.46Å; E454-R458 PolarHBondContact O-N 3.11Å; E454-R458 VanDerWaalsContact O-N 3.1Å; E454-R458 PolarHBondContact O-NE 2.93Å; K455-R458 PolarHBondContact O-N 3.47Å; R458-L460 VanDerWaalsContact C-N 3.31Å; R458-L460 PolarHBondContact O-N 2.84Å; R458-E461 PolarHBondContact O-N 3.06Å; R458-F462 WeakPolarHBondContact O-CB 3.24Å; R458-F462 PolarHBondContact O-N 3Å
459	D	94.4	Very high	94.2	Very high	76 Å²	76	100 Å²	100	41%	0.406	47%	0.469	S	S	.	.	H	α-helix	trans	-61.6	-40.3	176.2	-70.3	-12.6	0	0	0	110.5	K455 F462 I463	K455-D459 WeakPolarHBondContact CE-OD2 3.44Å; K455-D459 WeakPolarHBondContact O-CB 3.06Å; K455-D459 VanDerWaalsContact O-CG 3.26Å; K455-D459 PolarHBondContact O-N 2.94Å; D459-F462 PolarHBondContact O-N 2.94Å; D459-I463 WeakPolarHBondContact O-CB 3.39Å; D459-I463 WeakPolarHBondContact O-CD1 3.46Å; D459-I463 WeakPolarHBondContact O-CG1 3.37Å; D459-I463 PolarHBondContact O-N 3.4Å
460	L	95.4	Very high	94.2	Very high	91 Å²	91	102.6 Å²	102.6	48%	0.476	48%	0.483	S	S	.	.	H	α-helix	trans	-65.6	-46.6	176.2	-179.3	146.2	0	0	0	112.1	M456 K457 R458 F462 I463 E464	M456-L460 WeakPolarHBondContact O-CB 3.43Å; M456-L460 PolarHBondContact O-N 3.02Å; K457-L460 PolarHBondContact O-N 2.88Å; R458-L460 VanDerWaalsContact C-N 3.31Å; R458-L460 PolarHBondContact O-N 2.84Å; L460-F462 VanDerWaalsContact C-N 3.31Å; L460-F462 PolarHBondContact O-N 3Å; L460-I463 PolarHBondContact O-N 2.67Å; L460-E464 HydrophobicContact CD2-CG 4.22Å; L460-E464 WeakPolarHBondContact O-CB 3.27Å; L460-E464 WeakPolarHBondContact O-CG 3.34Å; L460-E464 PolarHBondContact O-N 3.07Å
461	E	95.2	Very high	94.2	Very high	105 Å²	105	107.4 Å²	107.4	49%	0.491	50%	0.496	S	S	.	.	H	α-helix	trans	-58.1	-42.9	175.8	-72.5	169.1	-172.2	0	0	111.4	K457 R458 E464 A465	K457-E461 WeakPolarHBondContact CE-OE1 3.3Å; K457-E461 WeakPolarHBondContact O-CG 3.39Å; K457-E461 PolarHBondContact O-N 2.72Å; R458-E461 PolarHBondContact O-N 3.06Å; E461-E464 PolarHBondContact O-N 3.02Å; E461-A465 WeakPolarHBondContact O-CB 3.42Å; E461-A465 PolarHBondContact O-N 2.87Å
462	F	94.4	Very high	94.3	Very high	130 Å²	130	107.9 Å²	107.9	57%	0.57	50%	0.499	S	S	*	.	H	α-helix	trans	-65.2	-44.2	174.6	-179.7	-95.8	0	0	0	112.7	R458 D459 L460 A465 K466	R458-F462 WeakPolarHBondContact O-CB 3.24Å; R458-F462 PolarHBondContact O-N 3Å; D459-F462 PolarHBondContact O-N 2.94Å; L460-F462 VanDerWaalsContact C-N 3.31Å; L460-F462 PolarHBondContact O-N 3Å; F462-A465 PolarHBondContact O-N 3.45Å; F462-K466 HydrophobicContact CD1-CG 4.34Å; F462-K466 HydrophobicContact CE1-CG 3.93Å; F462-K466 HydrophobicContact CE2-CG 4.34Å; F462-K466 HydrophobicContact CZ-CD 4.41Å; F462-K466 HydrophobicContact CZ-CG 3.93Å; F462-K466 WeakPolarHBondContact O-CG 3.38Å; F462-K466 PolarHBondContact O-N 2.92Å
463	I	94.9	Very high	94.2	Very high	87 Å²	87	106.8 Å²	106.8	45%	0.446	49%	0.494	S	S	.	.	H	α-helix	trans	-61.7	-44.5	176.7	-73.9	163.2	0	0	0	110.5	D459 L460 K466 Q467	D459-I463 WeakPolarHBondContact O-CB 3.39Å; D459-I463 WeakPolarHBondContact O-CD1 3.46Å; D459-I463 WeakPolarHBondContact O-CG1 3.37Å; D459-I463 PolarHBondContact O-N 3.4Å; L460-I463 PolarHBondContact O-N 2.67Å; I463-K466 PolarHBondContact O-N 3.21Å; I463-Q467 HydrophobicContact CG2-CG 4.26Å; I463-Q467 WeakPolarHBondContact O-CB 3.08Å; I463-Q467 VanDerWaalsContact O-CG 3.25Å; I463-Q467 WeakPolarHBondContact O-CG 3.22Å; I463-Q467 PolarHBondContact O-N 2.89Å
464	E	95.6	Very high	93.9	Very high	119 Å²	119	109 Å²	109	56%	0.556	50%	0.5	S	S	*	.	H	α-helix	trans	-63.1	-44.4	177.4	-75.2	-169.5	171.8	0	0	111.6	L460 E461 K466 Q467 K468	L460-E464 HydrophobicContact CD2-CG 4.22Å; L460-E464 WeakPolarHBondContact O-CB 3.27Å; L460-E464 WeakPolarHBondContact O-CG 3.34Å; L460-E464 PolarHBondContact O-N 3.07Å; E461-E464 PolarHBondContact O-N 3.02Å; E464-K466 PolarHBondContact O-N 2.88Å; E464-Q467 PolarHBondContact O-N 3.37Å; E464-K468 VanDerWaalsContact O-CB 3.24Å; E464-K468 WeakPolarHBondContact O-CB 2.86Å; E464-K468 PolarHBondContact O-N 3.13Å
465	A	95.4	Very high	93.7	Very high	47 Å²	47	108.2 Å²	108.2	39%	0.388	50%	0.496	S	S	.	.	H	α-helix	trans	-57	-50.1	174.3	0	0	0	0	0	111.6	E461 F462 Q467 K468 E469	E461-A465 WeakPolarHBondContact O-CB 3.42Å; E461-A465 PolarHBondContact O-N 2.87Å; F462-A465 PolarHBondContact O-N 3.45Å; A465-Q467 PolarHBondContact O-N 2.92Å; A465-K468 WeakPolarHBondContact O-CB 3.49Å; A465-K468 PolarHBondContact O-N 3.05Å; A465-E469 WeakPolarHBondContact O-CG 3.42Å; A465-E469 PolarHBondContact O-N 3.49Å
466	K	94.8	Very high	93.6	Very high	92 Å²	92	109 Å²	109	40%	0.4	50%	0.5	S	S	.	.	H	α-helix	trans	-66.1	-37.3	178.7	-69.6	-69.5	163.3	-140.2	0	113.2	F462 I463 E464 K468 E469 H470	F462-K466 HydrophobicContact CD1-CG 4.34Å; F462-K466 HydrophobicContact CE1-CG 3.93Å; F462-K466 HydrophobicContact CE2-CG 4.34Å; F462-K466 HydrophobicContact CZ-CD 4.41Å; F462-K466 HydrophobicContact CZ-CG 3.93Å; F462-K466 WeakPolarHBondContact O-CG 3.38Å; F462-K466 PolarHBondContact O-N 2.92Å; I463-K466 PolarHBondContact O-N 3.21Å; E464-K466 PolarHBondContact O-N 2.88Å; K466-K468 VanDerWaalsContact C-N 3.34Å; K466-E469 WeakPolarHBondContact CD-OE2 3.47Å; K466-E469 IonicContact NZ-OE1 2.67Å; K466-E469 PolarHBondContact NZ-OE1 3.44Å; K466-E469 IonicContact NZ-OE2 2.84Å; K466-E469 PolarHBondContact NZ-OE2 3.27Å; K466-H470 WeakPolarHBondContact O-CB 3.31Å; K466-H470 PolarHBondContact O-N 3.05Å
467	Q	93.6	Very high	93.2	Very high	105 Å²	105	108.5 Å²	108.5	49%	0.491	49%	0.494	S	S	.	.	H	α-helix	trans	-65.5	-36.9	172.6	-75.2	-175.2	27.7	0	0	112.1	I463 E464 A465 R471	I463-Q467 HydrophobicContact CG2-CG 4.26Å; I463-Q467 WeakPolarHBondContact O-CB 3.08Å; I463-Q467 VanDerWaalsContact O-CG 3.25Å; I463-Q467 WeakPolarHBondContact O-CG 3.22Å; I463-Q467 PolarHBondContact O-N 2.89Å; E464-Q467 PolarHBondContact O-N 3.37Å; A465-Q467 PolarHBondContact O-N 2.92Å; Q467-R471 WeakPolarHBondContact O-CB 3.17Å; Q467-R471 PolarHBondContact O-N 2.65Å
468	K	95.3	Very high	92.6	Very high	138 Å²	138	104.8 Å²	104.8	60%	0.6	48%	0.479	S	S	*	.	H	α-helix	trans	-69.5	-43.3	177.9	-164.3	-170	-179.7	176.9	0	111.5	E464 A465 K466 R471 M472	E464-K468 VanDerWaalsContact O-CB 3.24Å; E464-K468 WeakPolarHBondContact O-CB 2.86Å; E464-K468 PolarHBondContact O-N 3.13Å; A465-K468 WeakPolarHBondContact O-CB 3.49Å; A465-K468 PolarHBondContact O-N 3.05Å; K466-K468 VanDerWaalsContact C-N 3.34Å; K468-R471 PolarHBondContact O-N 3.07Å; K468-M472 HydrophobicContact CD-CE 4.5Å; K468-M472 HydrophobicContact CG-CE 4.13Å; K468-M472 WeakPolarHBondContact O-CG 3.2Å; K468-M472 PolarHBondContact O-N 3.48Å
469	E	94.1	Very high	92.3	Very high	99 Å²	99	104.4 Å²	104.4	46%	0.463	48%	0.484	S	S	.	.	H	α-helix	trans	-54.9	-55.2	170.5	-74.4	173.4	-163	0	0	111.2	A465 K466 R471 M472 E473	A465-E469 WeakPolarHBondContact O-CG 3.42Å; A465-E469 PolarHBondContact O-N 3.49Å; K466-E469 WeakPolarHBondContact CD-OE2 3.47Å; K466-E469 IonicContact NZ-OE1 2.67Å; K466-E469 PolarHBondContact NZ-OE1 3.44Å; K466-E469 IonicContact NZ-OE2 2.84Å; K466-E469 PolarHBondContact NZ-OE2 3.27Å; E469-R471 VanDerWaalsContact C-N 3.31Å; E469-R471 PolarHBondContact O-N 3.04Å; E469-M472 PolarHBondContact O-N 3.37Å; E469-E473 PolarHBondContact O-N 3.48Å
470	H	92.4	Very high	91.9	Very high	124 Å²	124	108.8 Å²	108.8	57%	0.574	50%	0.499	S	S	*	.	H	α-helix	trans	-59.9	-39.3	179.3	175.1	-101	0	0	0	112.3	K466 E473 Y474	K466-H470 WeakPolarHBondContact O-CB 3.31Å; K466-H470 PolarHBondContact O-N 3.05Å; H470-E473 PolarHBondContact O-N 3.34Å; H470-Y474 VanDerWaalsContact O-CB 3.29Å; H470-Y474 WeakPolarHBondContact O-CB 3.4Å; H470-Y474 PolarHBondContact O-N 2.83Å
471	R	93.2	Very high	91.4	Very high	150 Å²	150	105.5 Å²	105.5	57%	0.566	48%	0.482	S	S	*	.	H	α-helix	trans	-64.7	-46.9	176.5	-170.5	-175.5	-53.8	-131.7	3.3	111.8	Q467 K468 E469 E473 Y474 E475	Q467-R471 WeakPolarHBondContact O-CB 3.17Å; Q467-R471 PolarHBondContact O-N 2.65Å; K468-R471 PolarHBondContact O-N 3.07Å; E469-R471 VanDerWaalsContact C-N 3.31Å; E469-R471 PolarHBondContact O-N 3.04Å; R471-E473 VanDerWaalsContact C-N 3.31Å; R471-E473 PolarHBondContact O-N 2.93Å; R471-Y474 WeakPolarHBondContact O-CB 3.49Å; R471-Y474 PolarHBondContact O-N 3.02Å; R471-E475 WeakPolarHBondContact CG-OE1 3.44Å; R471-E475 WeakPolarHBondContact O-CB 3.18Å; R471-E475 WeakPolarHBondContact O-CG 3.1Å; R471-E475 PolarHBondContact O-N 3.04Å
472	M	93.8	Very high	90.8	Very high	86 Å²	86	103.7 Å²	103.7	42%	0.424	49%	0.485	S	S	.	.	H	α-helix	trans	-61.4	-39.4	175.7	-75.7	-169	-82.2	0	0	112.1	K468 E469 K476	K468-M472 HydrophobicContact CD-CE 4.5Å; K468-M472 HydrophobicContact CG-CE 4.13Å; K468-M472 WeakPolarHBondContact O-CG 3.2Å; K468-M472 PolarHBondContact O-N 3.48Å; E469-M472 PolarHBondContact O-N 3.37Å; M472-K476 WeakPolarHBondContact O-CB 3.44Å; M472-K476 VanDerWaalsContact O-CG 3.29Å; M472-K476 WeakPolarHBondContact O-CG 3.4Å; M472-K476 PolarHBondContact O-N 3.21Å
473	E	91.1	Very high	90.3	Very high	95 Å²	95	104.9 Å²	104.9	44%	0.444	49%	0.492	S	S	.	.	H	α-helix	trans	-67.7	-40.2	176.5	-154.4	-141.4	174.8	0	0	111.7	E469 H470 R471 K476 K477	E469-E473 PolarHBondContact O-N 3.48Å; H470-E473 PolarHBondContact O-N 3.34Å; R471-E473 VanDerWaalsContact C-N 3.31Å; R471-E473 PolarHBondContact O-N 2.93Å; E473-K476 PolarHBondContact O-N 3Å; E473-K477 WeakPolarHBondContact O-CB 3.29Å; E473-K477 VanDerWaalsContact O-CG 3.28Å; E473-K477 WeakPolarHBondContact O-CG 3.33Å; E473-K477 PolarHBondContact O-N 2.91Å; E473-K477 WeakPolarHBondContact OE1-CE 3.32Å; E473-K477 IonicContact OE1-NZ 3.66Å; E473-K477 PolarHBondContact OE1-NZ 3.33Å; E473-K477 IonicContact OE2-NZ 3.07Å; E473-K477 PolarHBondContact OE2-NZ 3.15Å
474	Y	87	Confident	89.8	Confident	126 Å²	126	102.6 Å²	102.6	49%	0.494	48%	0.481	S	S	.	.	H	α-helix	trans	-62.8	-43.8	174	-175.8	-89.9	0	0	0	112.3	H470 R471 K477 Q478	H470-Y474 VanDerWaalsContact O-CB 3.29Å; H470-Y474 WeakPolarHBondContact O-CB 3.4Å; H470-Y474 PolarHBondContact O-N 2.83Å; R471-Y474 WeakPolarHBondContact O-CB 3.49Å; R471-Y474 PolarHBondContact O-N 3.02Å; Y474-K477 WeakPolarHBondContact O-CB 3.18Å; Y474-K477 PolarHBondContact O-N 3.34Å; Y474-Q478 HydrophobicContact CD1-CG 4.01Å; Y474-Q478 HydrophobicContact CE1-CG 3.6Å; Y474-Q478 WeakPolarHBondContact O-CG 3.29Å; Y474-Q478 PolarHBondContact O-N 2.73Å; Y474-Q478 PolarHBondContact OH-NE2 3.15Å; Y474-Q478 VanDerWaalsContact OH-NE2 3.07Å
475	E	90.3	Very high	89.4	Confident	95 Å²	95	101 Å²	101	44%	0.444	48%	0.479	S	S	.	.	H	α-helix	trans	-62.7	-46.3	175.9	-75.4	168.7	-171	0	0	111.5	R471 K477 Q478 Q479	R471-E475 WeakPolarHBondContact CG-OE1 3.44Å; R471-E475 WeakPolarHBondContact O-CB 3.18Å; R471-E475 WeakPolarHBondContact O-CG 3.1Å; R471-E475 PolarHBondContact O-N 3.04Å; E475-K477 VanDerWaalsContact C-N 3.29Å; E475-K477 PolarHBondContact O-N 2.98Å; E475-Q478 PolarHBondContact O-N 2.85Å; E475-Q478 VanDerWaalsContact O-N 3.09Å; E475-Q479 WeakPolarHBondContact O-CG 3.35Å; E475-Q479 PolarHBondContact O-N 2.7Å
476	K	91.3	Very high	88.5	Confident	132 Å²	132	107 Å²	107	57%	0.574	49%	0.491	S	S	*	.	H	α-helix	trans	-57.4	-41	172.6	-73.8	171.5	-178.3	176.8	0	111.9	M472 E473 K480	M472-K476 WeakPolarHBondContact O-CB 3.44Å; M472-K476 VanDerWaalsContact O-CG 3.29Å; M472-K476 WeakPolarHBondContact O-CG 3.4Å; M472-K476 PolarHBondContact O-N 3.21Å; E473-K476 PolarHBondContact O-N 3Å; K476-K480 WeakPolarHBondContact O-CG 3.49Å; K476-K480 PolarHBondContact O-N 3.39Å
477	K	85.6	Confident	87.9	Confident	101 Å²	101	111.4 Å²	111.4	44%	0.439	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-41.5	174.1	-74.2	165.8	179.8	169.4	0	111.8	E473 Y474 E475 L481	E473-K477 WeakPolarHBondContact O-CB 3.29Å; E473-K477 VanDerWaalsContact O-CG 3.28Å; E473-K477 WeakPolarHBondContact O-CG 3.33Å; E473-K477 PolarHBondContact O-N 2.91Å; E473-K477 WeakPolarHBondContact OE1-CE 3.32Å; E473-K477 IonicContact OE1-NZ 3.66Å; E473-K477 PolarHBondContact OE1-NZ 3.33Å; E473-K477 IonicContact OE2-NZ 3.07Å; E473-K477 PolarHBondContact OE2-NZ 3.15Å; Y474-K477 WeakPolarHBondContact O-CB 3.18Å; Y474-K477 PolarHBondContact O-N 3.34Å; E475-K477 VanDerWaalsContact C-N 3.29Å; E475-K477 PolarHBondContact O-N 2.98Å; K477-L481 WeakPolarHBondContact O-CG 3.48Å; K477-L481 PolarHBondContact O-N 3.28Å
478	Q	83.1	Confident	87.4	Confident	57 Å²	57	111 Å²	111	27%	0.266	50%	0.504	S	S	.	.	H	α-helix	trans	-68.4	-40.5	177.2	-74.3	-64.5	-12.4	0	0	113.1	Y474 E475 L481 A482	Y474-Q478 HydrophobicContact CD1-CG 4.01Å; Y474-Q478 HydrophobicContact CE1-CG 3.6Å; Y474-Q478 WeakPolarHBondContact O-CG 3.29Å; Y474-Q478 PolarHBondContact O-N 2.73Å; Y474-Q478 PolarHBondContact OH-NE2 3.15Å; Y474-Q478 VanDerWaalsContact OH-NE2 3.07Å; E475-Q478 PolarHBondContact O-N 2.85Å; E475-Q478 VanDerWaalsContact O-N 3.09Å; Q478-L481 CarbonylContact O-C 3.42Å; Q478-L481 PolarHBondContact O-N 3.02Å; Q478-L481 VanDerWaalsContact O-N 3.14Å; Q478-A482 PolarHBondContact O-N 2.96Å
479	Q	87.3	Confident	86.7	Confident	138 Å²	138	106.7 Å²	106.7	65%	0.645	49%	0.485	S	S	*	.	H	α-helix	trans	-60.1	-48.2	176.4	-74.4	173.5	-3.7	0	0	111.4	E475 L481 A482	E475-Q479 WeakPolarHBondContact O-CG 3.35Å; E475-Q479 PolarHBondContact O-N 2.7Å; Q479-L481 PolarHBondContact O-N 3.25Å; Q479-L481 VanDerWaalsContact O-N 3.16Å; Q479-A482 WeakPolarHBondContact O-CB 3.48Å; Q479-A482 PolarHBondContact O-N 3.41Å
480	K	85.9	Confident	86	Confident	167 Å²	167	109 Å²	109	73%	0.726	49%	0.493	S	S	*	.	H	α-helix	trans	-55.2	-34.5	174.3	-72.5	177	-179.2	-175.6	0	112.6	K476 H483	K476-K480 WeakPolarHBondContact O-CG 3.49Å; K476-K480 PolarHBondContact O-N 3.39Å; K480-H483 PolarHBondContact O-CE1 3.38Å; K480-H483 VanDerWaalsContact O-CE1 3.23Å; K480-H483 PolarHBondContact O-ND1 3.05Å; K480-H483 VanDerWaalsContact O-ND1 3.1Å
481	L	84.3	Confident	85.6	Confident	22 Å²	22	105.6 Å²	105.6	12%	0.115	49%	0.487	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-4.8	179.4	-66.5	170.9	0	0	0	113.9	K477 Q478 Q479 H483 L484 K489 V492 L493	K477-L481 WeakPolarHBondContact O-CG 3.48Å; K477-L481 PolarHBondContact O-N 3.28Å; Q478-L481 CarbonylContact O-C 3.42Å; Q478-L481 PolarHBondContact O-N 3.02Å; Q478-L481 VanDerWaalsContact O-N 3.14Å; Q479-L481 PolarHBondContact O-N 3.25Å; Q479-L481 VanDerWaalsContact O-N 3.16Å; L481-H483 PolarHBondContact O-N 3.49Å; L481-H483 VanDerWaalsContact O-N 3.14Å; L481-L484 HydrophobicContact CD2-CD1 3.9Å; L481-L484 WeakPolarHBondContact O-CB 3.11Å; L481-L484 PolarHBondContact O-N 2.7Å; L481-K489 HydrophobicContact CB-CD 4.3Å; L481-K489 HydrophobicContact CB-CG 4.24Å; L481-K489 WeakPolarHBondContact O-CE 3.39Å; L481-V492 HydrophobicContact CD2-CG1 4.02Å; L481-L493 HydrophobicContact CD1-CD1 4.35Å; L481-L493 HydrophobicContact CD1-CD2 3.93Å; L481-L493 HydrophobicContact CD1-CG 4.11Å
482	A	82.6	Confident	85.1	Confident	68 Å²	68	101.6 Å²	101.6	56%	0.562	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-31.8	-168.3	0	0	0	0	0	113.9	Q478 Q479 L484	Q478-A482 PolarHBondContact O-N 2.96Å; Q479-A482 WeakPolarHBondContact O-CB 3.48Å; Q479-A482 PolarHBondContact O-N 3.41Å; A482-L484 PolarHBondContact O-N 3.5Å
483	H	84.7	Confident	84.5	Confident	154 Å²	154	100.9 Å²	100.9	71%	0.713	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-8.1	177.3	71.7	-83.1	0	0	0	114.8	K480 L481	K480-H483 PolarHBondContact O-CE1 3.38Å; K480-H483 VanDerWaalsContact O-CE1 3.23Å; K480-H483 PolarHBondContact O-ND1 3.05Å; K480-H483 VanDerWaalsContact O-ND1 3.1Å; L481-H483 PolarHBondContact O-N 3.49Å; L481-H483 VanDerWaalsContact O-N 3.14Å
484	L	85.4	Confident	83.9	Confident	40 Å²	40	103 Å²	103	21%	0.209	48%	0.481	C	S	.	.	S	Bend	trans	-105	141.5	-175.8	-65	170.3	0	0	0	112.6	L481 A482 Q488 K489 V492	L481-L484 HydrophobicContact CD2-CD1 3.9Å; L481-L484 WeakPolarHBondContact O-CB 3.11Å; L481-L484 PolarHBondContact O-N 2.7Å; A482-L484 PolarHBondContact O-N 3.5Å; L484-Q488 HydrophobicContact CB-CB 4.15Å; L484-Q488 HydrophobicContact CD2-CB 4.19Å; L484-K489 HydrophobicContact CB-CG 3.9Å; L484-K489 WeakPolarHBondContact O-CE 2.99Å; L484-V492 HydrophobicContact CD1-CG2 4.22Å
485	T	86.1	Confident	83.6	Confident	84 Å²	84	104.9 Å²	104.9	52%	0.515	49%	0.492	S	S	.	.			trans	-66.5	155.3	170.8	65.2	0	0	0	0	111.5	R487 Q488 K489	T485-R487 PolarHBondContact O-N 2.8Å; T485-R487 VanDerWaalsContact O-N 3.1Å; T485-Q488 WeakPolarHBondContact O-CA 3.34Å; T485-Q488 WeakPolarHBondContact O-CB 3.07Å; T485-Q488 PolarHBondContact O-N 2.84Å; T485-Q488 VanDerWaalsContact OG1-CD 3.27Å; T485-Q488 PolarHBondContact OG1-OE1 2.87Å; T485-K489 PolarHBondContact O-N 2.87Å
486	W	77.7	Confident	83.1	Confident	173 Å²	173	102.7 Å²	102.7	66%	0.655	49%	0.491	S	S	*	.	H	α-helix	trans	-56.1	-34.2	-174.5	79.5	-97.2	0	0	0	114.1	K490	W486-K490 HydrophobicContact CZ3-CD 4.29Å; W486-K490 WeakPolarHBondContact O-CB 3.46Å; W486-K490 PolarHBondContact O-N 3Å
487	R	80.6	Confident	82.6	Confident	185 Å²	185	99.8 Å²	99.8	70%	0.698	48%	0.481	S	S	*	.	H	α-helix	trans	-66.6	-41.3	176.6	-67.2	-174.4	177.1	171.4	-0.1	111.5	T485 A491	T485-R487 PolarHBondContact O-N 2.8Å; T485-R487 VanDerWaalsContact O-N 3.1Å; R487-A491 PolarHBondContact O-N 3.48Å
488	Q	82.9	Confident	82.2	Confident	97 Å²	97	100.4 Å²	100.4	45%	0.453	48%	0.484	S	S	.	.	H	α-helix	trans	-69.1	-45.7	175.4	-68.1	161.6	-38.7	0	0	110.8	L484 T485 K490 A491 V492	L484-Q488 HydrophobicContact CB-CB 4.15Å; L484-Q488 HydrophobicContact CD2-CB 4.19Å; T485-Q488 WeakPolarHBondContact O-CA 3.34Å; T485-Q488 WeakPolarHBondContact O-CB 3.07Å; T485-Q488 PolarHBondContact O-N 2.84Å; T485-Q488 VanDerWaalsContact OG1-CD 3.27Å; T485-Q488 PolarHBondContact OG1-OE1 2.87Å; Q488-K490 VanDerWaalsContact C-N 3.3Å; Q488-K490 PolarHBondContact O-N 3.02Å; Q488-A491 PolarHBondContact O-N 2.8Å; Q488-A491 VanDerWaalsContact O-N 3.09Å; Q488-V492 WeakPolarHBondContact O-CG2 3.49Å; Q488-V492 PolarHBondContact O-N 2.94Å
489	K	81.8	Confident	81.6	Confident	47 Å²	47	104.1 Å²	104.1	20%	0.204	50%	0.501	C	S	.	.	H	α-helix	trans	-50.7	-48.8	172.5	-70.4	-171.4	169.9	-168	0	111.5	L481 L484 T485 A491 V492 L493	L481-K489 HydrophobicContact CB-CD 4.3Å; L481-K489 HydrophobicContact CB-CG 4.24Å; L481-K489 WeakPolarHBondContact O-CE 3.39Å; L484-K489 HydrophobicContact CB-CG 3.9Å; L484-K489 WeakPolarHBondContact O-CE 2.99Å; T485-K489 PolarHBondContact O-N 2.87Å; K489-A491 PolarHBondContact O-N 2.76Å; K489-V492 PolarHBondContact O-N 2.83Å; K489-L493 WeakPolarHBondContact O-CB 3.44Å; K489-L493 VanDerWaalsContact O-CG 3.31Å; K489-L493 WeakPolarHBondContact O-CG 3.38Å; K489-L493 PolarHBondContact O-N 2.87Å
490	K	79.9	Confident	80.7	Confident	147 Å²	147	101.9 Å²	101.9	64%	0.639	49%	0.493	S	S	*	.	H	α-helix	trans	-60.2	-41.4	178.5	-174.2	174.6	-179.6	176.1	0	112.5	W486 Q488 Y494	W486-K490 HydrophobicContact CZ3-CD 4.29Å; W486-K490 WeakPolarHBondContact O-CB 3.46Å; W486-K490 PolarHBondContact O-N 3Å; Q488-K490 VanDerWaalsContact C-N 3.3Å; Q488-K490 PolarHBondContact O-N 3.02Å; K490-Y494 WeakPolarHBondContact O-CB 3.18Å; K490-Y494 PolarHBondContact O-N 2.77Å
491	A	83.4	Confident	79.6	Confident	53 Å²	53	100.7 Å²	100.7	44%	0.438	49%	0.491	S	S	.	.	H	α-helix	trans	-69.1	-39.9	177.9	0	0	0	0	0	112.8	R487 Q488 K489 K495	R487-A491 PolarHBondContact O-N 3.48Å; Q488-A491 PolarHBondContact O-N 2.8Å; Q488-A491 VanDerWaalsContact O-N 3.09Å; K489-A491 PolarHBondContact O-N 2.76Å; A491-K495 WeakPolarHBondContact O-CG 3.5Å; A491-K495 PolarHBondContact O-N 2.93Å
492	V	82.8	Confident	78.6	Confident	67 Å²	67	107.6 Å²	107.6	41%	0.406	52%	0.521	S	S	.	.	H	α-helix	trans	-66.6	-48.6	176.1	173.5	0	0	0	0	110.8	L481 L484 Q488 K489 Y494 K495 A496	L481-V492 HydrophobicContact CD2-CG1 4.02Å; L484-V492 HydrophobicContact CD1-CG2 4.22Å; Q488-V492 WeakPolarHBondContact O-CG2 3.49Å; Q488-V492 PolarHBondContact O-N 2.94Å; K489-V492 PolarHBondContact O-N 2.83Å; V492-Y494 VanDerWaalsContact C-N 3.33Å; V492-Y494 PolarHBondContact O-N 2.83Å; V492-K495 PolarHBondContact O-N 3.28Å; V492-A496 WeakPolarHBondContact O-CB 3.49Å; V492-A496 PolarHBondContact O-N 3.26Å
493	L	80.5	Confident	77.6	Confident	70 Å²	70	107.8 Å²	107.8	37%	0.366	52%	0.518	S	S	.	.	H	α-helix	trans	-61.7	-38.5	176.4	-72.4	169.6	0	0	0	112.3	L481 K489 A496 N497	L481-L493 HydrophobicContact CD1-CD1 4.35Å; L481-L493 HydrophobicContact CD1-CD2 3.93Å; L481-L493 HydrophobicContact CD1-CG 4.11Å; K489-L493 WeakPolarHBondContact O-CB 3.44Å; K489-L493 VanDerWaalsContact O-CG 3.31Å; K489-L493 WeakPolarHBondContact O-CG 3.38Å; K489-L493 PolarHBondContact O-N 2.87Å; L493-A496 PolarHBondContact O-N 3.42Å; L493-N497 VanDerWaalsContact O-CB 3.3Å; L493-N497 WeakPolarHBondContact O-CB 3.33Å; L493-N497 PolarHBondContact O-N 3.48Å
494	Y	79.1	Confident	76.4	Confident	139 Å²	139	109.1 Å²	109.1	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-65.3	-40.4	175.2	-179.9	-100.5	0	0	0	112.3	K490 V492 K498	K490-Y494 WeakPolarHBondContact O-CB 3.18Å; K490-Y494 PolarHBondContact O-N 2.77Å; V492-Y494 VanDerWaalsContact C-N 3.33Å; V492-Y494 PolarHBondContact O-N 2.83Å; Y494-K498 WeakPolarHBondContact O-CB 3.38Å; Y494-K498 PolarHBondContact O-N 3.09Å; Y494-K498 VanDerWaalsContact O-N 3.15Å
495	K	81.3	Confident	75	Confident	167 Å²	167	113.2 Å²	113.2	73%	0.726	55%	0.55	S	S	*	*	H	α-helix	trans	-64.8	-46.9	173.3	-76.5	-177.6	177.4	-175	0	111.6	A491 V492 K498	A491-K495 WeakPolarHBondContact O-CG 3.5Å; A491-K495 PolarHBondContact O-N 2.93Å; V492-K495 PolarHBondContact O-N 3.28Å; K495-K498 WeakPolarHBondContact O-CB 3.41Å; K495-K498 PolarHBondContact O-N 3.11Å
496	A	79.1	Confident	73.7	Confident	49 Å²	49	115.2 Å²	115.2	41%	0.405	55%	0.552	S	S	.	*	H	α-helix	trans	-61	-54.1	179.7	0	0	0	0	0	111.3	V492 L493 K498 H499	V492-A496 WeakPolarHBondContact O-CB 3.49Å; V492-A496 PolarHBondContact O-N 3.26Å; L493-A496 PolarHBondContact O-N 3.42Å; A496-K498 PolarHBondContact O-N 3.35Å; A496-H499 PolarHBondContact O-CE1 3.42Å; A496-H499 PolarHBondContact O-ND1 3.38Å
497	N	79.8	Confident	72.5	Confident	71 Å²	71	116.8 Å²	116.8	38%	0.38	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.4	4.2	-175.6	-61.1	0.7	0	0	0	113.4	L493 H499 I500 M501	L493-N497 VanDerWaalsContact O-CB 3.3Å; L493-N497 WeakPolarHBondContact O-CB 3.33Å; L493-N497 PolarHBondContact O-N 3.48Å; N497-H499 VanDerWaalsContact C-N 3.29Å; N497-H499 PolarHBondContact O-N 3.16Å; N497-I500 PolarHBondContact O-N 3.32Å; N497-M501 PolarHBondContact O-N 3.28Å
498	K	78.4	Confident	70.8	Confident	114 Å²	114	118.4 Å²	118.4	50%	0.496	57%	0.573	S	S	.	*	H	α-helix	trans	-56.8	-43.3	-178.9	-169.4	-179.3	177.8	-170.6	0	111.5	Y494 K495 A496 F502	Y494-K498 WeakPolarHBondContact O-CB 3.38Å; Y494-K498 PolarHBondContact O-N 3.09Å; Y494-K498 VanDerWaalsContact O-N 3.15Å; K495-K498 WeakPolarHBondContact O-CB 3.41Å; K495-K498 PolarHBondContact O-N 3.11Å; A496-K498 PolarHBondContact O-N 3.35Å; K498-F502 HydrophobicContact CG-CD2 4.45Å; K498-F502 HydrophobicContact CG-CE2 4.09Å; K498-F502 WeakPolarHBondContact O-CD2 3.05Å
499	H	70.4	Confident	69.2	Low	134 Å²	134	118.4 Å²	118.4	62%	0.62	58%	0.58	S	S	*	*	H	α-helix	trans	-65.3	-44.7	177.8	67.2	-80.6	0	0	0	111.6	A496 N497 M501 F502 S503	A496-H499 PolarHBondContact O-CE1 3.42Å; A496-H499 PolarHBondContact O-ND1 3.38Å; N497-H499 VanDerWaalsContact C-N 3.29Å; N497-H499 PolarHBondContact O-N 3.16Å; H499-M501 VanDerWaalsContact C-N 3.3Å; H499-M501 PolarHBondContact O-N 3.07Å; H499-F502 PolarHBondContact O-N 2.87Å; H499-S503 PolarHBondContact O-N 3.35Å; H499-S503 VanDerWaalsContact O-N 3.11Å; H499-S503 PolarHBondContact O-OG 3.39Å
500	I	68.8	Low	67.6	Low	92 Å²	92	123 Å²	123	47%	0.472	60%	0.602	S	S	.	*	H	α-helix	trans	-60.8	-37.1	179.2	-48.5	179.4	0	0	0	111.8	N497 F502 S503	N497-I500 PolarHBondContact O-N 3.32Å; I500-F502 VanDerWaalsContact C-N 3.26Å; I500-F502 PolarHBondContact O-N 2.57Å; I500-S503 WeakPolarHBondContact CA-OG 3.47Å; I500-S503 PolarHBondContact O-N 2.67Å; I500-S503 PolarHBondContact O-OG 3.15Å
501	M	61.1	Low	66.3	Low	142 Å²	142	120.2 Å²	120.2	70%	0.7	60%	0.601	S	S	*	*	H	α-helix	trans	-68.1	-21.4	177.2	-79.1	-163.4	167.3	0	0	114.3	N497 H499	N497-M501 PolarHBondContact O-N 3.28Å; H499-M501 VanDerWaalsContact C-N 3.3Å; H499-M501 PolarHBondContact O-N 3.07Å
502	F	64.8	Low	65	Low	167 Å²	167	123 Å²	123	73%	0.732	61%	0.609	S	S	*	*	H	α-helix	trans	-94.7	-24.9	175.7	-71.1	-68.1	0	0	0	112.8	K498 H499 I500 K504	K498-F502 HydrophobicContact CG-CD2 4.45Å; K498-F502 HydrophobicContact CG-CE2 4.09Å; K498-F502 WeakPolarHBondContact O-CD2 3.05Å; H499-F502 PolarHBondContact O-N 2.87Å; I500-F502 VanDerWaalsContact C-N 3.26Å; I500-F502 PolarHBondContact O-N 2.57Å; F502-K504 PolarHBondContact O-N 3.06Å; F502-K504 VanDerWaalsContact O-N 3.1Å
503	S	61.3	Low	64	Low	72 Å²	72	128.4 Å²	128.4	50%	0.503	63%	0.626	S	S	.	*			trans	-76.5	89.9	167.7	57.9	0	0	0	0	110.8	H499 I500	H499-S503 PolarHBondContact O-N 3.35Å; H499-S503 VanDerWaalsContact O-N 3.11Å; H499-S503 PolarHBondContact O-OG 3.39Å; I500-S503 WeakPolarHBondContact CA-OG 3.47Å; I500-S503 PolarHBondContact O-N 2.67Å; I500-S503 PolarHBondContact O-OG 3.15Å
504	K	59.5	Low	64	Low	181 Å²	181	127.5 Å²	127.5	79%	0.787	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-66	136.2	158.3	-74.2	-173.7	177.7	-177.9	0	108.5	F502 K506	F502-K504 PolarHBondContact O-N 3.06Å; F502-K504 VanDerWaalsContact O-N 3.1Å; K504-K506 PolarHBondContact O-N 3.26Å; K504-K506 VanDerWaalsContact O-N 3.08Å
505	P	56.3	Low	64.4	Low	126 Å²	126	122.4 Å²	122.4	82%	0.818	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-59.7	116.8	159.5	27.2	-31.7	0	0	0	106.9
506	K	58.7	Low	64.9	Low	127 Å²	127	114.4 Å²	114.4	55%	0.552	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-73.2	133.8	165.2	-63.6	175.4	-173.8	171.2	0	105.6	K504 R508 T509 E510	K504-K506 PolarHBondContact O-N 3.26Å; K504-K506 VanDerWaalsContact O-N 3.08Å; K506-R508 VanDerWaalsContact CB-C 3.43Å; K506-R508 WeakPolarHBondContact CB-O 3.46Å; K506-R508 VanDerWaalsContact CD-O 3.3Å; K506-R508 WeakPolarHBondContact CD-O 3.32Å; K506-R508 CarbonylContact O-C 3.58Å; K506-R508 PolarHBondContact O-N 3.15Å; K506-T509 PolarHBondContact O-N 3.29Å; K506-E510 IonicContact NZ-OE1 2.65Å; K506-E510 PolarHBondContact NZ-OE1 2.91Å
507	E	52.5	Low	65.6	Low	206 Å²	206	112.6 Å²	112.6	96%	0.963	56%	0.555	S	S	*	*	S	Bend	trans	-59.8	-27.1	166.8	-67.9	170.2	153.5	0	0	111
508	R	45.2	Very low	66.3	Low	218 Å²	218	109.3 Å²	109.3	82%	0.823	54%	0.537	S	S	*	.	S	Bend	trans	-93.7	75.2	159.4	-60.5	177.4	-175.9	179.1	-2.7	109.3	K506 E510	K506-R508 VanDerWaalsContact CB-C 3.43Å; K506-R508 WeakPolarHBondContact CB-O 3.46Å; K506-R508 VanDerWaalsContact CD-O 3.3Å; K506-R508 WeakPolarHBondContact CD-O 3.32Å; K506-R508 CarbonylContact O-C 3.58Å; K506-R508 PolarHBondContact O-N 3.15Å; R508-E510 PolarHBondContact O-N 3.42Å
509	T	48.4	Very low	67.2	Low	97 Å²	97	103.9 Å²	103.9	60%	0.595	51%	0.513	S	S	*	.			trans	-46.4	131.6	143.5	-9.2	0	0	0	0	105.4	K506 S511	K506-T509 PolarHBondContact O-N 3.29Å; T509-S511 PolarHBondContact O-N 2.73Å
510	E	48.2	Very low	68.4	Low	145 Å²	145	97.6 Å²	97.6	68%	0.678	48%	0.484	S	S	*	.			trans	-55.4	115.6	172.6	-80.1	147.9	-140.7	0	0	105.4	K506 R508 D512	K506-E510 IonicContact NZ-OE1 2.65Å; K506-E510 PolarHBondContact NZ-OE1 2.91Å; R508-E510 PolarHBondContact O-N 3.42Å; E510-D512 PolarHBondContact O-N 3.2Å
511	S	52	Low	69.7	Low	87 Å²	87	93.9 Å²	93.9	61%	0.608	47%	0.465	S	S	*	.			trans	-43.3	115.4	-168.1	50.2	0	0	0	0	108.4	T509 K513	T509-S511 PolarHBondContact O-N 2.73Å; S511-K513 VanDerWaalsContact O-CA 3.3Å; S511-K513 WeakPolarHBondContact O-CA 3.5Å; S511-K513 PolarHBondContact O-N 3.43Å
512	D	56.2	Low	71.3	Confident	113 Å²	113	87.1 Å²	87.1	60%	0.604	43%	0.432	S	S	*	.			trans	-50.1	114	-177.8	-70.9	-52.5	0	0	0	106	E510 N514 V515	E510-D512 PolarHBondContact O-N 3.2Å; D512-N514 PolarHBondContact O-N 3.32Å; D512-V515 HydrophobicContact CB-CG2 3.7Å; D512-V515 PolarHBondContact O-N 2.75Å
513	K	63.5	Low	72.6	Confident	180 Å²	180	81 Å²	81	78%	0.783	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-18.1	-151.6	-71.5	-177	179.3	177.6	0	113	S511	S511-K513 VanDerWaalsContact O-CA 3.3Å; S511-K513 WeakPolarHBondContact O-CA 3.5Å; S511-K513 PolarHBondContact O-N 3.43Å
514	N	79.8	Confident	74.1	Confident	51 Å²	51	77.7 Å²	77.7	27%	0.273	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	40.6	-178.2	-45.5	14.9	0	0	0	110.4	D512 E543 C544 K545	D512-N514 PolarHBondContact O-N 3.32Å; N514-E543 VanDerWaalsContact CB-O 3.31Å; N514-E543 WeakPolarHBondContact CB-O 3.4Å; N514-E543 PolarHBondContact ND2-O 3.05Å; N514-C544 HydrophobicContact CB-CB 4.22Å; N514-C544 CarbonylContact O-C 3.53Å; N514-C544 VanDerWaalsContact O-C 3.3Å; N514-C544 WeakPolarHBondContact O-CA 3.45Å; N514-C544 PolarHBondContact O-SG 3.02Å; N514-K545 PolarHBondContact O-N 3.46Å
515	V	87.8	Confident	75.7	Confident	31 Å²	31	70.4 Å²	70.4	19%	0.188	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.6	167.2	178.9	0	0	0	0	109.2	D512 K545 D547 R613	D512-V515 HydrophobicContact CB-CG2 3.7Å; D512-V515 PolarHBondContact O-N 2.75Å; V515-K545 CarbonylContact C-O 3.59Å; V515-K545 WeakPolarHBondContact CA-O 3.39Å; V515-K545 HydrophobicContact CG2-CB 4.31Å; V515-D547 HydrophobicContact CG1-CB 4.18Å; V515-D547 WeakPolarHBondContact CG1-OD2 3.33Å; V515-R613 PolarHBondContact O-NH1 3.41Å
516	L	91.2	Very high	77.3	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	93.8	170.4	-179	57.9	0	0	0	110.5	V518 K545 L546 D547 V570 V606 E609 L610 R613	L516-V518 HydrophobicContact CD1-CG2 4.44Å; L516-V518 HydrophobicContact CD2-CG2 4.19Å; L516-V518 HydrophobicContact CG-CG2 3.81Å; L516-V518 PolarHBondContact O-N 3.27Å; L516-K545 PolarHBondContact N-O 3.01Å; L516-L546 HydrophobicContact CB-CD1 4.33Å; L516-L546 HydrophobicContact CD2-CD1 4.13Å; L516-L546 HydrophobicContact CG-CD1 4.23Å; L516-D547 PolarHBondContact O-N 3.18Å; L516-V570 HydrophobicContact CD1-CG2 4.35Å; L516-V606 HydrophobicContact CD2-CG1 4.42Å; L516-E609 HydrophobicContact CD1-CG 3.68Å; L516-E609 HydrophobicContact CD2-CB 4.26Å; L516-E609 HydrophobicContact CD2-CG 4.23Å; L516-L610 HydrophobicContact CB-CD2 3.72Å; L516-L610 HydrophobicContact CD2-CD2 3.52Å; L516-L610 HydrophobicContact CD2-CG 3.61Å; L516-L610 HydrophobicContact CG-CD2 4.25Å; L516-R613 VanDerWaalsContact CD1-CZ 3.46Å
517	S	93.4	Very high	78.8	Confident	11 Å²	11	58.5 Å²	58.5	8%	0.077	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	117.8	166.9	-71.2	0	0	0	0	111.7	I549 F567 G569 V570	S517-I549 VanDerWaalsContact CB-CD1 3.46Å; S517-F567 VanDerWaalsContact CB-O 3.32Å; S517-F567 WeakPolarHBondContact CB-O 3.34Å; S517-F567 PolarHBondContact OG-O 3.01Å; S517-G569 VanDerWaalsContact CB-CA 3.44Å; S517-G569 CarbonylContact O-C 3.54Å; S517-G569 WeakPolarHBondContact O-CA 3.02Å; S517-V570 PolarHBondContact O-N 2.68Å
518	V	95.5	Very high	80.8	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	140.6	-178.8	176.8	0	0	0	0	112	L516 V520 L546 D547 I549 Y572	L516-V518 HydrophobicContact CD1-CG2 4.44Å; L516-V518 HydrophobicContact CD2-CG2 4.19Å; L516-V518 HydrophobicContact CG-CG2 3.81Å; L516-V518 PolarHBondContact O-N 3.27Å; V518-V520 HydrophobicContact CG1-CG2 3.77Å; V518-L546 HydrophobicContact CG2-CD1 3.69Å; V518-D547 PolarHBondContact N-O 3.18Å; V518-I549 PolarHBondContact O-N 3.12Å; V518-Y572 HydrophobicContact CG1-CD2 3.98Å; V518-Y572 HydrophobicContact CG1-CE2 4.48Å; V518-Y572 HydrophobicContact CG2-CE2 4.48Å
519	I	96.5	Very high	83	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.6	164.1	-63.6	-177.7	0	0	0	108.7	I549 H550 D560 L563 A564 V570 V571 Y572	I519-I549 HydrophobicContact CG1-CB 4.24Å; I519-H550 VanDerWaalsContact CA-O 3.28Å; I519-H550 WeakPolarHBondContact CA-O 2.94Å; I519-H550 HydrophobicContact CD1-CB 4.49Å; I519-H550 HydrophobicContact CG1-CB 4.28Å; I519-H550 HydrophobicContact CG2-CB 4.28Å; I519-H550 WeakPolarHBondContact CG2-O 3.32Å; I519-D560 WeakPolarHBondContact CD1-O 3.29Å; I519-D560 HydrophobicContact CG2-CB 4.47Å; I519-L563 HydrophobicContact CD1-CB 3.68Å; I519-A564 HydrophobicContact CD1-CB 4.04Å; I519-V570 PolarHBondContact N-O 2.94Å; I519-V571 HydrophobicContact CB-CG2 4.38Å; I519-V571 HydrophobicContact CG2-CG1 4.31Å; I519-V571 WeakPolarHBondContact O-CA 3.43Å; I519-Y572 PolarHBondContact O-N 3.09Å
520	V	96.7	Very high	85.1	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.5	-178.8	-175.9	0	0	0	0	110.5	V518 I531 L535 H550 F551 G552	V518-V520 HydrophobicContact CG1-CG2 3.77Å; V520-I531 HydrophobicContact CG1-CB 4.39Å; V520-I531 HydrophobicContact CG1-CD1 4.23Å; V520-I531 HydrophobicContact CG1-CG2 3.91Å; V520-I531 HydrophobicContact CG2-CG2 4.23Å; V520-L535 HydrophobicContact CG2-CD1 4.01Å; V520-H550 PolarHBondContact N-O 3.27Å; V520-F551 HydrophobicContact CB-CB 4.42Å; V520-F551 VanDerWaalsContact O-CA 3.29Å; V520-F551 WeakPolarHBondContact O-CA 3.48Å; V520-G552 PolarHBondContact O-N 2.85Å
521	K	95.6	Very high	87.2	Confident	15 Å²	15	29.4 Å²	29.4	7%	0.065	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	113.3	169.6	-67.7	-60.6	-173.3	-178.3	0	110.7	H550 G552 I556 D560 Y572 G573 F574 V576	K521-H550 PolarHBondContact NZ-CD2 3.11Å; K521-G552 WeakPolarHBondContact CA-O 3.41Å; K521-G552 WeakPolarHBondContact CD-O 3.49Å; K521-I556 HydrophobicContact CB-CG1 4.26Å; K521-I556 HydrophobicContact CG-CG1 4.16Å; K521-D560 WeakPolarHBondContact CE-OD1 3.26Å; K521-D560 WeakPolarHBondContact CE-OD2 3.46Å; K521-D560 VanDerWaalsContact NZ-CG 3.33Å; K521-D560 IonicContact NZ-OD1 2.74Å; K521-D560 PolarHBondContact NZ-OD1 2.95Å; K521-D560 IonicContact NZ-OD2 2.76Å; K521-D560 PolarHBondContact NZ-OD2 2.98Å; K521-Y572 PolarHBondContact N-O 2.91Å; K521-G573 CarbonylContact O-C 3.51Å; K521-G573 VanDerWaalsContact O-CA 3.32Å; K521-G573 WeakPolarHBondContact O-CA 3.27Å; K521-F574 PolarHBondContact O-N 2.82Å; K521-V576 HydrophobicContact CB-CG2 4.17Å; K521-V576 WeakPolarHBondContact O-CG2 3.38Å
522	G	94.6	Very high	89.2	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	165.7	169.3	0	0	0	0	0	111.2	G552 M553 G554 V576	G522-G552 PolarHBondContact N-O 2.95Å; G522-M553 CarbonylContact O-C 3.57Å; G522-M553 VanDerWaalsContact O-CA 3.32Å; G522-M553 WeakPolarHBondContact O-CA 3.26Å; G522-G554 PolarHBondContact O-N 3.46Å; G522-V576 VanDerWaalsContact C-CG1 3.45Å; G522-V576 WeakPolarHBondContact O-CG1 3.32Å
523	D	92.5	Very high	90.9	Very high	37 Å²	37	25.4 Å²	25.4	20%	0.198	13%	0.128	C	C	.	.	S	Bend	trans	-78.8	-41.1	173	59.5	-26.9	0	0	0	112.3	H216 S527 F574 S575 V576	H216-D523 IonicContact CE1-OD1 3.65Å; H216-D523 IonicContact CE1-OD2 2.6Å; H216-D523 PolarHBondContact CE1-OD2 2.98Å; H216-D523 IonicContact ND1-OD2 2.67Å; H216-D523 IonicContact NE2-OD2 3.76Å; D523-S527 PolarHBondContact OD1-OG 2.9Å; D523-F574 PolarHBondContact N-O 2.86Å; D523-S575 VanDerWaalsContact CG-CB 3.46Å; D523-S575 WeakPolarHBondContact OD2-CB 3.39Å; D523-V576 HydrophobicContact CB-CG1 4.13Å
524	V	92.8	Very high	92.3	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.024	9%	0.092	C	C	.	.	B	Isolated β-bridge	trans	-117.9	161.9	179.2	-53.9	0	0	0	0	111.3	H216 E361 S362 R363 S527	H216-V524 WeakPolarHBondContact ND1-CG2 3.43Å; E361-V524 HydrophobicContact CG-CB 3.79Å; E361-V524 HydrophobicContact CG-CG1 4.07Å; E361-V524 HydrophobicContact CG-CG2 4.31Å; S362-V524 CarbonylContact O-C 3.55Å; S362-V524 VanDerWaalsContact O-CA 3.28Å; S362-V524 WeakPolarHBondContact O-CA 3.49Å; R363-V524 HydrophobicContact CB-CG1 4.16Å; V524-S527 VanDerWaalsContact CG2-OG 3.31Å; V524-S527 WeakPolarHBondContact CG2-OG 3.35Å; V524-S527 PolarHBondContact O-OG 2.8Å; V524-S527 VanDerWaalsContact O-OG 3.09Å
525	D	92.4	Very high	92.8	Very high	28 Å²	28	15 Å²	15	15%	0.15	8%	0.081	C	C	.	.	H	α-helix	trans	-66	-46.4	-178.4	-158.7	41.2	0	0	0	112.3	S362 S426 A427 S527 V528 E529 M553	S362-D525 PolarHBondContact O-N 2.78Å; S426-D525 WeakPolarHBondContact CA-OD2 3.22Å; A427-D525 HydrophobicContact CB-CB 4.13Å; A427-D525 PolarHBondContact N-OD2 3.4Å; D525-S527 VanDerWaalsContact C-N 3.29Å; D525-S527 PolarHBondContact O-N 3.06Å; D525-V528 WeakPolarHBondContact O-CB 3.19Å; D525-V528 PolarHBondContact O-N 3.49Å; D525-V528 VanDerWaalsContact O-N 3.12Å; D525-E529 PolarHBondContact O-N 2.84Å; D525-M553 HydrophobicContact CB-CE 4.01Å; D525-M553 HydrophobicContact CB-CG 4.32Å; D525-M553 HydrophobicContact CB-SD 3.59Å; D525-M553 VanDerWaalsContact CB-SD 3.59Å; D525-M553 WeakPolarHBondContact OD1-CE 3.3Å
526	G	89.2	Confident	92.9	Very high	2 Å²	2	20.2 Å²	20.2	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-65.3	-27	-176.9	0	0	0	0	0	114.2	M244 A530	M244-G526 VanDerWaalsContact CE-O 3.27Å; M244-G526 WeakPolarHBondContact CE-O 3.33Å; G526-A530 WeakPolarHBondContact O-CB 3.42Å; G526-A530 PolarHBondContact O-N 2.91Å
527	S	91.5	Very high	92.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-74.8	-35.1	175.2	65.3	0	0	0	0	111.5	D523 V524 D525 I531	D523-S527 PolarHBondContact OD1-OG 2.9Å; V524-S527 VanDerWaalsContact CG2-OG 3.31Å; V524-S527 WeakPolarHBondContact CG2-OG 3.35Å; V524-S527 PolarHBondContact O-OG 2.8Å; V524-S527 VanDerWaalsContact O-OG 3.09Å; D525-S527 VanDerWaalsContact C-N 3.29Å; D525-S527 PolarHBondContact O-N 3.06Å; S527-I531 WeakPolarHBondContact O-CD1 3.47Å; S527-I531 VanDerWaalsContact O-CG1 3.26Å; S527-I531 WeakPolarHBondContact O-CG1 3.45Å; S527-I531 PolarHBondContact O-N 3.2Å; S527-I531 VanDerWaalsContact O-N 3.11Å
528	V	93.9	Very high	92.8	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.012	13%	0.126	C	C	.	.	H	α-helix	trans	-64.3	-48.3	169.5	-179.9	0	0	0	0	110.3	D525 A530 I531 L532 F551	D525-V528 WeakPolarHBondContact O-CB 3.19Å; D525-V528 PolarHBondContact O-N 3.49Å; D525-V528 VanDerWaalsContact O-N 3.12Å; V528-A530 PolarHBondContact O-N 3.44Å; V528-I531 PolarHBondContact O-N 3.08Å; V528-L532 HydrophobicContact CG1-CD1 3.9Å; V528-L532 HydrophobicContact CG1-CG 4.2Å; V528-L532 VanDerWaalsContact O-CG 3.27Å; V528-L532 WeakPolarHBondContact O-CG 3.33Å; V528-L532 PolarHBondContact O-N 2.84Å; V528-F551 HydrophobicContact CG1-CB 3.92Å; V528-F551 HydrophobicContact CG1-CD2 3.98Å; V528-F551 HydrophobicContact CG1-CG 4.34Å
529	E	92.3	Very high	92.5	Very high	51 Å²	51	28.9 Å²	28.9	24%	0.238	16%	0.155	C	C	.	.	H	α-helix	trans	-55.7	-48.5	177	-177.5	-176.1	-162.1	0	0	112.1	R247 D525 I531 L532 N533	R247-E529 IonicContact CZ-OE2 3.87Å; R247-E529 IonicContact NH1-OE2 3.65Å; R247-E529 PolarHBondContact NH1-OE2 2.76Å; R247-E529 VanDerWaalsContact NH2-CD 3.3Å; R247-E529 IonicContact NH2-OE1 3.43Å; R247-E529 PolarHBondContact NH2-OE1 3.5Å; R247-E529 VanDerWaalsContact NH2-OE1 3.07Å; R247-E529 IonicContact NH2-OE2 2.64Å; R247-E529 PolarHBondContact NH2-OE2 2.89Å; D525-E529 PolarHBondContact O-N 2.84Å; E529-I531 PolarHBondContact O-N 2.8Å; E529-L532 PolarHBondContact O-N 2.94Å; E529-N533 PolarHBondContact O-N 3.45Å; E529-N533 PolarHBondContact O-ND2 2.85Å; E529-N533 PolarHBondContact O-OD1 2.6Å
530	A	91.1	Very high	92	Very high	3 Å²	3	29.2 Å²	29.2	3%	0.025	16%	0.158	C	C	.	.	H	α-helix	trans	-60.1	-44.4	176.6	0	0	0	0	0	112.4	F241 G526 V528 N533 I534 I599	F241-A530 HydrophobicContact CD1-CB 3.52Å; F241-A530 HydrophobicContact CE1-CB 3.65Å; G526-A530 WeakPolarHBondContact O-CB 3.42Å; G526-A530 PolarHBondContact O-N 2.91Å; V528-A530 PolarHBondContact O-N 3.44Å; A530-N533 PolarHBondContact O-N 2.85Å; A530-I534 VanDerWaalsContact O-CG1 3.3Å; A530-I534 WeakPolarHBondContact O-CG1 3.47Å; A530-I534 PolarHBondContact O-N 3.43Å; A530-I534 VanDerWaalsContact O-N 3.16Å; A530-I599 HydrophobicContact CB-CD1 4.29Å
531	I	93.6	Very high	91.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64	-42.2	175.7	-67	163.3	0	0	0	110.9	V520 S527 V528 E529 N533 I534 L535 F574 I599 L602	V520-I531 HydrophobicContact CG1-CB 4.39Å; V520-I531 HydrophobicContact CG1-CD1 4.23Å; V520-I531 HydrophobicContact CG1-CG2 3.91Å; V520-I531 HydrophobicContact CG2-CG2 4.23Å; S527-I531 WeakPolarHBondContact O-CD1 3.47Å; S527-I531 VanDerWaalsContact O-CG1 3.26Å; S527-I531 WeakPolarHBondContact O-CG1 3.45Å; S527-I531 PolarHBondContact O-N 3.2Å; S527-I531 VanDerWaalsContact O-N 3.11Å; V528-I531 PolarHBondContact O-N 3.08Å; E529-I531 PolarHBondContact O-N 2.8Å; I531-N533 PolarHBondContact O-N 2.75Å; I531-I534 PolarHBondContact O-N 3.35Å; I531-L535 HydrophobicContact CG2-CD1 3.85Å; I531-L535 HydrophobicContact CG2-CG 4.27Å; I531-L535 VanDerWaalsContact O-CG 3.29Å; I531-L535 WeakPolarHBondContact O-CG 3.32Å; I531-L535 PolarHBondContact O-N 3.1Å; I531-F574 HydrophobicContact CD1-CB 3.68Å; I531-F574 HydrophobicContact CD1-CD1 4.46Å; I531-F574 HydrophobicContact CD1-CD2 4.03Å; I531-F574 HydrophobicContact CD1-CG 3.8Å; I531-I599 HydrophobicContact CG1-CD1 3.93Å; I531-I599 HydrophobicContact CG1-CG1 4.15Å; I531-L602 HydrophobicContact CD1-CD1 3.95Å; I531-L602 HydrophobicContact CG2-CD2 4.22Å
532	L	93.9	Very high	90.8	Very high	32 Å²	32	41.2 Å²	41.2	17%	0.168	22%	0.223	C	C	.	.	H	α-helix	trans	-61.8	-43.6	177.9	-70.8	174.4	0	0	0	111.7	V528 E529 I534 L535 D536 I548 F551	V528-L532 HydrophobicContact CG1-CD1 3.9Å; V528-L532 HydrophobicContact CG1-CG 4.2Å; V528-L532 VanDerWaalsContact O-CG 3.27Å; V528-L532 WeakPolarHBondContact O-CG 3.33Å; V528-L532 PolarHBondContact O-N 2.84Å; E529-L532 PolarHBondContact O-N 2.94Å; L532-I534 VanDerWaalsContact C-N 3.3Å; L532-I534 PolarHBondContact O-N 2.92Å; L532-L535 CarbonylContact O-C 3.56Å; L532-L535 PolarHBondContact O-N 2.89Å; L532-L535 VanDerWaalsContact O-N 3.11Å; L532-D536 WeakPolarHBondContact O-CB 3.37Å; L532-D536 PolarHBondContact O-N 2.97Å; L532-I548 HydrophobicContact CD2-CD1 3.87Å; L532-I548 HydrophobicContact CD2-CG2 3.9Å; L532-F551 HydrophobicContact CD1-CB 4.24Å; L532-F551 HydrophobicContact CD1-CD1 4.02Å; L532-F551 HydrophobicContact CD1-CD2 3.8Å; L532-F551 HydrophobicContact CD1-CE1 4.3Å; L532-F551 HydrophobicContact CD1-CE2 4.09Å; L532-F551 HydrophobicContact CD1-CG 3.76Å; L532-F551 HydrophobicContact CD1-CZ 4.33Å; L532-F551 HydrophobicContact CD2-CB 4.12Å; L532-F551 HydrophobicContact CD2-CD1 4.16Å; L532-F551 HydrophobicContact CD2-CG 4.22Å
533	N	91.4	Very high	90.3	Very high	83 Å²	83	44.1 Å²	44.1	44%	0.444	24%	0.237	S	C	.	.	H	α-helix	trans	-63.1	-34.3	177.6	-65.6	-17.3	0	0	0	112.5	E529 A530 I531 S537	E529-N533 PolarHBondContact O-N 3.45Å; E529-N533 PolarHBondContact O-ND2 2.85Å; E529-N533 PolarHBondContact O-OD1 2.6Å; A530-N533 PolarHBondContact O-N 2.85Å; I531-N533 PolarHBondContact O-N 2.75Å; N533-S537 PolarHBondContact O-N 3.41Å
534	I	91.7	Very high	90.1	Very high	7 Å²	7	42.4 Å²	42.4	4%	0.036	23%	0.227	C	C	.	.	H	α-helix	trans	-69.3	-40.8	172.2	-60.8	163.6	0	0	0	111	A240 A530 I531 L532 D536 S537 I599 I603 W722 P724 F726	A240-I534 HydrophobicContact CB-CD1 3.72Å; A240-I534 HydrophobicContact CB-CG1 4.15Å; A530-I534 VanDerWaalsContact O-CG1 3.3Å; A530-I534 WeakPolarHBondContact O-CG1 3.47Å; A530-I534 PolarHBondContact O-N 3.43Å; A530-I534 VanDerWaalsContact O-N 3.16Å; I531-I534 PolarHBondContact O-N 3.35Å; L532-I534 VanDerWaalsContact C-N 3.3Å; L532-I534 PolarHBondContact O-N 2.92Å; I534-D536 VanDerWaalsContact C-N 3.27Å; I534-D536 PolarHBondContact O-N 3.39Å; I534-S537 PolarHBondContact O-N 2.91Å; I534-S537 PolarHBondContact O-OG 3.03Å; I534-I599 HydrophobicContact CD1-CD1 3.71Å; I534-I599 HydrophobicContact CD1-CG1 4.08Å; I534-I603 HydrophobicContact CB-CD1 4.17Å; I534-I603 HydrophobicContact CD1-CD1 4.15Å; I534-I603 HydrophobicContact CD1-CG1 4.05Å; I534-I603 HydrophobicContact CG2-CD1 3.6Å; I534-I603 HydrophobicContact CG2-CG1 4.01Å; I534-I603 HydrophobicContact CG2-CG2 4.21Å; I534-W722 HydrophobicContact CG2-CH2 4.33Å; I534-W722 HydrophobicContact CG2-CZ2 3.98Å; I534-P724 HydrophobicContact CG2-CB 3.97Å; I534-F726 HydrophobicContact CB-CE1 4.44Å; I534-F726 HydrophobicContact CD1-CE1 3.69Å; I534-F726 HydrophobicContact CD1-CZ 4.13Å; I534-F726 HydrophobicContact CG1-CE1 3.79Å; I534-F726 HydrophobicContact CG2-CE1 3.77Å; I534-F726 HydrophobicContact CG2-CZ 4.36Å
535	L	91.6	Very high	89.9	Confident	7 Å²	7	46.4 Å²	46.4	4%	0.037	24%	0.244	C	C	.	.	H	α-helix	trans	-72.3	-23.1	179.3	-62.5	173.2	0	0	0	112.1	V520 I531 L532 Y538 L546 I548 I603 V606	V520-L535 HydrophobicContact CG2-CD1 4.01Å; I531-L535 HydrophobicContact CG2-CD1 3.85Å; I531-L535 HydrophobicContact CG2-CG 4.27Å; I531-L535 VanDerWaalsContact O-CG 3.29Å; I531-L535 WeakPolarHBondContact O-CG 3.32Å; I531-L535 PolarHBondContact O-N 3.1Å; L532-L535 CarbonylContact O-C 3.56Å; L532-L535 PolarHBondContact O-N 2.89Å; L532-L535 VanDerWaalsContact O-N 3.11Å; L535-Y538 VanDerWaalsContact O-CB 3.28Å; L535-Y538 WeakPolarHBondContact O-CB 3.43Å; L535-Y538 PolarHBondContact O-N 3Å; L535-L546 HydrophobicContact CB-CD2 4.09Å; L535-L546 HydrophobicContact CD2-CD2 3.93Å; L535-I548 HydrophobicContact CB-CD1 3.78Å; L535-I548 HydrophobicContact CD1-CD1 4.1Å; L535-I548 HydrophobicContact CD1-CG1 4.38Å; L535-I603 HydrophobicContact CD2-CD1 4.37Å; L535-V606 HydrophobicContact CD2-CG1 4.03Å
536	D	90.6	Very high	89.9	Confident	140 Å²	140	45.9 Å²	45.9	75%	0.749	24%	0.242	S	C	*	.	H	α-helix	trans	-77.9	-18.3	172.7	-157.9	59.7	0	0	0	112.6	L532 I534 Y538	L532-D536 WeakPolarHBondContact O-CB 3.37Å; L532-D536 PolarHBondContact O-N 2.97Å; I534-D536 VanDerWaalsContact C-N 3.27Å; I534-D536 PolarHBondContact O-N 3.39Å; D536-Y538 PolarHBondContact O-N 2.9Å
537	S	89.8	Confident	90	Very high	52 Å²	52	48.5 Å²	48.5	36%	0.364	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	6.3	169.7	81.9	0	0	0	0	113.7	N533 I534 D539 W722	N533-S537 PolarHBondContact O-N 3.41Å; I534-S537 PolarHBondContact O-N 2.91Å; I534-S537 PolarHBondContact O-OG 3.03Å; S537-D539 PolarHBondContact O-N 2.87Å; S537-W722 PolarHBondContact O-NE1 2.89Å
538	Y	90.6	Very high	90.2	Very high	24 Å²	24	51.4 Å²	51.4	9%	0.094	27%	0.27	C	S	.	.			trans	-71.7	117.7	176.2	-171.7	-106	0	0	0	111.7	L535 D536 A540 C544 L546 L610 W722	L535-Y538 VanDerWaalsContact O-CB 3.28Å; L535-Y538 WeakPolarHBondContact O-CB 3.43Å; L535-Y538 PolarHBondContact O-N 3Å; D536-Y538 PolarHBondContact O-N 2.9Å; Y538-A540 HydrophobicContact CE1-CB 4.35Å; Y538-A540 HydrophobicContact CE2-CB 4.02Å; Y538-A540 PolarHBondContact OH-O 2.95Å; Y538-A540 VanDerWaalsContact OH-O 3.07Å; Y538-C544 WeakPolarHBondContact CE1-O 3.33Å; Y538-C544 PolarHBondContact OH-O 3.27Å; Y538-L546 HydrophobicContact CD1-CB 3.79Å; Y538-L546 HydrophobicContact CD1-CD2 4.36Å; Y538-L546 HydrophobicContact CD2-CD2 4.4Å; Y538-L546 HydrophobicContact CE1-CB 4.05Å; Y538-L546 HydrophobicContact CG-CB 4.24Å; Y538-L546 HydrophobicContact CG-CD2 3.97Å; Y538-L610 HydrophobicContact CD2-CD1 4.34Å; Y538-L610 HydrophobicContact CE2-CD1 3.77Å; Y538-W722 HydrophobicContact CD2-CB 3.81Å; Y538-W722 AromaticContact CD2-CD1 3.87Å; Y538-W722 AromaticContact CD2-CD2 3.61Å; Y538-W722 HydrophobicContact CD2-CD2 3.61Å; Y538-W722 HydrophobicContact CD2-CE3 4.06Å; Y538-W722 AromaticContact CD2-CG 3.5Å; Y538-W722 HydrophobicContact CD2-CG 3.5Å; Y538-W722 VanDerWaalsContact CD2-CG 3.5Å; Y538-W722 HydrophobicContact CE2-CB 3.68Å; Y538-W722 HydrophobicContact CE2-CD2 4.14Å; Y538-W722 HydrophobicContact CE2-CE3 4.33Å; Y538-W722 AromaticContact CE2-CG 3.9Å; Y538-W722 HydrophobicContact CE2-CG 3.9Å
539	D	89.4	Confident	90.2	Very high	117 Å²	117	53.5 Å²	53.5	63%	0.626	28%	0.281	S	S	*	.			trans	-107.7	-14.5	-174.6	63.9	-27.6	0	0	0	114.1	S537 D541	S537-D539 PolarHBondContact O-N 2.87Å; D539-D541 VanDerWaalsContact C-N 3.34Å; D539-D541 PolarHBondContact O-N 3.13Å
540	A	86.7	Confident	90.3	Very high	7 Å²	7	55.4 Å²	55.4	6%	0.058	29%	0.289	C	S	.	.			trans	-91.4	37.2	-171.6	0	0	0	0	0	114.8	Y538 D542 E543 C544 S721 W722	Y538-A540 HydrophobicContact CE1-CB 4.35Å; Y538-A540 HydrophobicContact CE2-CB 4.02Å; Y538-A540 PolarHBondContact OH-O 2.95Å; Y538-A540 VanDerWaalsContact OH-O 3.07Å; A540-D542 PolarHBondContact O-N 3.38Å; A540-D542 VanDerWaalsContact O-N 3.11Å; A540-E543 HydrophobicContact CB-CB 4.47Å; A540-E543 HydrophobicContact CB-CG 4.37Å; A540-E543 WeakPolarHBondContact O-CB 3.32Å; A540-E543 PolarHBondContact O-N 2.76Å; A540-C544 PolarHBondContact O-N 3.34Å; A540-S721 WeakPolarHBondContact CB-OG 2.95Å; A540-W722 HydrophobicContact CB-CB 4.45Å
541	D	83.6	Confident	90.5	Very high	93 Å²	93	60.4 Å²	60.4	50%	0.497	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-28.1	-178	-104.4	-12.8	0	0	0	114.4	D539 E543	D539-D541 VanDerWaalsContact C-N 3.34Å; D539-D541 PolarHBondContact O-N 3.13Å; D541-E543 VanDerWaalsContact C-N 3.32Å
542	D	83.3	Confident	90.4	Very high	176 Å²	176	61 Å²	61	94%	0.941	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-24.4	175.2	-77.9	-33.1	0	0	0	113.1	A540	A540-D542 PolarHBondContact O-N 3.38Å; A540-D542 VanDerWaalsContact O-N 3.11Å
543	E	84.9	Confident	90.3	Very high	62 Å²	62	60.5 Å²	60.5	29%	0.29	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-56.1	179.3	-62.5	-179.1	-171	0	0	111.5	N514 A540 D541 L614 T720 S721	N514-E543 VanDerWaalsContact CB-O 3.31Å; N514-E543 WeakPolarHBondContact CB-O 3.4Å; N514-E543 PolarHBondContact ND2-O 3.05Å; A540-E543 HydrophobicContact CB-CB 4.47Å; A540-E543 HydrophobicContact CB-CG 4.37Å; A540-E543 WeakPolarHBondContact O-CB 3.32Å; A540-E543 PolarHBondContact O-N 2.76Å; D541-E543 VanDerWaalsContact C-N 3.32Å; E543-L614 HydrophobicContact CB-CD2 3.93Å; E543-T720 WeakPolarHBondContact OE2-CA 3.33Å; E543-S721 VanDerWaalsContact CD-OG 3.31Å; E543-S721 WeakPolarHBondContact OE1-CB 3.49Å; E543-S721 PolarHBondContact OE1-OG 2.95Å; E543-S721 PolarHBondContact OE2-N 3.07Å
544	C	87.6	Confident	90.3	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	-152.8	93.9	-176.9	-174.8	0	0	0	0	112.2	N514 Y538 A540 L546 L610 L614	N514-C544 HydrophobicContact CB-CB 4.22Å; N514-C544 CarbonylContact O-C 3.53Å; N514-C544 VanDerWaalsContact O-C 3.3Å; N514-C544 WeakPolarHBondContact O-CA 3.45Å; N514-C544 PolarHBondContact O-SG 3.02Å; Y538-C544 WeakPolarHBondContact CE1-O 3.33Å; Y538-C544 PolarHBondContact OH-O 3.27Å; A540-C544 PolarHBondContact O-N 3.34Å; C544-L546 PolarHBondContact O-N 3.13Å; C544-L610 HydrophobicContact CB-CD2 4.16Å; C544-L614 HydrophobicContact CB-CD2 3.83Å
545	K	89.6	Confident	90.4	Very high	88 Å²	88	59.1 Å²	59.1	38%	0.383	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	124.7	-179.1	-174.9	167.7	-173.6	-71.3	0	113.1	N514 V515 L516 D547	N514-K545 PolarHBondContact O-N 3.46Å; V515-K545 CarbonylContact C-O 3.59Å; V515-K545 WeakPolarHBondContact CA-O 3.39Å; V515-K545 HydrophobicContact CG2-CB 4.31Å; L516-K545 PolarHBondContact N-O 3.01Å; K545-D547 IonicContact NZ-OD1 2.77Å; K545-D547 PolarHBondContact NZ-OD1 3.41Å; K545-D547 IonicContact NZ-OD2 2.84Å; K545-D547 PolarHBondContact NZ-OD2 3.34Å
546	L	91.8	Very high	90.5	Very high	18 Å²	18	59 Å²	59	9%	0.094	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	115.3	178.9	179.5	63.8	0	0	0	109.8	L516 V518 L535 Y538 C544	L516-L546 HydrophobicContact CB-CD1 4.33Å; L516-L546 HydrophobicContact CD2-CD1 4.13Å; L516-L546 HydrophobicContact CG-CD1 4.23Å; V518-L546 HydrophobicContact CG2-CD1 3.69Å; L535-L546 HydrophobicContact CB-CD2 4.09Å; L535-L546 HydrophobicContact CD2-CD2 3.93Å; Y538-L546 HydrophobicContact CD1-CB 3.79Å; Y538-L546 HydrophobicContact CD1-CD2 4.36Å; Y538-L546 HydrophobicContact CD2-CD2 4.4Å; Y538-L546 HydrophobicContact CE1-CB 4.05Å; Y538-L546 HydrophobicContact CG-CB 4.24Å; Y538-L546 HydrophobicContact CG-CD2 3.97Å; C544-L546 PolarHBondContact O-N 3.13Å
547	D	91.9	Very high	90.6	Very high	57 Å²	57	54.3 Å²	54.3	31%	0.305	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	105.8	-176.6	-91.9	-33.6	0	0	0	111.9	V515 L516 V518 K545 I549	V515-D547 HydrophobicContact CG1-CB 4.18Å; V515-D547 WeakPolarHBondContact CG1-OD2 3.33Å; L516-D547 PolarHBondContact O-N 3.18Å; V518-D547 PolarHBondContact N-O 3.18Å; K545-D547 IonicContact NZ-OD1 2.77Å; K545-D547 PolarHBondContact NZ-OD1 3.41Å; K545-D547 IonicContact NZ-OD2 2.84Å; K545-D547 PolarHBondContact NZ-OD2 3.34Å; D547-I549 PolarHBondContact O-N 3.36Å
548	I	94.4	Very high	90.8	Very high	61 Å²	61	57.2 Å²	57.2	31%	0.313	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	101.3	174.2	-53.1	173	0	0	0	109	L532 L535 F551	L532-I548 HydrophobicContact CD2-CD1 3.87Å; L532-I548 HydrophobicContact CD2-CG2 3.9Å; L535-I548 HydrophobicContact CB-CD1 3.78Å; L535-I548 HydrophobicContact CD1-CD1 4.1Å; L535-I548 HydrophobicContact CD1-CG1 4.38Å; I548-F551 HydrophobicContact CG2-CD1 4.42Å
549	I	93.6	Very high	90.9	Very high	46 Å²	46	60.4 Å²	60.4	24%	0.236	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	-42.6	-175.5	-65.4	154	0	0	0	111.7	S517 V518 I519 D547 F567	S517-I549 VanDerWaalsContact CB-CD1 3.46Å; V518-I549 PolarHBondContact O-N 3.12Å; I519-I549 HydrophobicContact CG1-CB 4.24Å; D547-I549 PolarHBondContact O-N 3.36Å; I549-F567 HydrophobicContact CD1-CB 3.39Å; I549-F567 HydrophobicContact CD1-CD2 3.86Å; I549-F567 HydrophobicContact CD1-CG 3.7Å; I549-F567 HydrophobicContact CG1-CB 4.4Å; I549-F567 HydrophobicContact CG1-CD2 4.25Å; I549-F567 HydrophobicContact CG1-CG 4.25Å; I549-F567 HydrophobicContact CG2-CD2 3.78Å; I549-F567 HydrophobicContact CG2-CE2 3.8Å
550	H	94.9	Very high	91.1	Very high	91 Å²	91	55 Å²	55	42%	0.421	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	137.1	-175.4	-176.1	54.8	0	0	0	110.4	I519 V520 K521 D560 L563	I519-H550 VanDerWaalsContact CA-O 3.28Å; I519-H550 WeakPolarHBondContact CA-O 2.94Å; I519-H550 HydrophobicContact CD1-CB 4.49Å; I519-H550 HydrophobicContact CG1-CB 4.28Å; I519-H550 HydrophobicContact CG2-CB 4.28Å; I519-H550 WeakPolarHBondContact CG2-O 3.32Å; V520-H550 PolarHBondContact N-O 3.27Å; K521-H550 PolarHBondContact NZ-CD2 3.11Å; H550-D560 IonicContact CD2-OD1 3.48Å; H550-D560 PolarHBondContact CD2-OD1 3.04Å; H550-L563 HydrophobicContact CB-CD1 4.31Å
551	F	95.5	Very high	91.5	Very high	107 Å²	107	54.8 Å²	54.8	47%	0.469	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	159	171	61.4	-93.6	0	0	0	110	V520 V528 L532 I548	V520-F551 HydrophobicContact CB-CB 4.42Å; V520-F551 VanDerWaalsContact O-CA 3.29Å; V520-F551 WeakPolarHBondContact O-CA 3.48Å; V528-F551 HydrophobicContact CG1-CB 3.92Å; V528-F551 HydrophobicContact CG1-CD2 3.98Å; V528-F551 HydrophobicContact CG1-CG 4.34Å; L532-F551 HydrophobicContact CD1-CB 4.24Å; L532-F551 HydrophobicContact CD1-CD1 4.02Å; L532-F551 HydrophobicContact CD1-CD2 3.8Å; L532-F551 HydrophobicContact CD1-CE1 4.3Å; L532-F551 HydrophobicContact CD1-CE2 4.09Å; L532-F551 HydrophobicContact CD1-CG 3.76Å; L532-F551 HydrophobicContact CD1-CZ 4.33Å; L532-F551 HydrophobicContact CD2-CB 4.12Å; L532-F551 HydrophobicContact CD2-CD1 4.16Å; L532-F551 HydrophobicContact CD2-CG 4.22Å; I548-F551 HydrophobicContact CG2-CD1 4.42Å
552	G	92.1	Very high	92	Very high	13 Å²	13	52.9 Å²	52.9	13%	0.134	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.5	168.2	165.6	0	0	0	0	0	114.5	V520 K521 G522	V520-G552 PolarHBondContact O-N 2.85Å; K521-G552 WeakPolarHBondContact CA-O 3.41Å; K521-G552 WeakPolarHBondContact CD-O 3.49Å; G522-G552 PolarHBondContact N-O 2.95Å
553	M	92.2	Very high	92.5	Very high	21 Å²	21	47.5 Å²	47.5	10%	0.103	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	145.9	-178.3	-64.5	164.1	-92.8	0	0	113.8	K364 V424 G522 D525	K364-M553 HydrophobicContact CD-CB 4.38Å; K364-M553 WeakPolarHBondContact CD-O 3.27Å; K364-M553 HydrophobicContact CG-CB 4.29Å; K364-M553 PolarHBondContact NZ-O 3.22Å; V424-M553 HydrophobicContact CB-CE 3.8Å; V424-M553 HydrophobicContact CB-SD 4.39Å; V424-M553 HydrophobicContact CG1-CE 3.51Å; V424-M553 HydrophobicContact CG1-SD 3.65Å; V424-M553 HydrophobicContact CG2-CE 4.48Å; G522-M553 CarbonylContact O-C 3.57Å; G522-M553 VanDerWaalsContact O-CA 3.32Å; G522-M553 WeakPolarHBondContact O-CA 3.26Å; D525-M553 HydrophobicContact CB-CE 4.01Å; D525-M553 HydrophobicContact CB-CG 4.32Å; D525-M553 HydrophobicContact CB-SD 3.59Å; D525-M553 VanDerWaalsContact CB-SD 3.59Å; D525-M553 WeakPolarHBondContact OD1-CE 3.3Å
554	G	90.9	Very high	92.9	Very high	9 Å²	9	44.6 Å²	44.6	9%	0.093	24%	0.237	C	C	.	.	S	Bend	trans	105.1	165.7	168.7	0	0	0	0	0	114.7	G522	G522-G554 PolarHBondContact O-N 3.46Å
555	D	92.9	Very high	93.2	Very high	52 Å²	52	49.3 Å²	49.3	28%	0.278	26%	0.259	S	S	.	.	S	Bend	trans	-50.2	145.1	178.2	-79.9	-3.2	0	0	0	113.9	K366 S557 K577	K366-D555 WeakPolarHBondContact CE-OD2 3.39Å; K366-D555 IonicContact NZ-OD2 3.85Å; K366-D555 PolarHBondContact NZ-OD2 3.28Å; D555-S557 PolarHBondContact O-N 3.4Å; D555-K577 VanDerWaalsContact CB-O 3.25Å; D555-K577 WeakPolarHBondContact CB-O 3.38Å; D555-K577 PolarHBondContact OD1-N 3.27Å
556	I	94.3	Very high	93.3	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.026	27%	0.271	C	S	.	.			trans	-62.8	129.1	-175.5	-56.4	176.3	0	0	0	110.9	K521 D560 V561 V571 V576 A578 I582 I593 L595	K521-I556 HydrophobicContact CB-CG1 4.26Å; K521-I556 HydrophobicContact CG-CG1 4.16Å; I556-D560 HydrophobicContact CG2-CB 4.32Å; I556-V561 HydrophobicContact CG2-CG2 4.37Å; I556-V571 HydrophobicContact CD1-CG1 3.8Å; I556-V571 HydrophobicContact CG1-CG1 4.26Å; I556-V571 HydrophobicContact CG2-CG1 4.09Å; I556-V576 HydrophobicContact CG1-CG2 4.36Å; I556-A578 HydrophobicContact CD1-CB 4.37Å; I556-I582 HydrophobicContact CG2-CG2 4.01Å; I556-I593 HydrophobicContact CD1-CG2 3.52Å; I556-I593 HydrophobicContact CG2-CD1 4.45Å; I556-L595 HydrophobicContact CD1-CD2 3.7Å
557	S	92.4	Very high	93.2	Very high	42 Å²	42	53.3 Å²	53.3	29%	0.294	29%	0.29	S	S	.	.			trans	-112.9	172.2	-174.9	78.6	0	0	0	0	113.6	D555 T559 D560 V561	D555-S557 PolarHBondContact O-N 3.4Å; S557-T559 VanDerWaalsContact C-N 3.28Å; S557-T559 PolarHBondContact O-N 3.3Å; S557-T559 PolarHBondContact OG-OG1 2.9Å; S557-D560 WeakPolarHBondContact CA-OD2 3.28Å; S557-D560 WeakPolarHBondContact CB-OD2 3.34Å; S557-D560 PolarHBondContact N-OD2 2.8Å; S557-D560 PolarHBondContact O-N 2.86Å; S557-D560 VanDerWaalsContact OG-CG 3.3Å; S557-D560 PolarHBondContact OG-OD2 2.86Å; S557-V561 PolarHBondContact O-N 2.72Å
558	E	93.2	Very high	93	Very high	112 Å²	112	56 Å²	56	52%	0.523	31%	0.305	S	S	.	.	H	α-helix	trans	-67.1	-26.5	-179.8	-62.2	-173.2	176	0	0	113.4	S562 I582 L585	E558-S562 WeakPolarHBondContact O-CB 3.32Å; E558-S562 PolarHBondContact O-N 3.12Å; E558-S562 PolarHBondContact O-OG 2.81Å; E558-I582 HydrophobicContact CB-CD1 4.37Å; E558-I582 HydrophobicContact CG-CD1 3.33Å; E558-L585 HydrophobicContact CG-CD1 3.91Å
559	T	93.9	Very high	92.9	Very high	91 Å²	91	53.3 Å²	53.3	56%	0.558	29%	0.292	S	S	*	.	H	α-helix	trans	-68.9	-39.1	175.3	55.6	0	0	0	0	110.7	S557 S562 L563	S557-T559 VanDerWaalsContact C-N 3.28Å; S557-T559 PolarHBondContact O-N 3.3Å; S557-T559 PolarHBondContact OG-OG1 2.9Å; T559-S562 CarbonylContact O-C 3.58Å; T559-S562 PolarHBondContact O-N 2.62Å; T559-S562 VanDerWaalsContact O-N 3.13Å; T559-L563 WeakPolarHBondContact O-CG 3.4Å; T559-L563 PolarHBondContact O-N 3.29Å
560	D	94.4	Very high	92.9	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-67.1	-42.8	-178.6	-49.2	-52.1	0	0	0	111	I519 K521 H550 I556 S557 S562 L563 A564	I519-D560 WeakPolarHBondContact CD1-O 3.29Å; I519-D560 HydrophobicContact CG2-CB 4.47Å; K521-D560 WeakPolarHBondContact CE-OD1 3.26Å; K521-D560 WeakPolarHBondContact CE-OD2 3.46Å; K521-D560 VanDerWaalsContact NZ-CG 3.33Å; K521-D560 IonicContact NZ-OD1 2.74Å; K521-D560 PolarHBondContact NZ-OD1 2.95Å; K521-D560 IonicContact NZ-OD2 2.76Å; K521-D560 PolarHBondContact NZ-OD2 2.98Å; H550-D560 IonicContact CD2-OD1 3.48Å; H550-D560 PolarHBondContact CD2-OD1 3.04Å; I556-D560 HydrophobicContact CG2-CB 4.32Å; S557-D560 WeakPolarHBondContact CA-OD2 3.28Å; S557-D560 WeakPolarHBondContact CB-OD2 3.34Å; S557-D560 PolarHBondContact N-OD2 2.8Å; S557-D560 PolarHBondContact O-N 2.86Å; S557-D560 VanDerWaalsContact OG-CG 3.3Å; S557-D560 PolarHBondContact OG-OD2 2.86Å; D560-S562 VanDerWaalsContact C-N 3.29Å; D560-S562 PolarHBondContact O-N 3.36Å; D560-L563 PolarHBondContact O-N 2.8Å; D560-A564 WeakPolarHBondContact O-CB 3.43Å; D560-A564 PolarHBondContact O-N 3.05Å
561	V	94.9	Very high	93	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.018	26%	0.262	C	S	.	.	H	α-helix	trans	-63.6	-35.8	172.2	-179	0	0	0	0	111.2	I556 S557 E565 I582 A586 K589 I591 I593	I556-V561 HydrophobicContact CG2-CG2 4.37Å; S557-V561 PolarHBondContact O-N 2.72Å; V561-E565 PolarHBondContact O-N 3.04Å; V561-I582 HydrophobicContact CG2-CG2 3.69Å; V561-A586 HydrophobicContact CG1-CB 4.14Å; V561-A586 HydrophobicContact CG2-CB 4.49Å; V561-K589 HydrophobicContact CG1-CD 3.99Å; V561-I591 HydrophobicContact CG1-CD1 3.67Å; V561-I591 WeakPolarHBondContact O-CD1 3.28Å; V561-I593 HydrophobicContact CG2-CD1 4.2Å
562	S	93.6	Very high	93.1	Very high	54 Å²	54	41.9 Å²	41.9	38%	0.378	24%	0.239	S	C	.	.	H	α-helix	trans	-76.4	-27.9	179.1	-55.7	0	0	0	0	113.2	E558 T559 D560 A566 K589	E558-S562 WeakPolarHBondContact O-CB 3.32Å; E558-S562 PolarHBondContact O-N 3.12Å; E558-S562 PolarHBondContact O-OG 2.81Å; T559-S562 CarbonylContact O-C 3.58Å; T559-S562 PolarHBondContact O-N 2.62Å; T559-S562 VanDerWaalsContact O-N 3.13Å; D560-S562 VanDerWaalsContact C-N 3.29Å; D560-S562 PolarHBondContact O-N 3.36Å; S562-A566 PolarHBondContact O-N 3.29Å; S562-K589 PolarHBondContact OG-NZ 3.19Å
563	L	93.8	Very high	93.3	Very high	63 Å²	63	41.2 Å²	41.2	33%	0.33	23%	0.233	S	C	.	.	H	α-helix	trans	-70.3	-46.6	168.8	-71.9	168.8	0	0	0	110.7	I519 H550 T559 D560 E565 A566 F567	I519-L563 HydrophobicContact CD1-CB 3.68Å; H550-L563 HydrophobicContact CB-CD1 4.31Å; T559-L563 WeakPolarHBondContact O-CG 3.4Å; T559-L563 PolarHBondContact O-N 3.29Å; D560-L563 PolarHBondContact O-N 2.8Å; L563-E565 PolarHBondContact O-N 3.5Å; L563-A566 PolarHBondContact O-N 3.01Å; L563-F567 WeakPolarHBondContact O-CD2 3.48Å; L563-F567 PolarHBondContact O-N 3.45Å
564	A	94	Very high	93.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.8	-36.4	175.5	0	0	0	0	0	112.6	I519 D560 A566 N568 G569 V571 I591	I519-A564 HydrophobicContact CD1-CB 4.04Å; D560-A564 WeakPolarHBondContact O-CB 3.43Å; D560-A564 PolarHBondContact O-N 3.05Å; A564-A566 PolarHBondContact O-N 3.01Å; A564-N568 WeakPolarHBondContact O-CA 3.4Å; A564-N568 PolarHBondContact O-N 2.79Å; A564-G569 PolarHBondContact O-N 2.87Å; A564-V571 HydrophobicContact CB-CG2 3.73Å; A564-I591 HydrophobicContact CB-CD1 4.16Å; A564-I591 HydrophobicContact CB-CG2 3.84Å
565	E	92.9	Very high	93.5	Very high	100 Å²	100	41.5 Å²	41.5	47%	0.467	24%	0.236	S	C	.	.	H	α-helix	trans	-59.3	-43.6	173.5	-165.8	177.9	-157.5	0	0	112.5	V561 L563 F567 K589 I591	V561-E565 PolarHBondContact O-N 3.04Å; L563-E565 PolarHBondContact O-N 3.5Å; E565-F567 VanDerWaalsContact C-N 3.3Å; E565-F567 PolarHBondContact O-N 3.34Å; E565-K589 HydrophobicContact CB-CD 4.43Å; E565-K589 HydrophobicContact CG-CD 4.31Å; E565-K589 WeakPolarHBondContact OE2-CD 3.23Å; E565-K589 WeakPolarHBondContact OE2-CE 3.45Å; E565-K589 IonicContact OE2-NZ 3.45Å; E565-K589 PolarHBondContact OE2-NZ 3.05Å; E565-I591 HydrophobicContact CB-CD1 3.79Å; E565-I591 HydrophobicContact CG-CD1 4.47Å
566	A	90.8	Very high	93.5	Very high	78 Å²	78	39.4 Å²	39.4	65%	0.645	23%	0.225	S	C	*	.	H	α-helix	trans	-68.4	-29.9	-174.1	0	0	0	0	0	112.9	S562 L563 A564	S562-A566 PolarHBondContact O-N 3.29Å; L563-A566 PolarHBondContact O-N 3.01Å; A564-A566 PolarHBondContact O-N 3.01Å
567	F	89.7	Confident	93.3	Very high	111 Å²	111	46.5 Å²	46.5	49%	0.487	26%	0.255	S	S	.	.	H	α-helix	trans	-114.5	8	-175.2	-61.8	-78.2	0	0	0	114.2	S517 I549 L563 E565 G569	S517-F567 VanDerWaalsContact CB-O 3.32Å; S517-F567 WeakPolarHBondContact CB-O 3.34Å; S517-F567 PolarHBondContact OG-O 3.01Å; I549-F567 HydrophobicContact CD1-CB 3.39Å; I549-F567 HydrophobicContact CD1-CD2 3.86Å; I549-F567 HydrophobicContact CD1-CG 3.7Å; I549-F567 HydrophobicContact CG1-CB 4.4Å; I549-F567 HydrophobicContact CG1-CD2 4.25Å; I549-F567 HydrophobicContact CG1-CG 4.25Å; I549-F567 HydrophobicContact CG2-CD2 3.78Å; I549-F567 HydrophobicContact CG2-CE2 3.8Å; L563-F567 WeakPolarHBondContact O-CD2 3.48Å; L563-F567 PolarHBondContact O-N 3.45Å; E565-F567 VanDerWaalsContact C-N 3.3Å; E565-F567 PolarHBondContact O-N 3.34Å; F567-G569 VanDerWaalsContact C-N 3.26Å; F567-G569 PolarHBondContact O-N 3.48Å
568	N	88.6	Confident	93.3	Very high	114 Å²	114	45 Å²	45	61%	0.61	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	44.1	-174.4	-166.5	36.3	0	0	0	113.3	A564	A564-N568 WeakPolarHBondContact O-CA 3.4Å; A564-N568 PolarHBondContact O-N 2.79Å
569	G	91.4	Very high	93.2	Very high	5 Å²	5	43.5 Å²	43.5	5%	0.052	24%	0.241	C	C	.	.			trans	-93.4	165.4	-173.1	0	0	0	0	0	115.2	S517 A564 F567	S517-G569 VanDerWaalsContact CB-CA 3.44Å; S517-G569 CarbonylContact O-C 3.54Å; S517-G569 WeakPolarHBondContact O-CA 3.02Å; A564-G569 PolarHBondContact O-N 2.87Å; F567-G569 VanDerWaalsContact C-N 3.26Å; F567-G569 PolarHBondContact O-N 3.48Å
570	V	95.2	Very high	93.1	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.012	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	135.4	173	-178.2	0	0	0	0	109.1	L516 S517 I519 Y572 K592 K594 E609	L516-V570 HydrophobicContact CD1-CG2 4.35Å; S517-V570 PolarHBondContact O-N 2.68Å; I519-V570 PolarHBondContact N-O 2.94Å; V570-Y572 HydrophobicContact CB-CD2 4.37Å; V570-Y572 HydrophobicContact CB-CE2 3.8Å; V570-Y572 HydrophobicContact CG1-CD2 3.93Å; V570-Y572 HydrophobicContact CG1-CE1 4.45Å; V570-Y572 HydrophobicContact CG1-CE2 3.43Å; V570-Y572 VanDerWaalsContact CG1-CE2 3.43Å; V570-K592 HydrophobicContact CG1-CB 4.09Å; V570-K592 HydrophobicContact CG2-CB 4.37Å; V570-K592 HydrophobicContact CG2-CD 4.22Å; V570-K594 HydrophobicContact CG1-CD 4.18Å; V570-K594 HydrophobicContact CG1-CG 4.1Å; V570-E609 HydrophobicContact CG2-CG 4.1Å
571	V	96.8	Very high	93.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	116	175.6	-171.9	0	0	0	0	108.9	I519 I556 A564 I591 K592 I593 K594	I519-V571 HydrophobicContact CB-CG2 4.38Å; I519-V571 HydrophobicContact CG2-CG1 4.31Å; I519-V571 WeakPolarHBondContact O-CA 3.43Å; I556-V571 HydrophobicContact CD1-CG1 3.8Å; I556-V571 HydrophobicContact CG1-CG1 4.26Å; I556-V571 HydrophobicContact CG2-CG1 4.09Å; A564-V571 HydrophobicContact CB-CG2 3.73Å; V571-I591 HydrophobicContact CG2-CG2 4.26Å; V571-K592 PolarHBondContact N-O 2.98Å; V571-K592 VanDerWaalsContact N-O 3.08Å; V571-I593 HydrophobicContact CB-CG1 4.3Å; V571-I593 WeakPolarHBondContact O-CA 3.41Å; V571-K594 PolarHBondContact O-N 3.01Å
572	Y	97.2	Very high	93.1	Very high	1 Å²	1	49.6 Å²	49.6	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	122.9	173	-70	-89.2	0	0	0	109.7	V518 I519 K521 V570 K594 L602 D605 V606 E609	V518-Y572 HydrophobicContact CG1-CD2 3.98Å; V518-Y572 HydrophobicContact CG1-CE2 4.48Å; V518-Y572 HydrophobicContact CG2-CE2 4.48Å; I519-Y572 PolarHBondContact O-N 3.09Å; K521-Y572 PolarHBondContact N-O 2.91Å; V570-Y572 HydrophobicContact CB-CD2 4.37Å; V570-Y572 HydrophobicContact CB-CE2 3.8Å; V570-Y572 HydrophobicContact CG1-CD2 3.93Å; V570-Y572 HydrophobicContact CG1-CE1 4.45Å; V570-Y572 HydrophobicContact CG1-CE2 3.43Å; V570-Y572 VanDerWaalsContact CG1-CE2 3.43Å; Y572-K594 WeakPolarHBondContact CA-O 3.45Å; Y572-K594 HydrophobicContact CD1-CB 4.07Å; Y572-K594 HydrophobicContact CD1-CD 4.47Å; Y572-K594 HydrophobicContact CE1-CB 4.15Å; Y572-K594 HydrophobicContact CE1-CD 3.73Å; Y572-K594 HydrophobicContact CE1-CG 4.39Å; Y572-K594 PolarHBondContact OH-NZ 2.82Å; Y572-L602 HydrophobicContact CD1-CD2 4.49Å; Y572-L602 HydrophobicContact CD1-CG 4.11Å; Y572-D605 HydrophobicContact CE1-CB 4.38Å; Y572-D605 WeakPolarHBondContact CE1-OD2 3.16Å; Y572-D605 PolarHBondContact OH-O 3.24Å; Y572-V606 HydrophobicContact CD1-CG2 4.21Å; Y572-V606 HydrophobicContact CD2-CG2 4.24Å; Y572-V606 HydrophobicContact CE1-CG2 3.8Å; Y572-V606 HydrophobicContact CE2-CG2 3.8Å; Y572-V606 HydrophobicContact CG-CG2 4.42Å; Y572-E609 WeakPolarHBondContact OH-CB 3.39Å
573	G	96.1	Very high	93.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.1	171.1	0	0	0	0	0	111	K521 K594 L595 H596	K521-G573 CarbonylContact O-C 3.51Å; K521-G573 VanDerWaalsContact O-CA 3.32Å; K521-G573 WeakPolarHBondContact O-CA 3.27Å; G573-K594 PolarHBondContact N-O 3.02Å; G573-L595 CarbonylContact O-C 3.51Å; G573-L595 WeakPolarHBondContact O-CA 3.32Å; G573-H596 PolarHBondContact O-N 2.93Å
574	F	95.3	Very high	93.2	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	118.7	173.8	179.5	-91.6	0	0	0	109.7	Q215 K521 D523 I531 V576 H596 I599 L602	Q215-F574 HydrophobicContact CB-CZ 4.35Å; Q215-F574 VanDerWaalsContact OE1-CZ 3.24Å; K521-F574 PolarHBondContact O-N 2.82Å; D523-F574 PolarHBondContact N-O 2.86Å; I531-F574 HydrophobicContact CD1-CB 3.68Å; I531-F574 HydrophobicContact CD1-CD1 4.46Å; I531-F574 HydrophobicContact CD1-CD2 4.03Å; I531-F574 HydrophobicContact CD1-CG 3.8Å; F574-V576 PolarHBondContact O-N 3.47Å; F574-H596 CarbonylContact C-O 3.54Å; F574-H596 VanDerWaalsContact CA-O 3.32Å; F574-H596 WeakPolarHBondContact CA-O 3.41Å; F574-I599 HydrophobicContact CE2-CB 3.94Å; F574-L602 HydrophobicContact CB-CD1 3.92Å; F574-L602 HydrophobicContact CD2-CD1 4.19Å
575	S	91.5	Very high	93.3	Very high	36 Å²	36	57.5 Å²	57.5	25%	0.252	30%	0.296	S	S	.	.	S	Bend	trans	55.2	9.3	-177.2	-66.7	0	0	0	0	116.1	D523 H596	D523-S575 VanDerWaalsContact CG-CB 3.46Å; D523-S575 WeakPolarHBondContact OD2-CB 3.39Å; S575-H596 PolarHBondContact N-O 3.26Å
576	V	93	Very high	93.4	Very high	8 Å²	8	52.9 Å²	52.9	5%	0.048	28%	0.275	C	S	.	.			trans	-100.2	159.9	-179.8	-68.9	0	0	0	0	113.5	K521 G522 D523 I556 F574 L595	K521-V576 HydrophobicContact CB-CG2 4.17Å; K521-V576 WeakPolarHBondContact O-CG2 3.38Å; G522-V576 VanDerWaalsContact C-CG1 3.45Å; G522-V576 WeakPolarHBondContact O-CG1 3.32Å; D523-V576 HydrophobicContact CB-CG1 4.13Å; I556-V576 HydrophobicContact CG1-CG2 4.36Å; F574-V576 PolarHBondContact O-N 3.47Å; V576-L595 HydrophobicContact CG2-CD2 4.37Å
577	K	91.1	Very high	93.5	Very high	153 Å²	153	53 Å²	53	67%	0.665	28%	0.276	S	S	*	.			trans	-106.7	143.7	179	-65.5	167.7	-173.9	168	0	110.7	D555	D555-K577 VanDerWaalsContact CB-O 3.25Å; D555-K577 WeakPolarHBondContact CB-O 3.38Å; D555-K577 PolarHBondContact OD1-N 3.27Å
578	A	91.4	Very high	93.8	Very high	12 Å²	12	56.2 Å²	56.2	10%	0.099	29%	0.29	C	S	.	.			trans	-110.4	116.4	169.8	0	0	0	0	0	109.8	I556 K583 I593 L595	I556-A578 HydrophobicContact CD1-CB 4.37Å; A578-K583 HydrophobicContact CB-CG 4.08Å; A578-K583 WeakPolarHBondContact O-CE 3.49Å; A578-I593 HydrophobicContact CB-CG2 4.48Å; A578-L595 HydrophobicContact CB-CD1 4.14Å
579	N	91.1	Very high	94	Very high	79 Å²	79	54 Å²	54	42%	0.422	28%	0.275	S	S	.	.			trans	-58.2	149.7	175.8	-66	-14.1	0	0	0	110.5	K366 T581 I582 K583	K366-N579 PolarHBondContact NZ-OD1 3.49Å; N579-T581 PolarHBondContact O-N 3.07Å; N579-I582 HydrophobicContact CB-CG1 4.1Å; N579-I582 WeakPolarHBondContact O-CB 3.39Å; N579-I582 PolarHBondContact O-N 3.14Å; N579-K583 PolarHBondContact O-N 3.44Å
580	E	93	Very high	94.1	Very high	135 Å²	135	57 Å²	57	63%	0.631	31%	0.305	S	S	*	.	H	α-helix	trans	-58.4	-32.7	-179.9	-69.8	-167.1	-171.9	0	0	114.1	I582 K583 K584	E580-I582 VanDerWaalsContact C-N 3.32Å; E580-K583 PolarHBondContact O-N 3.45Å; E580-K584 WeakPolarHBondContact O-CB 3.31Å; E580-K584 WeakPolarHBondContact O-CD 3.49Å; E580-K584 VanDerWaalsContact O-CG 3.24Å; E580-K584 WeakPolarHBondContact O-CG 3.38Å; E580-K584 PolarHBondContact O-N 2.91Å; E580-K584 IonicContact OE2-NZ 3.62Å; E580-K584 PolarHBondContact OE2-NZ 2.83Å
581	T	94.8	Very high	94	Very high	83 Å²	83	57.8 Å²	57.8	51%	0.509	31%	0.309	S	S	.	.	H	α-helix	trans	-59.7	-44.6	175.3	49.2	0	0	0	0	111.1	N579 K584 L585	N579-T581 PolarHBondContact O-N 3.07Å; T581-K584 PolarHBondContact O-N 2.87Å; T581-L585 WeakPolarHBondContact O-CG 3.29Å; T581-L585 PolarHBondContact O-N 3.48Å
582	I	94.7	Very high	93.9	Very high	7 Å²	7	62.6 Å²	62.6	4%	0.036	33%	0.33	C	S	.	.	H	α-helix	trans	-66	-44.7	177.5	-53.4	-59	0	0	0	110.5	I556 E558 V561 N579 E580 K584 L585 A586 I593	I556-I582 HydrophobicContact CG2-CG2 4.01Å; E558-I582 HydrophobicContact CB-CD1 4.37Å; E558-I582 HydrophobicContact CG-CD1 3.33Å; V561-I582 HydrophobicContact CG2-CG2 3.69Å; N579-I582 HydrophobicContact CB-CG1 4.1Å; N579-I582 WeakPolarHBondContact O-CB 3.39Å; N579-I582 PolarHBondContact O-N 3.14Å; E580-I582 VanDerWaalsContact C-N 3.32Å; I582-K584 VanDerWaalsContact C-N 3.34Å; I582-K584 PolarHBondContact O-N 2.82Å; I582-L585 PolarHBondContact O-N 2.7Å; I582-A586 WeakPolarHBondContact O-CB 3.28Å; I582-A586 PolarHBondContact O-N 3.33Å; I582-I593 HydrophobicContact CG2-CD1 4.03Å
583	K	94.3	Very high	93.8	Very high	108 Å²	108	64.4 Å²	64.4	47%	0.47	34%	0.339	S	S	.	.	H	α-helix	trans	-59.5	-42.7	174.6	-66	-174.4	178.7	-176.3	0	111.9	A578 N579 E580 A586 A587	A578-K583 HydrophobicContact CB-CG 4.08Å; A578-K583 WeakPolarHBondContact O-CE 3.49Å; N579-K583 PolarHBondContact O-N 3.44Å; E580-K583 PolarHBondContact O-N 3.45Å; K583-A586 PolarHBondContact O-N 3.31Å; K583-A587 WeakPolarHBondContact O-CB 3.36Å; K583-A587 PolarHBondContact O-N 3Å
584	K	95.2	Very high	93.8	Very high	119 Å²	119	65.9 Å²	65.9	52%	0.517	35%	0.346	S	S	.	.	H	α-helix	trans	-66.7	-35.1	175.9	-71.2	163.8	-168.9	163.5	0	112.2	E580 T581 I582 K588	E580-K584 WeakPolarHBondContact O-CB 3.31Å; E580-K584 WeakPolarHBondContact O-CD 3.49Å; E580-K584 VanDerWaalsContact O-CG 3.24Å; E580-K584 WeakPolarHBondContact O-CG 3.38Å; E580-K584 PolarHBondContact O-N 2.91Å; E580-K584 IonicContact OE2-NZ 3.62Å; E580-K584 PolarHBondContact OE2-NZ 2.83Å; T581-K584 PolarHBondContact O-N 2.87Å; I582-K584 VanDerWaalsContact C-N 3.34Å; I582-K584 PolarHBondContact O-N 2.82Å; K584-K588 VanDerWaalsContact O-CG 3.29Å; K584-K588 WeakPolarHBondContact O-CG 3.16Å; K584-K588 PolarHBondContact O-N 2.85Å; K584-K588 VanDerWaalsContact O-N 3.16Å
585	L	94.8	Very high	93.8	Very high	56 Å²	56	68.9 Å²	68.9	29%	0.293	36%	0.362	S	S	.	.	H	α-helix	trans	-69.6	-45	173.9	-76.9	170.8	0	0	0	112.2	E558 T581 I582 K588 K589	E558-L585 HydrophobicContact CG-CD1 3.91Å; T581-L585 WeakPolarHBondContact O-CG 3.29Å; T581-L585 PolarHBondContact O-N 3.48Å; I582-L585 PolarHBondContact O-N 2.7Å; L585-K588 PolarHBondContact O-N 3.34Å; L585-K589 WeakPolarHBondContact O-CG 3.43Å; L585-K589 PolarHBondContact O-N 2.78Å
586	A	94.6	Very high	94	Very high	3 Å²	3	68.6 Å²	68.6	3%	0.025	36%	0.356	C	S	.	.	H	α-helix	trans	-61.6	-44.6	176.4	0	0	0	0	0	111.6	V561 I582 K583 K588 K589 G590 I591 I593	V561-A586 HydrophobicContact CG1-CB 4.14Å; V561-A586 HydrophobicContact CG2-CB 4.49Å; I582-A586 WeakPolarHBondContact O-CB 3.28Å; I582-A586 PolarHBondContact O-N 3.33Å; K583-A586 PolarHBondContact O-N 3.31Å; A586-K588 VanDerWaalsContact C-N 3.34Å; A586-K588 PolarHBondContact O-N 2.85Å; A586-K589 CarbonylContact O-C 3.57Å; A586-K589 PolarHBondContact O-N 2.77Å; A586-K589 VanDerWaalsContact O-N 3.1Å; A586-G590 PolarHBondContact O-N 3.31Å; A586-I591 HydrophobicContact CB-CB 4.28Å; A586-I591 PolarHBondContact O-N 2.79Å; A586-I593 HydrophobicContact CB-CD1 3.51Å; A586-I593 HydrophobicContact CB-CG1 3.91Å
587	A	94.2	Very high	94	Very high	80 Å²	80	72.3 Å²	72.3	66%	0.661	38%	0.376	S	S	*	.	H	α-helix	trans	-60	-39.7	174.4	0	0	0	0	0	112.9	K583 K589 G590	K583-A587 WeakPolarHBondContact O-CB 3.36Å; K583-A587 PolarHBondContact O-N 3Å; A587-K589 VanDerWaalsContact C-N 3.32Å; A587-K589 PolarHBondContact O-N 2.89Å; A587-G590 PolarHBondContact O-N 2.85Å
588	K	95	Very high	93.9	Very high	179 Å²	179	66.5 Å²	66.5	78%	0.778	35%	0.352	S	S	*	.	H	α-helix	trans	-65.5	-32.6	174	-77.2	174.3	178.8	-175.9	0	113.4	K584 L585 A586	K584-K588 VanDerWaalsContact O-CG 3.29Å; K584-K588 WeakPolarHBondContact O-CG 3.16Å; K584-K588 PolarHBondContact O-N 2.85Å; K584-K588 VanDerWaalsContact O-N 3.16Å; L585-K588 PolarHBondContact O-N 3.34Å; A586-K588 VanDerWaalsContact C-N 3.34Å; A586-K588 PolarHBondContact O-N 2.85Å
589	K	93.3	Very high	93.9	Very high	69 Å²	69	66 Å²	66	30%	0.3	35%	0.347	S	S	.	.	H	α-helix	trans	-90.5	-4.9	179.5	-70.1	-178.8	169	-159.3	0	113.7	V561 S562 E565 L585 A586 A587 I591	V561-K589 HydrophobicContact CG1-CD 3.99Å; S562-K589 PolarHBondContact OG-NZ 3.19Å; E565-K589 HydrophobicContact CB-CD 4.43Å; E565-K589 HydrophobicContact CG-CD 4.31Å; E565-K589 WeakPolarHBondContact OE2-CD 3.23Å; E565-K589 WeakPolarHBondContact OE2-CE 3.45Å; E565-K589 IonicContact OE2-NZ 3.45Å; E565-K589 PolarHBondContact OE2-NZ 3.05Å; L585-K589 WeakPolarHBondContact O-CG 3.43Å; L585-K589 PolarHBondContact O-N 2.78Å; A586-K589 CarbonylContact O-C 3.57Å; A586-K589 PolarHBondContact O-N 2.77Å; A586-K589 VanDerWaalsContact O-N 3.1Å; A587-K589 VanDerWaalsContact C-N 3.32Å; A587-K589 PolarHBondContact O-N 2.89Å; K589-I591 HydrophobicContact CB-CD1 3.69Å; K589-I591 HydrophobicContact CB-CG1 4.11Å; K589-I591 HydrophobicContact CD-CD1 4.17Å
590	G	93	Very high	93.7	Very high	66 Å²	66	65.4 Å²	65.4	68%	0.68	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	18.6	-177.7	0	0	0	0	0	115	A586 A587	A586-G590 PolarHBondContact O-N 3.31Å; A587-G590 PolarHBondContact O-N 2.85Å
591	I	94.6	Very high	93.6	Very high	20 Å²	20	63.5 Å²	63.5	10%	0.103	33%	0.331	C	S	.	.			trans	-93.2	131.6	-172.8	-65	162.2	0	0	0	110.8	V561 A564 E565 V571 A586 K589	V561-I591 HydrophobicContact CG1-CD1 3.67Å; V561-I591 WeakPolarHBondContact O-CD1 3.28Å; A564-I591 HydrophobicContact CB-CD1 4.16Å; A564-I591 HydrophobicContact CB-CG2 3.84Å; E565-I591 HydrophobicContact CB-CD1 3.79Å; E565-I591 HydrophobicContact CG-CD1 4.47Å; V571-I591 HydrophobicContact CG2-CG2 4.26Å; A586-I591 HydrophobicContact CB-CB 4.28Å; A586-I591 PolarHBondContact O-N 2.79Å; K589-I591 HydrophobicContact CB-CD1 3.69Å; K589-I591 HydrophobicContact CB-CG1 4.11Å; K589-I591 HydrophobicContact CD-CD1 4.17Å
592	K	94.1	Very high	93.6	Very high	100 Å²	100	59.6 Å²	59.6	44%	0.435	31%	0.307	S	S	.	.			trans	-76.7	119.9	172.4	-61.5	177.5	-178.5	177.3	0	109.6	V570 V571 E609	V570-K592 HydrophobicContact CG1-CB 4.09Å; V570-K592 HydrophobicContact CG2-CB 4.37Å; V570-K592 HydrophobicContact CG2-CD 4.22Å; V571-K592 PolarHBondContact N-O 2.98Å; V571-K592 VanDerWaalsContact N-O 3.08Å; K592-E609 IonicContact NZ-OE1 3.25Å; K592-E609 PolarHBondContact NZ-OE1 3.3Å; K592-E609 IonicContact NZ-OE2 2.68Å; K592-E609 PolarHBondContact NZ-OE2 3.02Å
593	I	95.8	Very high	93.5	Very high	39 Å²	39	59.6 Å²	59.6	20%	0.2	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.2	163.7	-63.5	176.7	0	0	0	107.1	I556 V561 V571 A578 I582 A586 L595	I556-I593 HydrophobicContact CD1-CG2 3.52Å; I556-I593 HydrophobicContact CG2-CD1 4.45Å; V561-I593 HydrophobicContact CG2-CD1 4.2Å; V571-I593 HydrophobicContact CB-CG1 4.3Å; V571-I593 WeakPolarHBondContact O-CA 3.41Å; A578-I593 HydrophobicContact CB-CG2 4.48Å; I582-I593 HydrophobicContact CG2-CD1 4.03Å; A586-I593 HydrophobicContact CB-CD1 3.51Å; A586-I593 HydrophobicContact CB-CG1 3.91Å; I593-L595 HydrophobicContact CG2-CD2 4.08Å; I593-L595 HydrophobicContact CG2-CG 4.24Å
594	K	95.6	Very high	93.3	Very high	31 Å²	31	60.8 Å²	60.8	14%	0.135	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.7	177.1	-49.8	-167.2	-165.5	167	0	108.5	V570 V571 Y572 G573 D605 E609	V570-K594 HydrophobicContact CG1-CD 4.18Å; V570-K594 HydrophobicContact CG1-CG 4.1Å; V571-K594 PolarHBondContact O-N 3.01Å; Y572-K594 WeakPolarHBondContact CA-O 3.45Å; Y572-K594 HydrophobicContact CD1-CB 4.07Å; Y572-K594 HydrophobicContact CD1-CD 4.47Å; Y572-K594 HydrophobicContact CE1-CB 4.15Å; Y572-K594 HydrophobicContact CE1-CD 3.73Å; Y572-K594 HydrophobicContact CE1-CG 4.39Å; Y572-K594 PolarHBondContact OH-NZ 2.82Å; G573-K594 PolarHBondContact N-O 3.02Å; K594-D605 WeakPolarHBondContact CD-OD1 3.4Å; K594-D605 WeakPolarHBondContact CD-OD2 3.44Å; K594-D605 IonicContact NZ-OD1 3.56Å; K594-D605 PolarHBondContact NZ-OD1 3.48Å; K594-D605 IonicContact NZ-OD2 3.92Å; K594-E609 WeakPolarHBondContact CE-OE2 3.24Å; K594-E609 IonicContact NZ-OE2 2.6Å; K594-E609 PolarHBondContact NZ-OE2 3.02Å
595	L	95.6	Very high	93.3	Very high	64 Å²	64	56.7 Å²	56.7	34%	0.335	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	127.5	-175.3	-62.5	179	0	0	0	109.3	I556 G573 V576 A578 I593	I556-L595 HydrophobicContact CD1-CD2 3.7Å; G573-L595 CarbonylContact O-C 3.51Å; G573-L595 WeakPolarHBondContact O-CA 3.32Å; V576-L595 HydrophobicContact CG2-CD2 4.37Å; A578-L595 HydrophobicContact CB-CD1 4.14Å; I593-L595 HydrophobicContact CG2-CD2 4.08Å; I593-L595 HydrophobicContact CG2-CG 4.24Å
596	H	95.3	Very high	93.2	Very high	29 Å²	29	54 Å²	54	13%	0.134	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	149	-175.9	-66	-75.7	0	0	0	110.2	G573 F574 S575 Q601 L602 D605	G573-H596 PolarHBondContact O-N 2.93Å; F574-H596 CarbonylContact C-O 3.54Å; F574-H596 VanDerWaalsContact CA-O 3.32Å; F574-H596 WeakPolarHBondContact CA-O 3.41Å; S575-H596 PolarHBondContact N-O 3.26Å; H596-Q601 PolarHBondContact CE1-O 3.37Å; H596-L602 HydrophobicContact CB-CB 3.93Å; H596-L602 HydrophobicContact CB-CD1 4.35Å; H596-D605 IonicContact CD2-OD2 3.9Å; H596-D605 IonicContact CE1-OD2 3Å; H596-D605 PolarHBondContact CE1-OD2 3.03Å; H596-D605 IonicContact NE2-OD2 3.61Å; H596-D605 PolarHBondContact NE2-OD2 2.93Å
597	N	91.6	Very high	93.1	Very high	87 Å²	87	56.6 Å²	56.6	47%	0.465	30%	0.295	S	S	.	.	S	Bend	trans	-117.7	5.3	174.9	-59.2	-17.6	0	0	0	112.2	A210 Q215	A210-N597 HydrophobicContact CB-CB 3.78Å; Q215-N597 PolarHBondContact NE2-O 2.85Å
598	I	90.9	Very high	93	Very high	30 Å²	30	58.5 Å²	58.5	15%	0.154	29%	0.289	C	S	.	.	S	Bend	trans	-138.5	126.1	-175.1	-65.8	176	0	0	0	106.4	I213 Y600 Q601 L602	I213-I598 HydrophobicContact CD1-CG2 4.33Å; I598-Y600 HydrophobicContact CG2-CD2 3.64Å; I598-Y600 HydrophobicContact CG2-CG 4.5Å; I598-Y600 PolarHBondContact O-N 2.88Å; I598-Q601 HydrophobicContact CB-CG 4.24Å; I598-Q601 HydrophobicContact CG2-CG 4.21Å; I598-Q601 PolarHBondContact O-N 2.81Å; I598-L602 PolarHBondContact O-N 3.43Å
599	I	89.7	Confident	92.8	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-64.3	-38	-169.8	-164.5	164.7	0	0	0	112.9	A240 F241 A530 I531 I534 F574 Q601 L602 I603	A240-I599 HydrophobicContact CB-CD1 4.24Å; F241-I599 HydrophobicContact CE1-CD1 4Å; F241-I599 HydrophobicContact CE2-CG2 4.23Å; F241-I599 HydrophobicContact CZ-CB 4.39Å; F241-I599 HydrophobicContact CZ-CD1 3.82Å; F241-I599 HydrophobicContact CZ-CG2 4.15Å; A530-I599 HydrophobicContact CB-CD1 4.29Å; I531-I599 HydrophobicContact CG1-CD1 3.93Å; I531-I599 HydrophobicContact CG1-CG1 4.15Å; I534-I599 HydrophobicContact CD1-CD1 3.71Å; I534-I599 HydrophobicContact CD1-CG1 4.08Å; F574-I599 HydrophobicContact CE2-CB 3.94Å; I599-Q601 PolarHBondContact O-N 2.87Å; I599-L602 WeakPolarHBondContact O-CB 3.47Å; I599-L602 PolarHBondContact O-N 2.81Å; I599-I603 WeakPolarHBondContact O-CG1 3.45Å; I599-I603 PolarHBondContact O-N 2.84Å; I599-I603 VanDerWaalsContact O-N 3.1Å
600	Y	87.4	Confident	92.6	Very high	68 Å²	68	47.1 Å²	47.1	27%	0.267	24%	0.24	S	C	.	.	H	α-helix	trans	-56.9	-47.8	176.7	-48.9	-82.2	0	0	0	112.5	I213 H238 I598 L602 I603 E604 F726	I213-Y600 HydrophobicContact CD1-CE2 3.91Å; H238-Y600 AromaticContact CD2-CE1 3.76Å; H238-Y600 AromaticContact CD2-CZ 3.71Å; H238-Y600 PolarHBondContact CD2-OH 3.04Å; H238-Y600 AromaticContact CE1-CE1 3.43Å; H238-Y600 VanDerWaalsContact CE1-CE1 3.43Å; H238-Y600 WeakPolarHBondContact CE1-CE1 3.46Å; H238-Y600 AromaticContact CE1-CZ 3.87Å; H238-Y600 AromaticContact CG-CZ 3.82Å; H238-Y600 AromaticContact ND1-CE1 3.95Å; H238-Y600 AromaticContact ND1-CZ 3.93Å; H238-Y600 AromaticContact NE2-CE1 3.31Å; H238-Y600 VanDerWaalsContact NE2-CE1 3.31Å; H238-Y600 WeakPolarHBondContact NE2-CE1 3.49Å; H238-Y600 AromaticContact NE2-CZ 3.77Å; H238-Y600 PolarHBondContact NE2-OH 2.83Å; I598-Y600 HydrophobicContact CG2-CD2 3.64Å; I598-Y600 HydrophobicContact CG2-CG 4.5Å; I598-Y600 PolarHBondContact O-N 2.88Å; Y600-L602 PolarHBondContact O-N 2.82Å; Y600-I603 PolarHBondContact O-N 2.77Å; Y600-I603 VanDerWaalsContact O-N 3.07Å; Y600-E604 WeakPolarHBondContact O-CB 3.34Å; Y600-E604 WeakPolarHBondContact O-CG 3.48Å; Y600-E604 PolarHBondContact O-N 3.18Å; Y600-F726 HydrophobicContact CD1-CD2 4.02Å; Y600-F726 AromaticContact CD1-CE2 3.69Å; Y600-F726 HydrophobicContact CD1-CE2 3.69Å; Y600-F726 AromaticContact CE1-CD2 3.98Å; Y600-F726 HydrophobicContact CE1-CD2 3.98Å; Y600-F726 HydrophobicContact CE1-CE2 4.1Å
601	Q	91.9	Very high	92.5	Very high	94 Å²	94	45.9 Å²	45.9	44%	0.439	22%	0.218	S	C	.	.	H	α-helix	trans	-63.4	-32	-178.6	-65.3	179.2	-12.3	0	0	112	H596 I598 I599 D605	H596-Q601 PolarHBondContact CE1-O 3.37Å; I598-Q601 HydrophobicContact CB-CG 4.24Å; I598-Q601 HydrophobicContact CG2-CG 4.21Å; I598-Q601 PolarHBondContact O-N 2.81Å; I599-Q601 PolarHBondContact O-N 2.87Å; Q601-D605 WeakPolarHBondContact O-CB 3.17Å; Q601-D605 PolarHBondContact O-N 3.47Å
602	L	93.4	Very high	92.2	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-67.6	-46.3	173.1	-172	155.4	0	0	0	111	I531 Y572 F574 H596 I598 I599 Y600 D605 V606	I531-L602 HydrophobicContact CD1-CD1 3.95Å; I531-L602 HydrophobicContact CG2-CD2 4.22Å; Y572-L602 HydrophobicContact CD1-CD2 4.49Å; Y572-L602 HydrophobicContact CD1-CG 4.11Å; F574-L602 HydrophobicContact CB-CD1 3.92Å; F574-L602 HydrophobicContact CD2-CD1 4.19Å; H596-L602 HydrophobicContact CB-CB 3.93Å; H596-L602 HydrophobicContact CB-CD1 4.35Å; I598-L602 PolarHBondContact O-N 3.43Å; I599-L602 WeakPolarHBondContact O-CB 3.47Å; I599-L602 PolarHBondContact O-N 2.81Å; Y600-L602 PolarHBondContact O-N 2.82Å; L602-D605 PolarHBondContact O-N 2.99Å; L602-V606 HydrophobicContact CD2-CG2 4.12Å; L602-V606 WeakPolarHBondContact O-CG2 3.44Å; L602-V606 PolarHBondContact O-N 2.87Å
603	I	92.6	Very high	91.8	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-71.3	-39.8	-177.9	-61.8	-59.7	0	0	0	112.1	I534 L535 I599 Y600 D605 V606 K607 W722 P724 F726	I534-I603 HydrophobicContact CB-CD1 4.17Å; I534-I603 HydrophobicContact CD1-CD1 4.15Å; I534-I603 HydrophobicContact CD1-CG1 4.05Å; I534-I603 HydrophobicContact CG2-CD1 3.6Å; I534-I603 HydrophobicContact CG2-CG1 4.01Å; I534-I603 HydrophobicContact CG2-CG2 4.21Å; L535-I603 HydrophobicContact CD2-CD1 4.37Å; I599-I603 WeakPolarHBondContact O-CG1 3.45Å; I599-I603 PolarHBondContact O-N 2.84Å; I599-I603 VanDerWaalsContact O-N 3.1Å; Y600-I603 PolarHBondContact O-N 2.77Å; Y600-I603 VanDerWaalsContact O-N 3.07Å; I603-D605 VanDerWaalsContact C-N 3.29Å; I603-D605 PolarHBondContact O-N 2.97Å; I603-V606 PolarHBondContact O-N 3.4Å; I603-K607 WeakPolarHBondContact O-CB 3.49Å; I603-K607 PolarHBondContact O-N 3.42Å; I603-W722 HydrophobicContact CG2-CH2 3.79Å; I603-W722 HydrophobicContact CG2-CZ3 4.27Å; I603-P724 HydrophobicContact CG2-CB 4.29Å; I603-P724 HydrophobicContact CG2-CG 4.11Å; I603-F726 HydrophobicContact CB-CZ 4.24Å; I603-F726 HydrophobicContact CG1-CZ 4.15Å; I603-F726 HydrophobicContact CG2-CZ 4.03Å
604	E	91.6	Very high	91.4	Very high	133 Å²	133	45.2 Å²	45.2	62%	0.621	22%	0.222	S	C	*	.	H	α-helix	trans	-57.1	-41.7	170.7	-74.4	176.9	174.6	0	0	111.9	Y600 K607 H608	Y600-E604 WeakPolarHBondContact O-CB 3.34Å; Y600-E604 WeakPolarHBondContact O-CG 3.48Å; Y600-E604 PolarHBondContact O-N 3.18Å; E604-K607 PolarHBondContact O-N 2.85Å; E604-H608 WeakPolarHBondContact O-CB 3.47Å; E604-H608 PolarHBondContact O-N 2.97Å
605	D	94.4	Very high	90.7	Very high	33 Å²	33	46.8 Å²	46.8	18%	0.176	24%	0.235	C	C	.	.	H	α-helix	trans	-75.2	-29.4	179.6	-177.2	27.3	0	0	0	112.7	Y572 K594 H596 Q601 L602 I603 E609	Y572-D605 HydrophobicContact CE1-CB 4.38Å; Y572-D605 WeakPolarHBondContact CE1-OD2 3.16Å; Y572-D605 PolarHBondContact OH-O 3.24Å; K594-D605 WeakPolarHBondContact CD-OD1 3.4Å; K594-D605 WeakPolarHBondContact CD-OD2 3.44Å; K594-D605 IonicContact NZ-OD1 3.56Å; K594-D605 PolarHBondContact NZ-OD1 3.48Å; K594-D605 IonicContact NZ-OD2 3.92Å; H596-D605 IonicContact CD2-OD2 3.9Å; H596-D605 IonicContact CE1-OD2 3Å; H596-D605 PolarHBondContact CE1-OD2 3.03Å; H596-D605 IonicContact NE2-OD2 3.61Å; H596-D605 PolarHBondContact NE2-OD2 2.93Å; Q601-D605 WeakPolarHBondContact O-CB 3.17Å; Q601-D605 PolarHBondContact O-N 3.47Å; L602-D605 PolarHBondContact O-N 2.99Å; I603-D605 VanDerWaalsContact C-N 3.29Å; I603-D605 PolarHBondContact O-N 2.97Å; D605-E609 WeakPolarHBondContact O-CB 3.46Å; D605-E609 PolarHBondContact O-N 3.16Å
606	V	93.1	Very high	90.1	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-49.7	165.3	170.3	0	0	0	0	110.3	L516 L535 Y572 L602 I603 H608 E609 L610 W722	L516-V606 HydrophobicContact CD2-CG1 4.42Å; L535-V606 HydrophobicContact CD2-CG1 4.03Å; Y572-V606 HydrophobicContact CD1-CG2 4.21Å; Y572-V606 HydrophobicContact CD2-CG2 4.24Å; Y572-V606 HydrophobicContact CE1-CG2 3.8Å; Y572-V606 HydrophobicContact CE2-CG2 3.8Å; Y572-V606 HydrophobicContact CG-CG2 4.42Å; L602-V606 HydrophobicContact CD2-CG2 4.12Å; L602-V606 WeakPolarHBondContact O-CG2 3.44Å; L602-V606 PolarHBondContact O-N 2.87Å; I603-V606 PolarHBondContact O-N 3.4Å; V606-H608 VanDerWaalsContact C-N 3.31Å; V606-H608 PolarHBondContact O-N 2.84Å; V606-E609 PolarHBondContact O-N 2.9Å; V606-E609 VanDerWaalsContact O-N 3.09Å; V606-L610 HydrophobicContact CG1-CD1 4.25Å; V606-L610 WeakPolarHBondContact O-CG 3.45Å; V606-L610 PolarHBondContact O-N 2.82Å; V606-W722 HydrophobicContact CG1-CZ3 4.41Å
607	K	91.8	Very high	89.5	Confident	57 Å²	57	47 Å²	47	25%	0.248	24%	0.244	C	C	.	.	H	α-helix	trans	-59.7	-39.7	176.9	-172.4	163.6	-179.9	163.5	0	111.8	I603 E604 L610 N611 W722	I603-K607 WeakPolarHBondContact O-CB 3.49Å; I603-K607 PolarHBondContact O-N 3.42Å; E604-K607 PolarHBondContact O-N 2.85Å; K607-L610 PolarHBondContact O-N 3.5Å; K607-N611 WeakPolarHBondContact O-CB 3.45Å; K607-N611 PolarHBondContact O-N 3.32Å; K607-N611 PolarHBondContact O-ND2 3.08Å; K607-N611 PolarHBondContact O-OD1 2.6Å; K607-W722 HydrophobicContact CB-CE3 4.46Å; K607-W722 HydrophobicContact CB-CZ3 4.24Å; K607-W722 HydrophobicContact CD-CE3 4.48Å; K607-W722 WeakPolarHBondContact CE-O 3.41Å; K607-W722 PolarHBondContact NZ-O 2.98Å
608	H	91.5	Very high	89.3	Confident	120 Å²	120	46.6 Å²	46.6	56%	0.556	24%	0.244	S	C	*	.	H	α-helix	trans	-64.5	-41.6	172.8	177.5	-84.7	0	0	0	112.6	E604 V606 N611 S612	E604-H608 WeakPolarHBondContact O-CB 3.47Å; E604-H608 PolarHBondContact O-N 2.97Å; V606-H608 VanDerWaalsContact C-N 3.31Å; V606-H608 PolarHBondContact O-N 2.84Å; H608-N611 PolarHBondContact O-N 3.22Å; H608-S612 VanDerWaalsContact O-CB 3.27Å; H608-S612 WeakPolarHBondContact O-CB 3.37Å; H608-S612 PolarHBondContact O-N 3.01Å
609	E	91.3	Very high	89.1	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.037	26%	0.255	C	S	.	.	H	α-helix	trans	-69.6	-32.9	176.9	-169.2	78.4	-157.1	0	0	112.4	L516 V570 Y572 K592 K594 D605 V606 R613	L516-E609 HydrophobicContact CD1-CG 3.68Å; L516-E609 HydrophobicContact CD2-CB 4.26Å; L516-E609 HydrophobicContact CD2-CG 4.23Å; V570-E609 HydrophobicContact CG2-CG 4.1Å; Y572-E609 WeakPolarHBondContact OH-CB 3.39Å; K592-E609 IonicContact NZ-OE1 3.25Å; K592-E609 PolarHBondContact NZ-OE1 3.3Å; K592-E609 IonicContact NZ-OE2 2.68Å; K592-E609 PolarHBondContact NZ-OE2 3.02Å; K594-E609 WeakPolarHBondContact CE-OE2 3.24Å; K594-E609 IonicContact NZ-OE2 2.6Å; K594-E609 PolarHBondContact NZ-OE2 3.02Å; D605-E609 WeakPolarHBondContact O-CB 3.46Å; D605-E609 PolarHBondContact O-N 3.16Å; V606-E609 PolarHBondContact O-N 2.9Å; V606-E609 VanDerWaalsContact O-N 3.09Å; E609-R613 WeakPolarHBondContact O-CG 3.4Å; E609-R613 PolarHBondContact O-N 3.3Å; E609-R613 IonicContact OE1-NE 2.73Å; E609-R613 IonicContact OE1-NH2 2.8Å
610	L	90.4	Very high	89.1	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.1	-54.2	168.5	-72.1	168.7	0	0	0	110.6	L516 Y538 C544 V606 K607 S612 R613 L614 T720 W722	L516-L610 HydrophobicContact CB-CD2 3.72Å; L516-L610 HydrophobicContact CD2-CD2 3.52Å; L516-L610 HydrophobicContact CD2-CG 3.61Å; L516-L610 HydrophobicContact CG-CD2 4.25Å; Y538-L610 HydrophobicContact CD2-CD1 4.34Å; Y538-L610 HydrophobicContact CE2-CD1 3.77Å; C544-L610 HydrophobicContact CB-CD2 4.16Å; V606-L610 HydrophobicContact CG1-CD1 4.25Å; V606-L610 WeakPolarHBondContact O-CG 3.45Å; V606-L610 PolarHBondContact O-N 2.82Å; K607-L610 PolarHBondContact O-N 3.5Å; L610-S612 PolarHBondContact O-N 3.39Å; L610-R613 PolarHBondContact O-N 2.68Å; L610-L614 PolarHBondContact O-N 3Å; L610-T720 HydrophobicContact CB-CG2 3.86Å; L610-T720 HydrophobicContact CD1-CG2 4.46Å; L610-W722 HydrophobicContact CD1-CE3 4.08Å; L610-W722 HydrophobicContact CD1-CZ3 4.2Å
611	N	89.6	Confident	89.2	Confident	40 Å²	40	50.7 Å²	50.7	21%	0.214	27%	0.271	C	S	.	.	H	α-helix	trans	-57.3	-36.9	178.2	-65.4	-12.8	0	0	0	112.1	K607 H608 R613 L614 T720	K607-N611 WeakPolarHBondContact O-CB 3.45Å; K607-N611 PolarHBondContact O-N 3.32Å; K607-N611 PolarHBondContact O-ND2 3.08Å; K607-N611 PolarHBondContact O-OD1 2.6Å; H608-N611 PolarHBondContact O-N 3.22Å; N611-R613 PolarHBondContact O-N 3.18Å; N611-L614 PolarHBondContact O-N 2.9Å; N611-T720 WeakPolarHBondContact OD1-CB 3.4Å; N611-T720 PolarHBondContact OD1-N 3.37Å; N611-T720 PolarHBondContact OD1-OG1 3.48Å
612	S	88.6	Confident	89.2	Confident	79 Å²	79	49.8 Å²	49.8	55%	0.552	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-16.2	176.9	-176.7	0	0	0	0	114	H608 L610	H608-S612 VanDerWaalsContact O-CB 3.27Å; H608-S612 WeakPolarHBondContact O-CB 3.37Å; H608-S612 PolarHBondContact O-N 3.01Å; L610-S612 PolarHBondContact O-N 3.39Å
613	R	86.6	Confident	89.2	Confident	53 Å²	53	51.7 Å²	51.7	20%	0.2	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-16.8	174.9	-69.6	-176.5	-171.8	-145.8	-0.2	113.2	V515 L516 E609 L610 N611	V515-R613 PolarHBondContact O-NH1 3.41Å; L516-R613 VanDerWaalsContact CD1-CZ 3.46Å; E609-R613 WeakPolarHBondContact O-CG 3.4Å; E609-R613 PolarHBondContact O-N 3.3Å; E609-R613 IonicContact OE1-NE 2.73Å; E609-R613 IonicContact OE1-NH2 2.8Å; L610-R613 PolarHBondContact O-N 2.68Å; N611-R613 PolarHBondContact O-N 3.18Å
614	L	85.6	Confident	89.2	Confident	14 Å²	14	51.5 Å²	51.5	7%	0.073	28%	0.282	C	S	.	.	S	Bend	trans	-63.3	138.6	175.7	-68.9	177.3	0	0	0	111.3	E543 C544 L610 N611 Q718 T720	E543-L614 HydrophobicContact CB-CD2 3.93Å; C544-L614 HydrophobicContact CB-CD2 3.83Å; L610-L614 PolarHBondContact O-N 3Å; N611-L614 PolarHBondContact O-N 2.9Å; L614-Q718 HydrophobicContact CB-CB 4.1Å; L614-Q718 HydrophobicContact CD1-CB 3.75Å; L614-T720 HydrophobicContact CD1-CG2 3.93Å
615	P	81.9	Confident	89.3	Confident	63 Å²	63	47.9 Å²	47.9	41%	0.409	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-65	140.4	170.9	28.7	-33.8	0	0	0	109.9	S617 Q718	P615-S617 PolarHBondContact O-N 3.36Å; P615-Q718 PolarHBondContact O-OE1 3.14Å
616	P	82.7	Confident	89.3	Confident	63 Å²	63	46.5 Å²	46.5	41%	0.409	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-62.3	135	176.5	25.6	-33.1	0	0	0	110.7	E715	P616-E715 HydrophobicContact CB-CB 4.01Å; P616-E715 HydrophobicContact CB-CG 4.35Å; P616-E715 HydrophobicContact CG-CB 4.48Å; P616-E715 HydrophobicContact CG-CG 4.36Å
617	S	83.8	Confident	89.3	Confident	35 Å²	35	47.3 Å²	47.3	25%	0.245	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	136.1	172.5	63.3	0	0	0	0	110	P615 E715 V716	P615-S617 PolarHBondContact O-N 3.36Å; S617-E715 WeakPolarHBondContact O-CA 3.22Å; S617-V716 PolarHBondContact N-O 2.89Å; S617-V716 PolarHBondContact O-N 3.49Å; S617-V716 PolarHBondContact OG-O 3.39Å
618	V	85.8	Confident	89.4	Confident	79 Å²	79	44.6 Å²	44.6	48%	0.479	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	107	178.4	-178.4	0	0	0	0	109	E713	V618-E713 HydrophobicContact CG1-CB 3.56Å; V618-E713 HydrophobicContact CG1-CG 3.54Å
619	V	87.6	Confident	89.5	Confident	61 Å²	61	43 Å²	43	37%	0.37	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120	178.3	-177.9	0	0	0	0	109.7	N621 K714 V716	V619-N621 PolarHBondContact O-N 3.02Å; V619-K714 PolarHBondContact N-O 2.86Å; V619-K714 PolarHBondContact O-N 2.87Å; V619-V716 HydrophobicContact CB-CG2 4.23Å; V619-V716 HydrophobicContact CG2-CB 4.19Å; V619-V716 HydrophobicContact CG2-CG2 3.77Å
620	E	90.1	Very high	89.5	Confident	61 Å²	61	46.4 Å²	46.4	29%	0.285	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	101	174.2	-65.7	-172.4	-176.8	0	0	110.7	K660 K670 Y711	E620-K660 IonicContact OE2-NZ 3.2Å; E620-K660 PolarHBondContact OE2-NZ 3.22Å; E620-K670 IonicContact OE1-NZ 2.89Å; E620-K670 PolarHBondContact OE1-NZ 2.89Å; E620-K670 IonicContact OE2-NZ 3.86Å; E620-Y711 HydrophobicContact CB-CD2 3.88Å; E620-Y711 HydrophobicContact CB-CE2 4.47Å; E620-Y711 HydrophobicContact CB-CG 4.44Å; E620-Y711 HydrophobicContact CG-CD2 3.66Å; E620-Y711 HydrophobicContact CG-CE2 3.74Å
621	N	89.9	Confident	89.5	Confident	62 Å²	62	49.4 Å²	49.4	33%	0.332	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	119.2	172.5	-72.1	-73.4	0	0	0	110.3	V619 I623 Y711 E712 K714	V619-N621 PolarHBondContact O-N 3.02Å; N621-I623 PolarHBondContact O-N 3.04Å; N621-Y711 CarbonylContact O-C 3.59Å; N621-Y711 WeakPolarHBondContact O-CA 3.11Å; N621-Y711 WeakPolarHBondContact O-CB 3.44Å; N621-E712 PolarHBondContact N-O 2.73Å; N621-E712 PolarHBondContact O-N 3.24Å; N621-K714 WeakPolarHBondContact ND2-CD 3.37Å; N621-K714 WeakPolarHBondContact ND2-CG 3.45Å
622	T	91.6	Very high	89.5	Confident	76 Å²	76	52.4 Å²	52.4	47%	0.466	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	122.5	179.8	-62.1	0	0	0	0	110.8	E625 I709	T622-E625 HydrophobicContact CG2-CG 4.31Å; T622-I709 HydrophobicContact CG2-CG2 3.51Å
623	I	93.1	Very high	89.3	Confident	41 Å²	41	53.6 Å²	53.6	21%	0.21	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-32.7	179.7	-62.5	175.5	0	0	0	111.3	N621 G651 Q652 M657 C710 E712	N621-I623 PolarHBondContact O-N 3.04Å; I623-G651 VanDerWaalsContact O-CA 3.32Å; I623-G651 WeakPolarHBondContact O-CA 3.06Å; I623-Q652 CarbonylContact C-O 3.57Å; I623-Q652 HydrophobicContact CG2-CG 3.7Å; I623-Q652 WeakPolarHBondContact CG2-O 3.24Å; I623-Q652 PolarHBondContact O-N 3.47Å; I623-Q652 VanDerWaalsContact O-N 3.11Å; I623-M657 HydrophobicContact CD1-CE 3.95Å; I623-M657 HydrophobicContact CD1-CG 3.77Å; I623-M657 HydrophobicContact CD1-SD 4Å; I623-C710 PolarHBondContact N-O 2.69Å; I623-E712 HydrophobicContact CD1-CB 3.5Å; I623-E712 HydrophobicContact CG1-CB 4.23Å
624	G	92.4	Very high	89.2	Confident	3 Å²	3	54.3 Å²	54.3	3%	0.031	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	157.7	179.8	0	0	0	0	0	114.3	K650 Q652 C710	G624-K650 CarbonylContact C-O 3.6Å; G624-K650 WeakPolarHBondContact CA-O 3.25Å; G624-Q652 WeakPolarHBondContact CA-O 3.35Å; G624-C710 PolarHBondContact N-O 2.91Å; G624-C710 PolarHBondContact O-N 3.3Å
625	E	93.8	Very high	89.2	Confident	57 Å²	57	58.1 Å²	58.1	27%	0.266	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132.5	-176.5	-64.6	168.3	-178	0	0	108.6	T622 Q649 K650 I709	T622-E625 HydrophobicContact CG2-CG 4.31Å; E625-Q649 PolarHBondContact O-N 2.87Å; E625-K650 HydrophobicContact CB-CB 4.39Å; E625-K650 PolarHBondContact N-O 2.85Å; E625-K650 PolarHBondContact O-N 3.46Å; E625-K650 IonicContact OE1-NZ 3.55Å; E625-K650 WeakPolarHBondContact OE2-CD 3.34Å; E625-K650 WeakPolarHBondContact OE2-CE 3.2Å; E625-K650 IonicContact OE2-NZ 2.65Å; E625-K650 PolarHBondContact OE2-NZ 2.81Å; E625-I709 HydrophobicContact CG-CG1 4.39Å
626	A	93.8	Very high	89	Confident	3 Å²	3	59.2 Å²	59.2	3%	0.025	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	137.3	176.8	0	0	0	0	0	111.3	C646 R647 V648 L653 I708	A626-C646 HydrophobicContact CB-CB 4.24Å; A626-R647 VanDerWaalsContact CA-O 3.23Å; A626-R647 WeakPolarHBondContact CA-O 3.38Å; A626-R647 WeakPolarHBondContact CB-O 3.43Å; A626-V648 HydrophobicContact CB-CG2 4.35Å; A626-L653 HydrophobicContact CB-CD1 3.9Å; A626-L653 HydrophobicContact CB-CD2 4.26Å; A626-I708 PolarHBondContact N-O 2.88Å; A626-I708 PolarHBondContact O-N 2.9Å
627	S	93.8	Very high	88.8	Confident	18 Å²	18	59.8 Å²	59.8	13%	0.126	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	136.3	177.2	52.2	0	0	0	0	111.4	L629 C646 R647 Q649	S627-L629 PolarHBondContact O-N 3.33Å; S627-C646 VanDerWaalsContact O-CA 3.26Å; S627-C646 WeakPolarHBondContact O-CA 3.43Å; S627-R647 PolarHBondContact N-O 2.88Å; S627-R647 PolarHBondContact O-N 3.18Å; S627-Q649 PolarHBondContact OG-NE2 2.84Å
628	V	94.3	Very high	88.6	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	118.6	172.9	-178	0	0	0	0	109.4	T631 A644 G705 D706 I708	V628-T631 HydrophobicContact CG1-CG2 4.14Å; V628-A644 HydrophobicContact CG1-CB 4.05Å; V628-A644 HydrophobicContact CG2-CB 4.08Å; V628-G705 PolarHBondContact O-N 2.81Å; V628-D706 HydrophobicContact CB-CB 4.11Å; V628-D706 HydrophobicContact CG2-CB 3.77Å; V628-D706 PolarHBondContact N-O 3.4Å; V628-I708 HydrophobicContact CG2-CD1 3.9Å; V628-I708 HydrophobicContact CG2-CG1 4.22Å
629	L	92.9	Very high	88.2	Confident	85 Å²	85	68.1 Å²	68.1	45%	0.445	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-36.6	179	-61.9	179.4	0	0	0	112.4	S627 G645 R647 V704	S627-L629 PolarHBondContact O-N 3.33Å; L629-G645 PolarHBondContact N-O 3.09Å; L629-R647 HydrophobicContact CD1-CB 3.79Å; L629-R647 HydrophobicContact CG-CB 4.41Å; L629-V704 WeakPolarHBondContact O-CG1 3.21Å
630	D	91	Very high	87.9	Confident	81 Å²	81	72.9 Å²	72.9	43%	0.433	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	163	-177.7	-160.4	-0.6	0	0	0	110.7	F632 G645	D630-F632 HydrophobicContact CB-CE2 4.02Å; D630-F632 HydrophobicContact CB-CZ 3.96Å; D630-F632 WeakPolarHBondContact OD2-CZ 3.5Å; D630-G645 PolarHBondContact N-O 2.83Å; D630-G645 PolarHBondContact O-N 3.14Å
631	T	91	Very high	87.6	Confident	63 Å²	63	71.7 Å²	71.7	39%	0.387	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	123.1	-174.1	60.7	0	0	0	0	111.6	V628 F702	V628-T631 HydrophobicContact CG1-CG2 4.14Å; T631-F702 HydrophobicContact CG2-CB 3.64Å
632	F	88.6	Confident	87.5	Confident	102 Å²	102	70.2 Å²	70.2	45%	0.447	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	146.7	-176.1	-55.7	-81.9	0	0	0	111.3	D630 V634 V643	D630-F632 HydrophobicContact CB-CE2 4.02Å; D630-F632 HydrophobicContact CB-CZ 3.96Å; D630-F632 WeakPolarHBondContact OD2-CZ 3.5Å; F632-V634 HydrophobicContact CB-CG2 4.42Å; F632-V643 HydrophobicContact CB-CB 4.41Å; F632-V643 PolarHBondContact N-O 3.29Å; F632-V643 PolarHBondContact O-N 3.24Å
633	C	84.9	Confident	87.5	Confident	105 Å²	105	68 Å²	68	71%	0.709	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	105.6	168	-68.4	0	0	0	0	109.5
634	V	85.6	Confident	87.4	Confident	68 Å²	68	66 Å²	66	41%	0.412	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124	-177.8	-175.5	0	0	0	0	109.7	F632 V636 V641 V643	F632-V634 HydrophobicContact CB-CG2 4.42Å; V634-V636 HydrophobicContact CG1-CG2 3.97Å; V634-V636 PolarHBondContact O-N 3.28Å; V634-V641 PolarHBondContact N-O 2.71Å; V634-V641 PolarHBondContact O-N 2.83Å; V634-V643 HydrophobicContact CB-CG2 4.18Å; V634-V643 HydrophobicContact CG2-CB 4.39Å; V634-V643 HydrophobicContact CG2-CG2 3.82Å
635	T	84	Confident	87.4	Confident	94 Å²	94	66.6 Å²	66.6	58%	0.577	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	108.6	174.2	-51.1	0	0	0	0	109.6	S639	T635-S639 WeakPolarHBondContact CA-O 3.43Å
636	V	77.6	Confident	87.4	Confident	85 Å²	85	64 Å²	64	52%	0.515	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	100.3	177.9	-175.3	0	0	0	0	108.4	V634 K638 S639 V641	V634-V636 HydrophobicContact CG1-CG2 3.97Å; V634-V636 PolarHBondContact O-N 3.28Å; V636-K638 PolarHBondContact O-N 2.75Å; V636-S639 PolarHBondContact N-O 3.36Å; V636-S639 PolarHBondContact O-N 3.48Å; V636-S639 PolarHBondContact O-OG 3.08Å; V636-V641 HydrophobicContact CB-CG2 4.35Å; V636-V641 HydrophobicContact CG2-CG2 4.33Å
637	G	80.3	Confident	87.4	Confident	75 Å²	75	69.1 Å²	69.1	77%	0.773	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	-109.3	-173.6	0	0	0	0	0	111.9
638	K	78.6	Confident	87.4	Confident	220 Å²	220	68.3 Å²	68.3	96%	0.957	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-10.1	179.8	-70.6	-174.1	179.2	179.9	0	114.3	V636	V636-K638 PolarHBondContact O-N 2.75Å
639	S	76.6	Confident	87.3	Confident	70 Å²	70	73.1 Å²	73.1	49%	0.49	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	146.4	178.9	43.6	0	0	0	0	111.3	T635 V636	T635-S639 WeakPolarHBondContact CA-O 3.43Å; V636-S639 PolarHBondContact N-O 3.36Å; V636-S639 PolarHBondContact O-N 3.48Å; V636-S639 PolarHBondContact O-OG 3.08Å
640	K	82.1	Confident	87.3	Confident	160 Å²	160	74.9 Å²	74.9	70%	0.696	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	123.2	164.6	-66.3	-176.7	178.4	-176.2	0	107.2
641	V	84	Confident	87.4	Confident	36 Å²	36	72.9 Å²	72.9	22%	0.218	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125.3	178.4	-178	0	0	0	0	108.3	V634 V636 V643	V634-V641 PolarHBondContact N-O 2.71Å; V634-V641 PolarHBondContact O-N 2.83Å; V636-V641 HydrophobicContact CB-CG2 4.35Å; V636-V641 HydrophobicContact CG2-CG2 4.33Å; V641-V643 HydrophobicContact CG1-CG2 4.48Å
642	P	88.3	Confident	87.5	Confident	32 Å²	32	73.7 Å²	73.7	21%	0.208	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	133.7	170.1	29.9	-32.7	0	0	0	109.8	F702	P642-F702 HydrophobicContact CB-CD2 4.17Å; P642-F702 HydrophobicContact CB-CE2 4.14Å
643	V	89.9	Confident	87.7	Confident	28 Å²	28	68.8 Å²	68.8	17%	0.17	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	117.7	180	-176.7	0	0	0	0	108.4	F632 V634 V641 I694	F632-V643 HydrophobicContact CB-CB 4.41Å; F632-V643 PolarHBondContact N-O 3.29Å; F632-V643 PolarHBondContact O-N 3.24Å; V634-V643 HydrophobicContact CB-CG2 4.18Å; V634-V643 HydrophobicContact CG2-CB 4.39Å; V634-V643 HydrophobicContact CG2-CG2 3.82Å; V641-V643 HydrophobicContact CG1-CG2 4.48Å; V643-I694 CarbonylContact C-O 3.3Å; V643-I694 WeakPolarHBondContact CA-O 3.41Å
644	A	91.3	Very high	88.1	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	128.9	171.3	0	0	0	0	0	110.1	V628 C646 G693 I694 F702	V628-A644 HydrophobicContact CG1-CB 4.05Å; V628-A644 HydrophobicContact CG2-CB 4.08Å; A644-C646 VanDerWaalsContact CB-SG 3.51Å; A644-G693 CarbonylContact O-C 3.58Å; A644-G693 WeakPolarHBondContact O-CA 3.26Å; A644-I694 PolarHBondContact N-O 2.94Å; A644-I694 PolarHBondContact O-N 3.31Å; A644-F702 HydrophobicContact CB-CB 4.38Å; A644-F702 HydrophobicContact CB-CD1 3.67Å; A644-F702 HydrophobicContact CB-CD2 3.88Å; A644-F702 HydrophobicContact CB-CE1 3.65Å; A644-F702 HydrophobicContact CB-CE2 3.87Å; A644-F702 HydrophobicContact CB-CG 3.75Å; A644-F702 HydrophobicContact CB-CZ 3.71Å
645	G	93.5	Very high	88.3	Confident	16 Å²	16	64.9 Å²	64.9	17%	0.165	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	106.6	166.2	0	0	0	0	0	109.3	L629 D630	L629-G645 PolarHBondContact N-O 3.09Å; D630-G645 PolarHBondContact N-O 2.83Å; D630-G645 PolarHBondContact O-N 3.14Å
646	C	93.2	Very high	88.6	Confident	1 Å²	1	68 Å²	68	1%	0.007	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	153.9	-172.4	-50.4	0	0	0	0	111.3	A626 S627 A644 D691 C692 I694	A626-C646 HydrophobicContact CB-CB 4.24Å; S627-C646 VanDerWaalsContact O-CA 3.26Å; S627-C646 WeakPolarHBondContact O-CA 3.43Å; A644-C646 VanDerWaalsContact CB-SG 3.51Å; C646-D691 CarbonylContact O-C 3.57Å; C646-D691 WeakPolarHBondContact O-CA 3.44Å; C646-C692 PolarHBondContact N-O 3.33Å; C646-C692 PolarHBondContact O-N 2.63Å; C646-I694 HydrophobicContact CB-CD1 4.09Å
647	R	93.2	Very high	89.2	Confident	112 Å²	112	66.1 Å²	66.1	42%	0.423	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.5	169.4	179.7	167.3	-69.1	167.8	1.7	110	A626 S627 L629 Q649 D691	A626-R647 VanDerWaalsContact CA-O 3.23Å; A626-R647 WeakPolarHBondContact CA-O 3.38Å; A626-R647 WeakPolarHBondContact CB-O 3.43Å; S627-R647 PolarHBondContact N-O 2.88Å; S627-R647 PolarHBondContact O-N 3.18Å; L629-R647 HydrophobicContact CD1-CB 3.79Å; L629-R647 HydrophobicContact CG-CB 4.41Å; R647-Q649 PolarHBondContact O-N 3.01Å; R647-D691 IonicContact CZ-OD1 3.46Å; R647-D691 IonicContact CZ-OD2 2.65Å; R647-D691 IonicContact NE-OD1 2.88Å; R647-D691 PolarHBondContact NE-OD1 3.27Å; R647-D691 VanDerWaalsContact NH2-CG 3.27Å; R647-D691 IonicContact NH2-OD1 2.97Å; R647-D691 PolarHBondContact NH2-OD1 3.46Å; R647-D691 IonicContact NH2-OD2 2.68Å; R647-D691 PolarHBondContact NH2-OD2 3.37Å
648	V	94.8	Very high	89.8	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.006	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	114.8	178.3	-172	0	0	0	0	109.5	A626 L653 I686 G689 M690	A626-V648 HydrophobicContact CB-CG2 4.35Å; V648-L653 HydrophobicContact CG1-CG 4.48Å; V648-L653 HydrophobicContact CG2-CD1 3.75Å; V648-L653 HydrophobicContact CG2-CG 3.79Å; V648-I686 HydrophobicContact CG2-CG2 3.84Å; V648-G689 PolarHBondContact O-N 2.88Å; V648-M690 PolarHBondContact N-O 3.25Å
649	Q	92.9	Very high	90.5	Very high	102 Å²	102	56.2 Å²	56.2	48%	0.477	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-44	180	-62.9	-166.4	7.7	0	0	112.1	E625 S627 R647 T688	E625-Q649 PolarHBondContact O-N 2.87Å; S627-Q649 PolarHBondContact OG-NE2 2.84Å; R647-Q649 PolarHBondContact O-N 3.01Å; Q649-T688 WeakPolarHBondContact O-CG2 3.46Å
650	K	91.9	Very high	91.3	Very high	122 Å²	122	54.2 Å²	54.2	53%	0.53	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148.1	-178.9	-54.1	-168.5	-158.8	112	0	110.6	G624 E625	G624-K650 CarbonylContact C-O 3.6Å; G624-K650 WeakPolarHBondContact CA-O 3.25Å; E625-K650 HydrophobicContact CB-CB 4.39Å; E625-K650 PolarHBondContact N-O 2.85Å; E625-K650 PolarHBondContact O-N 3.46Å; E625-K650 IonicContact OE1-NZ 3.55Å; E625-K650 WeakPolarHBondContact OE2-CD 3.34Å; E625-K650 WeakPolarHBondContact OE2-CE 3.2Å; E625-K650 IonicContact OE2-NZ 2.65Å; E625-K650 PolarHBondContact OE2-NZ 2.81Å
651	G	92.9	Very high	91.8	Very high	38 Å²	38	46.6 Å²	46.6	39%	0.392	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	64.8	-142.1	175.3	0	0	0	0	0	113.9	I623 T688	I623-G651 VanDerWaalsContact O-CA 3.32Å; I623-G651 WeakPolarHBondContact O-CA 3.06Å; G651-T688 PolarHBondContact O-N 3.08Å; G651-T688 PolarHBondContact O-OG1 3.13Å
652	Q	93.3	Very high	92.2	Very high	80 Å²	80	46 Å²	46	37%	0.374	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	154.6	-179.2	63.5	-175.9	5.7	0	0	111.7	I623 G624 I685 I686	I623-Q652 CarbonylContact C-O 3.57Å; I623-Q652 HydrophobicContact CG2-CG 3.7Å; I623-Q652 WeakPolarHBondContact CG2-O 3.24Å; I623-Q652 PolarHBondContact O-N 3.47Å; I623-Q652 VanDerWaalsContact O-N 3.11Å; G624-Q652 WeakPolarHBondContact CA-O 3.35Å; Q652-I685 HydrophobicContact CB-CG2 4.25Å; Q652-I685 HydrophobicContact CG-CG2 4.42Å; Q652-I686 CarbonylContact C-O 3.55Å; Q652-I686 VanDerWaalsContact CA-O 3.26Å; Q652-I686 WeakPolarHBondContact CA-O 3.3Å; Q652-I686 WeakPolarHBondContact CB-O 3.49Å
653	L	92.9	Very high	92.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	120.5	172.4	-51.4	-178.4	0	0	0	109	A626 V648 F659 I685 I686 I694 C710	A626-L653 HydrophobicContact CB-CD1 3.9Å; A626-L653 HydrophobicContact CB-CD2 4.26Å; V648-L653 HydrophobicContact CG1-CG 4.48Å; V648-L653 HydrophobicContact CG2-CD1 3.75Å; V648-L653 HydrophobicContact CG2-CG 3.79Å; L653-F659 HydrophobicContact CB-CE1 4.18Å; L653-F659 HydrophobicContact CB-CZ 4.41Å; L653-F659 HydrophobicContact CD2-CE1 4.18Å; L653-I685 CarbonylContact O-C 3.57Å; L653-I685 VanDerWaalsContact O-CA 3.31Å; L653-I685 WeakPolarHBondContact O-CA 3.38Å; L653-I686 PolarHBondContact N-O 3.06Å; L653-I686 PolarHBondContact O-N 3.06Å; L653-I694 HydrophobicContact CD1-CD1 3.81Å; L653-C710 HydrophobicContact CD2-CB 3.62Å
654	D	92.3	Very high	92.2	Very high	21 Å²	21	56 Å²	56	11%	0.112	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.7	172	-175.3	-27.2	0	0	0	109.9	K656 M657 F659 Q684 I685	D654-K656 PolarHBondContact O-N 2.76Å; D654-K656 VanDerWaalsContact O-N 3.09Å; D654-K656 WeakPolarHBondContact OD1-CB 3.47Å; D654-K656 PolarHBondContact OD1-N 2.7Å; D654-M657 HydrophobicContact CB-CG 3.92Å; D654-M657 PolarHBondContact O-N 2.79Å; D654-F659 VanDerWaalsContact O-CE2 3.25Å; D654-F659 WeakPolarHBondContact O-CE2 3.35Å; D654-F659 VanDerWaalsContact O-CZ 3.23Å; D654-F659 WeakPolarHBondContact O-CZ 3.34Å; D654-Q684 CarbonylContact C-O 3.57Å; D654-Q684 VanDerWaalsContact CA-O 3.32Å; D654-Q684 WeakPolarHBondContact CA-O 3.47Å; D654-I685 HydrophobicContact CB-CG1 4.29Å
655	K	90.1	Very high	91.9	Very high	69 Å²	69	59 Å²	59	30%	0.3	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-26.6	-180	-169.1	178.3	-178.6	-175.9	0	113.6	M657 S674 L676 Q684	K655-M657 VanDerWaalsContact C-N 3.31Å; K655-S674 WeakPolarHBondContact CE-O 3.46Å; K655-S674 PolarHBondContact NZ-O 3.27Å; K655-L676 HydrophobicContact CB-CB 4.2Å; K655-L676 HydrophobicContact CB-CD2 3.92Å; K655-L676 HydrophobicContact CD-CB 4.15Å; K655-L676 HydrophobicContact CG-CB 4.12Å; K655-Q684 PolarHBondContact N-O 3.28Å
656	K	90.3	Very high	91.7	Very high	160 Å²	160	64 Å²	64	70%	0.696	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-20.7	-179.8	-65	176.2	-176.1	168.7	0	113.7	D654	D654-K656 PolarHBondContact O-N 2.76Å; D654-K656 VanDerWaalsContact O-N 3.09Å; D654-K656 WeakPolarHBondContact OD1-CB 3.47Å; D654-K656 PolarHBondContact OD1-N 2.7Å
657	M	91	Very high	91.6	Very high	45 Å²	45	67.5 Å²	67.5	22%	0.222	34%	0.337	C	S	.	.	S	Bend	trans	-84.1	174.3	-174.4	-62.2	-60.1	-178.5	0	0	111.6	I623 D654 K655 F659 E712	I623-M657 HydrophobicContact CD1-CE 3.95Å; I623-M657 HydrophobicContact CD1-CG 3.77Å; I623-M657 HydrophobicContact CD1-SD 4Å; D654-M657 HydrophobicContact CB-CG 3.92Å; D654-M657 PolarHBondContact O-N 2.79Å; K655-M657 VanDerWaalsContact C-N 3.31Å; M657-F659 VanDerWaalsContact O-CD2 3.26Å; M657-F659 WeakPolarHBondContact O-CD2 3.06Å; M657-F659 VanDerWaalsContact O-CE2 3.26Å; M657-F659 WeakPolarHBondContact O-CE2 3.43Å; M657-E712 HydrophobicContact CE-CB 4.46Å; M657-E712 HydrophobicContact CE-CG 4.45Å; M657-E712 HydrophobicContact SD-CB 3.89Å; M657-E712 HydrophobicContact SD-CG 4.14Å
658	K	92.6	Very high	91.5	Very high	87 Å²	87	65.9 Å²	65.9	38%	0.378	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	153.9	175.6	-73.5	176.8	170.1	-179.2	0	110.5	C710 Y711 E713	K658-C710 WeakPolarHBondContact O-CA 3.35Å; K658-Y711 HydrophobicContact CB-CD1 4.42Å; K658-Y711 HydrophobicContact CB-CD2 4.22Å; K658-Y711 HydrophobicContact CB-CE1 3.95Å; K658-Y711 HydrophobicContact CB-CE2 3.75Å; K658-Y711 HydrophobicContact CD-CE2 4.27Å; K658-Y711 PolarHBondContact N-O 2.97Å; K658-Y711 VanDerWaalsContact N-O 3.07Å; K658-Y711 PolarHBondContact O-N 2.77Å; K658-Y711 VanDerWaalsContact O-O 3.11Å; K658-E713 VanDerWaalsContact CD-CD 3.46Å; K658-E713 HydrophobicContact CD-CG 4.14Å; K658-E713 WeakPolarHBondContact CD-OE1 3.39Å; K658-E713 WeakPolarHBondContact CE-OE1 3.05Å; K658-E713 IonicContact NZ-OE1 2.72Å; K658-E713 PolarHBondContact NZ-OE1 2.77Å; K658-E713 IonicContact NZ-OE2 3.7Å; K658-E713 PolarHBondContact NZ-OE2 2.86Å
659	F	93.1	Very high	91.4	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	143.2	-175.2	-69.6	-99.8	0	0	0	110	L653 D654 M657 W669 K670 G671 L673 I708 I709 C710	L653-F659 HydrophobicContact CB-CE1 4.18Å; L653-F659 HydrophobicContact CB-CZ 4.41Å; L653-F659 HydrophobicContact CD2-CE1 4.18Å; D654-F659 VanDerWaalsContact O-CE2 3.25Å; D654-F659 WeakPolarHBondContact O-CE2 3.35Å; D654-F659 VanDerWaalsContact O-CZ 3.23Å; D654-F659 WeakPolarHBondContact O-CZ 3.34Å; M657-F659 VanDerWaalsContact O-CD2 3.26Å; M657-F659 WeakPolarHBondContact O-CD2 3.06Å; M657-F659 VanDerWaalsContact O-CE2 3.26Å; M657-F659 WeakPolarHBondContact O-CE2 3.43Å; F659-W669 HydrophobicContact CB-CH2 4.31Å; F659-W669 HydrophobicContact CB-CZ3 3.78Å; F659-W669 WeakPolarHBondContact O-CZ3 3.47Å; F659-K670 WeakPolarHBondContact O-CA 3.36Å; F659-G671 PolarHBondContact N-O 3.47Å; F659-G671 PolarHBondContact O-N 3.46Å; F659-L673 HydrophobicContact CB-CD2 4.2Å; F659-L673 HydrophobicContact CD1-CD1 4.03Å; F659-L673 HydrophobicContact CD1-CD2 4.3Å; F659-L673 HydrophobicContact CD1-CG 4.22Å; F659-L673 HydrophobicContact CD2-CD1 3.92Å; F659-L673 HydrophobicContact CD2-CD2 4.12Å; F659-L673 HydrophobicContact CD2-CG 3.53Å; F659-L673 HydrophobicContact CE1-CD1 3.67Å; F659-L673 HydrophobicContact CE1-CG 4.29Å; F659-L673 HydrophobicContact CE2-CD1 3.57Å; F659-L673 HydrophobicContact CE2-CG 3.64Å; F659-L673 HydrophobicContact CG-CD1 4.13Å; F659-L673 HydrophobicContact CG-CD2 3.95Å; F659-L673 HydrophobicContact CG-CG 3.83Å; F659-L673 HydrophobicContact CZ-CD1 3.43Å; F659-L673 VanDerWaalsContact CZ-CD1 3.43Å; F659-L673 HydrophobicContact CZ-CG 4.03Å; F659-I708 HydrophobicContact CD1-CG2 3.84Å; F659-I709 CarbonylContact C-O 3.59Å; F659-I709 WeakPolarHBondContact CA-O 3.37Å; F659-C710 HydrophobicContact CD1-CB 3.92Å; F659-C710 HydrophobicContact CE1-CB 3.55Å; F659-C710 HydrophobicContact CZ-CB 4.06Å; F659-C710 VanDerWaalsContact CZ-SG 3.53Å
660	K	93.3	Very high	91.3	Very high	28 Å²	28	66.9 Å²	66.9	12%	0.122	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	137	171.2	59.5	-170.2	171.6	-172.1	0	110.7	E620 V667 W669 K670 I708 I709 Y711	E620-K660 IonicContact OE2-NZ 3.2Å; E620-K660 PolarHBondContact OE2-NZ 3.22Å; K660-V667 HydrophobicContact CB-CG1 4.19Å; K660-W669 CarbonylContact C-O 3.49Å; K660-W669 WeakPolarHBondContact CA-O 3.36Å; K660-W669 WeakPolarHBondContact CB-O 3.49Å; K660-K670 HydrophobicContact CB-CG 4.04Å; K660-I708 WeakPolarHBondContact O-CA 3.26Å; K660-I709 HydrophobicContact CG-CB 3.84Å; K660-I709 PolarHBondContact N-O 2.86Å; K660-I709 PolarHBondContact O-N 3.14Å; K660-Y711 HydrophobicContact CB-CD1 4.38Å; K660-Y711 HydrophobicContact CB-CE1 3.82Å; K660-Y711 HydrophobicContact CD-CD1 3.99Å; K660-Y711 HydrophobicContact CD-CE1 3.96Å; K660-Y711 HydrophobicContact CG-CD1 3.92Å; K660-Y711 HydrophobicContact CG-CE1 3.86Å
661	L	92.6	Very high	91.2	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.1	175.4	-175.5	72.1	0	0	0	108.3	V667 I668 W669 I700 F702 D706 I708	L661-V667 CarbonylContact O-C 3.59Å; L661-V667 WeakPolarHBondContact O-CA 3.26Å; L661-I668 HydrophobicContact CD2-CB 4.35Å; L661-I668 HydrophobicContact CD2-CG2 4.26Å; L661-I668 PolarHBondContact O-N 3.39Å; L661-W669 HydrophobicContact CB-CB 4.1Å; L661-W669 HydrophobicContact CB-CE3 4.39Å; L661-W669 PolarHBondContact N-O 3.17Å; L661-I700 HydrophobicContact CD2-CG2 4.1Å; L661-F702 HydrophobicContact CD1-CD1 4.32Å; L661-F702 HydrophobicContact CD2-CD1 4.5Å; L661-D706 HydrophobicContact CD1-CB 3.87Å; L661-I708 HydrophobicContact CD1-CD1 4.14Å; L661-I708 HydrophobicContact CD1-CG1 3.53Å
662	I	93.3	Very high	91.1	Very high	24 Å²	24	63.2 Å²	63.2	12%	0.123	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132.8	-179.4	-57.4	-175.4	0	0	0	109	D666 V667 E707 I709	I662-D666 VanDerWaalsContact CA-O 3.29Å; I662-D666 WeakPolarHBondContact CA-O 3.48Å; I662-V667 HydrophobicContact CD1-CG2 4.46Å; I662-V667 HydrophobicContact CG1-CG2 4.23Å; I662-E707 HydrophobicContact CB-CB 4.34Å; I662-E707 PolarHBondContact N-O 2.89Å; I662-E707 PolarHBondContact O-N 3.27Å; I662-I709 HydrophobicContact CD1-CD1 3.56Å; I662-I709 HydrophobicContact CD1-CG1 4.14Å
663	R	91.8	Very high	91	Very high	71 Å²	71	59.9 Å²	59.9	27%	0.268	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	121	174.9	-177.3	176.8	-62.9	162	5.7	108.4	G665 D666 I668 E701 S703 D706	R663-G665 PolarHBondContact O-N 3.23Å; R663-D666 PolarHBondContact N-O 2.94Å; R663-D666 PolarHBondContact O-N 3.06Å; R663-I668 HydrophobicContact CB-CD1 3.44Å; R663-I668 VanDerWaalsContact CB-CD1 3.44Å; R663-I668 HydrophobicContact CB-CG1 4.14Å; R663-I668 HydrophobicContact CG-CD1 4.17Å; R663-E701 PolarHBondContact NH2-O 2.6Å; R663-S703 PolarHBondContact NH2-OG 3.33Å; R663-D706 WeakPolarHBondContact CG-OD1 3.49Å; R663-D706 IonicContact CZ-OD1 3.32Å; R663-D706 IonicContact CZ-OD2 3.56Å; R663-D706 IonicContact NE-OD1 2.72Å; R663-D706 PolarHBondContact NE-OD1 2.86Å; R663-D706 IonicContact NE-OD2 3.56Å; R663-D706 IonicContact NH2-OD1 2.74Å; R663-D706 PolarHBondContact NH2-OD1 2.76Å; R663-D706 IonicContact NH2-OD2 3Å; R663-D706 PolarHBondContact NH2-OD2 3.02Å
664	Q	86	Confident	90.8	Very high	199 Å²	199	62 Å²	62	93%	0.93	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	25.1	-179.5	-59.7	-179.9	-13.3	0	0	114.5
665	G	85.9	Confident	90.6	Very high	61 Å²	61	62 Å²	62	63%	0.629	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.3	-20	-177.1	0	0	0	0	0	114.9	R663	R663-G665 PolarHBondContact O-N 3.23Å
666	D	88.3	Confident	90.7	Very high	122 Å²	122	58.7 Å²	58.7	65%	0.652	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	135.1	-178.7	-74.4	-36.5	0	0	0	112.6	I662 R663 I668	I662-D666 VanDerWaalsContact CA-O 3.29Å; I662-D666 WeakPolarHBondContact CA-O 3.48Å; R663-D666 PolarHBondContact N-O 2.94Å; R663-D666 PolarHBondContact O-N 3.06Å; D666-I668 PolarHBondContact O-N 3.02Å
667	V	91.6	Very high	90.7	Very high	74 Å²	74	55 Å²	55	45%	0.448	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	98.2	176	-176.7	0	0	0	0	110.1	K660 L661 I662 K670	K660-V667 HydrophobicContact CB-CG1 4.19Å; L661-V667 CarbonylContact O-C 3.59Å; L661-V667 WeakPolarHBondContact O-CA 3.26Å; I662-V667 HydrophobicContact CD1-CG2 4.46Å; I662-V667 HydrophobicContact CG1-CG2 4.23Å; V667-K670 HydrophobicContact CG1-CG 3.87Å
668	I	91.3	Very high	90.7	Very high	78 Å²	78	55.5 Å²	55.5	40%	0.4	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	-36.3	178.6	-67.8	-173.8	0	0	0	111.8	L661 R663 D666 I700	L661-I668 HydrophobicContact CD2-CB 4.35Å; L661-I668 HydrophobicContact CD2-CG2 4.26Å; L661-I668 PolarHBondContact O-N 3.39Å; R663-I668 HydrophobicContact CB-CD1 3.44Å; R663-I668 VanDerWaalsContact CB-CD1 3.44Å; R663-I668 HydrophobicContact CB-CG1 4.14Å; R663-I668 HydrophobicContact CG-CD1 4.17Å; D666-I668 PolarHBondContact O-N 3.02Å; I668-I700 HydrophobicContact CG2-CG2 4.44Å
669	W	91.4	Very high	90.4	Very high	19 Å²	19	59.2 Å²	59.2	7%	0.072	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	148.9	-172.7	176.2	82.5	0	0	0	112.5	F659 K660 L661 G671 S672 L673 L696 I700	F659-W669 HydrophobicContact CB-CH2 4.31Å; F659-W669 HydrophobicContact CB-CZ3 3.78Å; F659-W669 WeakPolarHBondContact O-CZ3 3.47Å; K660-W669 CarbonylContact C-O 3.49Å; K660-W669 WeakPolarHBondContact CA-O 3.36Å; K660-W669 WeakPolarHBondContact CB-O 3.49Å; L661-W669 HydrophobicContact CB-CB 4.1Å; L661-W669 HydrophobicContact CB-CE3 4.39Å; L661-W669 PolarHBondContact N-O 3.17Å; W669-G671 VanDerWaalsContact CZ2-CA 3.44Å; W669-S672 VanDerWaalsContact CH2-O 3.23Å; W669-S672 WeakPolarHBondContact CH2-O 3.36Å; W669-S672 WeakPolarHBondContact CZ2-O 3.46Å; W669-L673 HydrophobicContact CH2-CD2 4.46Å; W669-L696 HydrophobicContact CD2-CD1 3.87Å; W669-L696 HydrophobicContact CE3-CD1 3.88Å; W669-L696 HydrophobicContact CE3-CD2 4.21Å; W669-L696 HydrophobicContact CG-CD1 4.38Å; W669-L696 HydrophobicContact CH2-CB 4.38Å; W669-L696 HydrophobicContact CH2-CD1 4.43Å; W669-L696 HydrophobicContact CH2-CD2 3.73Å; W669-L696 HydrophobicContact CH2-CG 4.37Å; W669-L696 HydrophobicContact CZ2-CB 4.15Å; W669-L696 HydrophobicContact CZ2-CD1 4.41Å; W669-L696 HydrophobicContact CZ2-CD2 4.33Å; W669-L696 HydrophobicContact CZ3-CD1 4.17Å; W669-L696 HydrophobicContact CZ3-CD2 3.67Å; W669-L696 HydrophobicContact CZ3-CG 4.43Å; W669-I700 HydrophobicContact CB-CD1 3.82Å; W669-I700 HydrophobicContact CD2-CD1 4.34Å; W669-I700 HydrophobicContact CG-CD1 3.49Å; W669-I700 VanDerWaalsContact CG-CD1 3.49Å
670	K	91.3	Very high	90	Very high	106 Å²	106	69 Å²	69	46%	0.461	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	138.4	167	-63	-166.9	175.8	-170.3	0	109.4	E620 F659 K660 V667	E620-K670 IonicContact OE1-NZ 2.89Å; E620-K670 PolarHBondContact OE1-NZ 2.89Å; E620-K670 IonicContact OE2-NZ 3.86Å; F659-K670 WeakPolarHBondContact O-CA 3.36Å; K660-K670 HydrophobicContact CB-CG 4.04Å; V667-K670 HydrophobicContact CG1-CG 3.87Å
671	G	90.5	Very high	89.6	Confident	21 Å²	21	70.3 Å²	70.3	22%	0.216	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.5	-161.4	175	0	0	0	0	0	114.8	F659 W669	F659-G671 PolarHBondContact N-O 3.47Å; F659-G671 PolarHBondContact O-N 3.46Å; W669-G671 VanDerWaalsContact CZ2-CA 3.44Å
672	S	90.9	Very high	89.4	Confident	62 Å²	62	74.9 Å²	74.9	43%	0.434	40%	0.399	S	S	.	.			trans	-95.6	158.2	175.2	39.9	0	0	0	0	112.5	W669 D697	W669-S672 VanDerWaalsContact CH2-O 3.23Å; W669-S672 WeakPolarHBondContact CH2-O 3.36Å; W669-S672 WeakPolarHBondContact CZ2-O 3.46Å; S672-D697 WeakPolarHBondContact CB-OD2 3.42Å; S672-D697 VanDerWaalsContact O-OD2 3.11Å; S672-D697 PolarHBondContact OG-OD2 3.11Å
673	L	89.8	Confident	89.2	Confident	10 Å²	10	75.8 Å²	75.8	5%	0.052	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135.5	173.3	-60.8	-175.8	0	0	0	111.7	F659 W669 L676 I694 L696	F659-L673 HydrophobicContact CB-CD2 4.2Å; F659-L673 HydrophobicContact CD1-CD1 4.03Å; F659-L673 HydrophobicContact CD1-CD2 4.3Å; F659-L673 HydrophobicContact CD1-CG 4.22Å; F659-L673 HydrophobicContact CD2-CD1 3.92Å; F659-L673 HydrophobicContact CD2-CD2 4.12Å; F659-L673 HydrophobicContact CD2-CG 3.53Å; F659-L673 HydrophobicContact CE1-CD1 3.67Å; F659-L673 HydrophobicContact CE1-CG 4.29Å; F659-L673 HydrophobicContact CE2-CD1 3.57Å; F659-L673 HydrophobicContact CE2-CG 3.64Å; F659-L673 HydrophobicContact CG-CD1 4.13Å; F659-L673 HydrophobicContact CG-CD2 3.95Å; F659-L673 HydrophobicContact CG-CG 3.83Å; F659-L673 HydrophobicContact CZ-CD1 3.43Å; F659-L673 VanDerWaalsContact CZ-CD1 3.43Å; F659-L673 HydrophobicContact CZ-CG 4.03Å; W669-L673 HydrophobicContact CH2-CD2 4.46Å; L673-L676 HydrophobicContact CD1-CB 4.29Å; L673-L676 HydrophobicContact CD1-CD1 4.11Å; L673-I694 HydrophobicContact CD1-CG2 3.9Å; L673-I694 HydrophobicContact CD2-CG2 3.42Å; L673-I694 VanDerWaalsContact CD2-CG2 3.42Å; L673-I694 HydrophobicContact CG-CG2 4.26Å; L673-L696 HydrophobicContact CD2-CD2 3.51Å
674	S	88.8	Confident	89.1	Confident	44 Å²	44	78.2 Å²	78.2	31%	0.308	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-46.3	172.6	54.9	0	0	0	0	111.1	K655 S695 L696 D697	K655-S674 WeakPolarHBondContact CE-O 3.46Å; K655-S674 PolarHBondContact NZ-O 3.27Å; S674-S695 PolarHBondContact N-O 3.44Å; S674-S695 VanDerWaalsContact OG-C 3.25Å; S674-S695 WeakPolarHBondContact OG-CB 3.1Å; S674-S695 PolarHBondContact OG-O 3.02Å; S674-S695 PolarHBondContact OG-OG 3.02Å; S674-L696 WeakPolarHBondContact CB-O 3.17Å; S674-L696 PolarHBondContact OG-O 2.83Å; S674-D697 WeakPolarHBondContact CA-OD1 3.18Å; S674-D697 VanDerWaalsContact CB-OD1 3.25Å; S674-D697 WeakPolarHBondContact CB-OD1 3.26Å; S674-D697 PolarHBondContact N-OD1 2.86Å
675	S	88.7	Confident	89.4	Confident	20 Å²	20	72.3 Å²	72.3	14%	0.14	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	145.6	176.5	-174.8	0	0	0	0	111.3	K677 D682 S695	S675-K677 VanDerWaalsContact OG-CE 3.28Å; S675-K677 WeakPolarHBondContact OG-CE 3.34Å; S675-D682 PolarHBondContact OG-OD1 2.89Å; S675-S695 WeakPolarHBondContact CB-OG 3.31Å; S675-S695 PolarHBondContact N-OG 2.82Å; S675-S695 PolarHBondContact O-N 3.33Å
676	L	92.3	Very high	89.8	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	110	177	-178.8	63.5	0	0	0	106.4	K655 L673 D682 V683 I686 C692 I694	K655-L676 HydrophobicContact CB-CB 4.2Å; K655-L676 HydrophobicContact CB-CD2 3.92Å; K655-L676 HydrophobicContact CD-CB 4.15Å; K655-L676 HydrophobicContact CG-CB 4.12Å; L673-L676 HydrophobicContact CD1-CB 4.29Å; L673-L676 HydrophobicContact CD1-CD1 4.11Å; L676-D682 WeakPolarHBondContact O-CA 3.37Å; L676-V683 PolarHBondContact O-N 3.35Å; L676-I686 HydrophobicContact CD1-CD1 3.79Å; L676-I686 HydrophobicContact CD2-CD1 4.23Å; L676-I686 HydrophobicContact CD2-CG1 4.42Å; L676-I686 HydrophobicContact CG-CD1 3.8Å; L676-I686 HydrophobicContact CG-CG1 4.49Å; L676-C692 HydrophobicContact CD1-CB 4.39Å; L676-I694 HydrophobicContact CD1-CD1 4.36Å; L676-I694 HydrophobicContact CD1-CG1 3.81Å
677	K	90.9	Very high	90.1	Very high	84 Å²	84	70 Å²	70	37%	0.365	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	140.7	-171.4	-78.8	175.8	172.9	172.6	0	112	S675 A681 D682 C692 G693	S675-K677 VanDerWaalsContact OG-CE 3.28Å; S675-K677 WeakPolarHBondContact OG-CE 3.34Å; K677-A681 CarbonylContact C-O 3.54Å; K677-A681 VanDerWaalsContact CA-O 3.25Å; K677-A681 WeakPolarHBondContact CA-O 3.18Å; K677-D682 WeakPolarHBondContact CE-OD1 3.43Å; K677-D682 WeakPolarHBondContact CE-OD2 3.49Å; K677-D682 HydrophobicContact CG-CB 4.48Å; K677-D682 IonicContact NZ-OD2 3.07Å; K677-D682 PolarHBondContact NZ-OD2 2.67Å; K677-C692 CarbonylContact O-C 3.53Å; K677-C692 WeakPolarHBondContact O-CA 3.15Å; K677-G693 PolarHBondContact N-O 3.03Å; K677-G693 PolarHBondContact O-N 2.9Å
678	H	90.6	Very high	90.2	Very high	55 Å²	55	70.5 Å²	70.5	26%	0.255	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	117.9	166.7	-177.4	56.5	0	0	0	108.2	K680 A681 V683 I686 D691	H678-K680 PolarHBondContact O-N 3.35Å; H678-A681 PolarHBondContact N-O 3.17Å; H678-A681 PolarHBondContact O-N 2.9Å; H678-V683 HydrophobicContact CB-CG2 3.8Å; H678-I686 HydrophobicContact CB-CD1 4.43Å; H678-D691 PolarHBondContact CE1-O 3.27Å; H678-D691 PolarHBondContact ND1-O 3.31Å
679	H	85.9	Confident	90.1	Very high	164 Å²	164	69.3 Å²	69.3	76%	0.759	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	-85.7	-168.4	-59.2	-70.2	0	0	0	114.5
680	K	84	Confident	90	Very high	207 Å²	207	72.6 Å²	72.6	90%	0.9	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128	-6	-178.7	-67	-175.8	179	178.4	0	114	H678	H678-K680 PolarHBondContact O-N 3.35Å
681	A	85.3	Confident	90.1	Very high	54 Å²	54	70.6 Å²	70.6	45%	0.446	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	137.9	179	0	0	0	0	0	110.5	K677 H678 V683	K677-A681 CarbonylContact C-O 3.54Å; K677-A681 VanDerWaalsContact CA-O 3.25Å; K677-A681 WeakPolarHBondContact CA-O 3.18Å; H678-A681 PolarHBondContact N-O 3.17Å; H678-A681 PolarHBondContact O-N 2.9Å; A681-V683 HydrophobicContact CB-CG2 4.28Å
682	D	88.1	Confident	90.2	Very high	97 Å²	97	70 Å²	70	52%	0.519	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	127.7	160.8	-80.7	-82	0	0	0	108.2	S675 L676 K677	S675-D682 PolarHBondContact OG-OD1 2.89Å; L676-D682 WeakPolarHBondContact O-CA 3.37Å; K677-D682 WeakPolarHBondContact CE-OD1 3.43Å; K677-D682 WeakPolarHBondContact CE-OD2 3.49Å; K677-D682 HydrophobicContact CG-CB 4.48Å; K677-D682 IonicContact NZ-OD2 3.07Å; K677-D682 PolarHBondContact NZ-OD2 2.67Å
683	V	89.9	Confident	90.2	Very high	44 Å²	44	67.9 Å²	67.9	27%	0.267	36%	0.364	S	S	.	.			trans	-125	139.5	-176.2	-177.2	0	0	0	0	109.1	L676 H678 A681 I685 I686	L676-V683 PolarHBondContact O-N 3.35Å; H678-V683 HydrophobicContact CB-CG2 3.8Å; A681-V683 HydrophobicContact CB-CG2 4.28Å; V683-I685 VanDerWaalsContact CG1-O 3.23Å; V683-I685 WeakPolarHBondContact CG1-O 3.42Å; V683-I686 HydrophobicContact CB-CG1 4.33Å; V683-I686 HydrophobicContact CG1-CG1 4.1Å
684	Q	90.4	Very high	90.3	Very high	121 Å²	121	67.4 Å²	67.4	57%	0.565	36%	0.361	S	S	*	.	S	Bend	trans	-78.2	-44.5	178.1	-66.3	-171.5	17.1	0	0	112.3	D654 K655	D654-Q684 CarbonylContact C-O 3.57Å; D654-Q684 VanDerWaalsContact CA-O 3.32Å; D654-Q684 WeakPolarHBondContact CA-O 3.47Å; K655-Q684 PolarHBondContact N-O 3.28Å
685	I	92.6	Very high	90.3	Very high	75 Å²	75	65.8 Å²	65.8	39%	0.385	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.9	-174.8	-55.6	173.8	0	0	0	110.2	Q652 L653 D654 V683	Q652-I685 HydrophobicContact CB-CG2 4.25Å; Q652-I685 HydrophobicContact CG-CG2 4.42Å; L653-I685 CarbonylContact O-C 3.57Å; L653-I685 VanDerWaalsContact O-CA 3.31Å; L653-I685 WeakPolarHBondContact O-CA 3.38Å; D654-I685 HydrophobicContact CB-CG1 4.29Å; V683-I685 VanDerWaalsContact CG1-O 3.23Å; V683-I685 WeakPolarHBondContact CG1-O 3.42Å
686	I	93.5	Very high	90.3	Very high	2 Å²	2	65.5 Å²	65.5	1%	0.01	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.3	176.4	-59.3	-179.5	0	0	0	109	V648 Q652 L653 L676 H678 V683 M690 C692	V648-I686 HydrophobicContact CG2-CG2 3.84Å; Q652-I686 CarbonylContact C-O 3.55Å; Q652-I686 VanDerWaalsContact CA-O 3.26Å; Q652-I686 WeakPolarHBondContact CA-O 3.3Å; Q652-I686 WeakPolarHBondContact CB-O 3.49Å; L653-I686 PolarHBondContact N-O 3.06Å; L653-I686 PolarHBondContact O-N 3.06Å; L676-I686 HydrophobicContact CD1-CD1 3.79Å; L676-I686 HydrophobicContact CD2-CD1 4.23Å; L676-I686 HydrophobicContact CD2-CG1 4.42Å; L676-I686 HydrophobicContact CG-CD1 3.8Å; L676-I686 HydrophobicContact CG-CG1 4.49Å; H678-I686 HydrophobicContact CB-CD1 4.43Å; V683-I686 HydrophobicContact CB-CG1 4.33Å; V683-I686 HydrophobicContact CG1-CG1 4.1Å; I686-M690 HydrophobicContact CG2-CB 3.67Å; I686-C692 HydrophobicContact CD1-CB 3.29Å; I686-C692 HydrophobicContact CG2-CB 4.28Å
687	K	93.4	Very high	89.6	Confident	134 Å²	134	69.9 Å²	69.9	58%	0.583	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	164.3	-174.6	-62.4	-175.5	179.2	-175.6	0	112	M690	K687-M690 HydrophobicContact CB-SD 4.34Å; K687-M690 WeakPolarHBondContact O-CB 3.49Å; K687-M690 PolarHBondContact O-N 3.37Å
688	T	94.3	Very high	88.8	Confident	84 Å²	84	72.4 Å²	72.4	52%	0.515	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.5	136.4	173.2	-28	0	0	0	0	113	Q649 G651 M690	Q649-T688 WeakPolarHBondContact O-CG2 3.46Å; G651-T688 PolarHBondContact O-N 3.08Å; G651-T688 PolarHBondContact O-OG1 3.13Å; T688-M690 VanDerWaalsContact C-N 3.26Å; T688-M690 PolarHBondContact O-N 3.42Å
689	G	88.6	Confident	87.8	Confident	53 Å²	53	76.7 Å²	76.7	55%	0.546	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	-6.4	177.2	0	0	0	0	0	115.6	V648	V648-G689 PolarHBondContact O-N 2.88Å
690	M	90.9	Very high	87.7	Confident	87 Å²	87	70.5 Å²	70.5	43%	0.429	38%	0.378	S	S	.	.			trans	-86.5	144.8	174.5	-66.8	-179.3	162.7	0	0	112	V648 I686 K687 T688	V648-M690 PolarHBondContact N-O 3.25Å; I686-M690 HydrophobicContact CG2-CB 3.67Å; K687-M690 HydrophobicContact CB-SD 4.34Å; K687-M690 WeakPolarHBondContact O-CB 3.49Å; K687-M690 PolarHBondContact O-N 3.37Å; T688-M690 VanDerWaalsContact C-N 3.26Å; T688-M690 PolarHBondContact O-N 3.42Å
691	D	93	Very high	87.6	Confident	65 Å²	65	68.6 Å²	68.6	35%	0.348	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	145.4	172.8	-67.3	-29.4	0	0	0	111.2	C646 R647 H678	C646-D691 CarbonylContact O-C 3.57Å; C646-D691 WeakPolarHBondContact O-CA 3.44Å; R647-D691 IonicContact CZ-OD1 3.46Å; R647-D691 IonicContact CZ-OD2 2.65Å; R647-D691 IonicContact NE-OD1 2.88Å; R647-D691 PolarHBondContact NE-OD1 3.27Å; R647-D691 VanDerWaalsContact NH2-CG 3.27Å; R647-D691 IonicContact NH2-OD1 2.97Å; R647-D691 PolarHBondContact NH2-OD1 3.46Å; R647-D691 IonicContact NH2-OD2 2.68Å; R647-D691 PolarHBondContact NH2-OD2 3.37Å; H678-D691 PolarHBondContact CE1-O 3.27Å; H678-D691 PolarHBondContact ND1-O 3.31Å
692	C	91.4	Very high	87.7	Confident	7 Å²	7	66.9 Å²	66.9	5%	0.047	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	145.9	-179.4	59.7	0	0	0	0	113.2	C646 L676 K677 I686	C646-C692 PolarHBondContact N-O 3.33Å; C646-C692 PolarHBondContact O-N 2.63Å; L676-C692 HydrophobicContact CD1-CB 4.39Å; K677-C692 CarbonylContact O-C 3.53Å; K677-C692 WeakPolarHBondContact O-CA 3.15Å; I686-C692 HydrophobicContact CD1-CB 3.29Å; I686-C692 HydrophobicContact CG2-CB 4.28Å
693	G	91.9	Very high	87.7	Confident	19 Å²	19	64.6 Å²	64.6	20%	0.196	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	119.2	167.1	0	0	0	0	0	109.6	A644 K677	A644-G693 CarbonylContact O-C 3.58Å; A644-G693 WeakPolarHBondContact O-CA 3.26Å; K677-G693 PolarHBondContact N-O 3.03Å; K677-G693 PolarHBondContact O-N 2.9Å
694	I	91.3	Very high	87.7	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.3	-179.1	-58.2	-172.8	0	0	0	109.3	V643 A644 C646 L653 L673 L676 L696 I708	V643-I694 CarbonylContact C-O 3.3Å; V643-I694 WeakPolarHBondContact CA-O 3.41Å; A644-I694 PolarHBondContact N-O 2.94Å; A644-I694 PolarHBondContact O-N 3.31Å; C646-I694 HydrophobicContact CB-CD1 4.09Å; L653-I694 HydrophobicContact CD1-CD1 3.81Å; L673-I694 HydrophobicContact CD1-CG2 3.9Å; L673-I694 HydrophobicContact CD2-CG2 3.42Å; L673-I694 VanDerWaalsContact CD2-CG2 3.42Å; L673-I694 HydrophobicContact CG-CG2 4.26Å; L676-I694 HydrophobicContact CD1-CD1 4.36Å; L676-I694 HydrophobicContact CD1-CG1 3.81Å; I694-L696 HydrophobicContact CG2-CD2 4.19Å; I694-I708 HydrophobicContact CD1-CD1 4.05Å; I694-I708 HydrophobicContact CD1-CG2 4.3Å; I694-I708 HydrophobicContact CG2-CD1 4.38Å
695	S	89.1	Confident	87.6	Confident	9 Å²	9	64.3 Å²	64.3	6%	0.063	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.8	167.2	65.6	0	0	0	0	111	S674 S675	S674-S695 PolarHBondContact N-O 3.44Å; S674-S695 VanDerWaalsContact OG-C 3.25Å; S674-S695 WeakPolarHBondContact OG-CB 3.1Å; S674-S695 PolarHBondContact OG-O 3.02Å; S674-S695 PolarHBondContact OG-OG 3.02Å; S675-S695 WeakPolarHBondContact CB-OG 3.31Å; S675-S695 PolarHBondContact N-OG 2.82Å; S675-S695 PolarHBondContact O-N 3.33Å
696	L	88	Confident	87.6	Confident	14 Å²	14	60.9 Å²	60.9	7%	0.073	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	168.8	179.2	-49.8	-173.3	0	0	0	111	W669 L673 S674 I694 K698 I700 F702	W669-L696 HydrophobicContact CD2-CD1 3.87Å; W669-L696 HydrophobicContact CE3-CD1 3.88Å; W669-L696 HydrophobicContact CE3-CD2 4.21Å; W669-L696 HydrophobicContact CG-CD1 4.38Å; W669-L696 HydrophobicContact CH2-CB 4.38Å; W669-L696 HydrophobicContact CH2-CD1 4.43Å; W669-L696 HydrophobicContact CH2-CD2 3.73Å; W669-L696 HydrophobicContact CH2-CG 4.37Å; W669-L696 HydrophobicContact CZ2-CB 4.15Å; W669-L696 HydrophobicContact CZ2-CD1 4.41Å; W669-L696 HydrophobicContact CZ2-CD2 4.33Å; W669-L696 HydrophobicContact CZ3-CD1 4.17Å; W669-L696 HydrophobicContact CZ3-CD2 3.67Å; W669-L696 HydrophobicContact CZ3-CG 4.43Å; L673-L696 HydrophobicContact CD2-CD2 3.51Å; S674-L696 WeakPolarHBondContact CB-O 3.17Å; S674-L696 PolarHBondContact OG-O 2.83Å; I694-L696 HydrophobicContact CG2-CD2 4.19Å; L696-K698 VanDerWaalsContact C-N 3.28Å; L696-I700 HydrophobicContact CD1-CB 4.28Å; L696-I700 HydrophobicContact CD1-CD1 4.19Å; L696-F702 HydrophobicContact CD1-CE1 3.9Å; L696-F702 HydrophobicContact CD1-CZ 4.07Å; L696-F702 HydrophobicContact CD2-CE1 4.25Å; L696-F702 HydrophobicContact CD2-CZ 4.16Å; L696-F702 HydrophobicContact CG-CE1 3.92Å; L696-F702 HydrophobicContact CG-CZ 3.65Å
697	D	79.1	Confident	87.6	Confident	93 Å²	93	65.5 Å²	65.5	50%	0.497	37%	0.368	S	S	.	.	S	Bend	trans	-79	-7.9	172.3	-71	-37.3	0	0	0	113.5	S672 S674	S672-D697 WeakPolarHBondContact CB-OD2 3.42Å; S672-D697 VanDerWaalsContact O-OD2 3.11Å; S672-D697 PolarHBondContact OG-OD2 3.11Å; S674-D697 WeakPolarHBondContact CA-OD1 3.18Å; S674-D697 VanDerWaalsContact CB-OD1 3.25Å; S674-D697 WeakPolarHBondContact CB-OD1 3.26Å; S674-D697 PolarHBondContact N-OD1 2.86Å
698	K	73.1	Confident	87.5	Confident	137 Å²	137	59.3 Å²	59.3	60%	0.596	34%	0.341	S	S	*	.	S	Bend	trans	-124	144.6	177.8	-69.4	-176.6	179.7	176.8	0	110.4	L696 I700	L696-K698 VanDerWaalsContact C-N 3.28Å; K698-I700 HydrophobicContact CB-CD1 3.89Å; K698-I700 HydrophobicContact CB-CG1 4.01Å; K698-I700 PolarHBondContact O-N 3.01Å
699	D	71.1	Confident	87.5	Confident	145 Å²	145	56.2 Å²	56.2	78%	0.775	32%	0.321	S	S	*	.			trans	-68.1	92.7	170.4	-67.7	-41	0	0	0	109.7
700	I	81.8	Confident	87.8	Confident	33 Å²	33	53.7 Å²	53.7	17%	0.169	30%	0.295	C	S	.	.			trans	-122.5	134.2	179.2	-67.2	170.7	0	0	0	107.8	L661 I668 W669 L696 K698 F702	L661-I700 HydrophobicContact CD2-CG2 4.1Å; I668-I700 HydrophobicContact CG2-CG2 4.44Å; W669-I700 HydrophobicContact CB-CD1 3.82Å; W669-I700 HydrophobicContact CD2-CD1 4.34Å; W669-I700 HydrophobicContact CG-CD1 3.49Å; W669-I700 VanDerWaalsContact CG-CD1 3.49Å; L696-I700 HydrophobicContact CD1-CB 4.28Å; L696-I700 HydrophobicContact CD1-CD1 4.19Å; K698-I700 HydrophobicContact CB-CD1 3.89Å; K698-I700 HydrophobicContact CB-CG1 4.01Å; K698-I700 PolarHBondContact O-N 3.01Å; I700-F702 PolarHBondContact O-N 2.9Å
701	E	82.6	Confident	87.9	Confident	168 Å²	168	49.7 Å²	49.7	79%	0.785	28%	0.276	S	S	*	.			trans	-77.3	108.6	177.4	-66	-177	168.7	0	0	110.1	R663	R663-E701 PolarHBondContact NH2-O 2.6Å
702	F	87.6	Confident	87.9	Confident	18 Å²	18	49.6 Å²	49.6	8%	0.079	27%	0.273	C	S	.	.			trans	-68.2	151.5	166.4	-58.3	-75.5	0	0	0	110.7	T631 P642 A644 L661 L696 I700 I708	T631-F702 HydrophobicContact CG2-CB 3.64Å; P642-F702 HydrophobicContact CB-CD2 4.17Å; P642-F702 HydrophobicContact CB-CE2 4.14Å; A644-F702 HydrophobicContact CB-CB 4.38Å; A644-F702 HydrophobicContact CB-CD1 3.67Å; A644-F702 HydrophobicContact CB-CD2 3.88Å; A644-F702 HydrophobicContact CB-CE1 3.65Å; A644-F702 HydrophobicContact CB-CE2 3.87Å; A644-F702 HydrophobicContact CB-CG 3.75Å; A644-F702 HydrophobicContact CB-CZ 3.71Å; L661-F702 HydrophobicContact CD1-CD1 4.32Å; L661-F702 HydrophobicContact CD2-CD1 4.5Å; L696-F702 HydrophobicContact CD1-CE1 3.9Å; L696-F702 HydrophobicContact CD1-CZ 4.07Å; L696-F702 HydrophobicContact CD2-CE1 4.25Å; L696-F702 HydrophobicContact CD2-CZ 4.16Å; L696-F702 HydrophobicContact CG-CE1 3.92Å; L696-F702 HydrophobicContact CG-CZ 3.65Å; I700-F702 PolarHBondContact O-N 2.9Å; F702-I708 HydrophobicContact CE1-CD1 4.25Å
703	S	87.9	Confident	87.8	Confident	49 Å²	49	53 Å²	53	34%	0.343	29%	0.288	S	S	.	.			trans	-128.6	149.5	171.1	-67.3	0	0	0	0	110.2	R663 G705 D706	R663-S703 PolarHBondContact NH2-OG 3.33Å; S703-G705 PolarHBondContact O-N 3.05Å; S703-D706 PolarHBondContact N-OD2 2.74Å; S703-D706 WeakPolarHBondContact O-CB 3.21Å; S703-D706 VanDerWaalsContact O-CG 3.25Å; S703-D706 PolarHBondContact O-N 2.83Å; S703-D706 VanDerWaalsContact O-N 3.12Å
704	V	90.3	Very high	87.5	Confident	101 Å²	101	56.8 Å²	56.8	61%	0.612	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	128.3	174.5	177.7	0	0	0	0	108.8	L629	L629-V704 WeakPolarHBondContact O-CG1 3.21Å
705	G	87.7	Confident	87.3	Confident	58 Å²	58	64 Å²	64	60%	0.598	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	92	2.2	-173.1	0	0	0	0	0	115.2	V628 S703	V628-G705 PolarHBondContact O-N 2.81Å; S703-G705 PolarHBondContact O-N 3.05Å
706	D	92.9	Very high	87.2	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.011	35%	0.35	C	S	.	.			trans	-66	148.9	166.9	-72.9	-14.9	0	0	0	111.3	V628 L661 R663 S703	V628-D706 HydrophobicContact CB-CB 4.11Å; V628-D706 HydrophobicContact CG2-CB 3.77Å; V628-D706 PolarHBondContact N-O 3.4Å; L661-D706 HydrophobicContact CD1-CB 3.87Å; R663-D706 WeakPolarHBondContact CG-OD1 3.49Å; R663-D706 IonicContact CZ-OD1 3.32Å; R663-D706 IonicContact CZ-OD2 3.56Å; R663-D706 IonicContact NE-OD1 2.72Å; R663-D706 PolarHBondContact NE-OD1 2.86Å; R663-D706 IonicContact NE-OD2 3.56Å; R663-D706 IonicContact NH2-OD1 2.74Å; R663-D706 PolarHBondContact NH2-OD1 2.76Å; R663-D706 IonicContact NH2-OD2 3Å; R663-D706 PolarHBondContact NH2-OD2 3.02Å; S703-D706 PolarHBondContact N-OD2 2.74Å; S703-D706 WeakPolarHBondContact O-CB 3.21Å; S703-D706 VanDerWaalsContact O-CG 3.25Å; S703-D706 PolarHBondContact O-N 2.83Å; S703-D706 VanDerWaalsContact O-N 3.12Å
707	E	92.9	Very high	86.9	Confident	99 Å²	99	74.6 Å²	74.6	46%	0.463	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	134.6	174.4	-68.3	-178	175.9	0	0	110.9	I662	I662-E707 HydrophobicContact CB-CB 4.34Å; I662-E707 PolarHBondContact N-O 2.89Å; I662-E707 PolarHBondContact O-N 3.27Å
708	I	92.8	Very high	86.9	Confident	4 Å²	4	73.9 Å²	73.9	2%	0.021	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	116.4	175.8	-65.7	176.1	0	0	0	108	A626 V628 F659 K660 L661 I694 F702	A626-I708 PolarHBondContact N-O 2.88Å; A626-I708 PolarHBondContact O-N 2.9Å; V628-I708 HydrophobicContact CG2-CD1 3.9Å; V628-I708 HydrophobicContact CG2-CG1 4.22Å; F659-I708 HydrophobicContact CD1-CG2 3.84Å; K660-I708 WeakPolarHBondContact O-CA 3.26Å; L661-I708 HydrophobicContact CD1-CD1 4.14Å; L661-I708 HydrophobicContact CD1-CG1 3.53Å; I694-I708 HydrophobicContact CD1-CD1 4.05Å; I694-I708 HydrophobicContact CD1-CG2 4.3Å; I694-I708 HydrophobicContact CG2-CD1 4.38Å; F702-I708 HydrophobicContact CE1-CD1 4.25Å
709	I	94	Very high	87.4	Confident	19 Å²	19	72.4 Å²	72.4	10%	0.097	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	122.6	177.7	-55.8	-169.7	0	0	0	109.3	T622 E625 F659 K660 I662	T622-I709 HydrophobicContact CG2-CG2 3.51Å; E625-I709 HydrophobicContact CG-CG1 4.39Å; F659-I709 CarbonylContact C-O 3.59Å; F659-I709 WeakPolarHBondContact CA-O 3.37Å; K660-I709 HydrophobicContact CG-CB 3.84Å; K660-I709 PolarHBondContact N-O 2.86Å; K660-I709 PolarHBondContact O-N 3.14Å; I662-I709 HydrophobicContact CD1-CD1 3.56Å; I662-I709 HydrophobicContact CD1-CG1 4.14Å
710	C	93.5	Very high	87.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	126.4	169.3	-174.9	0	0	0	0	109.1	I623 G624 L653 K658 F659	I623-C710 PolarHBondContact N-O 2.69Å; G624-C710 PolarHBondContact N-O 2.91Å; G624-C710 PolarHBondContact O-N 3.3Å; L653-C710 HydrophobicContact CD2-CB 3.62Å; K658-C710 WeakPolarHBondContact O-CA 3.35Å; F659-C710 HydrophobicContact CD1-CB 3.92Å; F659-C710 HydrophobicContact CE1-CB 3.55Å; F659-C710 HydrophobicContact CZ-CB 4.06Å; F659-C710 VanDerWaalsContact CZ-SG 3.53Å
711	Y	93.7	Very high	88.1	Confident	4 Å²	4	67.7 Å²	67.7	2%	0.016	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	148.6	-179.2	68	-84.2	0	0	0	112.3	E620 N621 K658 K660 E713	E620-Y711 HydrophobicContact CB-CD2 3.88Å; E620-Y711 HydrophobicContact CB-CE2 4.47Å; E620-Y711 HydrophobicContact CB-CG 4.44Å; E620-Y711 HydrophobicContact CG-CD2 3.66Å; E620-Y711 HydrophobicContact CG-CE2 3.74Å; N621-Y711 CarbonylContact O-C 3.59Å; N621-Y711 WeakPolarHBondContact O-CA 3.11Å; N621-Y711 WeakPolarHBondContact O-CB 3.44Å; K658-Y711 HydrophobicContact CB-CD1 4.42Å; K658-Y711 HydrophobicContact CB-CD2 4.22Å; K658-Y711 HydrophobicContact CB-CE1 3.95Å; K658-Y711 HydrophobicContact CB-CE2 3.75Å; K658-Y711 HydrophobicContact CD-CE2 4.27Å; K658-Y711 PolarHBondContact N-O 2.97Å; K658-Y711 VanDerWaalsContact N-O 3.07Å; K658-Y711 PolarHBondContact O-N 2.77Å; K658-Y711 VanDerWaalsContact O-O 3.11Å; K660-Y711 HydrophobicContact CB-CD1 4.38Å; K660-Y711 HydrophobicContact CB-CE1 3.82Å; K660-Y711 HydrophobicContact CD-CD1 3.99Å; K660-Y711 HydrophobicContact CD-CE1 3.96Å; K660-Y711 HydrophobicContact CG-CD1 3.92Å; K660-Y711 HydrophobicContact CG-CE1 3.86Å; Y711-E713 HydrophobicContact CD2-CG 4.19Å; Y711-E713 HydrophobicContact CE2-CG 3.84Å
712	E	92.6	Very high	88.3	Confident	63 Å²	63	59.7 Å²	59.7	29%	0.294	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	128	170.1	172.5	177.8	-126.4	0	0	108.7	N621 I623 M657 K714	N621-E712 PolarHBondContact N-O 2.73Å; N621-E712 PolarHBondContact O-N 3.24Å; I623-E712 HydrophobicContact CD1-CB 3.5Å; I623-E712 HydrophobicContact CG1-CB 4.23Å; M657-E712 HydrophobicContact CE-CB 4.46Å; M657-E712 HydrophobicContact CE-CG 4.45Å; M657-E712 HydrophobicContact SD-CB 3.89Å; M657-E712 HydrophobicContact SD-CG 4.14Å; E712-K714 HydrophobicContact CG-CG 4.07Å; E712-K714 PolarHBondContact O-N 2.74Å; E712-K714 WeakPolarHBondContact OE2-CE 3.4Å; E712-K714 IonicContact OE2-NZ 3.45Å; E712-K714 PolarHBondContact OE2-NZ 2.94Å
713	E	89.4	Confident	88.1	Confident	77 Å²	77	64.5 Å²	64.5	36%	0.36	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	112.8	168.9	-77.3	176.2	-160.8	0	0	108.2	V618 K658 Y711	V618-E713 HydrophobicContact CG1-CB 3.56Å; V618-E713 HydrophobicContact CG1-CG 3.54Å; K658-E713 VanDerWaalsContact CD-CD 3.46Å; K658-E713 HydrophobicContact CD-CG 4.14Å; K658-E713 WeakPolarHBondContact CD-OE1 3.39Å; K658-E713 WeakPolarHBondContact CE-OE1 3.05Å; K658-E713 IonicContact NZ-OE1 2.72Å; K658-E713 PolarHBondContact NZ-OE1 2.77Å; K658-E713 IonicContact NZ-OE2 3.7Å; K658-E713 PolarHBondContact NZ-OE2 2.86Å; Y711-E713 HydrophobicContact CD2-CG 4.19Å; Y711-E713 HydrophobicContact CE2-CG 3.84Å
714	K	87	Confident	87.5	Confident	100 Å²	100	63.2 Å²	63.2	44%	0.435	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	127.2	169.5	-65.5	-168.4	-174	174.1	0	109.6	V619 N621 E712 V716	V619-K714 PolarHBondContact N-O 2.86Å; V619-K714 PolarHBondContact O-N 2.87Å; N621-K714 WeakPolarHBondContact ND2-CD 3.37Å; N621-K714 WeakPolarHBondContact ND2-CG 3.45Å; E712-K714 HydrophobicContact CG-CG 4.07Å; E712-K714 PolarHBondContact O-N 2.74Å; E712-K714 WeakPolarHBondContact OE2-CE 3.4Å; E712-K714 IonicContact OE2-NZ 3.45Å; E712-K714 PolarHBondContact OE2-NZ 2.94Å; K714-V716 PolarHBondContact O-N 3.26Å
715	E	86.6	Confident	86.5	Confident	152 Å²	152	61.6 Å²	61.6	71%	0.71	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	115.6	167.7	-70.9	179.6	-169.8	0	0	108.8	P616 S617	P616-E715 HydrophobicContact CB-CB 4.01Å; P616-E715 HydrophobicContact CB-CG 4.35Å; P616-E715 HydrophobicContact CG-CB 4.48Å; P616-E715 HydrophobicContact CG-CG 4.36Å; S617-E715 WeakPolarHBondContact O-CA 3.22Å
716	V	85.8	Confident	85.4	Confident	68 Å²	68	63.4 Å²	63.4	41%	0.412	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.8	174.9	-177.8	0	0	0	0	107.6	S617 V619 K714 Q718	S617-V716 PolarHBondContact N-O 2.89Å; S617-V716 PolarHBondContact O-N 3.49Å; S617-V716 PolarHBondContact OG-O 3.39Å; V619-V716 HydrophobicContact CB-CG2 4.23Å; V619-V716 HydrophobicContact CG2-CB 4.19Å; V619-V716 HydrophobicContact CG2-CG2 3.77Å; K714-V716 PolarHBondContact O-N 3.26Å; V716-Q718 PolarHBondContact O-N 2.99Å
717	Q	81.6	Confident	85	Confident	177 Å²	177	66.5 Å²	66.5	83%	0.827	36%	0.355	S	S	*	.			trans	-59.9	131.2	176.7	-70.8	-177.8	-20.6	0	0	110
718	Q	80.8	Confident	84.6	Confident	77 Å²	77	64.8 Å²	64.8	36%	0.36	35%	0.349	S	S	.	.			trans	-78.7	147.2	173.4	-65.7	-173.1	-47.4	0	0	110.2	L614 P615 V716	L614-Q718 HydrophobicContact CB-CB 4.1Å; L614-Q718 HydrophobicContact CD1-CB 3.75Å; P615-Q718 PolarHBondContact O-OE1 3.14Å; V716-Q718 PolarHBondContact O-N 2.99Å
719	T	83.9	Confident	84.1	Confident	107 Å²	107	68.2 Å²	68.2	66%	0.656	37%	0.367	S	S	*	.			trans	-108.7	135.5	164.9	51.8	0	0	0	0	108
720	T	80.1	Confident	83.6	Confident	7 Å²	7	71.1 Å²	71.1	4%	0.043	38%	0.383	C	S	.	.			trans	-52.1	137.9	170.4	37.2	0	0	0	0	111.4	E543 L610 N611 L614 W722	E543-T720 WeakPolarHBondContact OE2-CA 3.33Å; L610-T720 HydrophobicContact CB-CG2 3.86Å; L610-T720 HydrophobicContact CD1-CG2 4.46Å; N611-T720 WeakPolarHBondContact OD1-CB 3.4Å; N611-T720 PolarHBondContact OD1-N 3.37Å; N611-T720 PolarHBondContact OD1-OG1 3.48Å; L614-T720 HydrophobicContact CD1-CG2 3.93Å; T720-W722 VanDerWaalsContact C-N 3.26Å
721	S	85.6	Confident	82.9	Confident	72 Å²	72	75.5 Å²	75.5	50%	0.503	41%	0.407	S	S	.	.	S	Bend	trans	-67.2	-26.3	172.1	43.6	0	0	0	0	113	A540 E543 D723	A540-S721 WeakPolarHBondContact CB-OG 2.95Å; E543-S721 VanDerWaalsContact CD-OG 3.31Å; E543-S721 WeakPolarHBondContact OE1-CB 3.49Å; E543-S721 PolarHBondContact OE1-OG 2.95Å; E543-S721 PolarHBondContact OE2-N 3.07Å; S721-D723 PolarHBondContact O-N 3.26Å
722	W	87	Confident	82.2	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	43%	0.433	C	S	.	.			trans	-51.9	124.5	178.9	176.5	54.6	0	0	0	113.4	I534 S537 Y538 A540 I603 V606 K607 L610 T720 P724	I534-W722 HydrophobicContact CG2-CH2 4.33Å; I534-W722 HydrophobicContact CG2-CZ2 3.98Å; S537-W722 PolarHBondContact O-NE1 2.89Å; Y538-W722 HydrophobicContact CD2-CB 3.81Å; Y538-W722 AromaticContact CD2-CD1 3.87Å; Y538-W722 AromaticContact CD2-CD2 3.61Å; Y538-W722 HydrophobicContact CD2-CD2 3.61Å; Y538-W722 HydrophobicContact CD2-CE3 4.06Å; Y538-W722 AromaticContact CD2-CG 3.5Å; Y538-W722 HydrophobicContact CD2-CG 3.5Å; Y538-W722 VanDerWaalsContact CD2-CG 3.5Å; Y538-W722 HydrophobicContact CE2-CB 3.68Å; Y538-W722 HydrophobicContact CE2-CD2 4.14Å; Y538-W722 HydrophobicContact CE2-CE3 4.33Å; Y538-W722 AromaticContact CE2-CG 3.9Å; Y538-W722 HydrophobicContact CE2-CG 3.9Å; A540-W722 HydrophobicContact CB-CB 4.45Å; I603-W722 HydrophobicContact CG2-CH2 3.79Å; I603-W722 HydrophobicContact CG2-CZ3 4.27Å; V606-W722 HydrophobicContact CG1-CZ3 4.41Å; K607-W722 HydrophobicContact CB-CE3 4.46Å; K607-W722 HydrophobicContact CB-CZ3 4.24Å; K607-W722 HydrophobicContact CD-CE3 4.48Å; K607-W722 WeakPolarHBondContact CE-O 3.41Å; K607-W722 PolarHBondContact NZ-O 2.98Å; L610-W722 HydrophobicContact CD1-CE3 4.08Å; L610-W722 HydrophobicContact CD1-CZ3 4.2Å; T720-W722 VanDerWaalsContact C-N 3.26Å; W722-P724 HydrophobicContact CH2-CB 4.39Å; W722-P724 HydrophobicContact CZ2-CB 3.79Å
723	D	84.1	Confident	81.5	Confident	119 Å²	119	81.5 Å²	81.5	64%	0.636	44%	0.443	S	S	*	.			trans	-120.9	117.8	169.6	-164.4	17.1	0	0	0	108.4	S721 G725	S721-D723 PolarHBondContact O-N 3.26Å; D723-G725 PolarHBondContact O-N 3.01Å
724	P	75.9	Confident	80.9	Confident	21 Å²	21	81.8 Å²	81.8	14%	0.136	45%	0.449	C	S	.	.			trans	-70.8	-2.3	-170.5	29.6	-37.8	0	0	0	114.7	I534 I603 W722 F726	I534-P724 HydrophobicContact CG2-CB 3.97Å; I603-P724 HydrophobicContact CG2-CB 4.29Å; I603-P724 HydrophobicContact CG2-CG 4.11Å; W722-P724 HydrophobicContact CH2-CB 4.39Å; W722-P724 HydrophobicContact CZ2-CB 3.79Å; P724-F726 HydrophobicContact CB-CD1 4.06Å; P724-F726 HydrophobicContact CB-CE1 3.6Å; P724-F726 HydrophobicContact CB-CZ 4.01Å; P724-F726 HydrophobicContact CG-CD1 4.44Å; P724-F726 HydrophobicContact CG-CE1 4.01Å; P724-F726 HydrophobicContact CG-CE2 4.36Å; P724-F726 HydrophobicContact CG-CZ 3.96Å
725	G	68	Low	80.4	Confident	68 Å²	68	80.3 Å²	80.3	70%	0.701	45%	0.451	S	S	*	.			trans	79.5	27.9	169.8	0	0	0	0	0	115.2	D723	D723-G725 PolarHBondContact O-N 3.01Å
726	F	65.1	Low	79.8	Confident	96 Å²	96	73.8 Å²	73.8	42%	0.421	43%	0.427	S	S	.	.			trans	-147.9	0	177.3	63.6	-111.7	0	0	0	113	H238 A239 I534 Y600 I603 P724	H238-F726 AromaticContact CE1-CD2 3.38Å; H238-F726 WeakPolarHBondContact CE1-CD2 3.34Å; H238-F726 AromaticContact CE1-CE2 3.97Å; H238-F726 AromaticContact CE1-CG 3.45Å; H238-F726 VanDerWaalsContact CE1-CG 3.45Å; H238-F726 WeakPolarHBondContact CE1-CG 2.85Å; H238-F726 WeakPolarHBondContact NE2-CB 3.38Å; H238-F726 AromaticContact NE2-CD2 3.47Å; H238-F726 WeakPolarHBondContact NE2-CD2 3.21Å; H238-F726 AromaticContact NE2-CG 3.57Å; A239-F726 HydrophobicContact CB-CB 3.88Å; I534-F726 HydrophobicContact CB-CE1 4.44Å; I534-F726 HydrophobicContact CD1-CE1 3.69Å; I534-F726 HydrophobicContact CD1-CZ 4.13Å; I534-F726 HydrophobicContact CG1-CE1 3.79Å; I534-F726 HydrophobicContact CG2-CE1 3.77Å; I534-F726 HydrophobicContact CG2-CZ 4.36Å; Y600-F726 HydrophobicContact CD1-CD2 4.02Å; Y600-F726 AromaticContact CD1-CE2 3.69Å; Y600-F726 HydrophobicContact CD1-CE2 3.69Å; Y600-F726 AromaticContact CE1-CD2 3.98Å; Y600-F726 HydrophobicContact CE1-CD2 3.98Å; Y600-F726 HydrophobicContact CE1-CE2 4.1Å; I603-F726 HydrophobicContact CB-CZ 4.24Å; I603-F726 HydrophobicContact CG1-CZ 4.15Å; I603-F726 HydrophobicContact CG2-CZ 4.03Å; P724-F726 HydrophobicContact CB-CD1 4.06Å; P724-F726 HydrophobicContact CB-CE1 3.6Å; P724-F726 HydrophobicContact CB-CZ 4.01Å; P724-F726 HydrophobicContact CG-CD1 4.44Å; P724-F726 HydrophobicContact CG-CE1 4.01Å; P724-F726 HydrophobicContact CG-CE2 4.36Å; P724-F726 HydrophobicContact CG-CZ 3.96Å

Retrieved 726 of 726 residues in 1371.6 ms (Link to these results)

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