A0A077YXZ2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YXZ2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 581 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	31	Very low	238 Å²	238	142.5 Å²	142.5	100%	1.172	76%	0.762	S	S	*	*				0	124.3	0	-70.6	-167.4	-41.6	0	0	107
2	A	32.5	Very low	30.8	Very low	85 Å²	85	139.5 Å²	139.5	70%	0.702	76%	0.76	S	S	*	*			trans	54.4	138	161.1	0	0	0	0	0	118
3	E	31.6	Very low	30.5	Very low	169 Å²	169	134.2 Å²	134.2	79%	0.79	76%	0.757	S	S	*	*			cis	-175.5	120.2	-0.1	-109.1	156.2	-174.9	0	0	100.8
4	T	29.9	Very low	30.3	Very low	111 Å²	111	139.4 Å²	139.4	68%	0.681	77%	0.768	S	S	*	*				40.1	116.4	101.5	54.3	0	0	0	0	113.4
5	D	34.1	Very low	30.1	Very low	130 Å²	130	142.1 Å²	142.1	70%	0.695	78%	0.779	S	S	*	*				175	124.7	92	-103.5	-20.1	0	0	0	114.2
6	N	31	Very low	30	Very low	116 Å²	116	139.2 Å²	139.2	62%	0.62	77%	0.772	S	S	*	*				65.9	128.8	124	-75.7	-28.8	0	0	0	123.5
7	R	31.4	Very low	29.8	Very low	222 Å²	222	143.2 Å²	143.2	84%	0.838	78%	0.78	S	S	*	*			trans	78.2	142.5	134.9	-74.8	171.8	175.3	179.6	-2.7	117
8	S	28.9	Very low	29.6	Very low	83 Å²	83	139 Å²	139	58%	0.58	77%	0.768	S	S	*	*			cis	-175.4	167.3	-15.4	46.6	0	0	0	0	104.8
9	D	30.3	Very low	29.6	Very low	139 Å²	139	143.8 Å²	143.8	74%	0.743	77%	0.773	S	S	*	*			trans	88	90.7	155.6	-47.9	-36.9	0	0	0	118.5
10	D	27.3	Very low	29.5	Very low	156 Å²	156	146.6 Å²	146.6	83%	0.834	77%	0.774	S	S	*	*				70.4	156.2	114.3	-126	-10.6	0	0	0	120.6
11	V	29.1	Very low	29.5	Very low	119 Å²	119	148.6 Å²	148.6	72%	0.721	78%	0.776	S	S	*	*			trans	97.9	87.6	168.7	-166	0	0	0	0	116.7
12	S	28.5	Very low	29.1	Very low	106 Å²	106	142.9 Å²	142.9	74%	0.741	76%	0.757	S	S	*	*				58	124.8	128.8	79.8	0	0	0	0	121.1
13	G	26.1	Very low	28.8	Very low	70 Å²	70	147.6 Å²	147.6	72%	0.722	76%	0.764	S	S	*	*				86.2	126.7	128.1	0	0	0	0	0	116.9
14	K	28.8	Very low	28.6	Very low	208 Å²	208	150.7 Å²	150.7	90%	0.904	77%	0.769	S	S	*	*			trans	74.1	75.3	163	-54.8	179.6	177.4	-179.6	0	115.1	S16	K14-S16 PolarHBondContact O-N 3.27Å
15	L	27.5	Very low	28.6	Very low	180 Å²	180	153.3 Å²	153.3	94%	0.942	78%	0.777	S	S	*	*			trans	-71.6	117.2	156.3	-84.6	161	0	0	0	109.3
16	S	28.3	Very low	28.3	Very low	95 Å²	95	153.3 Å²	153.3	66%	0.664	78%	0.781	S	S	*	*			trans	-73.7	127.3	-169.5	52.1	0	0	0	0	113.8	K14 A18	K14-S16 PolarHBondContact O-N 3.27Å; S16-A18 PolarHBondContact O-N 3.32Å; S16-A18 VanDerWaalsContact O-N 3.17Å
17	F	25.8	Very low	28.3	Very low	207 Å²	207	152.8 Å²	152.8	91%	0.908	79%	0.787	S	S	*	*			trans	-75.9	22.8	162.7	-105.3	-91.2	0	0	0	113.2	R19	F17-R19 PolarHBondContact O-N 3.11Å
18	A	26.2	Very low	28.1	Very low	68 Å²	68	148.9 Å²	148.9	56%	0.562	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	82	177.1	0	0	0	0	0	110	S16	S16-A18 PolarHBondContact O-N 3.32Å; S16-A18 VanDerWaalsContact O-N 3.17Å
19	R	29.1	Very low	28.1	Very low	230 Å²	230	152.2 Å²	152.2	87%	0.868	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.4	10.1	165.7	-114.4	173.1	-162.4	-165.8	4.8	117.4	F17	F17-R19 PolarHBondContact O-N 3.11Å
20	Y	28.3	Very low	27.8	Very low	200 Å²	200	152.3 Å²	152.3	78%	0.784	79%	0.793	S	S	*	*	S	Bend	trans	-117.6	2.6	178.7	-75.6	-74.5	0	0	0	116.3
21	F	28.9	Very low	27.7	Very low	189 Å²	189	153.2 Å²	153.2	83%	0.829	80%	0.798	S	S	*	*	S	Bend	trans	-140.8	129.9	167.3	-65.5	-80.4	0	0	0	109.2	E23	F21-E23 PolarHBondContact O-N 3.26Å
22	P	28.6	Very low	27.4	Very low	117 Å²	117	153.8 Å²	153.8	76%	0.76	80%	0.796	S	S	*	*			trans	-66.4	116	170.7	25.9	-28.8	0	0	0	108.5	R24	P22-R24 PolarHBondContact O-N 3.19Å; P22-R24 VanDerWaalsContact O-N 3.11Å
23	E	25.4	Very low	27.1	Very low	185 Å²	185	158 Å²	158	86%	0.864	80%	0.804	S	S	*	*			trans	-55.9	113.9	161.9	-73.9	177.3	162.7	0	0	107.8	F21	F21-E23 PolarHBondContact O-N 3.26Å
24	R	27.1	Very low	27.1	Very low	234 Å²	234	160.4 Å²	160.4	88%	0.883	81%	0.808	S	S	*	*			trans	-113.9	127.2	161.9	-87.7	-170.3	176.7	-176.2	0.6	109.3	P22	P22-R24 PolarHBondContact O-N 3.19Å; P22-R24 VanDerWaalsContact O-N 3.11Å
25	I	30.9	Very low	27	Very low	166 Å²	166	153.9 Å²	153.9	85%	0.851	80%	0.8	S	S	*	*			trans	-58.1	126.4	-177.4	-62.9	161.6	0	0	0	108.9	S27	I25-S27 PolarHBondContact O-N 3.35Å
26	V	27.7	Very low	26.8	Very low	129 Å²	129	150.1 Å²	150.1	78%	0.782	79%	0.785	S	S	*	*			trans	-66.4	112	170.4	-179.4	0	0	0	0	107.4
27	S	30.9	Very low	26.6	Very low	106 Å²	106	148.6 Å²	148.6	74%	0.741	78%	0.778	S	S	*	*			trans	-100.9	124.8	158.4	58.9	0	0	0	0	107.4	I25	I25-S27 PolarHBondContact O-N 3.35Å
28	D	27.6	Very low	26.5	Very low	140 Å²	140	146.5 Å²	146.5	75%	0.749	78%	0.776	S	S	*	*	S	Bend	trans	-52	153.7	176.1	-59.9	-50.3	0	0	0	112
29	D	27.5	Very low	26.5	Very low	152 Å²	152	148.1 Å²	148.1	81%	0.813	79%	0.79	S	S	*	*			trans	73.9	85.5	178.3	-57.2	-27.1	0	0	0	115.9
30	I	25.3	Very low	26.2	Very low	141 Å²	141	143.6 Å²	143.6	72%	0.723	78%	0.782	S	S	*	*			trans	-166.1	116.6	137.6	-83	135.7	0	0	0	107.5	L32	I30-L32 HydrophobicContact CG2-CB 4.08Å; I30-L32 HydrophobicContact CG2-CD1 3.36Å; I30-L32 HydrophobicContact CG2-CG 3.38Å; I30-L32 PolarHBondContact O-N 3.05Å
31	D	23.7	Very low	26.1	Very low	176 Å²	176	143.1 Å²	143.1	94%	0.941	79%	0.787	S	S	*	*			trans	-66.5	111.4	159.7	-87.9	-37.4	0	0	0	108.3
32	L	23.1	Very low	25.8	Very low	130 Å²	130	141.2 Å²	141.2	68%	0.681	79%	0.785	S	S	*	*			trans	-125.3	107	173.8	-96.2	161	0	0	0	109.7	I30 C34	I30-L32 HydrophobicContact CG2-CB 4.08Å; I30-L32 HydrophobicContact CG2-CD1 3.36Å; I30-L32 HydrophobicContact CG2-CG 3.38Å; I30-L32 PolarHBondContact O-N 3.05Å; L32-C34 PolarHBondContact O-N 2.62Å
33	E	23	Very low	25.6	Very low	196 Å²	196	142.3 Å²	142.3	92%	0.916	78%	0.783	S	S	*	*			trans	-57.1	111.1	155.9	-69.2	176.4	147.9	0	0	108.8
34	C	25.7	Very low	25.5	Very low	120 Å²	120	138.3 Å²	138.3	81%	0.811	78%	0.781	S	S	*	*			trans	-99.7	100.1	178.7	-65.7	0	0	0	0	109.7	L32	L32-C34 PolarHBondContact O-N 2.62Å
35	G	25.5	Very low	25.3	Very low	71 Å²	71	136.1 Å²	136.1	73%	0.732	78%	0.779	S	S	*	*			trans	-68	155.5	174.2	0	0	0	0	0	115.3
36	T	24.1	Very low	24.9	Very low	101 Å²	101	134.7 Å²	134.7	62%	0.62	77%	0.773	S	S	*	*			trans	-28.4	141	159.2	40.5	0	0	0	0	118.7
37	A	23.3	Very low	24.5	Very low	63 Å²	63	138.7 Å²	138.7	52%	0.521	77%	0.774	S	S	.	*			trans	140	107.5	136.7	0	0	0	0	0	111.1
38	D	24.6	Very low	24.2	Very low	163 Å²	163	143.4 Å²	143.4	87%	0.872	78%	0.775	S	S	*	*			trans	161.4	100.1	158.9	-81.6	-19	0	0	0	104.7
39	A	26	Very low	23.9	Very low	102 Å²	102	143.1 Å²	143.1	84%	0.843	77%	0.772	S	S	*	*				-161	121.1	59.4	0	0	0	0	0	110.3
40	L	23	Very low	23.6	Very low	134 Å²	134	141.2 Å²	141.2	70%	0.702	77%	0.771	S	S	*	*			trans	-116.9	97.4	167.4	-152.9	162.4	0	0	0	103.1	L42	L40-L42 HydrophobicContact CD2-CD1 4.19Å
41	E	25.2	Very low	23.4	Very low	191 Å²	191	143 Å²	143	89%	0.893	78%	0.776	S	S	*	*			trans	-128.3	114.5	173.8	-90.9	-168.4	161.6	0	0	112
42	L	24.5	Very low	23.3	Very low	149 Å²	149	143 Å²	143	78%	0.78	77%	0.768	S	S	*	*			trans	-72.6	149.8	175.1	-89.5	126.4	0	0	0	112	L40	L40-L42 HydrophobicContact CD2-CD1 4.19Å
43	L	22.7	Very low	23.3	Very low	140 Å²	140	144.9 Å²	144.9	73%	0.733	78%	0.778	S	S	*	*			trans	-46.9	128.5	166.1	-75.9	123.6	0	0	0	113.5
44	A	24.2	Very low	23.3	Very low	100 Å²	100	140.7 Å²	140.7	83%	0.826	77%	0.769	S	S	*	*			trans	-141.1	150.6	152.9	0	0	0	0	0	111
45	K	22.7	Very low	23.1	Very low	189 Å²	189	138.7 Å²	138.7	82%	0.822	77%	0.768	S	S	*	*	S	Bend	trans	-55.7	146.4	-167.8	-69.8	171.4	172.6	175.6	0	115.4
46	D	21.7	Very low	22.9	Very low	136 Å²	136	139 Å²	139	73%	0.727	77%	0.772	S	S	*	*	S	Bend	trans	60.7	106	151.6	-55.3	-32.7	0	0	0	117.6
47	R	21.2	Very low	23	Very low	212 Å²	212	144 Å²	144	80%	0.8	79%	0.788	S	S	*	*			trans	85.3	140.9	169.8	-48.7	173.8	-177	-167.5	0	112.7
48	W	24	Very low	23	Very low	206 Å²	206	149.3 Å²	149.3	78%	0.78	80%	0.802	S	S	*	*				-169.1	157.4	53.1	-78.2	87.1	0	0	0	114.1
49	I	21.7	Very low	23	Very low	133 Å²	133	149.4 Å²	149.4	68%	0.682	80%	0.797	S	S	*	*			trans	64.5	116.6	134.8	-61.2	161.8	0	0	0	120.8
50	S	21	Very low	23	Very low	112 Å²	112	151.3 Å²	151.3	78%	0.783	79%	0.793	S	S	*	*			trans	-85.3	149.2	152.5	71.6	0	0	0	0	111.2
51	Q	20.8	Very low	23.2	Very low	179 Å²	179	153.9 Å²	153.9	84%	0.836	80%	0.799	S	S	*	*			trans	-154.8	121.9	142.1	-149	168.7	-5.1	0	0	112.4
52	K	22	Very low	23.3	Very low	177 Å²	177	151.1 Å²	151.1	77%	0.77	78%	0.784	S	S	*	*			trans	-55.2	154.1	165.3	-138	174.8	-173	176.4	0	110.4
53	L	22.8	Very low	23.4	Very low	169 Å²	169	150.8 Å²	150.8	89%	0.885	79%	0.788	S	S	*	*			trans	-164.7	147.3	133.2	-100.5	164.8	0	0	0	111.8
54	C	22.3	Very low	23.7	Very low	108 Å²	108	148.4 Å²	148.4	73%	0.73	77%	0.769	S	S	*	*			trans	-105.4	173.7	-152.6	-50.8	0	0	0	0	114.2
55	G	22.3	Very low	23.9	Very low	77 Å²	77	146.8 Å²	146.8	79%	0.794	75%	0.75	S	S	*	*			trans	153.6	100.6	152.4	0	0	0	0	0	110.7
56	G	21.7	Very low	24.1	Very low	79 Å²	79	143 Å²	143	81%	0.814	75%	0.745	S	S	*	*				100.1	133.9	88.6	0	0	0	0	0	108.3
57	Q	25.1	Very low	24.3	Very low	206 Å²	206	139.8 Å²	139.8	96%	0.963	73%	0.73	S	S	*	*			cis	-145.2	169.7	25.7	-73.5	-175.8	-52.5	0	0	111.8
58	Q	23.1	Very low	24.4	Very low	173 Å²	173	134.8 Å²	134.8	81%	0.808	72%	0.718	S	S	*	*			trans	-96.8	165.4	-179.3	-168.7	179	1.1	0	0	111.2
59	E	25.8	Very low	24.4	Very low	166 Å²	166	130.8 Å²	130.8	78%	0.776	72%	0.719	S	S	*	*			trans	90.2	127.7	171.3	-53.6	-176.2	171.2	0	0	113.9
60	D	26.2	Very low	24.6	Very low	142 Å²	142	129.8 Å²	129.8	76%	0.759	72%	0.719	S	S	*	*			cis	-156.5	164.6	29.2	-106.7	-35.8	0	0	0	113.2
61	K	25.8	Very low	24.8	Very low	188 Å²	188	134 Å²	134	82%	0.817	72%	0.723	S	S	*	*			trans	-22.9	128	-179.7	-69	168.2	179.5	168.3	0	118.8	V63	K61-V63 PolarHBondContact O-N 3.21Å
62	F	28.3	Very low	25	Very low	133 Å²	133	131.6 Å²	131.6	58%	0.583	71%	0.712	S	S	*	*			trans	-60.6	119	167.2	-68.4	-85.6	0	0	0	112.7	D208 V271	F62-D208 WeakPolarHBondContact CE2-OD2 3.41Å; F62-V271 HydrophobicContact CD1-CG1 4.37Å; F62-V271 HydrophobicContact CE1-CG1 4.17Å
63	V	25.2	Very low	25.3	Very low	142 Å²	142	130.6 Å²	130.6	86%	0.861	71%	0.713	S	S	*	*			trans	-108.9	105.6	163	-176.6	0	0	0	0	107.5	K61	K61-V63 PolarHBondContact O-N 3.21Å
64	W	29	Very low	25.4	Very low	90 Å²	90	130.1 Å²	130.1	34%	0.341	71%	0.706	S	S	.	*	P	Polyproline II helix	trans	-75.4	157.5	176.9	-70.4	88	0	0	0	111.6	R226	W64-R226 VanDerWaalsContact CB-NH2 3.34Å; W64-R226 VanDerWaalsContact CD2-CZ 3.46Å; W64-R226 VanDerWaalsContact CE3-CZ 3.45Å; W64-R226 VanDerWaalsContact CG-NH2 3.34Å
65	P	28.6	Very low	25.6	Very low	66 Å²	66	129.1 Å²	129.1	43%	0.429	70%	0.698	S	S	.	*	P	Polyproline II helix	trans	-59.7	150.9	169.5	24.9	-32.9	0	0	0	111.6	V67	P65-V67 PolarHBondContact O-N 3.17Å
66	P	27.3	Very low	25.7	Very low	108 Å²	108	131 Å²	131	70%	0.701	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-65	130.9	-171	24.9	-32.7	0	0	0	112.7
67	V	26.6	Very low	25.9	Very low	69 Å²	69	136.6 Å²	136.6	42%	0.418	69%	0.694	S	S	.	*	P	Polyproline II helix	trans	-80.1	130.5	176.6	178.9	0	0	0	0	109.9	P65 D235	P65-V67 PolarHBondContact O-N 3.17Å; V67-D235 HydrophobicContact CG1-CB 3.84Å; V67-D235 HydrophobicContact CG2-CB 4.45Å
68	I	23.3	Very low	25.9	Very low	108 Å²	108	138.7 Å²	138.7	55%	0.554	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-103.4	123.3	172.2	-55.4	176.6	0	0	0	108.5	V70 T238	I68-V70 PolarHBondContact O-N 3.05Å; I68-T238 HydrophobicContact CD1-CG2 4.08Å
69	P	23.5	Very low	26	Very low	121 Å²	121	135.8 Å²	135.8	79%	0.786	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-74.7	122.6	176.9	28.8	-30.6	0	0	0	110.4
70	V	25.5	Very low	25.9	Very low	113 Å²	113	137 Å²	137	69%	0.685	70%	0.695	S	S	*	*			trans	-110.1	140	172.5	-168.5	0	0	0	0	109.3	I68 Q72	I68-V70 PolarHBondContact O-N 3.05Å; V70-Q72 PolarHBondContact O-N 2.92Å; V70-Q72 VanDerWaalsContact O-N 3.11Å
71	K	25.4	Very low	25.8	Very low	200 Å²	200	137.8 Å²	137.8	87%	0.87	70%	0.697	S	S	*	*			trans	-57.2	113.2	-178.8	-88.8	-179.9	173.5	176.8	0	111.4	I73	K71-I73 PolarHBondContact O-N 2.91Å
72	Q	25.8	Very low	25.7	Very low	129 Å²	129	133.5 Å²	133.5	60%	0.603	69%	0.689	S	S	*	*			trans	-65.4	119.4	164.8	-167.1	174.8	13.8	0	0	108.9	V70	V70-Q72 PolarHBondContact O-N 2.92Å; V70-Q72 VanDerWaalsContact O-N 3.11Å
73	I	27.7	Very low	25.3	Very low	156 Å²	156	138.4 Å²	138.4	80%	0.8	70%	0.704	S	S	*	*			trans	-91.4	98.6	165.9	-56	173.3	0	0	0	105.3	K71 P75	K71-I73 PolarHBondContact O-N 2.91Å; I73-P75 WeakPolarHBondContact O-CD 3.47Å
74	E	24.7	Very low	25.2	Very low	159 Å²	159	142 Å²	142	74%	0.743	70%	0.702	S	S	*	*			trans	-55.8	125.7	169.4	-78.6	-176.8	155.6	0	0	109
75	P	25.6	Very low	24.8	Very low	86 Å²	86	143.1 Å²	143.1	56%	0.558	72%	0.723	S	S	*	*			trans	-67.5	136.7	168	26.2	-29	0	0	0	108.8	I73 Y77	I73-P75 WeakPolarHBondContact O-CD 3.47Å; P75-Y77 PolarHBondContact O-N 3.19Å
76	P	25.6	Very low	24.4	Very low	116 Å²	116	144.1 Å²	144.1	75%	0.753	74%	0.737	S	S	*	*	S	Bend	trans	-74.8	25.9	-172.9	29.7	-34.6	0	0	0	114.6
77	Y	26.4	Very low	24.2	Very low	198 Å²	198	145.2 Å²	145.2	78%	0.776	74%	0.742	S	S	*	*			trans	-138.8	103.3	-177.8	-66.9	-80.8	0	0	0	111.6	P75 S79	P75-Y77 PolarHBondContact O-N 3.19Å; Y77-S79 PolarHBondContact O-N 3.14Å
78	R	23.6	Very low	24	Very low	249 Å²	249	148.9 Å²	148.9	94%	0.94	76%	0.759	S	S	*	*			trans	-59.5	105.8	154	-74.3	-174.6	179	-155.2	-0.6	107.2	K80	R78-K80 PolarHBondContact O-N 2.77Å
79	S	25.2	Very low	24	Very low	112 Å²	112	150.9 Å²	150.9	78%	0.783	77%	0.77	S	S	*	*			trans	-62.7	107.4	171	51.5	0	0	0	0	108.7	Y77 I81	Y77-S79 PolarHBondContact O-N 3.14Å; S79-I81 PolarHBondContact O-N 3.46Å
80	K	24.5	Very low	24.1	Very low	192 Å²	192	148.8 Å²	148.8	84%	0.835	76%	0.756	S	S	*	*			trans	-54.4	125.7	166.9	-78.1	178.9	174.4	177.5	0	108.3	R78 P82	R78-K80 PolarHBondContact O-N 2.77Å; K80-P82 WeakPolarHBondContact O-CD 3.14Å; K80-P82 VanDerWaalsContact O-N 3.12Å
81	I	23.8	Very low	24.1	Very low	158 Å²	158	151.7 Å²	151.7	81%	0.81	76%	0.763	S	S	*	*			trans	-52.2	113.1	168.7	-59.1	168.4	0	0	0	107.9	S79 R83	S79-I81 PolarHBondContact O-N 3.46Å; I81-R83 PolarHBondContact O-N 3.07Å
82	P	23.4	Very low	24	Very low	99 Å²	99	146.6 Å²	146.6	64%	0.643	75%	0.752	S	S	*	*			trans	-76.9	113.4	176.7	-7.2	25.1	0	0	0	108.6	K80 W84	K80-P82 WeakPolarHBondContact O-CD 3.14Å; K80-P82 VanDerWaalsContact O-N 3.12Å; P82-W84 VanDerWaalsContact C-CD1 3.41Å
83	R	19.8	Very low	24	Very low	235 Å²	235	144.1 Å²	144.1	89%	0.887	75%	0.754	S	S	*	*			trans	-83.5	109.4	165	-76.6	-178.9	170.4	177.8	-3.8	109.3	I81	I81-R83 PolarHBondContact O-N 3.07Å
84	W	23.5	Very low	24	Very low	219 Å²	219	143.6 Å²	143.6	83%	0.83	75%	0.752	S	S	*	*			trans	-145.5	112.3	178	-58.6	80.6	0	0	0	114.3	P82	P82-W84 VanDerWaalsContact C-CD1 3.41Å
85	S	21.1	Very low	23.9	Very low	112 Å²	112	146.2 Å²	146.2	78%	0.783	76%	0.755	S	S	*	*			trans	27	122.2	142	-30.3	0	0	0	0	122.6
86	A	20.9	Very low	23.8	Very low	87 Å²	87	149.3 Å²	149.3	72%	0.719	77%	0.767	S	S	*	*			trans	-66.2	148.3	165.5	0	0	0	0	0	113.8
87	V	22.5	Very low	23.8	Very low	132 Å²	132	152.4 Å²	152.4	80%	0.8	76%	0.763	S	S	*	*			trans	-121.1	111.8	164.7	178.7	0	0	0	0	107.9	L89	V87-L89 PolarHBondContact O-N 3.43Å
88	N	22.9	Very low	23.8	Very low	146 Å²	146	148.7 Å²	148.7	78%	0.781	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-63	118.3	175.3	-76	-21.1	0	0	0	110.8
89	L	22.8	Very low	23.8	Very low	149 Å²	149	145.3 Å²	145.3	78%	0.78	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-87.1	129.4	164	-75.9	167.4	0	0	0	109.4	V87	V87-L89 PolarHBondContact O-N 3.43Å
90	P	25.1	Very low	23.7	Very low	78 Å²	78	146.1 Å²	146.1	51%	0.506	75%	0.752	S	S	.	*	P	Polyproline II helix	trans	-73.2	143.9	-170.1	26.9	-32.5	0	0	0	113.2	S92 A93	P90-S92 PolarHBondContact O-N 2.75Å; P90-A93 PolarHBondContact O-N 3.01Å
91	E	25.3	Very low	23.7	Very low	174 Å²	174	142 Å²	142	81%	0.813	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-41.2	-9.3	179.6	-103.3	-179.1	142	0	0	118.3
92	S	24.7	Very low	23.8	Very low	92 Å²	92	139 Å²	139	64%	0.643	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-16.3	-179.5	53.8	0	0	0	0	114.5	P90 L94	P90-S92 PolarHBondContact O-N 2.75Å; S92-L94 PolarHBondContact O-N 2.64Å
93	A	25.8	Very low	24	Very low	78 Å²	78	143.9 Å²	143.9	65%	0.645	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-7.7	172	0	0	0	0	0	113.2	P90	P90-A93 PolarHBondContact O-N 3.01Å
94	L	27.1	Very low	24.5	Very low	144 Å²	144	142.3 Å²	142.3	75%	0.754	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	7.9	-169.7	-80.2	163.1	0	0	0	114.9	S92	S92-L94 PolarHBondContact O-N 2.64Å
95	R	23.1	Very low	25	Very low	214 Å²	214	137.3 Å²	137.3	81%	0.808	75%	0.746	S	S	*	*	S	Bend	trans	-130.2	-7.6	-170	-84.2	-169.5	178.2	-178	2.4	120.3
96	N	23.4	Very low	25.3	Very low	152 Å²	152	136 Å²	136	81%	0.813	74%	0.743	S	S	*	*	S	Bend	trans	-158	150.9	172.3	-86.4	-49.2	0	0	0	112.2
97	R	24.5	Very low	25.8	Very low	181 Å²	181	139.7 Å²	139.7	68%	0.683	75%	0.748	S	S	*	*	S	Bend	trans	-32.3	140.5	164.9	-66.8	174.2	165.2	-174.9	-9.6	112	Y501	R97-Y501 PolarHBondContact NH2-O 2.65Å
98	F	25.9	Very low	25.9	Very low	120 Å²	120	144.9 Å²	144.9	53%	0.526	75%	0.754	S	S	.	*	S	Bend	trans	73.7	108.2	170.5	-54.8	-71.5	0	0	0	116.5	T100 F492	F98-T100 PolarHBondContact O-N 3.27Å; F98-T100 VanDerWaalsContact O-N 3.15Å; F98-F492 AromaticContact CD1-CE1 3.64Å; F98-F492 HydrophobicContact CD1-CE1 3.64Å; F98-F492 HydrophobicContact CD1-CZ 4.1Å; F98-F492 AromaticContact CE1-CE1 3.34Å; F98-F492 HydrophobicContact CE1-CE1 3.34Å; F98-F492 AromaticContact CE1-CZ 3.6Å; F98-F492 HydrophobicContact CE1-CZ 3.6Å; F98-F492 HydrophobicContact CZ-CE1 4.09Å
99	L	24.6	Very low	26.2	Very low	178 Å²	178	144.6 Å²	144.6	93%	0.932	76%	0.757	S	S	*	*			trans	-8.1	101.3	151.2	-67.6	162.4	0	0	0	114.4
100	T	23.4	Very low	26.4	Very low	129 Å²	129	142.6 Å²	142.6	79%	0.791	75%	0.753	S	S	*	*			trans	-152.1	128.3	147.2	45.9	0	0	0	0	110	F98	F98-T100 PolarHBondContact O-N 3.27Å; F98-T100 VanDerWaalsContact O-N 3.15Å
101	S	24.8	Very low	26.4	Very low	104 Å²	104	143.9 Å²	143.9	73%	0.727	76%	0.764	S	S	*	*			trans	-133.5	141.3	150.4	115.8	0	0	0	0	109.2
102	S	24.5	Very low	26.5	Very low	96 Å²	96	146 Å²	146	67%	0.671	77%	0.77	S	S	*	*			trans	-96.3	137.5	-155.5	56.7	0	0	0	0	113.1
103	K	29.4	Very low	26.7	Very low	201 Å²	201	144.6 Å²	144.6	87%	0.874	76%	0.76	S	S	*	*				155.3	117.3	120.6	-83.7	170.7	-178.1	178	0	112
104	K	29.6	Very low	26.8	Very low	202 Å²	202	150 Å²	150	88%	0.878	77%	0.769	S	S	*	*			trans	-59.7	-177.6	168.9	-78.9	-176.4	173.6	176.6	0	113.3
105	P	34.7	Very low	26.9	Very low	115 Å²	115	153.3 Å²	153.3	75%	0.747	77%	0.772	S	S	*	*				-136.9	170.1	-50.2	38.3	-20.9	0	0	0	111.1
106	A	26.3	Very low	27.1	Very low	85 Å²	85	151.9 Å²	151.9	70%	0.702	77%	0.768	S	S	*	*				145.6	129.9	102.8	0	0	0	0	0	106.4
107	I	30.5	Very low	27.4	Very low	163 Å²	163	149.1 Å²	149.1	84%	0.836	75%	0.75	S	S	*	*				177.4	142.4	92.5	-81	159.3	0	0	0	107.5
108	R	25.2	Very low	27.5	Very low	242 Å²	242	147.3 Å²	147.3	91%	0.913	75%	0.747	S	S	*	*			trans	-74	140.9	173.4	-68.7	171.5	169.7	176.1	-4.4	112.3
109	V	29.2	Very low	27.5	Very low	140 Å²	140	146.8 Å²	146.8	85%	0.848	75%	0.749	S	S	*	*			trans	-152.6	144.4	144.3	-175.7	0	0	0	0	110.3
110	P	26.9	Very low	27.6	Very low	107 Å²	107	143.5 Å²	143.5	70%	0.695	73%	0.732	S	S	*	*			trans	-110.9	161.5	-151.4	41.1	-31.4	0	0	0	116.5
111	S	25.5	Very low	27.7	Very low	105 Å²	105	139.2 Å²	139.2	73%	0.734	71%	0.709	S	S	*	*			trans	22.4	107.7	146.1	63.7	0	0	0	0	119.1
112	K	27.1	Very low	27.8	Very low	217 Å²	217	139.9 Å²	139.9	94%	0.943	70%	0.701	S	S	*	*			trans	-178.9	71.2	150.2	-101.5	167.3	-171.8	-173.4	0	111.9
113	S	28.9	Very low	27.8	Very low	63 Å²	63	139.4 Å²	139.4	44%	0.441	70%	0.698	S	S	.	*			trans	-156.4	-1.5	161.4	71.8	0	0	0	0	116.3	R115 Y116 E117	S113-R115 PolarHBondContact O-N 2.98Å; S113-Y116 PolarHBondContact O-N 2.93Å; S113-E117 PolarHBondContact OG-OE1 3.3Å
114	K	29.4	Very low	27.6	Very low	192 Å²	192	136.3 Å²	136.3	84%	0.835	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-3.6	-172.6	-70.6	-170.2	173.5	-172.4	0	117.1
115	R	28.9	Very low	27.4	Very low	214 Å²	214	129.2 Å²	129.2	81%	0.808	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-15.2	-177.4	-143.6	175.6	-172.6	174	1.8	114.3	S113	S113-R115 PolarHBondContact O-N 2.98Å
116	Y	27.3	Very low	26.9	Very low	184 Å²	184	131.3 Å²	131.3	72%	0.722	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-19.5	178.8	-71.8	-77.8	0	0	0	113.4	S113 L120	S113-Y116 PolarHBondContact O-N 2.93Å; Y116-L120 PolarHBondContact O-N 3.25Å; Y116-L120 VanDerWaalsContact O-N 3.16Å
117	E	28.3	Very low	26.9	Very low	94 Å²	94	133.6 Å²	133.6	44%	0.439	67%	0.666	S	S	.	*	H	α-helix	trans	-75.2	-32.5	175.5	-74.4	152.9	-158.9	0	0	112.5	S113 L120 A121	S113-E117 PolarHBondContact OG-OE1 3.3Å; E117-L120 PolarHBondContact O-N 3.06Å; E117-A121 WeakPolarHBondContact O-CB 3.49Å; E117-A121 PolarHBondContact O-N 3.39Å
118	K	27.4	Very low	26.6	Very low	143 Å²	143	128.8 Å²	128.8	62%	0.622	65%	0.647	S	S	*	*	H	α-helix	trans	-69.3	-39.4	175.9	-166.7	176.4	179.5	-179	0	112.4	A121 E122	K118-A121 PolarHBondContact O-N 2.71Å; K118-E122 WeakPolarHBondContact CE-OE1 3.2Å; K118-E122 WeakPolarHBondContact O-CB 3.42Å; K118-E122 WeakPolarHBondContact O-CG 3.41Å; K118-E122 PolarHBondContact O-N 2.76Å
119	L	26.1	Very low	26.6	Very low	109 Å²	109	122.5 Å²	122.5	57%	0.571	64%	0.638	S	S	*	*	H	α-helix	trans	-74.7	-26.2	176.1	-89.5	154.1	0	0	0	112.7	S123	L119-S123 WeakPolarHBondContact O-CB 3.41Å; L119-S123 PolarHBondContact O-N 3.49Å; L119-S123 VanDerWaalsContact O-N 3.13Å
120	L	26.1	Very low	26.3	Very low	109 Å²	109	125.9 Å²	125.9	57%	0.571	64%	0.637	S	S	*	*	H	α-helix	trans	-75.4	-36.3	171.2	-124.9	90.9	0	0	0	112.1	Y116 E117 E122 S123 L124	Y116-L120 PolarHBondContact O-N 3.25Å; Y116-L120 VanDerWaalsContact O-N 3.16Å; E117-L120 PolarHBondContact O-N 3.06Å; L120-E122 VanDerWaalsContact C-N 3.35Å; L120-S123 PolarHBondContact O-N 2.87Å; L120-L124 HydrophobicContact CD2-CD1 4.33Å; L120-L124 WeakPolarHBondContact O-CB 3.18Å; L120-L124 WeakPolarHBondContact O-CD1 3.4Å; L120-L124 WeakPolarHBondContact O-CG 3.32Å; L120-L124 PolarHBondContact O-N 2.77Å
121	A	25.6	Very low	26.2	Very low	38 Å²	38	130.7 Å²	130.7	31%	0.314	64%	0.641	S	S	.	*	H	α-helix	trans	-67	-35.8	173.8	0	0	0	0	0	111.9	E117 K118 C125	E117-A121 WeakPolarHBondContact O-CB 3.49Å; E117-A121 PolarHBondContact O-N 3.39Å; K118-A121 PolarHBondContact O-N 2.71Å; A121-C125 PolarHBondContact O-SG 2.97Å
122	E	26	Very low	26.3	Very low	119 Å²	119	128.6 Å²	128.6	56%	0.556	62%	0.623	S	S	*	*	H	α-helix	trans	-75.6	-22.4	174.3	-71.9	168.5	-173.3	0	0	113	K118 L120	K118-E122 WeakPolarHBondContact CE-OE1 3.2Å; K118-E122 WeakPolarHBondContact O-CB 3.42Å; K118-E122 WeakPolarHBondContact O-CG 3.41Å; K118-E122 PolarHBondContact O-N 2.76Å; L120-E122 VanDerWaalsContact C-N 3.35Å
123	S	25.4	Very low	26.4	Very low	86 Å²	86	123.1 Å²	123.1	60%	0.601	60%	0.604	S	S	*	*	H	α-helix	trans	-96	-10.6	177.2	138.1	0	0	0	0	115	L119 L120	L119-S123 WeakPolarHBondContact O-CB 3.41Å; L119-S123 PolarHBondContact O-N 3.49Å; L119-S123 VanDerWaalsContact O-N 3.13Å; L120-S123 PolarHBondContact O-N 2.87Å
124	L	25	Very low	26.6	Very low	136 Å²	136	124.6 Å²	124.6	71%	0.712	61%	0.606	S	S	*	*	H	α-helix	trans	-94.8	-10.2	171.6	-71.6	165.5	0	0	0	112.3	L120 D126	L120-L124 HydrophobicContact CD2-CD1 4.33Å; L120-L124 WeakPolarHBondContact O-CB 3.18Å; L120-L124 WeakPolarHBondContact O-CD1 3.4Å; L120-L124 WeakPolarHBondContact O-CG 3.32Å; L120-L124 PolarHBondContact O-N 2.77Å; L124-D126 PolarHBondContact O-N 3.22Å
125	C	24.7	Very low	26.8	Very low	53 Å²	53	120.2 Å²	120.2	36%	0.358	59%	0.591	S	S	.	*			trans	-97.8	65.8	174	-62.1	0	0	0	0	111.1	A121 Q127 Y474	A121-C125 PolarHBondContact O-SG 2.97Å; C125-Q127 PolarHBondContact O-N 3.41Å; C125-Q127 VanDerWaalsContact O-N 3.17Å; C125-Y474 VanDerWaalsContact SG-CE2 3.55Å; C125-Y474 PolarHBondContact SG-OH 2.77Å
126	D	24.5	Very low	27.2	Very low	159 Å²	159	112.5 Å²	112.5	85%	0.85	57%	0.566	S	S	*	*			trans	-76.9	12.2	172.4	-115.6	-0.8	0	0	0	113	L124	L124-D126 PolarHBondContact O-N 3.22Å
127	Q	26.8	Very low	28.2	Very low	132 Å²	132	105.6 Å²	105.6	62%	0.617	54%	0.541	S	S	*	.	S	Bend	trans	-130	114.1	168.9	-64.2	-164.3	3.1	0	0	110.4	C125	C125-Q127 PolarHBondContact O-N 3.41Å; C125-Q127 VanDerWaalsContact O-N 3.17Å
128	S	23.6	Very low	29.1	Very low	63 Å²	63	102.1 Å²	102.1	44%	0.441	53%	0.53	S	S	.	.			trans	-53.4	141.9	168	67.5	0	0	0	0	110	Y130 R131	S128-Y130 PolarHBondContact O-N 3.05Å; S128-R131 PolarHBondContact O-N 3.34Å
129	P	25.8	Very low	30.6	Very low	110 Å²	110	96.8 Å²	96.8	71%	0.714	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-0	179.8	22.6	-33.2	0	0	0	115.1
130	Y	24	Very low	32.5	Very low	211 Å²	211	91.6 Å²	91.6	83%	0.827	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-6.9	179.8	-65.8	-80.7	0	0	0	115.2	S128	S128-Y130 PolarHBondContact O-N 3.05Å
131	R	23.1	Very low	34.4	Very low	207 Å²	207	86.4 Å²	86.4	78%	0.781	45%	0.454	S	S	*	.	S	Bend	trans	-102.8	-16.6	-174.9	-82	-167	-178.4	-173.8	1.8	116.4	S128 N133	S128-R131 PolarHBondContact O-N 3.34Å; R131-N133 PolarHBondContact O-N 2.8Å
132	V	27.8	Very low	36.5	Very low	61 Å²	61	84.8 Å²	84.8	37%	0.37	44%	0.441	S	S	.	.	S	Bend	trans	-85.2	109.9	172.2	-175.9	0	0	0	0	107	M134 L137	V132-M134 PolarHBondContact O-N 3.32Å; V132-L137 HydrophobicContact CG1-CD1 4.5Å
133	N	29	Very low	38.6	Very low	102 Å²	102	80.1 Å²	80.1	55%	0.545	42%	0.421	S	S	.	.			trans	-70.4	84.7	174	-160.4	1	0	0	0	108.1	R131 L135 N136	R131-N133 PolarHBondContact O-N 2.8Å; N133-L135 PolarHBondContact O-N 2.83Å; N133-N136 PolarHBondContact O-N 3.08Å
134	M	33.7	Very low	40.9	Very low	94 Å²	94	77.3 Å²	77.3	46%	0.463	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-51.3	-26	-173.6	-68.1	-82.1	-156.1	0	0	112.9	V132 N136 L137 R394	V132-M134 PolarHBondContact O-N 3.32Å; M134-N136 PolarHBondContact O-N 3.15Å; M134-L137 PolarHBondContact O-N 3.03Å; M134-L137 HydrophobicContact SD-CD1 4.34Å; M134-R394 PolarHBondContact SD-NH1 2.84Å; M134-R394 VanDerWaalsContact SD-NH1 3.4Å; M134-R394 PolarHBondContact SD-NH2 3.17Å
135	L	33.2	Very low	43	Very low	101 Å²	101	71.5 Å²	71.5	53%	0.529	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-67.8	-16.5	179.5	-67.2	167.6	0	0	0	114.2	N133 T303	N133-L135 PolarHBondContact O-N 2.83Å; L135-T303 HydrophobicContact CD2-CG2 4.41Å
136	N	38.6	Very low	45.1	Very low	52 Å²	52	71.8 Å²	71.8	28%	0.278	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-99.1	12	-177.4	-72.2	-8.7	0	0	0	113.3	N133 M134 R215	N133-N136 PolarHBondContact O-N 3.08Å; M134-N136 PolarHBondContact O-N 3.15Å; N136-R215 PolarHBondContact O-NH1 3.46Å; N136-R215 PolarHBondContact O-NH2 2.98Å
137	L	46.7	Very low	47.1	Very low	39 Å²	39	67.5 Å²	67.5	20%	0.204	34%	0.344	C	S	.	.			trans	-92.4	124.5	179.3	-65.5	168.8	0	0	0	109.8	V132 M134 V199	V132-L137 HydrophobicContact CG1-CD1 4.5Å; M134-L137 PolarHBondContact O-N 3.03Å; M134-L137 HydrophobicContact SD-CD1 4.34Å; L137-V199 HydrophobicContact CD2-CB 4.31Å; L137-V199 HydrophobicContact CD2-CG1 3.76Å
138	G	48.9	Very low	49.1	Very low	20 Å²	20	68.7 Å²	68.7	21%	0.206	35%	0.354	C	S	.	.			trans	-108.8	-172.3	174.3	0	0	0	0	0	111.9	C140 V199	G138-C140 PolarHBondContact O-N 3.48Å; G138-V199 CarbonylContact C-O 3.51Å; G138-V199 WeakPolarHBondContact CA-O 3.03Å; G138-V199 PolarHBondContact N-O 2.83Å
139	N	58.8	Low	51.4	Low	32 Å²	32	71.8 Å²	71.8	17%	0.171	36%	0.36	C	S	.	.			trans	-66.2	122	176.1	178.3	12	0	0	0	110.5	L141 Q200 V201 R455 G456 R458	N139-L141 PolarHBondContact ND2-O 2.76Å; N139-L141 WeakPolarHBondContact OD1-CB 3.46Å; N139-L141 PolarHBondContact OD1-N 2.81Å; N139-L141 PolarHBondContact OD1-O 3.41Å; N139-Q200 CarbonylContact O-C 3.27Å; N139-Q200 VanDerWaalsContact O-CA 3.25Å; N139-Q200 WeakPolarHBondContact O-CA 3.5Å; N139-V201 PolarHBondContact O-N 2.95Å; N139-R455 PolarHBondContact OD1-O 2.81Å; N139-G456 VanDerWaalsContact OD1-CA 3.31Å; N139-G456 WeakPolarHBondContact OD1-CA 3.27Å; N139-R458 PolarHBondContact ND2-NH1 2.82Å; N139-R458 PolarHBondContact ND2-NH2 2.78Å
140	C	64.9	Low	53.4	Low	0 Å²	0	69.6 Å²	69.6	0%	0	35%	0.346	C	S	.	.			trans	-95.8	13.8	178.9	-67.4	0	0	0	0	112.7	G138 F157 A158 I198 R455 N468 V470	G138-C140 PolarHBondContact O-N 3.48Å; C140-F157 VanDerWaalsContact O-CA 3.3Å; C140-F157 WeakPolarHBondContact O-CA 3.37Å; C140-A158 HydrophobicContact CB-CB 4.1Å; C140-A158 PolarHBondContact O-N 3.16Å; C140-I198 PolarHBondContact SG-O 2.95Å; C140-I198 VanDerWaalsContact SG-O 3.34Å; C140-R455 HydrophobicContact CB-CB 3.88Å; C140-R455 PolarHBondContact N-O 3.1Å; C140-R455 VanDerWaalsContact SG-CD 3.6Å; C140-N468 PolarHBondContact O-ND2 3.23Å; C140-V470 HydrophobicContact CB-CG2 4.26Å
141	L	67.5	Low	55.7	Low	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	117.9	178.6	-175	54.4	0	0	0	112.4	N139 V143 A155 A156 F157 R458 V466 N468	N139-L141 PolarHBondContact ND2-O 2.76Å; N139-L141 WeakPolarHBondContact OD1-CB 3.46Å; N139-L141 PolarHBondContact OD1-N 2.81Å; N139-L141 PolarHBondContact OD1-O 3.41Å; L141-V143 HydrophobicContact CD1-CG2 3.71Å; L141-V143 HydrophobicContact CD2-CG2 3.92Å; L141-V143 HydrophobicContact CG-CG2 3.74Å; L141-A155 HydrophobicContact CD1-CB 4.49Å; L141-A156 WeakPolarHBondContact CA-O 3.44Å; L141-F157 HydrophobicContact CD1-CB 4.05Å; L141-R458 HydrophobicContact CD2-CG 4.39Å; L141-V466 HydrophobicContact CD2-CB 4.41Å; L141-V466 HydrophobicContact CD2-CG1 3.93Å; L141-N468 HydrophobicContact CB-CB 3.46Å; L141-N468 VanDerWaalsContact CB-CB 3.46Å; L141-N468 HydrophobicContact CD1-CB 4.01Å; L141-N468 HydrophobicContact CD2-CB 3.84Å; L141-N468 HydrophobicContact CG-CB 3.91Å
142	G	68.5	Low	58.3	Low	4 Å²	4	52.8 Å²	52.8	4%	0.041	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133.1	159.3	0	0	0	0	0	109.9	A155 A156 L203	G142-A155 CarbonylContact O-C 3.38Å; G142-A155 VanDerWaalsContact O-CA 3.26Å; G142-A155 WeakPolarHBondContact O-CA 3.34Å; G142-A156 PolarHBondContact N-O 3.47Å; G142-A156 PolarHBondContact O-N 3.27Å; G142-L203 WeakPolarHBondContact O-CD1 3.4Å
143	V	69.4	Low	60.4	Low	20 Å²	20	50 Å²	50	12%	0.121	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.8	168.7	-172.8	0	0	0	0	108.1	L141 V153 T154 A155 R458 L460 V466	L141-V143 HydrophobicContact CD1-CG2 3.71Å; L141-V143 HydrophobicContact CD2-CG2 3.92Å; L141-V143 HydrophobicContact CG-CG2 3.74Å; V143-V153 HydrophobicContact CG1-CG1 3.52Å; V143-T154 CarbonylContact C-O 3.42Å; V143-T154 WeakPolarHBondContact CA-O 3.07Å; V143-A155 HydrophobicContact CG2-CB 4.19Å; V143-R458 HydrophobicContact CB-CB 4.09Å; V143-R458 HydrophobicContact CB-CG 4.33Å; V143-R458 HydrophobicContact CG2-CB 3.93Å; V143-R458 HydrophobicContact CG2-CG 4.16Å; V143-L460 HydrophobicContact CG1-CD2 3.44Å; V143-L460 VanDerWaalsContact CG1-CD2 3.44Å; V143-V466 HydrophobicContact CG2-CB 4.2Å; V143-V466 HydrophobicContact CG2-CG1 4.1Å
144	F	73.6	Confident	62.6	Low	28 Å²	28	46.1 Å²	46.1	12%	0.123	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	128.9	179.2	171.6	-117.5	0	0	0	109.1	E146 P147 V153 T154 L203 E205	F144-E146 HydrophobicContact CE1-CG 4Å; F144-P147 HydrophobicContact CE2-CG 4.46Å; F144-P147 VanDerWaalsContact CZ-CD 3.49Å; F144-P147 HydrophobicContact CZ-CG 4.33Å; F144-V153 CarbonylContact O-C 3.59Å; F144-V153 WeakPolarHBondContact O-CA 3.39Å; F144-T154 PolarHBondContact N-O 3.01Å; F144-T154 PolarHBondContact O-N 3.49Å; F144-L203 HydrophobicContact CB-CB 4.25Å; F144-L203 HydrophobicContact CB-CD1 3.84Å; F144-E205 HydrophobicContact CD2-CB 4.03Å; F144-E205 VanDerWaalsContact CD2-CD 3.48Å; F144-E205 HydrophobicContact CD2-CG 3.4Å; F144-E205 WeakPolarHBondContact CD2-OE1 3.4Å; F144-E205 HydrophobicContact CE2-CB 3.67Å; F144-E205 HydrophobicContact CE2-CG 3.57Å; F144-E205 HydrophobicContact CG-CG 4.39Å; F144-E205 HydrophobicContact CZ-CB 4.49Å
145	E	69.4	Low	64.5	Low	13 Å²	13	41.8 Å²	41.8	6%	0.061	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	123.9	171.4	-168.7	-178.7	140.5	0	0	108.6	P147 P150 V153 L460 R461 H462	E145-P147 VanDerWaalsContact O-CD 3.28Å; E145-P147 WeakPolarHBondContact O-CD 3.37Å; E145-P150 WeakPolarHBondContact CG-O 3.43Å; E145-P150 WeakPolarHBondContact OE1-CA 2.98Å; E145-V153 HydrophobicContact CG-CG2 4.43Å; E145-L460 HydrophobicContact CB-CD2 4.47Å; E145-R461 WeakPolarHBondContact OE1-CD 3.2Å; E145-R461 VanDerWaalsContact OE2-CB 3.24Å; E145-R461 WeakPolarHBondContact OE2-CB 3.01Å; E145-R461 VanDerWaalsContact OE2-CG 3.32Å; E145-R461 WeakPolarHBondContact OE2-CG 3.13Å; E145-R461 PolarHBondContact OE2-N 2.71Å; E145-H462 IonicContact OE1-CE1 3.24Å; E145-H462 PolarHBondContact OE1-CE1 2.76Å; E145-H462 IonicContact OE1-ND1 2.7Å; E145-H462 PolarHBondContact OE1-ND1 3.38Å; E145-H462 IonicContact OE2-ND1 2.8Å
146	E	69.7	Low	66.4	Low	60 Å²	60	37 Å²	37	28%	0.28	21%	0.211	S	C	.	.			trans	-62.2	120.1	-179.3	-72.9	-169.1	177.3	0	0	109.9	F144 D148 K149 S152	F144-E146 HydrophobicContact CE1-CG 4Å; E146-D148 PolarHBondContact O-N 2.98Å; E146-D148 VanDerWaalsContact O-N 3.13Å; E146-K149 HydrophobicContact CB-CB 4.1Å; E146-K149 CarbonylContact O-C 3.51Å; E146-K149 PolarHBondContact O-N 2.78Å; E146-K149 WeakPolarHBondContact OE2-CD 3.29Å; E146-K149 IonicContact OE2-NZ 3.85Å; E146-S152 PolarHBondContact N-O 3.16Å
147	P	66.5	Low	67.9	Low	69 Å²	69	34.5 Å²	34.5	45%	0.448	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-34.9	-176	-26.7	33.4	0	0	0	113.8	F144 E145	F144-P147 HydrophobicContact CE2-CG 4.46Å; F144-P147 VanDerWaalsContact CZ-CD 3.49Å; F144-P147 HydrophobicContact CZ-CG 4.33Å; E145-P147 VanDerWaalsContact O-CD 3.28Å; E145-P147 WeakPolarHBondContact O-CD 3.37Å
148	D	68	Low	68.8	Low	156 Å²	156	32.7 Å²	32.7	83%	0.834	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-8.4	-177.1	-60.8	-36.8	0	0	0	113.2	E146	E146-D148 PolarHBondContact O-N 2.98Å; E146-D148 VanDerWaalsContact O-N 3.13Å
149	K	72.9	Confident	69.3	Low	128 Å²	128	33.1 Å²	33.1	56%	0.557	19%	0.186	S	C	*	.			trans	-140.9	80.6	177.3	-65.6	-174	-160.3	150.8	0	108.8	E146 A151 S152	E146-K149 HydrophobicContact CB-CB 4.1Å; E146-K149 CarbonylContact O-C 3.51Å; E146-K149 PolarHBondContact O-N 2.78Å; E146-K149 WeakPolarHBondContact OE2-CD 3.29Å; E146-K149 IonicContact OE2-NZ 3.85Å; K149-A151 PolarHBondContact O-N 2.82Å; K149-S152 WeakPolarHBondContact O-CA 3.27Å; K149-S152 WeakPolarHBondContact O-CB 3.37Å; K149-S152 PolarHBondContact O-N 2.84Å
150	P	66.4	Low	69	Low	64 Å²	64	33.2 Å²	33.2	42%	0.416	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-27.6	-174.6	19.5	-31.6	0	0	0	113.5	E145 S152 H462	E145-P150 WeakPolarHBondContact CG-O 3.43Å; E145-P150 WeakPolarHBondContact OE1-CA 2.98Å; P150-S152 VanDerWaalsContact C-N 3.25Å; P150-S152 PolarHBondContact O-N 3.45Å; P150-H462 PolarHBondContact O-CE1 3.05Å
151	A	73.5	Confident	68.2	Low	46 Å²	46	37.7 Å²	37.7	38%	0.38	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-12.6	174	0	0	0	0	0	113.8	K149 E172 I173	K149-A151 PolarHBondContact O-N 2.82Å; A151-E172 CarbonylContact O-C 3.45Å; A151-E172 VanDerWaalsContact O-CA 3.27Å; A151-E172 WeakPolarHBondContact O-CA 3.39Å; A151-I173 HydrophobicContact CB-CB 4.4Å; A151-I173 PolarHBondContact O-N 3.48Å
152	S	77.1	Confident	67.9	Low	19 Å²	19	42.9 Å²	42.9	13%	0.133	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	122.2	-177.6	-163.1	0	0	0	0	111.1	E146 K149 P150 F171	E146-S152 PolarHBondContact N-O 3.16Å; K149-S152 WeakPolarHBondContact O-CA 3.27Å; K149-S152 WeakPolarHBondContact O-CB 3.37Å; K149-S152 PolarHBondContact O-N 2.84Å; P150-S152 VanDerWaalsContact C-N 3.25Å; P150-S152 PolarHBondContact O-N 3.45Å; S152-F171 WeakPolarHBondContact CA-O 3.26Å
153	V	72.4	Confident	67.7	Low	2 Å²	2	42.8 Å²	42.8	1%	0.012	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	124.8	-176.6	178.4	0	0	0	0	109	V143 F144 E145 A170 F171 I173 L184 L460	V143-V153 HydrophobicContact CG1-CG1 3.52Å; F144-V153 CarbonylContact O-C 3.59Å; F144-V153 WeakPolarHBondContact O-CA 3.39Å; E145-V153 HydrophobicContact CG-CG2 4.43Å; V153-A170 CarbonylContact O-C 3.59Å; V153-A170 WeakPolarHBondContact O-CA 3.39Å; V153-F171 HydrophobicContact CB-CB 4.23Å; V153-F171 PolarHBondContact N-O 3.4Å; V153-F171 PolarHBondContact O-N 3.35Å; V153-I173 HydrophobicContact CG2-CD1 3.82Å; V153-I173 HydrophobicContact CG2-CG1 3.95Å; V153-L184 HydrophobicContact CB-CD2 4.39Å; V153-L184 HydrophobicContact CG2-CD2 4.24Å; V153-L460 HydrophobicContact CG1-CD1 4.21Å; V153-L460 HydrophobicContact CG1-CD2 3.86Å; V153-L460 HydrophobicContact CG2-CD1 3.68Å; V153-L460 HydrophobicContact CG2-CD2 4.09Å
154	T	75.8	Confident	67.6	Low	22 Å²	22	44.8 Å²	44.8	14%	0.135	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	128.5	167.2	-60.5	0	0	0	0	108.7	V143 F144 V168 S169 L203 L227	V143-T154 CarbonylContact C-O 3.42Å; V143-T154 WeakPolarHBondContact CA-O 3.07Å; F144-T154 PolarHBondContact N-O 3.01Å; F144-T154 PolarHBondContact O-N 3.49Å; T154-V168 HydrophobicContact CG2-CG1 3.88Å; T154-S169 CarbonylContact C-O 3.5Å; T154-S169 WeakPolarHBondContact CA-O 3.47Å; T154-L203 HydrophobicContact CG2-CD1 3.97Å; T154-L203 VanDerWaalsContact O-CD1 3.28Å; T154-L203 WeakPolarHBondContact O-CD1 3.24Å; T154-L227 HydrophobicContact CG2-CD1 4.49Å
155	A	72.5	Confident	67.3	Low	3 Å²	3	44.6 Å²	44.6	3%	0.025	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	138.5	169.5	0	0	0	0	0	110.8	L141 G142 V143 F157 V168 S169 F171	L141-A155 HydrophobicContact CD1-CB 4.49Å; G142-A155 CarbonylContact O-C 3.38Å; G142-A155 VanDerWaalsContact O-CA 3.26Å; G142-A155 WeakPolarHBondContact O-CA 3.34Å; V143-A155 HydrophobicContact CG2-CB 4.19Å; A155-F157 HydrophobicContact CB-CD1 4.44Å; A155-V168 CarbonylContact O-C 3.51Å; A155-V168 WeakPolarHBondContact O-CA 3.22Å; A155-S169 PolarHBondContact N-O 2.86Å; A155-S169 PolarHBondContact O-N 2.86Å; A155-F171 HydrophobicContact CB-CD2 4.25Å; A155-F171 HydrophobicContact CB-CE2 3.69Å
156	A	73.6	Confident	67.5	Low	0 Å²	0	44 Å²	44	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.6	172.8	0	0	0	0	0	108.7	L141 G142 L166 I167 V168 V201 L203	L141-A156 WeakPolarHBondContact CA-O 3.44Å; G142-A156 PolarHBondContact N-O 3.47Å; G142-A156 PolarHBondContact O-N 3.27Å; A156-L166 HydrophobicContact CB-CD1 4.46Å; A156-I167 CarbonylContact C-O 3.56Å; A156-I167 VanDerWaalsContact CA-O 3.28Å; A156-I167 WeakPolarHBondContact CA-O 3.23Å; A156-V168 HydrophobicContact CB-CG2 3.67Å; A156-V201 HydrophobicContact CB-CG1 3.61Å; A156-V201 WeakPolarHBondContact O-CG1 3.17Å; A156-L203 HydrophobicContact CB-CD1 4.17Å; A156-L203 HydrophobicContact CB-CD2 3.73Å; A156-L203 HydrophobicContact CB-CG 3.86Å
157	F	69.3	Low	67.6	Low	0 Å²	0	42 Å²	42	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	141.5	-176.9	53.9	-85	0	0	0	112	C140 L141 A155 T159 I167	C140-F157 VanDerWaalsContact O-CA 3.3Å; C140-F157 WeakPolarHBondContact O-CA 3.37Å; L141-F157 HydrophobicContact CD1-CB 4.05Å; A155-F157 HydrophobicContact CB-CD1 4.44Å; F157-T159 HydrophobicContact CE2-CG2 4.42Å; F157-I167 HydrophobicContact CD2-CB 4.21Å; F157-I167 HydrophobicContact CE1-CB 4.14Å; F157-I167 HydrophobicContact CE1-CG2 3.84Å; F157-I167 HydrophobicContact CE2-CB 3.76Å; F157-I167 HydrophobicContact CE2-CD1 4Å; F157-I167 HydrophobicContact CE2-CG1 4.32Å; F157-I167 HydrophobicContact CE2-CG2 4.06Å; F157-I167 HydrophobicContact CZ-CB 3.71Å; F157-I167 HydrophobicContact CZ-CD1 4.3Å; F157-I167 HydrophobicContact CZ-CG2 3.49Å; F157-I167 VanDerWaalsContact CZ-CG2 3.49Å; F157-I167 PolarHBondContact N-O 2.82Å; F157-I167 PolarHBondContact O-N 2.97Å
158	A	65.4	Low	67.9	Low	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	148.8	167.8	0	0	0	0	0	109.7	C140 A163 T165 I198 V201 V470	C140-A158 HydrophobicContact CB-CB 4.1Å; C140-A158 PolarHBondContact O-N 3.16Å; A158-A163 HydrophobicContact CB-CB 4.18Å; A158-T165 CarbonylContact C-O 3.57Å; A158-T165 VanDerWaalsContact CA-O 3.3Å; A158-T165 WeakPolarHBondContact CA-O 3.27Å; A158-I198 HydrophobicContact CB-CB 3.75Å; A158-I198 HydrophobicContact CB-CD1 4.06Å; A158-I198 HydrophobicContact CB-CG2 3.96Å; A158-V201 HydrophobicContact CB-CG2 4.39Å; A158-V470 HydrophobicContact CB-CG2 4.19Å; A158-V470 WeakPolarHBondContact O-CG2 3.28Å
159	T	60.9	Low	68.1	Low	29 Å²	29	32.1 Å²	32.1	18%	0.178	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	178	179.1	-169.2	0	0	0	0	111.5	F157 A163 K164 T165 I167	F157-T159 HydrophobicContact CE2-CG2 4.42Å; T159-A163 CarbonylContact O-C 3.52Å; T159-A163 WeakPolarHBondContact O-CA 3.29Å; T159-K164 PolarHBondContact O-N 2.79Å; T159-T165 HydrophobicContact CG2-CG2 4.23Å; T159-T165 PolarHBondContact N-O 3.16Å; T159-T165 WeakPolarHBondContact O-CB 3.38Å; T159-T165 PolarHBondContact O-N 3.38Å; T159-I167 HydrophobicContact CG2-CD1 3.39Å; T159-I167 HydrophobicContact CG2-CG1 3.63Å
160	G	51.5	Low	68.2	Low	35 Å²	35	27.2 Å²	27.2	36%	0.361	17%	0.173	S	C	.	.	S	Bend	trans	88.5	165.8	-172	0	0	0	0	0	112.6	Q162 A163	G160-Q162 PolarHBondContact O-N 2.93Å; G160-A163 PolarHBondContact O-N 2.74Å
161	S	49.1	Very low	68.4	Low	93 Å²	93	24.3 Å²	24.3	65%	0.65	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-7.5	-174.1	59.3	0	0	0	0	115.4
162	Q	59.9	Low	68.5	Low	109 Å²	109	26.8 Å²	26.8	51%	0.509	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-134	17	178	-66.4	-173.8	-20.6	0	0	112	G160 K164 E197	G160-Q162 PolarHBondContact O-N 2.93Å; Q162-K164 HydrophobicContact CB-CD 4.02Å; Q162-K164 HydrophobicContact CB-CG 3.72Å; Q162-K164 WeakPolarHBondContact O-CG 3.21Å; Q162-K164 PolarHBondContact O-N 2.89Å; Q162-E197 WeakPolarHBondContact O-CG 3.39Å
163	A	64.3	Low	68.1	Low	2 Å²	2	26.7 Å²	26.7	2%	0.017	16%	0.156	C	C	.	.	S	Bend	trans	49.7	29.7	-172.4	0	0	0	0	0	114.7	A158 T159 G160 E197 I198 V470	A158-A163 HydrophobicContact CB-CB 4.18Å; T159-A163 CarbonylContact O-C 3.52Å; T159-A163 WeakPolarHBondContact O-CA 3.29Å; G160-A163 PolarHBondContact O-N 2.74Å; A163-E197 HydrophobicContact CB-CG 3.88Å; A163-I198 VanDerWaalsContact O-CB 3.26Å; A163-I198 WeakPolarHBondContact O-CB 3.42Å; A163-I198 WeakPolarHBondContact O-CG1 3.44Å; A163-I198 PolarHBondContact O-N 2.86Å; A163-V470 HydrophobicContact CB-CB 4.14Å; A163-V470 HydrophobicContact CB-CG1 3.3Å
164	K	68.8	Low	67.9	Low	62 Å²	62	28.3 Å²	28.3	27%	0.27	17%	0.166	S	C	.	.			trans	-89.6	-3.3	-176.5	-66.1	-166	176	-177.3	0	114.1	T159 Q162 R193 F194 D195 S196	T159-K164 PolarHBondContact O-N 2.79Å; Q162-K164 HydrophobicContact CB-CD 4.02Å; Q162-K164 HydrophobicContact CB-CG 3.72Å; Q162-K164 WeakPolarHBondContact O-CG 3.21Å; Q162-K164 PolarHBondContact O-N 2.89Å; K164-R193 WeakPolarHBondContact O-CA 3.44Å; K164-F194 WeakPolarHBondContact CB-O 3.41Å; K164-F194 PolarHBondContact O-N 3.04Å; K164-D195 WeakPolarHBondContact CE-O 3.46Å; K164-D195 PolarHBondContact NZ-O 2.92Å; K164-S196 WeakPolarHBondContact CG-O 3.08Å
165	T	65.5	Low	67.5	Low	24 Å²	24	32.9 Å²	32.9	15%	0.147	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	118.6	-178.7	-53.4	0	0	0	0	109.1	A158 T159 I167 D191 W192 R193	A158-T165 CarbonylContact C-O 3.57Å; A158-T165 VanDerWaalsContact CA-O 3.3Å; A158-T165 WeakPolarHBondContact CA-O 3.27Å; T159-T165 HydrophobicContact CG2-CG2 4.23Å; T159-T165 PolarHBondContact N-O 3.16Å; T159-T165 WeakPolarHBondContact O-CB 3.38Å; T159-T165 PolarHBondContact O-N 3.38Å; T165-I167 HydrophobicContact CG2-CG1 4.27Å; T165-D191 HydrophobicContact CG2-CB 4.12Å; T165-W192 CarbonylContact C-O 3.12Å; T165-W192 WeakPolarHBondContact CA-O 3.3Å; T165-W192 WeakPolarHBondContact CG2-O 3.45Å; T165-R193 HydrophobicContact CG2-CG 4.38Å
166	L	74	Confident	66.9	Low	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	128.7	168	-180	66.7	0	0	0	107.9	A156 V168 D191 W192 F194 I198 V201 L214 V225	A156-L166 HydrophobicContact CB-CD1 4.46Å; L166-V168 HydrophobicContact CG-CG2 4.47Å; L166-D191 CarbonylContact O-C 3.57Å; L166-D191 VanDerWaalsContact O-CA 3.25Å; L166-D191 WeakPolarHBondContact O-CA 3.3Å; L166-W192 HydrophobicContact CB-CE3 4Å; L166-W192 HydrophobicContact CD2-CE3 3.74Å; L166-W192 HydrophobicContact CD2-CZ3 4.07Å; L166-W192 HydrophobicContact CG-CE3 3.83Å; L166-W192 HydrophobicContact CG-CZ3 4.16Å; L166-W192 PolarHBondContact N-O 2.75Å; L166-W192 PolarHBondContact O-N 3.44Å; L166-F194 HydrophobicContact CB-CD2 4.48Å; L166-F194 HydrophobicContact CB-CE2 3.7Å; L166-F194 HydrophobicContact CD2-CE2 4.5Å; L166-I198 HydrophobicContact CB-CD1 3.75Å; L166-V201 HydrophobicContact CD1-CG1 3.99Å; L166-V201 HydrophobicContact CD1-CG2 3.91Å; L166-L214 HydrophobicContact CD2-CD2 3.92Å; L166-V225 HydrophobicContact CD2-CG2 4.36Å
167	I	71.5	Confident	66.4	Low	19 Å²	19	43.9 Å²	43.9	10%	0.097	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.9	167.6	-64.7	-176.3	0	0	0	108	A156 F157 T159 T165 S169 A189 V190 D191	A156-I167 CarbonylContact C-O 3.56Å; A156-I167 VanDerWaalsContact CA-O 3.28Å; A156-I167 WeakPolarHBondContact CA-O 3.23Å; F157-I167 HydrophobicContact CD2-CB 4.21Å; F157-I167 HydrophobicContact CE1-CB 4.14Å; F157-I167 HydrophobicContact CE1-CG2 3.84Å; F157-I167 HydrophobicContact CE2-CB 3.76Å; F157-I167 HydrophobicContact CE2-CD1 4Å; F157-I167 HydrophobicContact CE2-CG1 4.32Å; F157-I167 HydrophobicContact CE2-CG2 4.06Å; F157-I167 HydrophobicContact CZ-CB 3.71Å; F157-I167 HydrophobicContact CZ-CD1 4.3Å; F157-I167 HydrophobicContact CZ-CG2 3.49Å; F157-I167 VanDerWaalsContact CZ-CG2 3.49Å; F157-I167 PolarHBondContact N-O 2.82Å; F157-I167 PolarHBondContact O-N 2.97Å; T159-I167 HydrophobicContact CG2-CD1 3.39Å; T159-I167 HydrophobicContact CG2-CG1 3.63Å; T165-I167 HydrophobicContact CG2-CG1 4.27Å; I167-S169 VanDerWaalsContact CG2-OG 3.27Å; I167-S169 WeakPolarHBondContact CG2-OG 3.47Å; I167-A189 HydrophobicContact CG2-CB 4.5Å; I167-V190 CarbonylContact C-O 3.58Å; I167-V190 WeakPolarHBondContact CA-O 3.29Å; I167-D191 HydrophobicContact CG1-CB 3.87Å
168	V	74	Confident	65.6	Low	16 Å²	16	50.6 Å²	50.6	10%	0.097	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.6	165.1	174.2	0	0	0	0	107.9	T154 A155 A156 L166 A189 V190 W192 L227	T154-V168 HydrophobicContact CG2-CG1 3.88Å; A155-V168 CarbonylContact O-C 3.51Å; A155-V168 WeakPolarHBondContact O-CA 3.22Å; A156-V168 HydrophobicContact CB-CG2 3.67Å; L166-V168 HydrophobicContact CG-CG2 4.47Å; V168-A189 CarbonylContact O-C 3.48Å; V168-A189 WeakPolarHBondContact O-CA 3.17Å; V168-V190 PolarHBondContact N-O 3.23Å; V168-V190 PolarHBondContact O-N 2.92Å; V168-W192 HydrophobicContact CB-CH2 3.8Å; V168-W192 HydrophobicContact CB-CZ3 3.66Å; V168-W192 HydrophobicContact CG2-CH2 3.86Å; V168-W192 HydrophobicContact CG2-CZ3 3.41Å; V168-W192 VanDerWaalsContact CG2-CZ3 3.41Å; V168-L227 HydrophobicContact CB-CD2 4.22Å; V168-L227 HydrophobicContact CG1-CD1 4.02Å; V168-L227 HydrophobicContact CG1-CD2 3.99Å; V168-L227 HydrophobicContact CG2-CD2 3.74Å
169	S	72.2	Confident	64.8	Low	1 Å²	1	53.8 Å²	53.8	1%	0.007	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	139	-175.3	-64.3	0	0	0	0	110.9	T154 A155 I167 Q186 S188	T154-S169 CarbonylContact C-O 3.5Å; T154-S169 WeakPolarHBondContact CA-O 3.47Å; A155-S169 PolarHBondContact N-O 2.86Å; A155-S169 PolarHBondContact O-N 2.86Å; I167-S169 VanDerWaalsContact CG2-OG 3.27Å; I167-S169 WeakPolarHBondContact CG2-OG 3.47Å; S169-Q186 PolarHBondContact OG-NE2 3.45Å; S169-S188 CarbonylContact C-O 3.54Å; S169-S188 VanDerWaalsContact CA-O 3.22Å; S169-S188 WeakPolarHBondContact CA-O 3.35Å; S169-S188 WeakPolarHBondContact CB-O 3.25Å
170	A	74.7	Confident	64.5	Low	25 Å²	25	61.2 Å²	61.2	21%	0.207	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	134.1	166.6	0	0	0	0	0	108.7	V153 V187 S188	V153-A170 CarbonylContact O-C 3.59Å; V153-A170 WeakPolarHBondContact O-CA 3.39Å; A170-V187 PolarHBondContact O-N 2.79Å; A170-S188 PolarHBondContact N-O 3.34Å; A170-S188 PolarHBondContact O-N 2.91Å
171	F	71.3	Confident	64.4	Low	4 Å²	4	62.2 Å²	62.2	2%	0.018	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	150.1	177.6	-58.3	-96.7	0	0	0	109.7	S152 V153 A155 L184 E185 Q186 L446 F450	S152-F171 WeakPolarHBondContact CA-O 3.26Å; V153-F171 HydrophobicContact CB-CB 4.23Å; V153-F171 PolarHBondContact N-O 3.4Å; V153-F171 PolarHBondContact O-N 3.35Å; A155-F171 HydrophobicContact CB-CD2 4.25Å; A155-F171 HydrophobicContact CB-CE2 3.69Å; F171-L184 HydrophobicContact CB-CD2 3.83Å; F171-L184 HydrophobicContact CD1-CB 4.19Å; F171-L184 HydrophobicContact CG-CD2 4.47Å; F171-E185 CarbonylContact C-O 3.33Å; F171-E185 WeakPolarHBondContact CA-O 3.19Å; F171-Q186 HydrophobicContact CD1-CB 3.89Å; F171-Q186 HydrophobicContact CE1-CB 3.76Å; F171-Q186 HydrophobicContact CE1-CG 4.3Å; F171-L446 HydrophobicContact CD1-CD1 4.38Å; F171-L446 HydrophobicContact CE1-CD1 3.71Å; F171-L446 HydrophobicContact CE1-CD2 3.78Å; F171-L446 HydrophobicContact CE1-CG 4.4Å; F171-L446 HydrophobicContact CZ-CD2 4.06Å; F171-F450 HydrophobicContact CZ-CE2 4.48Å; F171-F450 HydrophobicContact CZ-CZ 4.16Å
172	E	74.3	Confident	64.8	Low	97 Å²	97	59.4 Å²	59.4	45%	0.453	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.3	165.4	-79.9	173.4	-172.1	0	0	108.9	A151 T174 E185 V187	A151-E172 CarbonylContact O-C 3.45Å; A151-E172 VanDerWaalsContact O-CA 3.27Å; A151-E172 WeakPolarHBondContact O-CA 3.39Å; E172-T174 PolarHBondContact O-N 3.4Å; E172-E185 PolarHBondContact N-O 3.22Å; E172-E185 PolarHBondContact O-N 2.79Å; E172-V187 HydrophobicContact CB-CG2 3.96Å; E172-V187 HydrophobicContact CG-CG2 3.59Å
173	I	68.9	Low	64.6	Low	18 Å²	18	55 Å²	55	9%	0.092	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	112	168.6	-57.1	171.5	0	0	0	106.4	A151 V153 Q182 T183 L184 L460 I464	A151-I173 HydrophobicContact CB-CB 4.4Å; A151-I173 PolarHBondContact O-N 3.48Å; V153-I173 HydrophobicContact CG2-CD1 3.82Å; V153-I173 HydrophobicContact CG2-CG1 3.95Å; I173-Q182 HydrophobicContact CG2-CB 3.96Å; I173-Q182 HydrophobicContact CG2-CG 4.04Å; I173-T183 CarbonylContact C-O 3.49Å; I173-T183 VanDerWaalsContact CA-O 3.28Å; I173-T183 WeakPolarHBondContact CA-O 3.14Å; I173-L184 HydrophobicContact CG1-CD2 3.73Å; I173-L460 HydrophobicContact CD1-CD1 4.15Å; I173-I464 HydrophobicContact CD1-CD1 3.95Å; I173-I464 HydrophobicContact CG1-CD1 4.21Å; I173-I464 HydrophobicContact CG2-CD1 4.09Å
174	T	68.3	Low	64.5	Low	36 Å²	36	55.2 Å²	55.2	22%	0.221	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	144	174.8	57.9	0	0	0	0	109.5	E172 Q182 T183 E185	E172-T174 PolarHBondContact O-N 3.4Å; T174-Q182 CarbonylContact O-C 3.6Å; T174-Q182 WeakPolarHBondContact O-CA 3.48Å; T174-T183 PolarHBondContact N-O 3Å; T174-T183 PolarHBondContact O-N 2.95Å; T174-T183 PolarHBondContact OG1-OG1 3.24Å; T174-E185 HydrophobicContact CG2-CG 4.33Å; T174-E185 PolarHBondContact OG1-OE1 2.66Å
175	D	66.9	Low	64.3	Low	118 Å²	118	57 Å²	57	63%	0.631	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	122.5	169.4	-67.4	-36.7	0	0	0	108.3	E177 Q182	D175-E177 PolarHBondContact O-N 2.77Å; D175-Q182 WeakPolarHBondContact OD1-CG 3.22Å
176	D	61.1	Low	64.3	Low	49 Å²	49	58.4 Å²	58.4	26%	0.262	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	105.7	168.1	177.6	-12.6	0	0	0	108.1	D178 T179 K180 L181 T183	D176-D178 PolarHBondContact O-N 3.26Å; D176-D178 WeakPolarHBondContact OD1-CB 3.4Å; D176-D178 PolarHBondContact OD1-N 3.02Å; D176-T179 VanDerWaalsContact CB-OG1 3.32Å; D176-T179 WeakPolarHBondContact CB-OG1 3.31Å; D176-T179 PolarHBondContact O-N 2.81Å; D176-T179 PolarHBondContact OD1-N 2.95Å; D176-T179 VanDerWaalsContact OD2-CG2 3.32Å; D176-T179 WeakPolarHBondContact OD2-CG2 3.22Å; D176-T179 PolarHBondContact OD2-OG1 2.74Å; D176-K180 VanDerWaalsContact O-CA 3.25Å; D176-K180 WeakPolarHBondContact O-CA 3.44Å; D176-K180 PolarHBondContact O-N 2.89Å; D176-L181 WeakPolarHBondContact CB-O 3.29Å; D176-L181 PolarHBondContact N-O 2.65Å; D176-T183 HydrophobicContact CB-CG2 3.73Å
177	E	63.7	Low	64.4	Low	184 Å²	184	62.4 Å²	62.4	86%	0.86	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-29	-179.1	-66.3	-163.5	169.3	0	0	112.8	D175	D175-E177 PolarHBondContact O-N 2.77Å
178	D	51.3	Low	64.5	Low	141 Å²	141	64.7 Å²	64.7	75%	0.754	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-41.3	-177	-70.3	-30.8	0	0	0	111.4	D176	D176-D178 PolarHBondContact O-N 3.26Å; D176-D178 WeakPolarHBondContact OD1-CB 3.4Å; D176-D178 PolarHBondContact OD1-N 3.02Å
179	T	49.6	Very low	64.3	Low	67 Å²	67	66.4 Å²	66.4	41%	0.411	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-13.2	-177.2	64.6	0	0	0	0	113.8	D176 L181	D176-T179 VanDerWaalsContact CB-OG1 3.32Å; D176-T179 WeakPolarHBondContact CB-OG1 3.31Å; D176-T179 PolarHBondContact O-N 2.81Å; D176-T179 PolarHBondContact OD1-N 2.95Å; D176-T179 VanDerWaalsContact OD2-CG2 3.32Å; D176-T179 WeakPolarHBondContact OD2-CG2 3.22Å; D176-T179 PolarHBondContact OD2-OG1 2.74Å; T179-L181 PolarHBondContact O-N 3.15Å; T179-L181 WeakPolarHBondContact OG1-CB 3.19Å; T179-L181 PolarHBondContact OG1-N 3.04Å
180	K	54	Low	64.2	Low	186 Å²	186	69 Å²	69	81%	0.809	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	24.5	-168.2	-56.8	-175.4	177.2	-175.5	0	113.1	D176	D176-K180 VanDerWaalsContact O-CA 3.25Å; D176-K180 WeakPolarHBondContact O-CA 3.44Å; D176-K180 PolarHBondContact O-N 2.89Å
181	L	50.1	Low	64.2	Low	56 Å²	56	71.6 Å²	71.6	29%	0.293	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	148.4	173.4	-63	173.3	0	0	0	108.5	D176 T179	D176-L181 WeakPolarHBondContact CB-O 3.29Å; D176-L181 PolarHBondContact N-O 2.65Å; T179-L181 PolarHBondContact O-N 3.15Å; T179-L181 WeakPolarHBondContact OG1-CB 3.19Å; T179-L181 PolarHBondContact OG1-N 3.04Å
182	Q	56.8	Low	64.3	Low	34 Å²	34	72.6 Å²	72.6	16%	0.159	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	154.8	163	-72.6	178.7	-26.5	0	0	108.3	I173 T174 D175 A440 A441 I464	I173-Q182 HydrophobicContact CG2-CB 3.96Å; I173-Q182 HydrophobicContact CG2-CG 4.04Å; T174-Q182 CarbonylContact O-C 3.6Å; T174-Q182 WeakPolarHBondContact O-CA 3.48Å; D175-Q182 WeakPolarHBondContact OD1-CG 3.22Å; Q182-A440 CarbonylContact O-C 3.6Å; Q182-A440 WeakPolarHBondContact O-CA 3.05Å; Q182-A441 PolarHBondContact O-N 2.97Å; Q182-I464 HydrophobicContact CB-CD1 4.2Å
183	T	55.4	Low	64.3	Low	16 Å²	16	77.9 Å²	77.9	10%	0.098	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	151	172.7	88	0	0	0	0	109.4	I173 T174 D176 A441	I173-T183 CarbonylContact C-O 3.49Å; I173-T183 VanDerWaalsContact CA-O 3.28Å; I173-T183 WeakPolarHBondContact CA-O 3.14Å; T174-T183 PolarHBondContact N-O 3Å; T174-T183 PolarHBondContact O-N 2.95Å; T174-T183 PolarHBondContact OG1-OG1 3.24Å; D176-T183 HydrophobicContact CB-CG2 3.73Å; T183-A441 HydrophobicContact CG2-CB 3.74Å
184	L	62.1	Low	64.5	Low	7 Å²	7	78.2 Å²	78.2	4%	0.037	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	105.5	176.7	-81.2	166.8	0	0	0	108.4	V153 F171 I173 A440 P443 L460 I464 V466	V153-L184 HydrophobicContact CB-CD2 4.39Å; V153-L184 HydrophobicContact CG2-CD2 4.24Å; F171-L184 HydrophobicContact CB-CD2 3.83Å; F171-L184 HydrophobicContact CD1-CB 4.19Å; F171-L184 HydrophobicContact CG-CD2 4.47Å; I173-L184 HydrophobicContact CG1-CD2 3.73Å; L184-A440 HydrophobicContact CB-CB 4.05Å; L184-A440 HydrophobicContact CD1-CB 3.64Å; L184-A440 HydrophobicContact CG-CB 3.57Å; L184-P443 VanDerWaalsContact O-CD 3.28Å; L184-P443 WeakPolarHBondContact O-CD 3.38Å; L184-L460 HydrophobicContact CD2-CD1 4.38Å; L184-I464 HydrophobicContact CD1-CG2 4.16Å; L184-V466 HydrophobicContact CD1-CG2 4.21Å
185	E	64.8	Low	64.9	Low	98 Å²	98	84.2 Å²	84.2	46%	0.458	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	116	178.7	-69.9	-174.4	-153.8	0	0	110.1	F171 E172 T174 V187	F171-E185 CarbonylContact C-O 3.33Å; F171-E185 WeakPolarHBondContact CA-O 3.19Å; E172-E185 PolarHBondContact N-O 3.22Å; E172-E185 PolarHBondContact O-N 2.79Å; T174-E185 HydrophobicContact CG2-CG 4.33Å; T174-E185 PolarHBondContact OG1-OE1 2.66Å; E185-V187 PolarHBondContact O-N 3.26Å; E185-V187 VanDerWaalsContact O-N 3.14Å
186	Q	65.3	Low	65.3	Low	54 Å²	54	79.1 Å²	79.1	25%	0.252	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	110.7	175.8	178.9	176.1	43.5	0	0	110.1	S169 F171 A189 L446 R449	S169-Q186 PolarHBondContact OG-NE2 3.45Å; F171-Q186 HydrophobicContact CD1-CB 3.89Å; F171-Q186 HydrophobicContact CE1-CB 3.76Å; F171-Q186 HydrophobicContact CE1-CG 4.3Å; Q186-A189 VanDerWaalsContact NE2-CB 3.27Å; Q186-L446 HydrophobicContact CB-CD1 3.93Å; Q186-R449 VanDerWaalsContact OE1-NH1 3.16Å
187	V	76	Confident	65.9	Low	85 Å²	85	78.8 Å²	78.8	52%	0.515	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-40.4	178.4	-178.2	0	0	0	0	110.7	A170 E172 E185	A170-V187 PolarHBondContact O-N 2.79Å; E172-V187 HydrophobicContact CB-CG2 3.96Å; E172-V187 HydrophobicContact CG-CG2 3.59Å; E185-V187 PolarHBondContact O-N 3.26Å; E185-V187 VanDerWaalsContact O-N 3.14Å
188	S	73.4	Confident	66.2	Low	66 Å²	66	70 Å²	70	46%	0.462	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	158.8	-179.9	68.1	0	0	0	0	111.8	S169 A170	S169-S188 CarbonylContact C-O 3.54Å; S169-S188 VanDerWaalsContact CA-O 3.22Å; S169-S188 WeakPolarHBondContact CA-O 3.35Å; S169-S188 WeakPolarHBondContact CB-O 3.25Å; A170-S188 PolarHBondContact N-O 3.34Å; A170-S188 PolarHBondContact O-N 2.91Å
189	A	70	Confident	67.2	Low	53 Å²	53	63.5 Å²	63.5	44%	0.438	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	143.7	177.4	0	0	0	0	0	109.8	I167 V168 Q186	I167-A189 HydrophobicContact CG2-CB 4.5Å; V168-A189 CarbonylContact O-C 3.48Å; V168-A189 WeakPolarHBondContact O-CA 3.17Å; Q186-A189 VanDerWaalsContact NE2-CB 3.27Å
190	V	69.9	Low	68.4	Low	54 Å²	54	60.8 Å²	60.8	33%	0.327	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	139.9	167.7	-169.3	0	0	0	0	107.8	I167 V168 W192	I167-V190 CarbonylContact C-O 3.58Å; I167-V190 WeakPolarHBondContact CA-O 3.29Å; V168-V190 PolarHBondContact N-O 3.23Å; V168-V190 PolarHBondContact O-N 2.92Å; V190-W192 HydrophobicContact CB-CH2 3.71Å; V190-W192 HydrophobicContact CB-CZ2 3.68Å; V190-W192 HydrophobicContact CB-CZ3 4.48Å; V190-W192 HydrophobicContact CG1-CH2 3.84Å; V190-W192 HydrophobicContact CG1-CZ2 3.25Å
191	D	74.3	Confident	69.4	Low	81 Å²	81	52 Å²	52	43%	0.433	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	147.8	-179	69.1	-32.6	0	0	0	112.7	T165 L166 I167	T165-D191 HydrophobicContact CG2-CB 4.12Å; L166-D191 CarbonylContact O-C 3.57Å; L166-D191 VanDerWaalsContact O-CA 3.25Å; L166-D191 WeakPolarHBondContact O-CA 3.3Å; I167-D191 HydrophobicContact CG1-CB 3.87Å
192	W	73	Confident	70.8	Confident	24 Å²	24	51 Å²	51	9%	0.091	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	138.9	176.6	-56	-76.8	0	0	0	110.1	T165 L166 V168 V190 F194 L227 T234 F236	T165-W192 CarbonylContact C-O 3.12Å; T165-W192 WeakPolarHBondContact CA-O 3.3Å; T165-W192 WeakPolarHBondContact CG2-O 3.45Å; L166-W192 HydrophobicContact CB-CE3 4Å; L166-W192 HydrophobicContact CD2-CE3 3.74Å; L166-W192 HydrophobicContact CD2-CZ3 4.07Å; L166-W192 HydrophobicContact CG-CE3 3.83Å; L166-W192 HydrophobicContact CG-CZ3 4.16Å; L166-W192 PolarHBondContact N-O 2.75Å; L166-W192 PolarHBondContact O-N 3.44Å; V168-W192 HydrophobicContact CB-CH2 3.8Å; V168-W192 HydrophobicContact CB-CZ3 3.66Å; V168-W192 HydrophobicContact CG2-CH2 3.86Å; V168-W192 HydrophobicContact CG2-CZ3 3.41Å; V168-W192 VanDerWaalsContact CG2-CZ3 3.41Å; V190-W192 HydrophobicContact CB-CH2 3.71Å; V190-W192 HydrophobicContact CB-CZ2 3.68Å; V190-W192 HydrophobicContact CB-CZ3 4.48Å; V190-W192 HydrophobicContact CG1-CH2 3.84Å; V190-W192 HydrophobicContact CG1-CZ2 3.25Å; W192-F194 HydrophobicContact CB-CE2 3.87Å; W192-F194 HydrophobicContact CB-CZ 4.31Å; W192-L227 HydrophobicContact CH2-CD2 4.3Å; W192-T234 VanDerWaalsContact CE2-OG1 3.31Å; W192-T234 HydrophobicContact CH2-CG2 4Å; W192-T234 HydrophobicContact CZ2-CG2 3.18Å; W192-T234 PolarHBondContact NE1-OG1 2.83Å; W192-F236 HydrophobicContact CB-CE1 4.22Å; W192-F236 HydrophobicContact CB-CZ 3.97Å; W192-F236 AromaticContact CD1-CZ 3.28Å; W192-F236 HydrophobicContact CG-CE1 4.06Å; W192-F236 AromaticContact CG-CZ 3.68Å; W192-F236 HydrophobicContact CG-CZ 3.68Å
193	R	76.2	Confident	71.6	Confident	208 Å²	208	50.1 Å²	50.1	79%	0.785	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	137.7	175.7	-65.3	-176.2	-178.9	177.7	0.2	110.4	K164 T165	K164-R193 WeakPolarHBondContact O-CA 3.44Å; T165-R193 HydrophobicContact CG2-CG 4.38Å
194	F	73	Confident	72.5	Confident	25 Å²	25	49.9 Å²	49.9	11%	0.11	26%	0.259	C	S	.	.			trans	-115.9	155.4	176.2	-63.3	-94.3	0	0	0	109.5	K164 L166 W192 S196 I198 L214 L216 F236	K164-F194 WeakPolarHBondContact CB-O 3.41Å; K164-F194 PolarHBondContact O-N 3.04Å; L166-F194 HydrophobicContact CB-CD2 4.48Å; L166-F194 HydrophobicContact CB-CE2 3.7Å; L166-F194 HydrophobicContact CD2-CE2 4.5Å; W192-F194 HydrophobicContact CB-CE2 3.87Å; W192-F194 HydrophobicContact CB-CZ 4.31Å; F194-S196 PolarHBondContact O-N 2.94Å; F194-I198 HydrophobicContact CD2-CD1 3.72Å; F194-I198 HydrophobicContact CD2-CG1 4.08Å; F194-I198 HydrophobicContact CE2-CD1 4.04Å; F194-I198 HydrophobicContact CG-CG1 4.48Å; F194-L214 HydrophobicContact CD1-CD1 4.32Å; F194-L214 HydrophobicContact CE1-CD1 3.83Å; F194-L214 HydrophobicContact CE1-CD2 3.81Å; F194-L214 HydrophobicContact CE2-CD2 4.18Å; F194-L214 HydrophobicContact CZ-CD1 4.1Å; F194-L214 HydrophobicContact CZ-CD2 3.36Å; F194-L214 HydrophobicContact CZ-CG 4.4Å; F194-L216 HydrophobicContact CB-CD2 3.99Å; F194-L216 HydrophobicContact CD1-CD1 4.16Å; F194-L216 HydrophobicContact CD1-CD2 3.91Å; F194-L216 HydrophobicContact CG-CD2 3.99Å; F194-F236 HydrophobicContact CE1-CD1 4.49Å; F194-F236 HydrophobicContact CE1-CE1 4.13Å; F194-F236 HydrophobicContact CZ-CD1 4.47Å; F194-F236 AromaticContact CZ-CE1 3.82Å; F194-F236 HydrophobicContact CZ-CE1 3.82Å
195	D	75.8	Confident	72.6	Confident	163 Å²	163	55.2 Å²	55.2	87%	0.872	28%	0.283	S	S	*	.	S	Bend	trans	-75	-12.7	177.1	-64.6	-36.8	0	0	0	112.2	K164	K164-D195 WeakPolarHBondContact CE-O 3.46Å; K164-D195 PolarHBondContact NZ-O 2.92Å
196	S	75.4	Confident	72.4	Confident	10 Å²	10	56.2 Å²	56.2	7%	0.07	29%	0.286	C	S	.	.	S	Bend	trans	-129.2	156.5	-171.5	-159.6	0	0	0	0	113	K164 F194 I198 E218	K164-S196 WeakPolarHBondContact CG-O 3.08Å; F194-S196 PolarHBondContact O-N 2.94Å; S196-I198 PolarHBondContact O-N 3.4Å; S196-E218 WeakPolarHBondContact CB-O 3.46Å; S196-E218 WeakPolarHBondContact OG-CA 3.43Å; S196-E218 PolarHBondContact OG-N 2.97Å; S196-E218 PolarHBondContact OG-O 2.95Å
197	E	73.2	Confident	72	Confident	43 Å²	43	55.1 Å²	55.1	20%	0.201	28%	0.282	C	S	.	.			trans	-61.1	130.7	176.6	-173.5	178.1	-180	0	0	110.2	Q162 A163 V199 L216 A217 R455	Q162-E197 WeakPolarHBondContact O-CG 3.39Å; A163-E197 HydrophobicContact CB-CG 3.88Å; E197-V199 HydrophobicContact CB-CG1 4.34Å; E197-V199 HydrophobicContact CG-CG1 3.94Å; E197-V199 PolarHBondContact O-N 3.12Å; E197-L216 CarbonylContact O-C 3.53Å; E197-L216 WeakPolarHBondContact O-CA 3.35Å; E197-A217 HydrophobicContact CB-CB 4.07Å; E197-A217 PolarHBondContact O-N 3.21Å; E197-R455 IonicContact OE1-CZ 2.61Å; E197-R455 IonicContact OE1-NH1 2.66Å; E197-R455 PolarHBondContact OE1-NH1 2.9Å; E197-R455 IonicContact OE1-NH2 3.17Å; E197-R455 PolarHBondContact OE1-NH2 2.78Å
198	I	71.4	Confident	71.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	114.4	171.2	-56.3	160.6	0	0	0	108	C140 A158 A163 L166 F194 S196 Q200 V201 L214 R215 L216	C140-I198 PolarHBondContact SG-O 2.95Å; C140-I198 VanDerWaalsContact SG-O 3.34Å; A158-I198 HydrophobicContact CB-CB 3.75Å; A158-I198 HydrophobicContact CB-CD1 4.06Å; A158-I198 HydrophobicContact CB-CG2 3.96Å; A163-I198 VanDerWaalsContact O-CB 3.26Å; A163-I198 WeakPolarHBondContact O-CB 3.42Å; A163-I198 WeakPolarHBondContact O-CG1 3.44Å; A163-I198 PolarHBondContact O-N 2.86Å; L166-I198 HydrophobicContact CB-CD1 3.75Å; F194-I198 HydrophobicContact CD2-CD1 3.72Å; F194-I198 HydrophobicContact CD2-CG1 4.08Å; F194-I198 HydrophobicContact CE2-CD1 4.04Å; F194-I198 HydrophobicContact CG-CG1 4.48Å; S196-I198 PolarHBondContact O-N 3.4Å; I198-Q200 WeakPolarHBondContact CG2-O 3.46Å; I198-V201 HydrophobicContact CG2-CG2 3.57Å; I198-L214 HydrophobicContact CG2-CB 4.32Å; I198-R215 CarbonylContact C-O 3.37Å; I198-R215 WeakPolarHBondContact CA-O 3.32Å; I198-L216 HydrophobicContact CG1-CD2 4Å
199	V	71.4	Confident	70.6	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.024	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	-3	-173.1	-66.9	0	0	0	0	112.9	L137 G138 E197 R215 A217	L137-V199 HydrophobicContact CD2-CB 4.31Å; L137-V199 HydrophobicContact CD2-CG1 3.76Å; G138-V199 CarbonylContact C-O 3.51Å; G138-V199 WeakPolarHBondContact CA-O 3.03Å; G138-V199 PolarHBondContact N-O 2.83Å; E197-V199 HydrophobicContact CB-CG1 4.34Å; E197-V199 HydrophobicContact CG-CG1 3.94Å; E197-V199 PolarHBondContact O-N 3.12Å; V199-R215 HydrophobicContact CG2-CB 4.13Å; V199-R215 HydrophobicContact CG2-CG 4.05Å; V199-R215 VanDerWaalsContact CG2-NH1 3.27Å; V199-R215 VanDerWaalsContact CG2-O 3.28Å; V199-R215 WeakPolarHBondContact CG2-O 3.26Å; V199-R215 PolarHBondContact N-O 2.72Å; V199-R215 PolarHBondContact O-NH2 2.69Å; V199-A217 HydrophobicContact CG1-CB 3.8Å; V199-A217 HydrophobicContact CG2-CB 4.48Å
200	Q	75.6	Confident	70.4	Confident	9 Å²	9	58.5 Å²	58.5	4%	0.042	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	142.7	168.6	-166.5	177.2	-13.4	0	0	110.1	N139 I198 L214 R215 V247	N139-Q200 CarbonylContact O-C 3.27Å; N139-Q200 VanDerWaalsContact O-CA 3.25Å; N139-Q200 WeakPolarHBondContact O-CA 3.5Å; I198-Q200 WeakPolarHBondContact CG2-O 3.46Å; Q200-L214 CarbonylContact O-C 3.58Å; Q200-L214 VanDerWaalsContact O-CA 3.24Å; Q200-L214 WeakPolarHBondContact O-CA 3.43Å; Q200-R215 HydrophobicContact CB-CB 3.64Å; Q200-R215 PolarHBondContact O-N 2.87Å; Q200-V247 PolarHBondContact NE2-O 3.31Å
201	V	74.6	Confident	70.6	Confident	1 Å²	1	56 Å²	56	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	129.2	172.9	-178.4	0	0	0	0	108.8	N139 A156 A158 L166 I198 L213	N139-V201 PolarHBondContact O-N 2.95Å; A156-V201 HydrophobicContact CB-CG1 3.61Å; A156-V201 WeakPolarHBondContact O-CG1 3.17Å; A158-V201 HydrophobicContact CB-CG2 4.39Å; L166-V201 HydrophobicContact CD1-CG1 3.99Å; L166-V201 HydrophobicContact CD1-CG2 3.91Å; I198-V201 HydrophobicContact CG2-CG2 3.57Å; V201-L213 WeakPolarHBondContact CA-O 3.37Å
202	E	78.6	Confident	70.7	Confident	36 Å²	36	52.1 Å²	52.1	17%	0.168	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	136.5	174.9	-172.9	179.4	175.7	0	0	109.6	L204 C212 L213	E202-L204 HydrophobicContact CG-CD2 4.34Å; E202-C212 CarbonylContact O-C 3.58Å; E202-C212 WeakPolarHBondContact O-CA 3.41Å; E202-L213 HydrophobicContact CB-CB 4.18Å; E202-L213 HydrophobicContact CB-CD2 4.19Å; E202-L213 PolarHBondContact N-O 2.92Å; E202-L213 PolarHBondContact O-N 2.92Å
203	L	74.9	Confident	71.1	Confident	15 Å²	15	51 Å²	51	8%	0.079	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	134.3	173.4	-76.4	176.2	0	0	0	109.8	G142 F144 T154 A156 C212 L227	G142-L203 WeakPolarHBondContact O-CD1 3.4Å; F144-L203 HydrophobicContact CB-CB 4.25Å; F144-L203 HydrophobicContact CB-CD1 3.84Å; T154-L203 HydrophobicContact CG2-CD1 3.97Å; T154-L203 VanDerWaalsContact O-CD1 3.28Å; T154-L203 WeakPolarHBondContact O-CD1 3.24Å; A156-L203 HydrophobicContact CB-CD1 4.17Å; A156-L203 HydrophobicContact CB-CD2 3.73Å; A156-L203 HydrophobicContact CB-CG 3.86Å; L203-C212 HydrophobicContact CD2-CB 4.09Å; L203-L227 HydrophobicContact CD2-CD1 3.61Å
204	L	72.7	Confident	71.4	Confident	12 Å²	12	41.1 Å²	41.1	6%	0.063	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	114.3	-175.9	-53.5	-175.5	0	0	0	110.7	E202 L207 C211 L224 F249	E202-L204 HydrophobicContact CG-CD2 4.34Å; L204-L207 HydrophobicContact CB-CD1 4.16Å; L204-L207 HydrophobicContact CD1-CD1 3.77Å; L204-C211 HydrophobicContact CB-CB 4.21Å; L204-C211 HydrophobicContact CD1-CB 3.97Å; L204-C211 HydrophobicContact CG-CB 4.33Å; L204-C211 PolarHBondContact N-O 3.23Å; L204-L224 HydrophobicContact CD1-CD2 3.65Å; L204-F249 HydrophobicContact CD1-CD1 3.97Å; L204-F249 HydrophobicContact CD1-CD2 3.79Å; L204-F249 HydrophobicContact CD1-CE1 3.86Å; L204-F249 HydrophobicContact CD1-CE2 3.63Å; L204-F249 HydrophobicContact CD1-CG 3.94Å; L204-F249 HydrophobicContact CD1-CZ 3.67Å; L204-F249 HydrophobicContact CD2-CB 3.56Å; L204-F249 HydrophobicContact CD2-CD1 4.14Å; L204-F249 HydrophobicContact CD2-CD2 3.23Å; L204-F249 HydrophobicContact CD2-CE2 3.91Å; L204-F249 HydrophobicContact CD2-CG 3.34Å; L204-F249 HydrophobicContact CG-CD2 4.14Å; L204-F249 HydrophobicContact CG-CE2 4.38Å; L204-F249 HydrophobicContact CG-CG 4.29Å
205	E	65.2	Low	71.9	Confident	118 Å²	118	40.1 Å²	40.1	55%	0.551	20%	0.204	S	C	*	.	S	Bend	trans	-86.3	-26.7	-172.7	-46.7	-171.1	166	0	0	113.8	F144	F144-E205 HydrophobicContact CD2-CB 4.03Å; F144-E205 VanDerWaalsContact CD2-CD 3.48Å; F144-E205 HydrophobicContact CD2-CG 3.4Å; F144-E205 WeakPolarHBondContact CD2-OE1 3.4Å; F144-E205 HydrophobicContact CE2-CB 3.67Å; F144-E205 HydrophobicContact CE2-CG 3.57Å; F144-E205 HydrophobicContact CG-CG 4.39Å; F144-E205 HydrophobicContact CZ-CB 4.49Å
206	K	59.5	Low	72.2	Confident	119 Å²	119	33.1 Å²	33.1	52%	0.517	17%	0.166	S	C	.	.	S	Bend	trans	-99.2	5.4	-166.6	-69.4	-164.2	169.1	-160.7	0	115.7	P251 A254	K206-P251 WeakPolarHBondContact CD-O 3.43Å; K206-P251 WeakPolarHBondContact CE-O 3.28Å; K206-P251 PolarHBondContact NZ-O 2.88Å; K206-A254 HydrophobicContact CB-CB 4.23Å; K206-A254 VanDerWaalsContact O-CB 3.23Å; K206-A254 WeakPolarHBondContact O-CB 3.04Å
207	L	57.7	Low	72.1	Confident	32 Å²	32	34.3 Å²	34.3	17%	0.168	18%	0.176	C	C	.	.	S	Bend	trans	-91.4	149	175.7	-67.6	172.8	0	0	0	109.3	L204 Q209 C211 A254 L270	L204-L207 HydrophobicContact CB-CD1 4.16Å; L204-L207 HydrophobicContact CD1-CD1 3.77Å; L207-Q209 WeakPolarHBondContact CB-O 3.48Å; L207-Q209 PolarHBondContact O-N 3.46Å; L207-C211 HydrophobicContact CD1-CB 4.04Å; L207-A254 HydrophobicContact CD2-CB 4.38Å; L207-L270 HydrophobicContact CD1-CD1 4.33Å
208	D	57.9	Low	72.5	Confident	140 Å²	140	39.8 Å²	39.8	75%	0.749	20%	0.202	S	C	*	.	S	Bend	trans	-53.3	-19	176.1	-67.6	-25	0	0	0	113	F62	F62-D208 WeakPolarHBondContact CE2-OD2 3.41Å
209	Q	62	Low	72.9	Confident	74 Å²	74	44.5 Å²	44.5	35%	0.346	23%	0.233	S	C	.	.	S	Bend	trans	-130.2	136.5	171	-65	-176.4	-23.5	0	0	110.3	L207 C211	L207-Q209 WeakPolarHBondContact CB-O 3.48Å; L207-Q209 PolarHBondContact O-N 3.46Å; Q209-C211 PolarHBondContact O-N 3.47Å; Q209-C211 PolarHBondContact O-SG 2.81Å
210	P	66.4	Low	73.4	Confident	60 Å²	60	45.8 Å²	45.8	39%	0.39	24%	0.243	S	C	.	.			trans	-60	128.3	174.7	23.6	-30.4	0	0	0	109.6	L227	P210-L227 HydrophobicContact CB-CB 4.27Å; P210-L227 HydrophobicContact CB-CD1 4.3Å; P210-L227 HydrophobicContact CG-CB 4.17Å; P210-L227 VanDerWaalsContact O-CB 3.25Å; P210-L227 WeakPolarHBondContact O-CB 3.24Å; P210-L227 PolarHBondContact O-N 3.03Å
211	C	73.2	Confident	73.8	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.014	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.7	179.9	-67.3	0	0	0	0	109.4	L204 L207 Q209 V225	L204-C211 HydrophobicContact CB-CB 4.21Å; L204-C211 HydrophobicContact CD1-CB 3.97Å; L204-C211 HydrophobicContact CG-CB 4.33Å; L204-C211 PolarHBondContact N-O 3.23Å; L207-C211 HydrophobicContact CD1-CB 4.04Å; Q209-C211 PolarHBondContact O-N 3.47Å; Q209-C211 PolarHBondContact O-SG 2.81Å; C211-V225 CarbonylContact C-O 3.55Å; C211-V225 WeakPolarHBondContact CA-O 3.44Å
212	C	76.6	Confident	74.3	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	118.8	170.8	-177.2	0	0	0	0	108.1	E202 L203 L224 V225 L227	E202-C212 CarbonylContact O-C 3.58Å; E202-C212 WeakPolarHBondContact O-CA 3.41Å; L203-C212 HydrophobicContact CD2-CB 4.09Å; C212-L224 CarbonylContact O-C 3.57Å; C212-L224 WeakPolarHBondContact O-CA 3.48Å; C212-V225 HydrophobicContact CB-CB 4.24Å; C212-V225 PolarHBondContact N-O 3.01Å; C212-V225 PolarHBondContact O-N 3.48Å; C212-L227 HydrophobicContact CB-CD1 4.39Å; C212-L227 HydrophobicContact CB-CD2 4.21Å; C212-L227 HydrophobicContact CB-CG 4.44Å
213	L	81.8	Confident	74.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	136.3	162.3	168.6	68	0	0	0	108	V201 E202 A222 L224 F240 V247 F249	V201-L213 WeakPolarHBondContact CA-O 3.37Å; E202-L213 HydrophobicContact CB-CB 4.18Å; E202-L213 HydrophobicContact CB-CD2 4.19Å; E202-L213 PolarHBondContact N-O 2.92Å; E202-L213 PolarHBondContact O-N 2.92Å; L213-A222 HydrophobicContact CD1-CB 4.03Å; L213-L224 HydrophobicContact CB-CD2 4.31Å; L213-F240 HydrophobicContact CD1-CE1 3.79Å; L213-F240 HydrophobicContact CD1-CZ 3.87Å; L213-V247 HydrophobicContact CD1-CB 4.48Å; L213-V247 HydrophobicContact CD1-CG1 4.29Å; L213-V247 HydrophobicContact CD2-CB 3.82Å; L213-V247 HydrophobicContact CD2-CG1 3.8Å; L213-F249 HydrophobicContact CB-CD2 4.4Å; L213-F249 HydrophobicContact CB-CE2 3.92Å; L213-F249 HydrophobicContact CD1-CE2 4.09Å; L213-F249 HydrophobicContact CD2-CD2 3.97Å; L213-F249 HydrophobicContact CD2-CE2 3.8Å; L213-F249 HydrophobicContact CG-CE2 4.13Å
214	L	81.6	Confident	74.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.7	166	68.1	98.3	0	0	0	110.7	L166 F194 I198 Q200 L216 A222 I223 V225	L166-L214 HydrophobicContact CD2-CD2 3.92Å; F194-L214 HydrophobicContact CD1-CD1 4.32Å; F194-L214 HydrophobicContact CE1-CD1 3.83Å; F194-L214 HydrophobicContact CE1-CD2 3.81Å; F194-L214 HydrophobicContact CE2-CD2 4.18Å; F194-L214 HydrophobicContact CZ-CD1 4.1Å; F194-L214 HydrophobicContact CZ-CD2 3.36Å; F194-L214 HydrophobicContact CZ-CG 4.4Å; I198-L214 HydrophobicContact CG2-CB 4.32Å; Q200-L214 CarbonylContact O-C 3.58Å; Q200-L214 VanDerWaalsContact O-CA 3.24Å; Q200-L214 WeakPolarHBondContact O-CA 3.43Å; L214-L216 HydrophobicContact CD1-CD2 3.7Å; L214-L216 HydrophobicContact CD1-CG 3.88Å; L214-A222 WeakPolarHBondContact O-CA 3.28Å; L214-I223 HydrophobicContact CD1-CB 3.78Å; L214-I223 HydrophobicContact CD1-CD1 4.03Å; L214-I223 HydrophobicContact CD1-CG1 4.19Å; L214-I223 HydrophobicContact CD2-CB 4.39Å; L214-I223 HydrophobicContact CD2-CG2 4.45Å; L214-I223 HydrophobicContact CG-CB 3.86Å; L214-I223 HydrophobicContact CG-CG2 4.44Å; L214-I223 PolarHBondContact N-O 3.46Å; L214-I223 PolarHBondContact O-N 3.35Å; L214-V225 HydrophobicContact CD2-CB 4.46Å; L214-V225 HydrophobicContact CD2-CG2 3.28Å
215	R	85.1	Confident	75	Confident	5 Å²	5	43.8 Å²	43.8	2%	0.019	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130.3	172.8	-167.9	170.8	61.4	79.1	6.5	109.8	N136 I198 V199 Q200 C221 A244 L245	N136-R215 PolarHBondContact O-NH1 3.46Å; N136-R215 PolarHBondContact O-NH2 2.98Å; I198-R215 CarbonylContact C-O 3.37Å; I198-R215 WeakPolarHBondContact CA-O 3.32Å; V199-R215 HydrophobicContact CG2-CB 4.13Å; V199-R215 HydrophobicContact CG2-CG 4.05Å; V199-R215 VanDerWaalsContact CG2-NH1 3.27Å; V199-R215 VanDerWaalsContact CG2-O 3.28Å; V199-R215 WeakPolarHBondContact CG2-O 3.26Å; V199-R215 PolarHBondContact N-O 2.72Å; V199-R215 PolarHBondContact O-NH2 2.69Å; Q200-R215 HydrophobicContact CB-CB 3.64Å; Q200-R215 PolarHBondContact O-N 2.87Å; R215-C221 CarbonylContact C-O 3.52Å; R215-C221 VanDerWaalsContact CA-O 3.26Å; R215-C221 WeakPolarHBondContact CA-O 3.38Å; R215-C221 WeakPolarHBondContact CG-O 3.28Å; R215-A244 VanDerWaalsContact CD-O 3.31Å; R215-A244 WeakPolarHBondContact CD-O 3.34Å; R215-L245 PolarHBondContact NE-O 2.98Å; R215-L245 PolarHBondContact NH1-O 3.05Å; R215-L245 PolarHBondContact NH2-O 2.87Å
216	L	81.7	Confident	75.2	Confident	15 Å²	15	39.6 Å²	39.6	8%	0.079	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	151.6	174.7	-60.5	-177.1	0	0	0	110.3	F194 E197 I198 L214 A220 C221 I223	F194-L216 HydrophobicContact CB-CD2 3.99Å; F194-L216 HydrophobicContact CD1-CD1 4.16Å; F194-L216 HydrophobicContact CD1-CD2 3.91Å; F194-L216 HydrophobicContact CG-CD2 3.99Å; E197-L216 CarbonylContact O-C 3.53Å; E197-L216 WeakPolarHBondContact O-CA 3.35Å; I198-L216 HydrophobicContact CG1-CD2 4Å; L214-L216 HydrophobicContact CD1-CD2 3.7Å; L214-L216 HydrophobicContact CD1-CG 3.88Å; L216-A220 WeakPolarHBondContact O-CA 3.48Å; L216-C221 PolarHBondContact N-O 3.4Å; L216-C221 PolarHBondContact O-N 2.71Å; L216-I223 HydrophobicContact CD1-CD1 3.68Å; L216-I223 HydrophobicContact CG-CD1 4.2Å
217	A	73.4	Confident	75.5	Confident	35 Å²	35	34.8 Å²	34.8	29%	0.289	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-41.1	176.2	0	0	0	0	0	112.7	E197 V199 A220	E197-A217 HydrophobicContact CB-CB 4.07Å; E197-A217 PolarHBondContact O-N 3.21Å; V199-A217 HydrophobicContact CG1-CB 3.8Å; V199-A217 HydrophobicContact CG2-CB 4.48Å; A217-A220 WeakPolarHBondContact O-CA 3.39Å; A217-A220 PolarHBondContact O-N 3.24Å
218	E	80.5	Confident	75.6	Confident	159 Å²	159	35.4 Å²	35.4	74%	0.743	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-143.1	112.3	-171.8	-67.5	-172.6	175.2	0	0	111.8	S196	S196-E218 WeakPolarHBondContact CB-O 3.46Å; S196-E218 WeakPolarHBondContact OG-CA 3.43Å; S196-E218 PolarHBondContact OG-N 2.97Å; S196-E218 PolarHBondContact OG-O 2.95Å
219	P	79.5	Confident	75.1	Confident	99 Å²	99	33.4 Å²	33.4	64%	0.643	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	cis	-61.3	148.7	-13.8	29.6	-34.3	0	0	0	110.4	C221	P219-C221 PolarHBondContact O-N 3.03Å
220	A	82.3	Confident	74.1	Confident	30 Å²	30	37.3 Å²	37.3	25%	0.248	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	106.3	173.7	0	0	0	0	0	108.6	L216 A217 D242 E243	L216-A220 WeakPolarHBondContact O-CA 3.48Å; A217-A220 WeakPolarHBondContact O-CA 3.39Å; A217-A220 PolarHBondContact O-N 3.24Å; A220-D242 CarbonylContact O-C 3.56Å; A220-E243 WeakPolarHBondContact O-CA 3.16Å; A220-E243 PolarHBondContact O-N 3.38Å
221	C	84.5	Confident	72.7	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.02	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	154.7	-177.6	70.1	0	0	0	0	111.7	R215 L216 P219 P239 L241	R215-C221 CarbonylContact C-O 3.52Å; R215-C221 VanDerWaalsContact CA-O 3.26Å; R215-C221 WeakPolarHBondContact CA-O 3.38Å; R215-C221 WeakPolarHBondContact CG-O 3.28Å; L216-C221 PolarHBondContact N-O 3.4Å; L216-C221 PolarHBondContact O-N 2.71Å; P219-C221 PolarHBondContact O-N 3.03Å; C221-P239 HydrophobicContact CB-CB 4.19Å; C221-L241 CarbonylContact C-O 3.59Å; C221-L241 VanDerWaalsContact CA-O 3.25Å; C221-L241 WeakPolarHBondContact CA-O 3.24Å; C221-L241 WeakPolarHBondContact CB-O 3.49Å
222	A	85.5	Confident	71.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	131.6	176.1	0	0	0	0	0	110.7	L213 L214 P239 F240 L241 A244 V247	L213-A222 HydrophobicContact CD1-CB 4.03Å; L214-A222 WeakPolarHBondContact O-CA 3.28Å; A222-P239 WeakPolarHBondContact O-CA 2.99Å; A222-F240 HydrophobicContact CB-CD1 4.27Å; A222-F240 HydrophobicContact CB-CE1 3.55Å; A222-F240 HydrophobicContact CB-CE2 4.33Å; A222-F240 HydrophobicContact CB-CZ 3.6Å; A222-F240 VanDerWaalsContact O-CD1 3.23Å; A222-F240 WeakPolarHBondContact O-CD1 3.24Å; A222-F240 PolarHBondContact O-N 2.58Å; A222-L241 HydrophobicContact CB-CB 4.19Å; A222-L241 PolarHBondContact N-O 3.15Å; A222-A244 HydrophobicContact CB-CB 4.3Å; A222-V247 HydrophobicContact CB-CG2 3.76Å
223	I	84.4	Confident	69.4	Low	16 Å²	16	54.1 Å²	54.1	8%	0.082	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.1	-176.9	-56	177.2	0	0	0	108.3	L214 L216 P239	L214-I223 HydrophobicContact CD1-CB 3.78Å; L214-I223 HydrophobicContact CD1-CD1 4.03Å; L214-I223 HydrophobicContact CD1-CG1 4.19Å; L214-I223 HydrophobicContact CD2-CB 4.39Å; L214-I223 HydrophobicContact CD2-CG2 4.45Å; L214-I223 HydrophobicContact CG-CB 3.86Å; L214-I223 HydrophobicContact CG-CG2 4.44Å; L214-I223 PolarHBondContact N-O 3.46Å; L214-I223 PolarHBondContact O-N 3.35Å; L216-I223 HydrophobicContact CD1-CD1 3.68Å; L216-I223 HydrophobicContact CG-CD1 4.2Å; I223-P239 HydrophobicContact CD1-CG 4.24Å; I223-P239 HydrophobicContact CG1-CB 4.24Å; I223-P239 HydrophobicContact CG1-CG 4.06Å
224	L	80.9	Confident	67.8	Low	13 Å²	13	55.4 Å²	55.4	7%	0.068	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	132.6	168	-67.9	160.9	0	0	0	110.5	L204 C212 L213 S237 F240 F249 L270	L204-L224 HydrophobicContact CD1-CD2 3.65Å; C212-L224 CarbonylContact O-C 3.57Å; C212-L224 WeakPolarHBondContact O-CA 3.48Å; L213-L224 HydrophobicContact CB-CD2 4.31Å; L224-S237 WeakPolarHBondContact CA-OG 3.32Å; L224-S237 WeakPolarHBondContact CB-OG 3.41Å; L224-S237 PolarHBondContact N-OG 3.22Å; L224-S237 WeakPolarHBondContact O-CB 3.39Å; L224-S237 PolarHBondContact O-N 2.81Å; L224-S237 PolarHBondContact O-OG 3.17Å; L224-F240 HydrophobicContact CD1-CD1 4.08Å; L224-F240 HydrophobicContact CD1-CE1 4.18Å; L224-F240 HydrophobicContact CD2-CE1 4.47Å; L224-F240 HydrophobicContact CG-CD1 3.99Å; L224-F240 HydrophobicContact CG-CE1 3.8Å; L224-F249 HydrophobicContact CD2-CE2 4.13Å; L224-F249 HydrophobicContact CD2-CZ 3.85Å; L224-L270 HydrophobicContact CD1-CD1 3.37Å; L224-L270 HydrophobicContact CD1-CD2 3.49Å; L224-L270 VanDerWaalsContact CD1-CD2 3.49Å; L224-L270 HydrophobicContact CD1-CG 4.04Å; L224-L270 HydrophobicContact CD2-CD1 4.48Å
225	V	74.8	Confident	66.4	Low	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	118.7	171.6	176.4	0	0	0	0	107.6	L166 C211 C212 L214 L227 T234 F236	L166-V225 HydrophobicContact CD2-CG2 4.36Å; C211-V225 CarbonylContact C-O 3.55Å; C211-V225 WeakPolarHBondContact CA-O 3.44Å; C212-V225 HydrophobicContact CB-CB 4.24Å; C212-V225 PolarHBondContact N-O 3.01Å; C212-V225 PolarHBondContact O-N 3.48Å; L214-V225 HydrophobicContact CD2-CB 4.46Å; L214-V225 HydrophobicContact CD2-CG2 3.28Å; V225-L227 HydrophobicContact CG1-CD2 4.23Å; V225-T234 HydrophobicContact CG1-CG2 4.37Å; V225-F236 HydrophobicContact CG2-CD1 3.86Å; V225-F236 HydrophobicContact CG2-CE1 4.1Å
226	R	69.2	Low	65	Low	29 Å²	29	61.3 Å²	61.3	11%	0.109	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	125.8	175.9	-63.1	-168.8	-168.3	165.1	15	109.8	W64 N228 T234 D235	W64-R226 VanDerWaalsContact CB-NH2 3.34Å; W64-R226 VanDerWaalsContact CD2-CZ 3.46Å; W64-R226 VanDerWaalsContact CE3-CZ 3.45Å; W64-R226 VanDerWaalsContact CG-NH2 3.34Å; R226-N228 PolarHBondContact O-N 3.34Å; R226-T234 VanDerWaalsContact O-CG2 3.29Å; R226-T234 WeakPolarHBondContact O-CG2 3.33Å; R226-D235 PolarHBondContact N-O 2.85Å
227	L	66.5	Low	64	Low	19 Å²	19	61.7 Å²	61.7	10%	0.099	33%	0.325	C	S	.	.			trans	-89.5	78.8	178.1	-51.2	178.5	0	0	0	108.2	T154 V168 W192 L203 P210 C212 V225 S229	T154-L227 HydrophobicContact CG2-CD1 4.49Å; V168-L227 HydrophobicContact CB-CD2 4.22Å; V168-L227 HydrophobicContact CG1-CD1 4.02Å; V168-L227 HydrophobicContact CG1-CD2 3.99Å; V168-L227 HydrophobicContact CG2-CD2 3.74Å; W192-L227 HydrophobicContact CH2-CD2 4.3Å; L203-L227 HydrophobicContact CD2-CD1 3.61Å; P210-L227 HydrophobicContact CB-CB 4.27Å; P210-L227 HydrophobicContact CB-CD1 4.3Å; P210-L227 HydrophobicContact CG-CB 4.17Å; P210-L227 VanDerWaalsContact O-CB 3.25Å; P210-L227 WeakPolarHBondContact O-CB 3.24Å; P210-L227 PolarHBondContact O-N 3.03Å; C212-L227 HydrophobicContact CB-CD1 4.39Å; C212-L227 HydrophobicContact CB-CD2 4.21Å; C212-L227 HydrophobicContact CB-CG 4.44Å; V225-L227 HydrophobicContact CG1-CD2 4.23Å; L227-S229 PolarHBondContact O-N 2.87Å
228	N	60.3	Low	63.3	Low	44 Å²	44	62.9 Å²	62.9	24%	0.235	33%	0.329	C	S	.	.			trans	-72.4	102.5	175.3	-74.4	-27.9	0	0	0	109.7	R226 H230 R233 D235	R226-N228 PolarHBondContact O-N 3.34Å; N228-H230 PolarHBondContact O-N 2.75Å; N228-H230 VanDerWaalsContact O-N 3.12Å; N228-R233 WeakPolarHBondContact CB-O 3.4Å; N228-D235 PolarHBondContact ND2-OD2 2.81Å
229	S	47.2	Very low	63.1	Low	98 Å²	98	58.4 Å²	58.4	69%	0.685	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-13.9	179.7	56.1	0	0	0	0	114.6	L227	L227-S229 PolarHBondContact O-N 2.87Å
230	H	41.3	Very low	63	Low	157 Å²	157	56 Å²	56	73%	0.727	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-10.2	-167.1	-70	-58.1	0	0	0	117	N228	N228-H230 PolarHBondContact O-N 2.75Å; N228-H230 VanDerWaalsContact O-N 3.12Å
231	Y	36.4	Very low	63	Low	191 Å²	191	54.9 Å²	54.9	75%	0.749	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.2	3.2	-171.4	-71.8	-74.3	0	0	0	116.6	R233	Y231-R233 PolarHBondContact O-N 3.38Å
232	G	39.2	Very low	63	Low	51 Å²	51	60.1 Å²	60.1	53%	0.526	31%	0.311	S	S	.	.	S	Bend	trans	56.1	19	-173.9	0	0	0	0	0	113.1
233	R	41	Very low	62.9	Low	172 Å²	172	66 Å²	66	65%	0.649	34%	0.338	S	S	*	.			trans	-120.4	121.6	179.7	-78.2	-173	175.2	-179.2	0.3	107.9	N228 Y231	N228-R233 WeakPolarHBondContact CB-O 3.4Å; Y231-R233 PolarHBondContact O-N 3.38Å
234	T	48.8	Very low	62.8	Low	28 Å²	28	65.2 Å²	65.2	17%	0.172	33%	0.334	C	S	.	.			trans	-106.4	127.8	174.1	44.1	0	0	0	0	109.6	W192 V225 R226	W192-T234 VanDerWaalsContact CE2-OG1 3.31Å; W192-T234 HydrophobicContact CH2-CG2 4Å; W192-T234 HydrophobicContact CZ2-CG2 3.18Å; W192-T234 PolarHBondContact NE1-OG1 2.83Å; V225-T234 HydrophobicContact CG1-CG2 4.37Å; R226-T234 VanDerWaalsContact O-CG2 3.29Å; R226-T234 WeakPolarHBondContact O-CG2 3.33Å
235	D	51.6	Low	62.8	Low	63 Å²	63	66 Å²	66	34%	0.337	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-89.9	117.6	171.4	-62.1	-43.3	0	0	0	107.5	V67 R226 N228	V67-D235 HydrophobicContact CG1-CB 3.84Å; V67-D235 HydrophobicContact CG2-CB 4.45Å; R226-D235 PolarHBondContact N-O 2.85Å; N228-D235 PolarHBondContact ND2-OD2 2.81Å
236	F	56.3	Low	63.2	Low	65 Å²	65	67 Å²	67	29%	0.285	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-73.5	134.2	169.1	-62	-86.2	0	0	0	108.5	W192 F194 V225	W192-F236 HydrophobicContact CB-CE1 4.22Å; W192-F236 HydrophobicContact CB-CZ 3.97Å; W192-F236 AromaticContact CD1-CZ 3.28Å; W192-F236 HydrophobicContact CG-CE1 4.06Å; W192-F236 AromaticContact CG-CZ 3.68Å; W192-F236 HydrophobicContact CG-CZ 3.68Å; F194-F236 HydrophobicContact CE1-CD1 4.49Å; F194-F236 HydrophobicContact CE1-CE1 4.13Å; F194-F236 HydrophobicContact CZ-CD1 4.47Å; F194-F236 AromaticContact CZ-CE1 3.82Å; F194-F236 HydrophobicContact CZ-CE1 3.82Å; V225-F236 HydrophobicContact CG2-CD1 3.86Å; V225-F236 HydrophobicContact CG2-CE1 4.1Å
237	S	59.5	Low	64	Low	23 Å²	23	65.6 Å²	65.6	16%	0.161	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-74.1	152.2	161.9	61.9	0	0	0	0	109.8	L224	L224-S237 WeakPolarHBondContact CA-OG 3.32Å; L224-S237 WeakPolarHBondContact CB-OG 3.41Å; L224-S237 PolarHBondContact N-OG 3.22Å; L224-S237 WeakPolarHBondContact O-CB 3.39Å; L224-S237 PolarHBondContact O-N 2.81Å; L224-S237 PolarHBondContact O-OG 3.17Å
238	T	60.5	Low	64.9	Low	61 Å²	61	65 Å²	65	37%	0.374	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-56.8	146.7	158.3	48.7	0	0	0	0	108.9	I68 F240	I68-T238 HydrophobicContact CD1-CG2 4.08Å; T238-F240 PolarHBondContact O-N 2.92Å; T238-F240 VanDerWaalsContact O-N 3.17Å
239	P	74.9	Confident	65.9	Low	64 Å²	64	63.5 Å²	63.5	42%	0.416	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-46.1	127.5	169.3	-25	32.4	0	0	0	110.2	C221 A222 I223	C221-P239 HydrophobicContact CB-CB 4.19Å; A222-P239 WeakPolarHBondContact O-CA 2.99Å; I223-P239 HydrophobicContact CD1-CG 4.24Å; I223-P239 HydrophobicContact CG1-CB 4.24Å; I223-P239 HydrophobicContact CG1-CG 4.06Å
240	F	77.8	Confident	67.5	Low	49 Å²	49	59.2 Å²	59.2	22%	0.215	30%	0.296	C	S	.	.	S	Bend	trans	-98.1	-13.4	-178.3	72.3	-89.1	0	0	0	112	L213 A222 L224 T238 V247 F249 Y257 L270	L213-F240 HydrophobicContact CD1-CE1 3.79Å; L213-F240 HydrophobicContact CD1-CZ 3.87Å; A222-F240 HydrophobicContact CB-CD1 4.27Å; A222-F240 HydrophobicContact CB-CE1 3.55Å; A222-F240 HydrophobicContact CB-CE2 4.33Å; A222-F240 HydrophobicContact CB-CZ 3.6Å; A222-F240 VanDerWaalsContact O-CD1 3.23Å; A222-F240 WeakPolarHBondContact O-CD1 3.24Å; A222-F240 PolarHBondContact O-N 2.58Å; L224-F240 HydrophobicContact CD1-CD1 4.08Å; L224-F240 HydrophobicContact CD1-CE1 4.18Å; L224-F240 HydrophobicContact CD2-CE1 4.47Å; L224-F240 HydrophobicContact CG-CD1 3.99Å; L224-F240 HydrophobicContact CG-CE1 3.8Å; T238-F240 PolarHBondContact O-N 2.92Å; T238-F240 VanDerWaalsContact O-N 3.17Å; F240-V247 HydrophobicContact CZ-CG1 4.16Å; F240-F249 HydrophobicContact CZ-CZ 4.33Å; F240-Y257 HydrophobicContact CD2-CE1 4.22Å; F240-Y257 HydrophobicContact CD2-CE2 4.45Å; F240-Y257 HydrophobicContact CE2-CD1 4.27Å; F240-Y257 HydrophobicContact CE2-CD2 4.14Å; F240-Y257 HydrophobicContact CE2-CE1 4.03Å; F240-Y257 AromaticContact CE2-CE2 3.92Å; F240-Y257 HydrophobicContact CE2-CE2 3.92Å; F240-Y257 HydrophobicContact CE2-CG 4.32Å; F240-Y257 AromaticContact CE2-CZ 3.86Å; F240-L270 HydrophobicContact CD2-CD2 4.03Å; F240-L270 HydrophobicContact CE2-CD2 4.22Å; F240-L270 HydrophobicContact CG-CD2 4.27Å
241	L	82.1	Confident	69	Low	7 Å²	7	52.8 Å²	52.8	4%	0.037	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	127.4	177.4	-172.3	71.1	0	0	0	110.8	C221 A222 A244 V247 A259	C221-L241 CarbonylContact C-O 3.59Å; C221-L241 VanDerWaalsContact CA-O 3.25Å; C221-L241 WeakPolarHBondContact CA-O 3.24Å; C221-L241 WeakPolarHBondContact CB-O 3.49Å; A222-L241 HydrophobicContact CB-CB 4.19Å; A222-L241 PolarHBondContact N-O 3.15Å; L241-A244 HydrophobicContact CD2-CB 3.84Å; L241-A244 HydrophobicContact CG-CB 4.29Å; L241-V247 HydrophobicContact CD2-CG2 4.11Å; L241-A259 HydrophobicContact CD2-CB 3.06Å
242	D	84.5	Confident	70.9	Confident	112 Å²	112	47 Å²	47	60%	0.599	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	157.9	171.9	-60.3	-43.5	0	0	0	110.8	A220 A244	A220-D242 CarbonylContact O-C 3.56Å; D242-A244 PolarHBondContact O-N 2.79Å
243	E	84.3	Confident	72.6	Confident	123 Å²	123	48.6 Å²	48.6	58%	0.575	24%	0.242	S	C	*	.	S	Bend	trans	56.2	27.4	179.7	-57.4	-174.9	172.3	0	0	114.6	A220 L245 P262	A220-E243 WeakPolarHBondContact O-CA 3.16Å; A220-E243 PolarHBondContact O-N 3.38Å; E243-L245 PolarHBondContact O-N 3.29Å; E243-P262 WeakPolarHBondContact O-CD 3.16Å
244	A	82.6	Confident	74.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.			trans	-70	120.2	177	0	0	0	0	0	110.5	R215 A222 L241 D242 V247	R215-A244 VanDerWaalsContact CD-O 3.31Å; R215-A244 WeakPolarHBondContact CD-O 3.34Å; A222-A244 HydrophobicContact CB-CB 4.3Å; L241-A244 HydrophobicContact CD2-CB 3.84Å; L241-A244 HydrophobicContact CG-CB 4.29Å; D242-A244 PolarHBondContact O-N 2.79Å; A244-V247 HydrophobicContact CB-CG2 3.78Å
245	L	80.2	Confident	75.5	Confident	29 Å²	29	41.6 Å²	41.6	15%	0.152	22%	0.223	C	C	.	.	S	Bend	trans	-85.4	-34.7	167.4	-59	-179.8	0	0	0	110.8	R215 E243 I260 P262	R215-L245 PolarHBondContact NE-O 2.98Å; R215-L245 PolarHBondContact NH1-O 3.05Å; R215-L245 PolarHBondContact NH2-O 2.87Å; E243-L245 PolarHBondContact O-N 3.29Å; L245-I260 WeakPolarHBondContact CB-O 3.49Å; L245-I260 PolarHBondContact N-O 2.96Å; L245-P262 HydrophobicContact CD1-CG 4.15Å; L245-P262 HydrophobicContact CD2-CG 4.38Å; L245-P262 HydrophobicContact CG-CG 4.32Å
246	H	83.9	Confident	77	Confident	21 Å²	21	40.3 Å²	40.3	10%	0.097	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	147.2	176.5	179.8	87.4	0	0	0	109.6	F258 A259 I260 S287 G289	H246-F258 AromaticContact CD2-CE2 3.58Å; H246-F258 AromaticContact CD2-CZ 3.73Å; H246-F258 AromaticContact NE2-CZ 3.7Å; H246-A259 CarbonylContact O-C 3.41Å; H246-A259 WeakPolarHBondContact O-CA 3.42Å; H246-A259 WeakPolarHBondContact O-CB 3.47Å; H246-I260 HydrophobicContact CB-CB 4.2Å; H246-I260 HydrophobicContact CB-CD1 4.19Å; H246-I260 HydrophobicContact CB-CG1 4.26Å; H246-I260 PolarHBondContact N-O 2.94Å; H246-I260 PolarHBondContact O-N 3.2Å; H246-S287 WeakPolarHBondContact CB-O 3.41Å; H246-G289 PolarHBondContact CE1-O 3.14Å; H246-G289 PolarHBondContact NE2-O 2.72Å
247	V	85.2	Confident	78.5	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	136.7	170.4	-177.7	0	0	0	0	108.4	Q200 L213 A222 F240 L241 A244 F249 Y257 F258 A259	Q200-V247 PolarHBondContact NE2-O 3.31Å; L213-V247 HydrophobicContact CD1-CB 4.48Å; L213-V247 HydrophobicContact CD1-CG1 4.29Å; L213-V247 HydrophobicContact CD2-CB 3.82Å; L213-V247 HydrophobicContact CD2-CG1 3.8Å; A222-V247 HydrophobicContact CB-CG2 3.76Å; F240-V247 HydrophobicContact CZ-CG1 4.16Å; L241-V247 HydrophobicContact CD2-CG2 4.11Å; A244-V247 HydrophobicContact CB-CG2 3.78Å; V247-F249 HydrophobicContact CG1-CE2 4.36Å; V247-Y257 HydrophobicContact CG1-CD2 4.28Å; V247-F258 CarbonylContact C-O 3.53Å; V247-F258 WeakPolarHBondContact CA-O 3.49Å; V247-A259 HydrophobicContact CG2-CB 3.92Å
248	S	84.5	Confident	79.8	Confident	6 Å²	6	36.9 Å²	36.9	4%	0.042	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	138.6	170.8	174.9	0	0	0	0	110.6	Y257 F258 W291	S248-Y257 WeakPolarHBondContact O-CA 3.37Å; S248-F258 VanDerWaalsContact CB-CE1 3.48Å; S248-F258 PolarHBondContact N-O 2.59Å; S248-F258 PolarHBondContact O-N 3.26Å; S248-W291 PolarHBondContact O-NE1 3.01Å
249	F	81.6	Confident	81.2	Confident	13 Å²	13	34 Å²	34	6%	0.057	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	141.8	179.9	-81.6	-90.6	0	0	0	112.4	L204 L213 L224 F240 V247 P251 E256 Y257 L270 W291	L204-F249 HydrophobicContact CD1-CD1 3.97Å; L204-F249 HydrophobicContact CD1-CD2 3.79Å; L204-F249 HydrophobicContact CD1-CE1 3.86Å; L204-F249 HydrophobicContact CD1-CE2 3.63Å; L204-F249 HydrophobicContact CD1-CG 3.94Å; L204-F249 HydrophobicContact CD1-CZ 3.67Å; L204-F249 HydrophobicContact CD2-CB 3.56Å; L204-F249 HydrophobicContact CD2-CD1 4.14Å; L204-F249 HydrophobicContact CD2-CD2 3.23Å; L204-F249 HydrophobicContact CD2-CE2 3.91Å; L204-F249 HydrophobicContact CD2-CG 3.34Å; L204-F249 HydrophobicContact CG-CD2 4.14Å; L204-F249 HydrophobicContact CG-CE2 4.38Å; L204-F249 HydrophobicContact CG-CG 4.29Å; L213-F249 HydrophobicContact CB-CD2 4.4Å; L213-F249 HydrophobicContact CB-CE2 3.92Å; L213-F249 HydrophobicContact CD1-CE2 4.09Å; L213-F249 HydrophobicContact CD2-CD2 3.97Å; L213-F249 HydrophobicContact CD2-CE2 3.8Å; L213-F249 HydrophobicContact CG-CE2 4.13Å; L224-F249 HydrophobicContact CD2-CE2 4.13Å; L224-F249 HydrophobicContact CD2-CZ 3.85Å; F240-F249 HydrophobicContact CZ-CZ 4.33Å; V247-F249 HydrophobicContact CG1-CE2 4.36Å; F249-P251 WeakPolarHBondContact O-CD 2.92Å; F249-E256 WeakPolarHBondContact CD1-O 3.35Å; F249-Y257 HydrophobicContact CE1-CD1 4.33Å; F249-Y257 HydrophobicContact CE1-CG 4.48Å; F249-L270 HydrophobicContact CE1-CD1 3.47Å; F249-L270 VanDerWaalsContact CE1-CD1 3.47Å; F249-L270 HydrophobicContact CE1-CD2 4.38Å; F249-L270 HydrophobicContact CE1-CG 3.85Å; F249-L270 HydrophobicContact CZ-CD1 3.82Å; F249-L270 HydrophobicContact CZ-CD2 4.32Å; F249-L270 HydrophobicContact CZ-CG 4.24Å; F249-W291 VanDerWaalsContact C-CD1 3.49Å; F249-W291 PolarHBondContact O-NE1 3.5Å
250	S	80.4	Confident	81.7	Confident	8 Å²	8	31 Å²	31	6%	0.056	16%	0.16	C	C	.	.			trans	-62.5	122.4	178.8	-176	0	0	0	0	108.8	Y252 I253 E256 W291	S250-Y252 PolarHBondContact O-N 2.95Å; S250-Y252 PolarHBondContact OG-N 3.17Å; S250-I253 PolarHBondContact OG-N 2.69Å; S250-I253 VanDerWaalsContact OG-N 3.14Å; S250-E256 WeakPolarHBondContact CB-O 3.23Å; S250-E256 VanDerWaalsContact CB-OE2 3.23Å; S250-E256 WeakPolarHBondContact CB-OE2 3.41Å; S250-E256 PolarHBondContact N-O 3.3Å; S250-E256 PolarHBondContact OG-OE2 2.9Å; S250-W291 VanDerWaalsContact N-NE1 3.12Å
251	P	73.7	Confident	82	Confident	22 Å²	22	29.3 Å²	29.3	14%	0.143	15%	0.154	C	C	.	.	S	Bend	trans	-69.1	-9	167.2	29	-33.2	0	0	0	111.3	K206 F249 W291 R333	K206-P251 WeakPolarHBondContact CD-O 3.43Å; K206-P251 WeakPolarHBondContact CE-O 3.28Å; K206-P251 PolarHBondContact NZ-O 2.88Å; F249-P251 WeakPolarHBondContact O-CD 2.92Å; P251-W291 HydrophobicContact CG-CB 4.13Å; P251-R333 VanDerWaalsContact CB-NH1 3.3Å; P251-R333 VanDerWaalsContact CG-CZ 3.41Å
252	Y	75.6	Confident	82	Confident	70 Å²	70	32.2 Å²	32.2	28%	0.275	17%	0.173	S	C	.	.	S	Bend	trans	-99.7	-42.8	-171.8	-52.2	-69.3	0	0	0	111.7	S250 W291 S292 G293 P295	S250-Y252 PolarHBondContact O-N 2.95Å; S250-Y252 PolarHBondContact OG-N 3.17Å; Y252-W291 HydrophobicContact CE2-CB 4.25Å; Y252-S292 WeakPolarHBondContact CE2-O 3.31Å; Y252-S292 VanDerWaalsContact CZ-O 3.27Å; Y252-S292 PolarHBondContact OH-O 2.8Å; Y252-G293 WeakPolarHBondContact OH-CA 3.3Å; Y252-G293 PolarHBondContact OH-O 2.8Å; Y252-P295 HydrophobicContact CD1-CG 3.96Å; Y252-P295 HydrophobicContact CD2-CB 4.05Å; Y252-P295 HydrophobicContact CD2-CG 4.15Å; Y252-P295 HydrophobicContact CG-CB 3.92Å; Y252-P295 HydrophobicContact CG-CG 3.7Å
253	I	76.1	Confident	81.8	Confident	85 Å²	85	32 Å²	32	44%	0.436	17%	0.172	S	C	.	.	S	Bend	trans	-122.3	120.4	-173	-55.7	179.9	0	0	0	109.1	S250 G255 E256	S250-I253 PolarHBondContact OG-N 2.69Å; S250-I253 VanDerWaalsContact OG-N 3.14Å; I253-G255 PolarHBondContact O-N 2.79Å; I253-E256 HydrophobicContact CB-CB 3.87Å; I253-E256 HydrophobicContact CG2-CB 3.98Å; I253-E256 WeakPolarHBondContact O-CB 3.44Å; I253-E256 PolarHBondContact O-N 2.97Å
254	A	74.5	Confident	81.9	Confident	48 Å²	48	27.8 Å²	27.8	40%	0.397	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	127.8	-179	0	0	0	0	0	111.5	K206 L207 E256	K206-A254 HydrophobicContact CB-CB 4.23Å; K206-A254 VanDerWaalsContact O-CB 3.23Å; K206-A254 WeakPolarHBondContact O-CB 3.04Å; L207-A254 HydrophobicContact CD2-CB 4.38Å; A254-E256 PolarHBondContact O-N 2.99Å
255	G	74.8	Confident	82.1	Confident	4 Å²	4	27.9 Å²	27.9	4%	0.041	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	-2	178.5	0	0	0	0	0	115.3	I253 S269 L270	I253-G255 PolarHBondContact O-N 2.79Å; G255-S269 CarbonylContact O-C 3.6Å; G255-S269 WeakPolarHBondContact O-CA 3.34Å; G255-L270 WeakPolarHBondContact O-CG 3.19Å; G255-L270 PolarHBondContact O-N 3.3Å
256	E	84.3	Confident	82.5	Confident	36 Å²	36	30.3 Å²	30.3	17%	0.168	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	138.3	166.9	-178	-177.5	-117.4	0	0	109.4	F249 S250 I253 A254 V267 G268 W291	F249-E256 WeakPolarHBondContact CD1-O 3.35Å; S250-E256 WeakPolarHBondContact CB-O 3.23Å; S250-E256 VanDerWaalsContact CB-OE2 3.23Å; S250-E256 WeakPolarHBondContact CB-OE2 3.41Å; S250-E256 PolarHBondContact N-O 3.3Å; S250-E256 PolarHBondContact OG-OE2 2.9Å; I253-E256 HydrophobicContact CB-CB 3.87Å; I253-E256 HydrophobicContact CG2-CB 3.98Å; I253-E256 WeakPolarHBondContact O-CB 3.44Å; I253-E256 PolarHBondContact O-N 2.97Å; A254-E256 PolarHBondContact O-N 2.99Å; E256-V267 HydrophobicContact CG-CG1 4.42Å; E256-G268 WeakPolarHBondContact CA-O 3.47Å; E256-W291 HydrophobicContact CG-CH2 3.8Å; E256-W291 HydrophobicContact CG-CZ2 4.11Å; E256-W291 WeakPolarHBondContact OE2-CH2 3.2Å
257	Y	86.5	Confident	82.7	Confident	17 Å²	17	29.8 Å²	29.8	7%	0.067	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	156.2	177.7	65.8	-88.8	0	0	0	110	F240 V247 S248 F249 A259 V267 G268 L270	F240-Y257 HydrophobicContact CD2-CE1 4.22Å; F240-Y257 HydrophobicContact CD2-CE2 4.45Å; F240-Y257 HydrophobicContact CE2-CD1 4.27Å; F240-Y257 HydrophobicContact CE2-CD2 4.14Å; F240-Y257 HydrophobicContact CE2-CE1 4.03Å; F240-Y257 AromaticContact CE2-CE2 3.92Å; F240-Y257 HydrophobicContact CE2-CE2 3.92Å; F240-Y257 HydrophobicContact CE2-CG 4.32Å; F240-Y257 AromaticContact CE2-CZ 3.86Å; V247-Y257 HydrophobicContact CG1-CD2 4.28Å; S248-Y257 WeakPolarHBondContact O-CA 3.37Å; F249-Y257 HydrophobicContact CE1-CD1 4.33Å; F249-Y257 HydrophobicContact CE1-CG 4.48Å; Y257-A259 HydrophobicContact CD2-CB 4.42Å; Y257-A259 HydrophobicContact CE2-CB 4.49Å; Y257-V267 CarbonylContact O-C 3.59Å; Y257-V267 WeakPolarHBondContact O-CA 3.48Å; Y257-G268 WeakPolarHBondContact CD1-O 3.32Å; Y257-G268 PolarHBondContact N-O 3.31Å; Y257-G268 PolarHBondContact O-N 3.24Å; Y257-L270 HydrophobicContact CD1-CD2 4.08Å; Y257-L270 HydrophobicContact CD1-CG 4.27Å; Y257-L270 HydrophobicContact CE1-CD2 3.98Å; Y257-L270 HydrophobicContact CE1-CG 4.49Å
258	F	88.3	Confident	82.7	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	156.6	156.7	81.5	-93.7	0	0	0	110.1	H246 V247 S248 I260 I265 R266 V267 W291 I298 V300	H246-F258 AromaticContact CD2-CE2 3.58Å; H246-F258 AromaticContact CD2-CZ 3.73Å; H246-F258 AromaticContact NE2-CZ 3.7Å; V247-F258 CarbonylContact C-O 3.53Å; V247-F258 WeakPolarHBondContact CA-O 3.49Å; S248-F258 VanDerWaalsContact CB-CE1 3.48Å; S248-F258 PolarHBondContact N-O 2.59Å; S248-F258 PolarHBondContact O-N 3.26Å; F258-I260 HydrophobicContact CD2-CG1 4.28Å; F258-I260 HydrophobicContact CE2-CD1 4.25Å; F258-I260 HydrophobicContact CE2-CG1 4Å; F258-I265 HydrophobicContact CD2-CG2 4.49Å; F258-R266 CarbonylContact C-O 3.57Å; F258-R266 WeakPolarHBondContact CA-O 3.41Å; F258-V267 HydrophobicContact CB-CG2 4.15Å; F258-W291 HydrophobicContact CB-CZ2 4.18Å; F258-W291 AromaticContact CD1-CD1 3.81Å; F258-W291 HydrophobicContact CD1-CD2 4.07Å; F258-W291 AromaticContact CD1-CE2 3.52Å; F258-W291 HydrophobicContact CD1-CG 4.27Å; F258-W291 AromaticContact CD1-CZ2 3.93Å; F258-W291 HydrophobicContact CD1-CZ2 3.93Å; F258-W291 AromaticContact CD1-NE1 3.3Å; F258-W291 VanDerWaalsContact CD1-NE1 3.3Å; F258-W291 AromaticContact CE1-CD1 3.68Å; F258-W291 HydrophobicContact CE1-CD2 4.48Å; F258-W291 HydrophobicContact CE1-CG 4.21Å; F258-W291 AromaticContact CE1-NE1 3.63Å; F258-I298 HydrophobicContact CB-CD1 3.44Å; F258-I298 VanDerWaalsContact CB-CD1 3.44Å; F258-I298 HydrophobicContact CD1-CB 4.5Å; F258-I298 HydrophobicContact CD1-CD1 3.75Å; F258-I298 HydrophobicContact CD1-CG1 3.96Å; F258-I298 HydrophobicContact CD1-CG2 3.69Å; F258-I298 HydrophobicContact CD2-CD1 4.42Å; F258-I298 HydrophobicContact CD2-CG2 4Å; F258-I298 HydrophobicContact CE1-CG2 3.56Å; F258-I298 HydrophobicContact CE2-CG2 3.88Å; F258-I298 HydrophobicContact CG-CD1 3.63Å; F258-I298 HydrophobicContact CG-CG1 4.31Å; F258-I298 HydrophobicContact CG-CG2 3.94Å; F258-I298 HydrophobicContact CZ-CG2 3.7Å; F258-V300 HydrophobicContact CE2-CG1 4.39Å
259	A	89.3	Confident	82.7	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	143.6	174.3	0	0	0	0	0	111.1	L241 H246 V247 Y257 I265 R266	L241-A259 HydrophobicContact CD2-CB 3.06Å; H246-A259 CarbonylContact O-C 3.41Å; H246-A259 WeakPolarHBondContact O-CA 3.42Å; H246-A259 WeakPolarHBondContact O-CB 3.47Å; V247-A259 HydrophobicContact CG2-CB 3.92Å; Y257-A259 HydrophobicContact CD2-CB 4.42Å; Y257-A259 HydrophobicContact CE2-CB 4.49Å; A259-I265 CarbonylContact O-C 3.58Å; A259-I265 WeakPolarHBondContact O-CA 3.31Å; A259-R266 PolarHBondContact N-O 3.2Å; A259-R266 PolarHBondContact O-N 2.82Å
260	I	85.8	Confident	82.4	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.2	172.6	-52.9	179	0	0	0	106.7	L245 H246 F258 I265 I280 F286 F288 V300	L245-I260 WeakPolarHBondContact CB-O 3.49Å; L245-I260 PolarHBondContact N-O 2.96Å; H246-I260 HydrophobicContact CB-CB 4.2Å; H246-I260 HydrophobicContact CB-CD1 4.19Å; H246-I260 HydrophobicContact CB-CG1 4.26Å; H246-I260 PolarHBondContact N-O 2.94Å; H246-I260 PolarHBondContact O-N 3.2Å; F258-I260 HydrophobicContact CD2-CG1 4.28Å; F258-I260 HydrophobicContact CE2-CD1 4.25Å; F258-I260 HydrophobicContact CE2-CG1 4Å; I260-I265 HydrophobicContact CG1-CG1 4.37Å; I260-I280 HydrophobicContact CG2-CD1 4.11Å; I260-F286 HydrophobicContact CG2-CB 4.33Å; I260-F286 WeakPolarHBondContact CG2-O 3.45Å; I260-F288 VanDerWaalsContact CD1-C 3.41Å; I260-F288 WeakPolarHBondContact CD1-O 3.44Å; I260-V300 HydrophobicContact CD1-CB 4.12Å; I260-V300 HydrophobicContact CD1-CG1 3.86Å; I260-V300 HydrophobicContact CG1-CG1 4.37Å
261	T	84.4	Confident	82	Confident	14 Å²	14	36.3 Å²	36.3	9%	0.086	20%	0.199	C	C	.	.			trans	-117.3	167.6	170.8	67.3	0	0	0	0	108	L263 L264	T261-L263 PolarHBondContact O-N 3.14Å; T261-L264 HydrophobicContact CG2-CD1 4.42Å; T261-L264 PolarHBondContact N-O 3.24Å; T261-L264 WeakPolarHBondContact OG1-CG 3.44Å; T261-L264 PolarHBondContact OG1-N 3.21Å; T261-L264 VanDerWaalsContact OG1-N 3.15Å; T261-L264 PolarHBondContact OG1-O 2.84Å
262	P	81	Confident	82.1	Confident	69 Å²	69	37.3 Å²	37.3	45%	0.448	21%	0.207	S	C	.	.	S	Bend	trans	-55.2	-26.2	179.5	-27.7	35.7	0	0	0	115	E243 L245	E243-P262 WeakPolarHBondContact O-CD 3.16Å; L245-P262 HydrophobicContact CD1-CG 4.15Å; L245-P262 HydrophobicContact CD2-CG 4.38Å; L245-P262 HydrophobicContact CG-CG 4.32Å
263	L	79.9	Confident	82.2	Confident	108 Å²	108	40 Å²	40	57%	0.565	24%	0.235	S	C	*	.	S	Bend	trans	-114.3	-21.3	-172.3	-60.2	177.8	0	0	0	114.4	T261 I280	T261-L263 PolarHBondContact O-N 3.14Å; L263-I280 PolarHBondContact O-N 2.81Å
264	L	86.6	Confident	82.2	Confident	34 Å²	34	43.3 Å²	43.3	18%	0.178	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	160.4	-174	61.2	82.4	0	0	0	112.7	T261 R266 I278	T261-L264 HydrophobicContact CG2-CD1 4.42Å; T261-L264 PolarHBondContact N-O 3.24Å; T261-L264 WeakPolarHBondContact OG1-CG 3.44Å; T261-L264 PolarHBondContact OG1-N 3.21Å; T261-L264 VanDerWaalsContact OG1-N 3.15Å; T261-L264 PolarHBondContact OG1-O 2.84Å; L264-R266 HydrophobicContact CD1-CB 3.77Å; L264-I278 CarbonylContact C-O 3.54Å; L264-I278 VanDerWaalsContact CA-O 3.27Å; L264-I278 WeakPolarHBondContact CA-O 3.33Å; L264-I278 WeakPolarHBondContact CB-O 3.47Å
265	I	86.9	Confident	82.6	Confident	2 Å²	2	44 Å²	44	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	121.2	165.6	-62.3	164.9	0	0	0	106.8	F258 A259 I260 S277 I278 I280 V300 L309	F258-I265 HydrophobicContact CD2-CG2 4.49Å; A259-I265 CarbonylContact O-C 3.58Å; A259-I265 WeakPolarHBondContact O-CA 3.31Å; I260-I265 HydrophobicContact CG1-CG1 4.37Å; I265-S277 CarbonylContact O-C 3.58Å; I265-S277 WeakPolarHBondContact O-CA 3.42Å; I265-I278 HydrophobicContact CB-CB 4.45Å; I265-I278 PolarHBondContact N-O 3.13Å; I265-I278 PolarHBondContact O-N 3.45Å; I265-I280 HydrophobicContact CD1-CD1 3.97Å; I265-I280 HydrophobicContact CD1-CG1 3.97Å; I265-I280 HydrophobicContact CG1-CD1 3.52Å; I265-I280 HydrophobicContact CG1-CG1 3.76Å; I265-V300 HydrophobicContact CD1-CB 4.25Å; I265-V300 HydrophobicContact CD1-CG1 3.91Å; I265-V300 HydrophobicContact CD1-CG2 3.73Å; I265-L309 HydrophobicContact CD1-CD1 3.23Å; I265-L309 HydrophobicContact CG1-CD1 4.48Å
266	R	88.4	Confident	83.1	Confident	80 Å²	80	46.9 Å²	46.9	30%	0.302	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	131.7	177.5	-177.7	177.8	-69.1	177.9	1	109.3	F258 A259 L264 V276	F258-R266 CarbonylContact C-O 3.57Å; F258-R266 WeakPolarHBondContact CA-O 3.41Å; A259-R266 PolarHBondContact N-O 3.2Å; A259-R266 PolarHBondContact O-N 2.82Å; L264-R266 HydrophobicContact CD1-CB 3.77Å; R266-V276 CarbonylContact C-O 3.47Å; R266-V276 WeakPolarHBondContact CA-O 3.36Å
267	V	88.4	Confident	83.1	Confident	9 Å²	9	47.7 Å²	47.7	6%	0.055	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	122.9	164.6	-174.3	0	0	0	0	106.8	E256 Y257 F258 S275 V276 W291 I298 V311	E256-V267 HydrophobicContact CG-CG1 4.42Å; Y257-V267 CarbonylContact O-C 3.59Å; Y257-V267 WeakPolarHBondContact O-CA 3.48Å; F258-V267 HydrophobicContact CB-CG2 4.15Å; V267-S275 CarbonylContact O-C 3.59Å; V267-S275 WeakPolarHBondContact O-CA 3.18Å; V267-S275 VanDerWaalsContact O-CB 3.3Å; V267-S275 WeakPolarHBondContact O-CB 3.39Å; V267-V276 HydrophobicContact CB-CB 4.43Å; V267-V276 PolarHBondContact N-O 3.15Å; V267-V276 PolarHBondContact O-N 2.79Å; V267-W291 HydrophobicContact CG1-CH2 4.13Å; V267-I298 HydrophobicContact CG2-CD1 3.73Å; V267-V311 HydrophobicContact CG2-CB 4.06Å; V267-V311 HydrophobicContact CG2-CG1 3.61Å
268	G	86.2	Confident	82.9	Confident	4 Å²	4	47.4 Å²	47.4	4%	0.041	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	176.5	-174.5	0	0	0	0	0	112.1	E256 Y257	E256-G268 WeakPolarHBondContact CA-O 3.47Å; Y257-G268 WeakPolarHBondContact CD1-O 3.32Å; Y257-G268 PolarHBondContact N-O 3.31Å; Y257-G268 PolarHBondContact O-N 3.24Å
269	S	82.9	Confident	82.5	Confident	29 Å²	29	53.7 Å²	53.7	20%	0.203	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	145	176	-179.1	0	0	0	0	110	G255 V271 S272	G255-S269 CarbonylContact O-C 3.6Å; G255-S269 WeakPolarHBondContact O-CA 3.34Å; S269-V271 WeakPolarHBondContact OG-CG2 3.19Å; S269-V271 PolarHBondContact OG-N 2.84Å; S269-S272 PolarHBondContact OG-N 2.92Å
270	L	77.4	Confident	81.8	Confident	34 Å²	34	54.4 Å²	54.4	18%	0.178	31%	0.314	C	S	.	.	S	Bend	trans	-74.1	-18.4	170.1	-64.2	-179.1	0	0	0	112.9	L207 L224 F240 F249 G255 Y257	L207-L270 HydrophobicContact CD1-CD1 4.33Å; L224-L270 HydrophobicContact CD1-CD1 3.37Å; L224-L270 HydrophobicContact CD1-CD2 3.49Å; L224-L270 VanDerWaalsContact CD1-CD2 3.49Å; L224-L270 HydrophobicContact CD1-CG 4.04Å; L224-L270 HydrophobicContact CD2-CD1 4.48Å; F240-L270 HydrophobicContact CD2-CD2 4.03Å; F240-L270 HydrophobicContact CE2-CD2 4.22Å; F240-L270 HydrophobicContact CG-CD2 4.27Å; F249-L270 HydrophobicContact CE1-CD1 3.47Å; F249-L270 VanDerWaalsContact CE1-CD1 3.47Å; F249-L270 HydrophobicContact CE1-CD2 4.38Å; F249-L270 HydrophobicContact CE1-CG 3.85Å; F249-L270 HydrophobicContact CZ-CD1 3.82Å; F249-L270 HydrophobicContact CZ-CD2 4.32Å; F249-L270 HydrophobicContact CZ-CG 4.24Å; G255-L270 WeakPolarHBondContact O-CG 3.19Å; G255-L270 PolarHBondContact O-N 3.3Å; Y257-L270 HydrophobicContact CD1-CD2 4.08Å; Y257-L270 HydrophobicContact CD1-CG 4.27Å; Y257-L270 HydrophobicContact CE1-CD2 3.98Å; Y257-L270 HydrophobicContact CE1-CG 4.49Å
271	V	71.9	Confident	81	Confident	97 Å²	97	58.7 Å²	58.7	59%	0.588	34%	0.342	S	S	*	.	S	Bend	trans	-108.3	-14.8	-175.8	-62.3	0	0	0	0	113.2	F62 S269	F62-V271 HydrophobicContact CD1-CG1 4.37Å; F62-V271 HydrophobicContact CE1-CG1 4.17Å; S269-V271 WeakPolarHBondContact OG-CG2 3.19Å; S269-V271 PolarHBondContact OG-N 2.84Å
272	S	75.3	Confident	79.8	Confident	44 Å²	44	66.9 Å²	66.9	31%	0.308	38%	0.379	S	S	.	.			trans	-122.3	141.6	176.2	-179.6	0	0	0	0	110.2	S269 E274	S269-S272 PolarHBondContact OG-N 2.92Å; S272-E274 PolarHBondContact O-N 3.18Å; S272-E274 WeakPolarHBondContact OG-CB 3.39Å; S272-E274 WeakPolarHBondContact OG-CG 3.26Å; S272-E274 PolarHBondContact OG-N 3.34Å; S272-E274 VanDerWaalsContact OG-N 3.12Å
273	S	76.7	Confident	78.8	Confident	125 Å²	125	71.9 Å²	71.9	87%	0.874	40%	0.397	S	S	*	.	S	Bend	trans	-74.2	-8.8	170.8	53.6	0	0	0	0	112.9
274	E	76.8	Confident	78.1	Confident	156 Å²	156	67.5 Å²	67.5	73%	0.729	38%	0.376	S	S	*	.			trans	-67.9	134.8	176.4	-64.5	-176.5	167.7	0	0	110.9	S272	S272-E274 PolarHBondContact O-N 3.18Å; S272-E274 WeakPolarHBondContact OG-CB 3.39Å; S272-E274 WeakPolarHBondContact OG-CG 3.26Å; S272-E274 PolarHBondContact OG-N 3.34Å; S272-E274 VanDerWaalsContact OG-N 3.12Å
275	S	83.3	Confident	77.4	Confident	62 Å²	62	68.8 Å²	68.8	43%	0.434	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	146.9	172.6	59.9	0	0	0	0	110.9	V267	V267-S275 CarbonylContact O-C 3.59Å; V267-S275 WeakPolarHBondContact O-CA 3.18Å; V267-S275 VanDerWaalsContact O-CB 3.3Å; V267-S275 WeakPolarHBondContact O-CB 3.39Å
276	V	84	Confident	77	Confident	65 Å²	65	69.5 Å²	69.5	39%	0.394	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.5	172.1	180	0	0	0	0	107.2	R266 V267	R266-V276 CarbonylContact C-O 3.47Å; R266-V276 WeakPolarHBondContact CA-O 3.36Å; V267-V276 HydrophobicContact CB-CB 4.43Å; V267-V276 PolarHBondContact N-O 3.15Å; V267-V276 PolarHBondContact O-N 2.79Å
277	S	85.3	Confident	76.4	Confident	52 Å²	52	66.6 Å²	66.6	36%	0.364	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	134	175.9	-62.6	0	0	0	0	110.2	I265	I265-S277 CarbonylContact O-C 3.58Å; I265-S277 WeakPolarHBondContact O-CA 3.42Å
278	I	82.9	Confident	76	Confident	12 Å²	12	67.8 Å²	67.8	6%	0.062	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	118.1	177.6	-56.7	171.2	0	0	0	106.7	L264 I265 I280	L264-I278 CarbonylContact C-O 3.54Å; L264-I278 VanDerWaalsContact CA-O 3.27Å; L264-I278 WeakPolarHBondContact CA-O 3.33Å; L264-I278 WeakPolarHBondContact CB-O 3.47Å; I265-I278 HydrophobicContact CB-CB 4.45Å; I265-I278 PolarHBondContact N-O 3.13Å; I265-I278 PolarHBondContact O-N 3.45Å; I278-I280 PolarHBondContact O-N 3.48Å
279	N	79.9	Confident	75.8	Confident	132 Å²	132	68 Å²	68	71%	0.706	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	132.1	179.4	-66.6	-22.3	0	0	0	110.3
280	I	74.2	Confident	75.9	Confident	15 Å²	15	67.5 Å²	67.5	8%	0.077	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-92.8	133.7	170.6	-56.8	172.6	0	0	0	106.9	I260 L263 I265 I278 E282 A284 F286	I260-I280 HydrophobicContact CG2-CD1 4.11Å; L263-I280 PolarHBondContact O-N 2.81Å; I265-I280 HydrophobicContact CD1-CD1 3.97Å; I265-I280 HydrophobicContact CD1-CG1 3.97Å; I265-I280 HydrophobicContact CG1-CD1 3.52Å; I265-I280 HydrophobicContact CG1-CG1 3.76Å; I278-I280 PolarHBondContact O-N 3.48Å; I280-E282 PolarHBondContact O-N 2.88Å; I280-A284 HydrophobicContact CG2-CB 3.56Å; I280-A284 VanDerWaalsContact CG2-O 3.29Å; I280-A284 WeakPolarHBondContact CG2-O 3.46Å; I280-F286 HydrophobicContact CD1-CD2 4.27Å; I280-F286 HydrophobicContact CG1-CD2 4.44Å; I280-F286 HydrophobicContact CG2-CD2 3.72Å; I280-F286 HydrophobicContact CG2-CE2 4.1Å
281	P	68	Low	75.9	Confident	90 Å²	90	65.9 Å²	65.9	58%	0.584	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-53.7	136.3	170.4	-22.6	32.2	0	0	0	109.9	Q283 A284	P281-Q283 PolarHBondContact O-N 3.49Å; P281-A284 HydrophobicContact CB-CB 4.4Å; P281-A284 WeakPolarHBondContact O-CB 3.21Å; P281-A284 PolarHBondContact O-N 3.44Å
282	E	60.1	Low	76	Confident	185 Å²	185	61.3 Å²	61.3	86%	0.864	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-21.9	-177.4	-67.5	179.5	171.1	0	0	114	I280	I280-E282 PolarHBondContact O-N 2.88Å
283	Q	60	Low	75.6	Confident	174 Å²	174	59.9 Å²	59.9	81%	0.813	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-15.7	177.6	-63.8	180	-5.5	0	0	113.7	P281 N304	P281-Q283 PolarHBondContact O-N 3.49Å; Q283-N304 PolarHBondContact O-ND2 2.85Å
284	A	63.9	Low	75.2	Confident	16 Å²	16	58.5 Å²	58.5	13%	0.132	32%	0.317	C	S	.	.			trans	-91.5	109.7	-176.6	0	0	0	0	0	111.3	I280 P281 F286 N304	I280-A284 HydrophobicContact CG2-CB 3.56Å; I280-A284 VanDerWaalsContact CG2-O 3.29Å; I280-A284 WeakPolarHBondContact CG2-O 3.46Å; P281-A284 HydrophobicContact CB-CB 4.4Å; P281-A284 WeakPolarHBondContact O-CB 3.21Å; P281-A284 PolarHBondContact O-N 3.44Å; A284-F286 HydrophobicContact CB-CD2 4.17Å; A284-F286 HydrophobicContact CB-CE2 3.81Å; A284-F286 HydrophobicContact CB-CZ 4.45Å; A284-F286 PolarHBondContact O-N 3.26Å; A284-N304 WeakPolarHBondContact CA-ND2 3.44Å; A284-N304 HydrophobicContact CB-CB 4.49Å
285	S	72.2	Confident	74.8	Confident	62 Å²	62	54 Å²	54	43%	0.434	30%	0.301	S	S	.	.			trans	-95.6	72.9	175.8	27.9	0	0	0	0	111.1	G302 T303 N304	S285-G302 WeakPolarHBondContact O-CA 3.47Å; S285-T303 PolarHBondContact O-N 3.42Å; S285-T303 PolarHBondContact OG-OG1 3.2Å; S285-N304 PolarHBondContact N-OD1 3.13Å; S285-N304 PolarHBondContact OG-OD1 2.76Å
286	F	78.9	Confident	74.3	Confident	16 Å²	16	51.8 Å²	51.8	7%	0.07	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	132.1	162.7	-61.3	-62.3	0	0	0	109	I260 I280 A284 V300 G301 I307	I260-F286 HydrophobicContact CG2-CB 4.33Å; I260-F286 WeakPolarHBondContact CG2-O 3.45Å; I280-F286 HydrophobicContact CD1-CD2 4.27Å; I280-F286 HydrophobicContact CG1-CD2 4.44Å; I280-F286 HydrophobicContact CG2-CD2 3.72Å; I280-F286 HydrophobicContact CG2-CE2 4.1Å; A284-F286 HydrophobicContact CB-CD2 4.17Å; A284-F286 HydrophobicContact CB-CE2 3.81Å; A284-F286 HydrophobicContact CB-CZ 4.45Å; A284-F286 PolarHBondContact O-N 3.26Å; F286-V300 HydrophobicContact CD1-CB 4.42Å; F286-V300 HydrophobicContact CD1-CG2 4.09Å; F286-V300 HydrophobicContact CD2-CG2 4.29Å; F286-V300 HydrophobicContact CE1-CG2 4.35Å; F286-V300 HydrophobicContact CG-CB 4.43Å; F286-V300 HydrophobicContact CG-CG2 4.08Å; F286-G301 WeakPolarHBondContact CA-O 3.25Å; F286-I307 HydrophobicContact CD2-CD1 4.42Å; F286-I307 HydrophobicContact CE1-CD1 4.26Å; F286-I307 HydrophobicContact CE1-CG1 4.02Å; F286-I307 HydrophobicContact CE1-CG2 4.27Å; F286-I307 HydrophobicContact CE2-CD1 3.56Å; F286-I307 HydrophobicContact CE2-CG1 4.22Å; F286-I307 HydrophobicContact CZ-CB 4.41Å; F286-I307 HydrophobicContact CZ-CD1 3.47Å; F286-I307 VanDerWaalsContact CZ-CD1 3.47Å; F286-I307 HydrophobicContact CZ-CG1 3.7Å; F286-I307 HydrophobicContact CZ-CG2 3.82Å
287	S	75.4	Confident	74.1	Confident	19 Å²	19	48.8 Å²	48.8	13%	0.133	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	-12	-177.1	56	0	0	0	0	113.5	H246 G301	H246-S287 WeakPolarHBondContact CB-O 3.41Å; S287-G301 PolarHBondContact N-O 2.9Å
288	F	79.7	Confident	74.2	Confident	35 Å²	35	46.3 Å²	46.3	15%	0.154	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	163.2	178.3	58	-91.6	0	0	0	111.1	I260 V300 G301 V326 M329	I260-F288 VanDerWaalsContact CD1-C 3.41Å; I260-F288 WeakPolarHBondContact CD1-O 3.44Å; F288-V300 WeakPolarHBondContact O-CA 3.26Å; F288-G301 PolarHBondContact N-O 2.74Å; F288-G301 PolarHBondContact O-N 2.81Å; F288-V326 WeakPolarHBondContact CE1-O 3.28Å; F288-V326 HydrophobicContact CE2-CG1 4.1Å; F288-V326 HydrophobicContact CZ-CB 4.19Å; F288-V326 HydrophobicContact CZ-CG1 3.9Å; F288-V326 WeakPolarHBondContact CZ-O 3.49Å; F288-M329 HydrophobicContact CD2-CE 3.54Å; F288-M329 HydrophobicContact CD2-CG 3.97Å; F288-M329 HydrophobicContact CD2-SD 4.49Å; F288-M329 HydrophobicContact CE2-CB 4.26Å; F288-M329 HydrophobicContact CE2-CE 3.36Å; F288-M329 HydrophobicContact CE2-CG 3.98Å; F288-M329 HydrophobicContact CZ-CE 4.49Å
289	G	82.4	Confident	74.4	Confident	8 Å²	8	45.8 Å²	45.8	8%	0.082	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	-179.8	174.6	0	0	0	0	0	112.1	H246 A299	H246-G289 PolarHBondContact CE1-O 3.14Å; H246-G289 PolarHBondContact NE2-O 2.72Å; G289-A299 CarbonylContact C-O 3.59Å; G289-A299 WeakPolarHBondContact CA-O 3.43Å
290	D	84.8	Confident	74.7	Confident	19 Å²	19	39.5 Å²	39.5	10%	0.102	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	154.8	169.4	-159	-15.2	0	0	0	108.9	S292 A299 H330 C331 R333	D290-S292 PolarHBondContact O-N 2.99Å; D290-A299 PolarHBondContact N-O 2.97Å; D290-A299 PolarHBondContact O-N 2.85Å; D290-H330 IonicContact OD2-ND1 3.54Å; D290-C331 HydrophobicContact CB-CB 3.87Å; D290-C331 VanDerWaalsContact OD2-CB 3.26Å; D290-C331 WeakPolarHBondContact OD2-CB 3.26Å; D290-C331 PolarHBondContact OD2-N 2.81Å; D290-R333 IonicContact OD1-CZ 3.28Å; D290-R333 IonicContact OD1-NE 3.07Å; D290-R333 IonicContact OD1-NH2 2.82Å; D290-R333 PolarHBondContact OD1-NH2 2.8Å
291	W	79.1	Confident	75.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	126.2	169.3	-70.4	86.7	0	0	0	108.6	S248 F249 S250 P251 Y252 E256 F258 V267 P295 I298 C331	S248-W291 PolarHBondContact O-NE1 3.01Å; F249-W291 VanDerWaalsContact C-CD1 3.49Å; F249-W291 PolarHBondContact O-NE1 3.5Å; S250-W291 VanDerWaalsContact N-NE1 3.12Å; P251-W291 HydrophobicContact CG-CB 4.13Å; Y252-W291 HydrophobicContact CE2-CB 4.25Å; E256-W291 HydrophobicContact CG-CH2 3.8Å; E256-W291 HydrophobicContact CG-CZ2 4.11Å; E256-W291 WeakPolarHBondContact OE2-CH2 3.2Å; F258-W291 HydrophobicContact CB-CZ2 4.18Å; F258-W291 AromaticContact CD1-CD1 3.81Å; F258-W291 HydrophobicContact CD1-CD2 4.07Å; F258-W291 AromaticContact CD1-CE2 3.52Å; F258-W291 HydrophobicContact CD1-CG 4.27Å; F258-W291 AromaticContact CD1-CZ2 3.93Å; F258-W291 HydrophobicContact CD1-CZ2 3.93Å; F258-W291 AromaticContact CD1-NE1 3.3Å; F258-W291 VanDerWaalsContact CD1-NE1 3.3Å; F258-W291 AromaticContact CE1-CD1 3.68Å; F258-W291 HydrophobicContact CE1-CD2 4.48Å; F258-W291 HydrophobicContact CE1-CG 4.21Å; F258-W291 AromaticContact CE1-NE1 3.63Å; V267-W291 HydrophobicContact CG1-CH2 4.13Å; W291-P295 WeakPolarHBondContact CZ3-O 3.29Å; W291-I298 HydrophobicContact CD2-CG1 4.27Å; W291-I298 HydrophobicContact CE3-CG1 3.87Å; W291-I298 HydrophobicContact CH2-CD1 4.29Å; W291-I298 HydrophobicContact CH2-CG1 4.49Å; W291-I298 HydrophobicContact CZ3-CD1 4.23Å; W291-I298 HydrophobicContact CZ3-CG1 3.99Å; W291-C331 VanDerWaalsContact O-CB 3.24Å; W291-C331 WeakPolarHBondContact O-CB 3.48Å; W291-C331 PolarHBondContact O-SG 2.96Å
292	S	73.8	Confident	75.6	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.007	18%	0.184	C	C	.	.			trans	-65.3	178.5	170.3	79.5	0	0	0	0	109.9	Y252 D290 Y294 C297	Y252-S292 WeakPolarHBondContact CE2-O 3.31Å; Y252-S292 VanDerWaalsContact CZ-O 3.27Å; Y252-S292 PolarHBondContact OH-O 2.8Å; D290-S292 PolarHBondContact O-N 2.99Å; S292-Y294 PolarHBondContact O-N 2.89Å; S292-Y294 PolarHBondContact OG-N 2.86Å; S292-Y294 PolarHBondContact OG-O 2.86Å; S292-C297 VanDerWaalsContact CB-O 3.24Å; S292-C297 WeakPolarHBondContact CB-O 3.37Å; S292-C297 PolarHBondContact N-O 3.04Å; S292-C297 WeakPolarHBondContact OG-CA 3.36Å; S292-C297 WeakPolarHBondContact OG-CB 3.42Å; S292-C297 PolarHBondContact OG-O 2.86Å; S292-C297 PolarHBondContact OG-SG 2.89Å; S292-C297 VanDerWaalsContact OG-SG 3.34Å
293	G	65.3	Low	76.5	Confident	14 Å²	14	28.4 Å²	28.4	14%	0.144	16%	0.159	C	C	.	.	S	Bend	trans	-59	-6.9	174.1	0	0	0	0	0	117.3	Y252 T337	Y252-G293 WeakPolarHBondContact OH-CA 3.3Å; Y252-G293 PolarHBondContact OH-O 2.8Å; G293-T337 WeakPolarHBondContact CA-OG1 3.39Å
294	Y	70	Confident	77.2	Confident	96 Å²	96	23.6 Å²	23.6	38%	0.376	14%	0.138	S	C	.	.	S	Bend	trans	-119.7	133	-171.4	-78.2	-101.3	0	0	0	109	S292 S296 C297 R353	S292-Y294 PolarHBondContact O-N 2.89Å; S292-Y294 PolarHBondContact OG-N 2.86Å; S292-Y294 PolarHBondContact OG-O 2.86Å; Y294-S296 PolarHBondContact O-N 2.81Å; Y294-C297 PolarHBondContact O-N 2.91Å; Y294-R353 HydrophobicContact CE2-CB 3.95Å; Y294-R353 HydrophobicContact CE2-CG 4.18Å; Y294-R353 VanDerWaalsContact CE2-O 3.25Å; Y294-R353 WeakPolarHBondContact CE2-O 3.48Å; Y294-R353 PolarHBondContact OH-O 2.86Å; Y294-R353 VanDerWaalsContact OH-O 3.04Å
295	P	68.2	Low	78.1	Confident	61 Å²	61	22.9 Å²	22.9	40%	0.396	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-19.5	-179.5	-26.5	31.9	0	0	0	115.9	Y252 W291	Y252-P295 HydrophobicContact CD1-CG 3.96Å; Y252-P295 HydrophobicContact CD2-CB 4.05Å; Y252-P295 HydrophobicContact CD2-CG 4.15Å; Y252-P295 HydrophobicContact CG-CB 3.92Å; Y252-P295 HydrophobicContact CG-CG 3.7Å; W291-P295 WeakPolarHBondContact CZ3-O 3.29Å
296	S	72.7	Confident	78.8	Confident	16 Å²	16	19.9 Å²	19.9	11%	0.112	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	9.3	-177.2	45	0	0	0	0	113.1	Y294 D310 V311 R312	Y294-S296 PolarHBondContact O-N 2.81Å; S296-D310 CarbonylContact O-C 3.6Å; S296-D310 VanDerWaalsContact O-CA 3.29Å; S296-D310 WeakPolarHBondContact O-CA 3.5Å; S296-V311 WeakPolarHBondContact O-CG2 3.24Å; S296-V311 PolarHBondContact O-N 2.86Å; S296-R312 VanDerWaalsContact CB-NE 3.33Å; S296-R312 PolarHBondContact OG-NE 2.72Å; S296-R312 VanDerWaalsContact OG-NE 3.16Å; S296-R312 PolarHBondContact OG-NH2 2.87Å
297	C	80	Confident	79.1	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.007	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	134.4	-175.9	176.8	0	0	0	0	111.5	S292 Y294 L309 P355	S292-C297 VanDerWaalsContact CB-O 3.24Å; S292-C297 WeakPolarHBondContact CB-O 3.37Å; S292-C297 PolarHBondContact N-O 3.04Å; S292-C297 WeakPolarHBondContact OG-CA 3.36Å; S292-C297 WeakPolarHBondContact OG-CB 3.42Å; S292-C297 PolarHBondContact OG-O 2.86Å; S292-C297 PolarHBondContact OG-SG 2.89Å; S292-C297 VanDerWaalsContact OG-SG 3.34Å; Y294-C297 PolarHBondContact O-N 2.91Å; C297-L309 CarbonylContact C-O 3.46Å; C297-L309 VanDerWaalsContact CA-O 3.22Å; C297-L309 WeakPolarHBondContact CA-O 3.23Å; C297-P355 HydrophobicContact CB-CG 4.32Å
298	I	86.1	Confident	79.6	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137	-178.6	-58.5	165.3	0	0	0	107.7	F258 V267 W291 V300 L309 V311	F258-I298 HydrophobicContact CB-CD1 3.44Å; F258-I298 VanDerWaalsContact CB-CD1 3.44Å; F258-I298 HydrophobicContact CD1-CB 4.5Å; F258-I298 HydrophobicContact CD1-CD1 3.75Å; F258-I298 HydrophobicContact CD1-CG1 3.96Å; F258-I298 HydrophobicContact CD1-CG2 3.69Å; F258-I298 HydrophobicContact CD2-CD1 4.42Å; F258-I298 HydrophobicContact CD2-CG2 4Å; F258-I298 HydrophobicContact CE1-CG2 3.56Å; F258-I298 HydrophobicContact CE2-CG2 3.88Å; F258-I298 HydrophobicContact CG-CD1 3.63Å; F258-I298 HydrophobicContact CG-CG1 4.31Å; F258-I298 HydrophobicContact CG-CG2 3.94Å; F258-I298 HydrophobicContact CZ-CG2 3.7Å; V267-I298 HydrophobicContact CG2-CD1 3.73Å; W291-I298 HydrophobicContact CD2-CG1 4.27Å; W291-I298 HydrophobicContact CE3-CG1 3.87Å; W291-I298 HydrophobicContact CH2-CD1 4.29Å; W291-I298 HydrophobicContact CH2-CG1 4.49Å; W291-I298 HydrophobicContact CZ3-CD1 4.23Å; W291-I298 HydrophobicContact CZ3-CG1 3.99Å; I298-V300 HydrophobicContact CG2-CG1 3.77Å; I298-L309 PolarHBondContact N-O 2.98Å; I298-L309 PolarHBondContact O-N 3.43Å; I298-V311 HydrophobicContact CD1-CG1 3.39Å; I298-V311 HydrophobicContact CG1-CG1 3.92Å
299	A	87	Confident	79.7	Confident	1 Å²	1	17.9 Å²	17.9	1%	0.008	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126.8	167.9	0	0	0	0	0	108.7	G289 D290 L306 I307 L308 M329 L339	G289-A299 CarbonylContact C-O 3.59Å; G289-A299 WeakPolarHBondContact CA-O 3.43Å; D290-A299 PolarHBondContact N-O 2.97Å; D290-A299 PolarHBondContact O-N 2.85Å; A299-L306 HydrophobicContact CB-CD1 4.35Å; A299-I307 WeakPolarHBondContact CA-O 3.37Å; A299-L308 HydrophobicContact CB-CD2 3.74Å; A299-M329 HydrophobicContact CB-SD 3.73Å; A299-L339 HydrophobicContact CB-CD1 3.99Å; A299-L339 HydrophobicContact CB-CD2 3.78Å
300	V	86.5	Confident	79.5	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.5	175.6	-60.3	0	0	0	0	110.6	F258 I260 I265 F286 F288 I298 L306 I307 L309	F258-V300 HydrophobicContact CE2-CG1 4.39Å; I260-V300 HydrophobicContact CD1-CB 4.12Å; I260-V300 HydrophobicContact CD1-CG1 3.86Å; I260-V300 HydrophobicContact CG1-CG1 4.37Å; I265-V300 HydrophobicContact CD1-CB 4.25Å; I265-V300 HydrophobicContact CD1-CG1 3.91Å; I265-V300 HydrophobicContact CD1-CG2 3.73Å; F286-V300 HydrophobicContact CD1-CB 4.42Å; F286-V300 HydrophobicContact CD1-CG2 4.09Å; F286-V300 HydrophobicContact CD2-CG2 4.29Å; F286-V300 HydrophobicContact CE1-CG2 4.35Å; F286-V300 HydrophobicContact CG-CB 4.43Å; F286-V300 HydrophobicContact CG-CG2 4.08Å; F288-V300 WeakPolarHBondContact O-CA 3.26Å; I298-V300 HydrophobicContact CG2-CG1 3.77Å; V300-L306 WeakPolarHBondContact O-CA 3.38Å; V300-L306 WeakPolarHBondContact O-CD1 3Å; V300-I307 HydrophobicContact CG2-CD1 3.66Å; V300-I307 HydrophobicContact CG2-CG1 3.23Å; V300-I307 PolarHBondContact N-O 3.44Å; V300-I307 PolarHBondContact O-N 2.8Å; V300-L309 HydrophobicContact CG1-CD1 4.3Å; V300-L309 HydrophobicContact CG2-CD1 3.7Å; V300-L309 HydrophobicContact CG2-CG 4.27Å
301	G	83.5	Confident	78.9	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	159.9	-168.3	0	0	0	0	0	111.9	F286 S287 F288 G305	F286-G301 WeakPolarHBondContact CA-O 3.25Å; S287-G301 PolarHBondContact N-O 2.9Å; F288-G301 PolarHBondContact N-O 2.74Å; F288-G301 PolarHBondContact O-N 2.81Å; G301-G305 WeakPolarHBondContact CA-O 3.23Å
302	G	79.2	Confident	78.3	Confident	2 Å²	2	27.1 Å²	27.1	2%	0.021	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.6	-157	177.6	0	0	0	0	0	111	S285 N304 G305 V326	S285-G302 WeakPolarHBondContact O-CA 3.47Å; G302-N304 PolarHBondContact O-N 3.22Å; G302-N304 VanDerWaalsContact O-N 3.15Å; G302-G305 PolarHBondContact N-O 3.27Å; G302-G305 PolarHBondContact O-N 3.31Å; G302-V326 PolarHBondContact O-N 2.8Å
303	T	77.9	Confident	77.6	Confident	56 Å²	56	29.5 Å²	29.5	34%	0.344	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.2	-174	56.8	0	0	0	0	113.6	L135 S285	L135-T303 HydrophobicContact CD2-CG2 4.41Å; S285-T303 PolarHBondContact O-N 3.42Å; S285-T303 PolarHBondContact OG-OG1 3.2Å
304	N	73.8	Confident	77	Confident	72 Å²	72	31.2 Å²	31.2	39%	0.385	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	0.6	-175.9	-71	54.7	0	0	0	113.6	Q283 A284 S285 G302	Q283-N304 PolarHBondContact O-ND2 2.85Å; A284-N304 WeakPolarHBondContact CA-ND2 3.44Å; A284-N304 HydrophobicContact CB-CB 4.49Å; S285-N304 PolarHBondContact N-OD1 3.13Å; S285-N304 PolarHBondContact OG-OD1 2.76Å; G302-N304 PolarHBondContact O-N 3.22Å; G302-N304 VanDerWaalsContact O-N 3.15Å
305	G	83.9	Confident	76.2	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	125.8	-164.3	-174.9	0	0	0	0	0	114.2	G301 G302 A322 E324	G301-G305 WeakPolarHBondContact CA-O 3.23Å; G302-G305 PolarHBondContact N-O 3.27Å; G302-G305 PolarHBondContact O-N 3.31Å; G305-A322 CarbonylContact C-O 3.6Å; G305-A322 WeakPolarHBondContact CA-O 3.38Å; G305-E324 VanDerWaalsContact CA-O 3.24Å; G305-E324 WeakPolarHBondContact CA-O 3.19Å
306	L	86	Confident	75	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	128.9	177.6	176.1	64.6	0	0	0	108	A299 V300 L321 A322 V326 M329 L339 Y341	A299-L306 HydrophobicContact CB-CD1 4.35Å; V300-L306 WeakPolarHBondContact O-CA 3.38Å; V300-L306 WeakPolarHBondContact O-CD1 3Å; L306-L321 HydrophobicContact CB-CB 4.17Å; L306-L321 HydrophobicContact CD2-CB 3.84Å; L306-L321 HydrophobicContact CD2-CD1 3.71Å; L306-L321 HydrophobicContact CD2-CG 4.46Å; L306-L321 HydrophobicContact CG-CB 3.84Å; L306-L321 HydrophobicContact CG-CD1 3.82Å; L306-L321 HydrophobicContact CG-CG 4.47Å; L306-L321 PolarHBondContact O-N 3.41Å; L306-A322 HydrophobicContact CB-CB 3.96Å; L306-A322 PolarHBondContact N-O 3.46Å; L306-A322 PolarHBondContact O-N 3.22Å; L306-V326 HydrophobicContact CB-CG2 3.7Å; L306-M329 HydrophobicContact CD1-CE 3.22Å; L306-M329 HydrophobicContact CD1-SD 3.92Å; L306-L339 HydrophobicContact CD1-CD2 4.34Å; L306-L339 HydrophobicContact CD2-CD2 3.82Å; L306-L339 HydrophobicContact CG-CD2 4.41Å; L306-Y341 HydrophobicContact CD2-CD1 3.51Å; L306-Y341 HydrophobicContact CD2-CD2 3.8Å; L306-Y341 HydrophobicContact CD2-CE1 3.69Å; L306-Y341 HydrophobicContact CD2-CE2 3.99Å; L306-Y341 HydrophobicContact CD2-CG 3.55Å
307	I	86.4	Confident	74	Confident	24 Å²	24	39.1 Å²	39.1	12%	0.123	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	144.1	177.3	66.4	174	0	0	0	110.3	F286 A299 V300 L309 L319 P320	F286-I307 HydrophobicContact CD2-CD1 4.42Å; F286-I307 HydrophobicContact CE1-CD1 4.26Å; F286-I307 HydrophobicContact CE1-CG1 4.02Å; F286-I307 HydrophobicContact CE1-CG2 4.27Å; F286-I307 HydrophobicContact CE2-CD1 3.56Å; F286-I307 HydrophobicContact CE2-CG1 4.22Å; F286-I307 HydrophobicContact CZ-CB 4.41Å; F286-I307 HydrophobicContact CZ-CD1 3.47Å; F286-I307 VanDerWaalsContact CZ-CD1 3.47Å; F286-I307 HydrophobicContact CZ-CG1 3.7Å; F286-I307 HydrophobicContact CZ-CG2 3.82Å; A299-I307 WeakPolarHBondContact CA-O 3.37Å; V300-I307 HydrophobicContact CG2-CD1 3.66Å; V300-I307 HydrophobicContact CG2-CG1 3.23Å; V300-I307 PolarHBondContact N-O 3.44Å; V300-I307 PolarHBondContact O-N 2.8Å; I307-L309 HydrophobicContact CD1-CD1 4.1Å; I307-L309 HydrophobicContact CD1-CD2 3.62Å; I307-L309 HydrophobicContact CD1-CG 3.91Å; I307-L309 HydrophobicContact CG1-CD1 4.49Å; I307-L309 HydrophobicContact CG1-CD2 4.22Å; I307-L309 HydrophobicContact CG1-CG 4.1Å; I307-L319 WeakPolarHBondContact CA-O 3.26Å; I307-P320 HydrophobicContact CG2-CB 4.46Å
308	L	85	Confident	73.3	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	132	163.9	-65.7	176.1	0	0	0	109	A299 N318 L319 L321 L339 V352 P355	A299-L308 HydrophobicContact CB-CD2 3.74Å; L308-N318 WeakPolarHBondContact O-CA 3.49Å; L308-L319 PolarHBondContact N-O 3.48Å; L308-L319 PolarHBondContact O-N 3.17Å; L308-L319 VanDerWaalsContact O-N 3.15Å; L308-L321 HydrophobicContact CD1-CD1 3.8Å; L308-L321 HydrophobicContact CD1-CD2 4.22Å; L308-L321 HydrophobicContact CD1-CG 4.05Å; L308-L321 HydrophobicContact CD2-CD1 3.73Å; L308-L321 HydrophobicContact CG-CD1 3.43Å; L308-L321 VanDerWaalsContact CG-CD1 3.43Å; L308-L321 HydrophobicContact CG-CG 3.89Å; L308-L339 HydrophobicContact CD2-CD2 4.32Å; L308-V352 HydrophobicContact CD1-CB 4.32Å; L308-V352 HydrophobicContact CD1-CG1 4.09Å; L308-V352 HydrophobicContact CD2-CG1 4.43Å; L308-P355 HydrophobicContact CD1-CB 4.25Å
309	L	81.7	Confident	72.6	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	115	-179.6	-66.1	177.1	0	0	0	109.6	I265 C297 I298 V300 I307 V311 N318	I265-L309 HydrophobicContact CD1-CD1 3.23Å; I265-L309 HydrophobicContact CG1-CD1 4.48Å; C297-L309 CarbonylContact C-O 3.46Å; C297-L309 VanDerWaalsContact CA-O 3.22Å; C297-L309 WeakPolarHBondContact CA-O 3.23Å; I298-L309 PolarHBondContact N-O 2.98Å; I298-L309 PolarHBondContact O-N 3.43Å; V300-L309 HydrophobicContact CG1-CD1 4.3Å; V300-L309 HydrophobicContact CG2-CD1 3.7Å; V300-L309 HydrophobicContact CG2-CG 4.27Å; I307-L309 HydrophobicContact CD1-CD1 4.1Å; I307-L309 HydrophobicContact CD1-CD2 3.62Å; I307-L309 HydrophobicContact CD1-CG 3.91Å; I307-L309 HydrophobicContact CG1-CD1 4.49Å; I307-L309 HydrophobicContact CG1-CD2 4.22Å; I307-L309 HydrophobicContact CG1-CG 4.1Å; L309-V311 PolarHBondContact O-N 2.7Å; L309-N318 HydrophobicContact CD2-CB 4.16Å; L309-N318 WeakPolarHBondContact CD2-OD1 3.49Å
310	D	78.5	Confident	72.1	Confident	26 Å²	26	49 Å²	49	14%	0.139	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	108.8	164.7	-171.2	-29.7	0	0	0	109.3	S296 R312 C313	S296-D310 CarbonylContact O-C 3.6Å; S296-D310 VanDerWaalsContact O-CA 3.29Å; S296-D310 WeakPolarHBondContact O-CA 3.5Å; D310-R312 PolarHBondContact O-N 3Å; D310-R312 VanDerWaalsContact O-N 3.16Å; D310-R312 VanDerWaalsContact OD1-CB 3.26Å; D310-R312 WeakPolarHBondContact OD1-CB 3.22Å; D310-R312 IonicContact OD1-CZ 3.81Å; D310-R312 PolarHBondContact OD1-N 2.69Å; D310-R312 IonicContact OD1-NE 3.01Å; D310-R312 PolarHBondContact OD1-NE 3.03Å; D310-R312 IonicContact OD1-NH2 3.71Å; D310-R312 IonicContact OD2-CZ 3.54Å; D310-R312 IonicContact OD2-NE 3.47Å; D310-R312 PolarHBondContact OD2-NE 3.44Å; D310-R312 IonicContact OD2-NH2 2.76Å; D310-R312 PolarHBondContact OD2-NH2 3.01Å; D310-C313 HydrophobicContact CB-CB 4.33Å; D310-C313 CarbonylContact O-C 3.56Å; D310-C313 PolarHBondContact O-N 3.32Å
311	V	73.1	Confident	71.8	Confident	18 Å²	18	50.5 Å²	50.5	11%	0.109	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.6	-174.8	-53	0	0	0	0	112.9	V267 S296 I298 L309 C313	V267-V311 HydrophobicContact CG2-CB 4.06Å; V267-V311 HydrophobicContact CG2-CG1 3.61Å; S296-V311 WeakPolarHBondContact O-CG2 3.24Å; S296-V311 PolarHBondContact O-N 2.86Å; I298-V311 HydrophobicContact CD1-CG1 3.39Å; I298-V311 HydrophobicContact CG1-CG1 3.92Å; L309-V311 PolarHBondContact O-N 2.7Å; V311-C313 VanDerWaalsContact C-N 3.31Å
312	R	65.9	Low	71.6	Confident	178 Å²	178	50.9 Å²	50.9	67%	0.672	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-25.9	173.4	-57.7	169.3	-63.1	-177.3	0.3	111.5	S296 D310	S296-R312 VanDerWaalsContact CB-NE 3.33Å; S296-R312 PolarHBondContact OG-NE 2.72Å; S296-R312 VanDerWaalsContact OG-NE 3.16Å; S296-R312 PolarHBondContact OG-NH2 2.87Å; D310-R312 PolarHBondContact O-N 3Å; D310-R312 VanDerWaalsContact O-N 3.16Å; D310-R312 VanDerWaalsContact OD1-CB 3.26Å; D310-R312 WeakPolarHBondContact OD1-CB 3.22Å; D310-R312 IonicContact OD1-CZ 3.81Å; D310-R312 PolarHBondContact OD1-N 2.69Å; D310-R312 IonicContact OD1-NE 3.01Å; D310-R312 PolarHBondContact OD1-NE 3.03Å; D310-R312 IonicContact OD1-NH2 3.71Å; D310-R312 IonicContact OD2-CZ 3.54Å; D310-R312 IonicContact OD2-NE 3.47Å; D310-R312 PolarHBondContact OD2-NE 3.44Å; D310-R312 IonicContact OD2-NH2 2.76Å; D310-R312 PolarHBondContact OD2-NH2 3.01Å
313	C	58.7	Low	71.7	Confident	50 Å²	50	59.7 Å²	59.7	34%	0.338	32%	0.32	S	S	.	.			trans	-108.4	71.6	-175.5	-62.6	0	0	0	0	109.9	D310 V311 K315 S316	D310-C313 HydrophobicContact CB-CB 4.33Å; D310-C313 CarbonylContact O-C 3.56Å; D310-C313 PolarHBondContact O-N 3.32Å; V311-C313 VanDerWaalsContact C-N 3.31Å; C313-K315 PolarHBondContact O-N 2.77Å; C313-S316 PolarHBondContact O-N 3.04Å
314	A	53.2	Low	71.8	Confident	51 Å²	51	60.5 Å²	60.5	42%	0.421	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-1.9	-175.6	0	0	0	0	0	116.6
315	K	53.1	Low	72.1	Confident	205 Å²	205	58.6 Å²	58.6	89%	0.891	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.6	-12.2	-175.3	-65.7	-172.3	178.2	-179.1	0	116.7	C313	C313-K315 PolarHBondContact O-N 2.77Å
316	S	43.8	Very low	71.8	Confident	107 Å²	107	58.7 Å²	58.7	75%	0.748	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.5	5.2	-165.6	57.3	0	0	0	0	116	C313	C313-S316 PolarHBondContact O-N 3.04Å
317	G	51.5	Low	71.2	Confident	26 Å²	26	60.2 Å²	60.2	27%	0.268	32%	0.323	S	S	.	.			trans	-105.1	3.1	-170.2	0	0	0	0	0	116.5	L319	G317-L319 PolarHBondContact O-N 2.6Å; G317-L319 VanDerWaalsContact O-N 3.08Å
318	N	65.5	Low	70.7	Confident	86 Å²	86	59.7 Å²	59.7	46%	0.46	32%	0.321	S	S	.	.			trans	-75.8	102.7	-171.6	-59.3	9.1	0	0	0	109.9	L308 L309 P320	L308-N318 WeakPolarHBondContact O-CA 3.49Å; L309-N318 HydrophobicContact CD2-CB 4.16Å; L309-N318 WeakPolarHBondContact CD2-OD1 3.49Å; N318-P320 WeakPolarHBondContact O-CD 3.42Å
319	L	69.7	Low	70.5	Confident	52 Å²	52	60.8 Å²	60.8	27%	0.272	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	112.7	172.2	-169.3	75.7	0	0	0	109.3	I307 L308 G317 L321 P355 P358	I307-L319 WeakPolarHBondContact CA-O 3.26Å; L308-L319 PolarHBondContact N-O 3.48Å; L308-L319 PolarHBondContact O-N 3.17Å; L308-L319 VanDerWaalsContact O-N 3.15Å; G317-L319 PolarHBondContact O-N 2.6Å; G317-L319 VanDerWaalsContact O-N 3.08Å; L319-L321 PolarHBondContact O-N 3.44Å; L319-P355 WeakPolarHBondContact CD2-O 3.34Å; L319-P358 HydrophobicContact CD2-CG 3.6Å
320	P	77.3	Confident	70.2	Confident	73 Å²	73	63 Å²	63	47%	0.474	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	116	171.1	28.3	-31.9	0	0	0	109.7	I307 N318	I307-P320 HydrophobicContact CG2-CB 4.46Å; N318-P320 WeakPolarHBondContact O-CD 3.42Å
321	L	80.5	Confident	70.1	Confident	30 Å²	30	61.9 Å²	61.9	16%	0.157	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	-37.6	172.8	-81.8	173.7	0	0	0	112	L306 L308 L319 L339 T350 P358	L306-L321 HydrophobicContact CB-CB 4.17Å; L306-L321 HydrophobicContact CD2-CB 3.84Å; L306-L321 HydrophobicContact CD2-CD1 3.71Å; L306-L321 HydrophobicContact CD2-CG 4.46Å; L306-L321 HydrophobicContact CG-CB 3.84Å; L306-L321 HydrophobicContact CG-CD1 3.82Å; L306-L321 HydrophobicContact CG-CG 4.47Å; L306-L321 PolarHBondContact O-N 3.41Å; L308-L321 HydrophobicContact CD1-CD1 3.8Å; L308-L321 HydrophobicContact CD1-CD2 4.22Å; L308-L321 HydrophobicContact CD1-CG 4.05Å; L308-L321 HydrophobicContact CD2-CD1 3.73Å; L308-L321 HydrophobicContact CG-CD1 3.43Å; L308-L321 VanDerWaalsContact CG-CD1 3.43Å; L308-L321 HydrophobicContact CG-CG 3.89Å; L319-L321 PolarHBondContact O-N 3.44Å; L321-L339 HydrophobicContact CD1-CD2 3.5Å; L321-L339 VanDerWaalsContact CD1-CD2 3.5Å; L321-T350 HydrophobicContact CD2-CG2 4.27Å; L321-P358 HydrophobicContact CD2-CB 3.42Å; L321-P358 VanDerWaalsContact CD2-CB 3.42Å; L321-P358 HydrophobicContact CD2-CG 3.22Å; L321-P358 HydrophobicContact CG-CG 4.45Å
322	A	79.7	Confident	69.8	Low	9 Å²	9	61.3 Å²	61.3	7%	0.074	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	140.4	176.9	0	0	0	0	0	109	G305 L306 E324 V326 Y341	G305-A322 CarbonylContact C-O 3.6Å; G305-A322 WeakPolarHBondContact CA-O 3.38Å; L306-A322 HydrophobicContact CB-CB 3.96Å; L306-A322 PolarHBondContact N-O 3.46Å; L306-A322 PolarHBondContact O-N 3.22Å; A322-E324 HydrophobicContact CB-CG 4.35Å; A322-V326 HydrophobicContact CB-CG2 4.12Å; A322-Y341 HydrophobicContact CB-CE2 4.11Å
323	K	80.7	Confident	69.6	Low	187 Å²	187	57.9 Å²	57.9	81%	0.813	31%	0.314	S	S	*	.	S	Bend	trans	-98.6	-11.1	173.2	-63.4	-179.2	-178.6	174.8	0	112.6
324	E	79.4	Confident	69.5	Low	72 Å²	72	57.5 Å²	57.5	34%	0.336	31%	0.309	S	S	.	.	S	Bend	trans	-89.1	155.8	178	64.1	-167.9	156.1	0	0	111	G305 A322 V326 T343 K348	G305-E324 VanDerWaalsContact CA-O 3.24Å; G305-E324 WeakPolarHBondContact CA-O 3.19Å; A322-E324 HydrophobicContact CB-CG 4.35Å; E324-V326 PolarHBondContact O-N 3.05Å; E324-T343 HydrophobicContact CG-CG2 3.64Å; E324-T343 WeakPolarHBondContact OE1-CG2 3.33Å; E324-K348 IonicContact OE1-NZ 2.71Å; E324-K348 PolarHBondContact OE1-NZ 2.7Å
325	S	79.8	Confident	69.3	Low	32 Å²	32	62.6 Å²	62.6	22%	0.224	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-52.5	123.9	176.6	-175.8	0	0	0	0	110.8	T343	S325-T343 WeakPolarHBondContact O-CA 3.27Å
326	V	79	Confident	69.5	Low	3 Å²	3	55.2 Å²	55.2	2%	0.018	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126.7	172.6	-178.8	0	0	0	0	107.2	F288 G302 L306 A322 E324 C328 Y341 A342 T343	F288-V326 WeakPolarHBondContact CE1-O 3.28Å; F288-V326 HydrophobicContact CE2-CG1 4.1Å; F288-V326 HydrophobicContact CZ-CB 4.19Å; F288-V326 HydrophobicContact CZ-CG1 3.9Å; F288-V326 WeakPolarHBondContact CZ-O 3.49Å; G302-V326 PolarHBondContact O-N 2.8Å; L306-V326 HydrophobicContact CB-CG2 3.7Å; A322-V326 HydrophobicContact CB-CG2 4.12Å; E324-V326 PolarHBondContact O-N 3.05Å; V326-C328 WeakPolarHBondContact CG1-O 3.39Å; V326-Y341 HydrophobicContact CG1-CD2 4.27Å; V326-Y341 HydrophobicContact CG2-CD2 4.31Å; V326-A342 WeakPolarHBondContact CA-O 3.33Å; V326-A342 WeakPolarHBondContact CG1-O 3.29Å; V326-T343 HydrophobicContact CG2-CG2 4.28Å
327	S	73.6	Confident	70.6	Confident	33 Å²	33	50.7 Å²	50.7	23%	0.231	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-40.1	-177.9	-52.4	0	0	0	0	111.3	A342 I373	S327-A342 PolarHBondContact N-O 2.74Å; S327-I373 WeakPolarHBondContact CB-O 3.02Å
328	C	74.2	Confident	71.7	Confident	12 Å²	12	49.4 Å²	49.4	8%	0.081	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	160.2	178.5	58.9	0	0	0	0	110.9	V326 Y341 A342 I373 L376	V326-C328 WeakPolarHBondContact CG1-O 3.39Å; C328-Y341 WeakPolarHBondContact O-CA 3.32Å; C328-A342 PolarHBondContact O-N 2.78Å; C328-I373 VanDerWaalsContact SG-CG2 3.56Å; C328-L376 VanDerWaalsContact SG-CD1 3.59Å
329	M	80.7	Confident	72.5	Confident	25 Å²	25	45.4 Å²	45.4	12%	0.123	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	158.6	174	74.9	176.5	82.9	0	0	110.5	F288 A299 L306 L339 L340	F288-M329 HydrophobicContact CD2-CE 3.54Å; F288-M329 HydrophobicContact CD2-CG 3.97Å; F288-M329 HydrophobicContact CD2-SD 4.49Å; F288-M329 HydrophobicContact CE2-CB 4.26Å; F288-M329 HydrophobicContact CE2-CE 3.36Å; F288-M329 HydrophobicContact CE2-CG 3.98Å; F288-M329 HydrophobicContact CZ-CE 4.49Å; A299-M329 HydrophobicContact CB-SD 3.73Å; L306-M329 HydrophobicContact CD1-CE 3.22Å; L306-M329 HydrophobicContact CD1-SD 3.92Å; M329-L339 HydrophobicContact CB-CD1 4.26Å; M329-L339 HydrophobicContact CG-CD1 4.45Å; M329-L339 HydrophobicContact SD-CD1 4.05Å; M329-L340 CarbonylContact C-O 3.53Å; M329-L340 VanDerWaalsContact CA-O 3.29Å; M329-L340 WeakPolarHBondContact CA-O 3.49Å
330	H	77	Confident	73.2	Confident	49 Å²	49	42.9 Å²	42.9	23%	0.227	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	124.8	171.7	-174.6	45.5	0	0	0	109.2	D290 L340 L376	D290-H330 IonicContact OD2-ND1 3.54Å; H330-L340 PolarHBondContact N-O 2.98Å; H330-L340 PolarHBondContact O-N 3.31Å; H330-L376 HydrophobicContact CB-CB 4.5Å
331	C	74.7	Confident	73.5	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.014	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	119.2	173	-166.8	0	0	0	0	109.6	D290 W291 R333 T337 L339	D290-C331 HydrophobicContact CB-CB 3.87Å; D290-C331 VanDerWaalsContact OD2-CB 3.26Å; D290-C331 WeakPolarHBondContact OD2-CB 3.26Å; D290-C331 PolarHBondContact OD2-N 2.81Å; W291-C331 VanDerWaalsContact O-CB 3.24Å; W291-C331 WeakPolarHBondContact O-CB 3.48Å; W291-C331 PolarHBondContact O-SG 2.96Å; C331-R333 PolarHBondContact O-N 3.49Å; C331-T337 WeakPolarHBondContact SG-CG2 3.45Å; C331-L339 HydrophobicContact CB-CD1 4.33Å
332	L	67.8	Low	73.5	Confident	5 Å²	5	38.1 Å²	38.1	3%	0.026	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	114.2	179.3	-62.1	163.7	0	0	0	108.4	D334 T337 F338 L340 L349 L378	L332-D334 PolarHBondContact O-N 2.79Å; L332-T337 WeakPolarHBondContact O-CA 3.26Å; L332-T337 WeakPolarHBondContact O-CG2 3.42Å; L332-F338 HydrophobicContact CB-CB 4.32Å; L332-F338 WeakPolarHBondContact CB-O 3.32Å; L332-F338 HydrophobicContact CD1-CB 3.93Å; L332-F338 PolarHBondContact N-O 3.49Å; L332-L340 HydrophobicContact CD1-CB 4.24Å; L332-L349 HydrophobicContact CD1-CD1 3.63Å; L332-L378 HydrophobicContact CD1-CB 3.79Å; L332-L378 HydrophobicContact CD1-CD2 3.3Å; L332-L378 HydrophobicContact CD1-CG 4.17Å; L332-L378 HydrophobicContact CD2-CB 3.39Å; L332-L378 HydrophobicContact CD2-CD2 4.06Å; L332-L378 HydrophobicContact CD2-CG 4.35Å; L332-L378 HydrophobicContact CG-CB 4.2Å; L332-L378 HydrophobicContact CG-CD2 4.23Å
333	R	61.7	Low	73.4	Confident	107 Å²	107	37.7 Å²	37.7	40%	0.404	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	63.5	-178	-58.1	172.2	-172.2	174.4	-4.5	108.6	P251 D290 C331	P251-R333 VanDerWaalsContact CB-NH1 3.3Å; P251-R333 VanDerWaalsContact CG-CZ 3.41Å; D290-R333 IonicContact OD1-CZ 3.28Å; D290-R333 IonicContact OD1-NE 3.07Å; D290-R333 IonicContact OD1-NH2 2.82Å; D290-R333 PolarHBondContact OD1-NH2 2.8Å; C331-R333 PolarHBondContact O-N 3.49Å
334	D	55.8	Low	72.9	Confident	41 Å²	41	33.2 Å²	33.2	22%	0.219	17%	0.165	C	C	.	.	S	Bend	trans	-90.2	-166	166.4	61.4	11.8	0	0	0	109.9	L332 R336 R387	L332-D334 PolarHBondContact O-N 2.79Å; D334-R336 CarbonylContact C-O 3.56Å; D334-R336 VanDerWaalsContact C-O 3.27Å; D334-R336 PolarHBondContact N-O 2.78Å; D334-R336 PolarHBondContact O-N 3.37Å; D334-R336 VanDerWaalsContact OD1-CA 3.28Å; D334-R336 WeakPolarHBondContact OD1-CA 3.12Å; D334-R336 WeakPolarHBondContact OD1-CB 3.48Å; D334-R336 PolarHBondContact OD1-N 2.86Å; D334-R387 IonicContact OD2-CZ 3.66Å; D334-R387 VanDerWaalsContact OD2-CZ 3.24Å; D334-R387 IonicContact OD2-NH1 3.95Å; D334-R387 PolarHBondContact OD2-NH1 3.28Å; D334-R387 IonicContact OD2-NH2 2.67Å; D334-R387 PolarHBondContact OD2-NH2 3.39Å
335	N	49.4	Very low	72.5	Confident	159 Å²	159	33.6 Å²	33.6	85%	0.85	17%	0.172	S	C	*	.	S	Bend	trans	-60.2	-10.1	172.1	-74.1	-30.7	0	0	0	112.4
336	R	57.9	Low	72.4	Confident	49 Å²	49	32.2 Å²	32.2	19%	0.185	16%	0.162	C	C	.	.	S	Bend	trans	-121.3	178.7	170.4	-66.5	-173.8	171.7	-164	-3.1	108.3	D334 F338 N410 A411	D334-R336 CarbonylContact C-O 3.56Å; D334-R336 VanDerWaalsContact C-O 3.27Å; D334-R336 PolarHBondContact N-O 2.78Å; D334-R336 PolarHBondContact O-N 3.37Å; D334-R336 VanDerWaalsContact OD1-CA 3.28Å; D334-R336 WeakPolarHBondContact OD1-CA 3.12Å; D334-R336 WeakPolarHBondContact OD1-CB 3.48Å; D334-R336 PolarHBondContact OD1-N 2.86Å; R336-F338 HydrophobicContact CB-CD2 4.37Å; R336-F338 HydrophobicContact CB-CE2 3.65Å; R336-F338 HydrophobicContact CB-CZ 4.03Å; R336-N410 VanDerWaalsContact CZ-C 3.41Å; R336-N410 VanDerWaalsContact NH1-C 3.34Å; R336-N410 PolarHBondContact NH1-O 2.83Å; R336-N410 PolarHBondContact NH2-O 3.01Å; R336-A411 VanDerWaalsContact NH1-C 3.26Å
337	T	66.5	Low	72.4	Confident	12 Å²	12	32 Å²	32	7%	0.074	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	114.7	176.1	-47	0	0	0	0	111.3	G293 C331 L332 V352	G293-T337 WeakPolarHBondContact CA-OG1 3.39Å; C331-T337 WeakPolarHBondContact SG-CG2 3.45Å; L332-T337 WeakPolarHBondContact O-CA 3.26Å; L332-T337 WeakPolarHBondContact O-CG2 3.42Å; T337-V352 HydrophobicContact CG2-CG2 3.96Å; T337-V352 PolarHBondContact O-N 2.98Å
338	F	75.5	Confident	72.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	135.5	175.4	-56.7	-77.4	0	0	0	108.5	L332 R336 L349 T350 D351 Q361 F414	L332-F338 HydrophobicContact CB-CB 4.32Å; L332-F338 WeakPolarHBondContact CB-O 3.32Å; L332-F338 HydrophobicContact CD1-CB 3.93Å; L332-F338 PolarHBondContact N-O 3.49Å; R336-F338 HydrophobicContact CB-CD2 4.37Å; R336-F338 HydrophobicContact CB-CE2 3.65Å; R336-F338 HydrophobicContact CB-CZ 4.03Å; F338-L349 HydrophobicContact CB-CD1 3.62Å; F338-L349 HydrophobicContact CB-CG 4.21Å; F338-L349 HydrophobicContact CG-CD1 4.39Å; F338-T350 CarbonylContact C-O 3.54Å; F338-T350 VanDerWaalsContact CA-O 3.28Å; F338-T350 WeakPolarHBondContact CA-O 3.42Å; F338-D351 HydrophobicContact CD1-CB 3.96Å; F338-D351 HydrophobicContact CE1-CB 3.92Å; F338-Q361 HydrophobicContact CD1-CG 4.2Å; F338-Q361 HydrophobicContact CE1-CG 3.97Å; F338-F414 HydrophobicContact CD1-CE2 4.06Å; F338-F414 HydrophobicContact CD2-CE2 4.1Å; F338-F414 HydrophobicContact CD2-CZ 4.18Å; F338-F414 AromaticContact CE1-CE2 3.76Å; F338-F414 HydrophobicContact CE1-CE2 3.76Å; F338-F414 AromaticContact CE2-CE2 3.77Å; F338-F414 HydrophobicContact CE2-CE2 3.77Å; F338-F414 AromaticContact CE2-CZ 3.91Å; F338-F414 HydrophobicContact CE2-CZ 3.91Å; F338-F414 HydrophobicContact CG-CE2 4.23Å; F338-F414 AromaticContact CZ-CE2 3.59Å; F338-F414 HydrophobicContact CZ-CE2 3.59Å; F338-F414 HydrophobicContact CZ-CZ 4.18Å
339	L	82.5	Confident	73.2	Confident	1 Å²	1	31 Å²	31	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	110.3	167.5	-174.7	63	0	0	0	107.8	A299 L306 L308 L321 M329 C331 Y341 T350 V352	A299-L339 HydrophobicContact CB-CD1 3.99Å; A299-L339 HydrophobicContact CB-CD2 3.78Å; L306-L339 HydrophobicContact CD1-CD2 4.34Å; L306-L339 HydrophobicContact CD2-CD2 3.82Å; L306-L339 HydrophobicContact CG-CD2 4.41Å; L308-L339 HydrophobicContact CD2-CD2 4.32Å; L321-L339 HydrophobicContact CD1-CD2 3.5Å; L321-L339 VanDerWaalsContact CD1-CD2 3.5Å; M329-L339 HydrophobicContact CB-CD1 4.26Å; M329-L339 HydrophobicContact CG-CD1 4.45Å; M329-L339 HydrophobicContact SD-CD1 4.05Å; C331-L339 HydrophobicContact CB-CD1 4.33Å; L339-Y341 HydrophobicContact CD2-CD1 4.41Å; L339-Y341 HydrophobicContact CG-CD1 4.2Å; L339-T350 PolarHBondContact N-O 2.94Å; L339-T350 PolarHBondContact O-N 2.8Å; L339-V352 HydrophobicContact CB-CG1 3.56Å; L339-V352 HydrophobicContact CB-CG2 4.18Å; L339-V352 HydrophobicContact CD2-CG1 4.13Å
340	L	83.2	Confident	73.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	123.5	169.7	178.4	62.2	0	0	0	107.6	M329 H330 L332 V347 K348 L349 L376 L378 V389	M329-L340 CarbonylContact C-O 3.53Å; M329-L340 VanDerWaalsContact CA-O 3.29Å; M329-L340 WeakPolarHBondContact CA-O 3.49Å; H330-L340 PolarHBondContact N-O 2.98Å; H330-L340 PolarHBondContact O-N 3.31Å; L332-L340 HydrophobicContact CD1-CB 4.24Å; L340-V347 HydrophobicContact CD1-CG1 3.67Å; L340-K348 WeakPolarHBondContact CA-O 2.94Å; L340-L349 HydrophobicContact CB-CD1 3.92Å; L340-L349 HydrophobicContact CD1-CB 4.3Å; L340-L349 HydrophobicContact CD1-CD1 4.16Å; L340-L376 HydrophobicContact CD2-CB 3.92Å; L340-L376 HydrophobicContact CG-CB 4.19Å; L340-L376 HydrophobicContact CG-CD1 4.15Å; L340-L378 HydrophobicContact CD2-CB 4.46Å; L340-V389 HydrophobicContact CD1-CG1 4.07Å; L340-V389 HydrophobicContact CD1-CG2 4.15Å; L340-V389 HydrophobicContact CD2-CG1 4.07Å; L340-V389 HydrophobicContact CD2-CG2 4.19Å
341	Y	84.2	Confident	73.2	Confident	3 Å²	3	27.8 Å²	27.8	1%	0.012	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	154.6	176.6	67.1	-88.2	0	0	0	111.3	L306 A322 V326 C328 L339 T343 K348 T350	L306-Y341 HydrophobicContact CD2-CD1 3.51Å; L306-Y341 HydrophobicContact CD2-CD2 3.8Å; L306-Y341 HydrophobicContact CD2-CE1 3.69Å; L306-Y341 HydrophobicContact CD2-CE2 3.99Å; L306-Y341 HydrophobicContact CD2-CG 3.55Å; A322-Y341 HydrophobicContact CB-CE2 4.11Å; V326-Y341 HydrophobicContact CG1-CD2 4.27Å; V326-Y341 HydrophobicContact CG2-CD2 4.31Å; C328-Y341 WeakPolarHBondContact O-CA 3.32Å; L339-Y341 HydrophobicContact CD2-CD1 4.41Å; L339-Y341 HydrophobicContact CG-CD1 4.2Å; Y341-T343 HydrophobicContact CD2-CG2 4.16Å; Y341-T343 HydrophobicContact CE2-CG2 4.1Å; Y341-K348 HydrophobicContact CD1-CB 4.35Å; Y341-K348 HydrophobicContact CE1-CB 3.87Å; Y341-K348 HydrophobicContact CE2-CB 4.04Å; Y341-K348 HydrophobicContact CE2-CD 3.67Å; Y341-K348 HydrophobicContact CE2-CG 4.39Å; Y341-K348 PolarHBondContact N-O 2.73Å; Y341-K348 PolarHBondContact O-N 2.91Å; Y341-K348 WeakPolarHBondContact OH-CD 3.27Å; Y341-T350 WeakPolarHBondContact CE1-OG1 3.25Å
342	A	79.2	Confident	73.2	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	143.4	178	0	0	0	0	0	111.1	V326 S327 C328 S346 V347 I373 L376	V326-A342 WeakPolarHBondContact CA-O 3.33Å; V326-A342 WeakPolarHBondContact CG1-O 3.29Å; S327-A342 PolarHBondContact N-O 2.74Å; C328-A342 PolarHBondContact O-N 2.78Å; A342-S346 WeakPolarHBondContact CA-O 3.19Å; A342-V347 HydrophobicContact CB-CG2 3.9Å; A342-I373 HydrophobicContact CB-CB 4.37Å; A342-I373 HydrophobicContact CB-CD1 3.53Å; A342-I373 HydrophobicContact CB-CG2 4.03Å; A342-L376 HydrophobicContact CB-CD1 3.61Å; A342-L376 HydrophobicContact CB-CD2 4.09Å; A342-L376 HydrophobicContact CB-CG 4.22Å; A342-L376 VanDerWaalsContact N-CD1 3.34Å
343	T	78.7	Confident	73.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	172.6	175.9	62.7	0	0	0	0	107	E324 S325 V326 Y341 T345 S346 I373	E324-T343 HydrophobicContact CG-CG2 3.64Å; E324-T343 WeakPolarHBondContact OE1-CG2 3.33Å; S325-T343 WeakPolarHBondContact O-CA 3.27Å; V326-T343 HydrophobicContact CG2-CG2 4.28Å; Y341-T343 HydrophobicContact CD2-CG2 4.16Å; Y341-T343 HydrophobicContact CE2-CG2 4.1Å; T343-T345 PolarHBondContact O-N 2.7Å; T343-S346 PolarHBondContact N-O 3.44Å; T343-S346 PolarHBondContact O-N 2.75Å; T343-S346 PolarHBondContact OG1-N 3.27Å; T343-S346 PolarHBondContact OG1-O 3.22Å; T343-S346 PolarHBondContact OG1-OG 2.85Å; T343-I373 VanDerWaalsContact O-CD1 3.26Å; T343-I373 WeakPolarHBondContact O-CD1 3.39Å
344	E	69.5	Low	73.5	Confident	92 Å²	92	32 Å²	32	43%	0.43	16%	0.158	S	C	.	.	S	Bend	trans	-56.8	-22.7	178.9	-63.6	-178.8	-172.9	0	0	113.7
345	T	70.7	Confident	73.8	Confident	80 Å²	80	31.5 Å²	31.5	49%	0.491	16%	0.157	S	C	.	.	S	Bend	trans	-124.1	-9.3	-172.5	62.6	0	0	0	0	114.4	T343 M365 L366	T343-T345 PolarHBondContact O-N 2.7Å; T345-M365 CarbonylContact O-C 3.41Å; T345-M365 WeakPolarHBondContact O-CA 3.44Å; T345-L366 PolarHBondContact O-N 3.22Å
346	S	79.4	Confident	74.7	Confident	3 Å²	3	33 Å²	33	2%	0.021	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	152.5	-173.8	69.5	0	0	0	0	113.8	A342 T343 K348 H364	A342-S346 WeakPolarHBondContact CA-O 3.19Å; T343-S346 PolarHBondContact N-O 3.44Å; T343-S346 PolarHBondContact O-N 2.75Å; T343-S346 PolarHBondContact OG1-N 3.27Å; T343-S346 PolarHBondContact OG1-O 3.22Å; T343-S346 PolarHBondContact OG1-OG 2.85Å; S346-K348 WeakPolarHBondContact OG-CE 3.49Å; S346-H364 CarbonylContact C-O 3.55Å; S346-H364 WeakPolarHBondContact CA-O 3.36Å; S346-H364 WeakPolarHBondContact CB-O 3.19Å
347	V	79.2	Confident	75.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	134	168.6	-172.8	0	0	0	0	108.6	L340 A342 W362 K363 H364 L366 L376 V389 V391	L340-V347 HydrophobicContact CD1-CG1 3.67Å; A342-V347 HydrophobicContact CB-CG2 3.9Å; V347-W362 HydrophobicContact CB-CZ3 4.22Å; V347-W362 HydrophobicContact CG1-CZ3 3.99Å; V347-K363 CarbonylContact O-C 3.44Å; V347-K363 WeakPolarHBondContact O-CA 3.48Å; V347-H364 PolarHBondContact N-O 3.28Å; V347-H364 PolarHBondContact O-N 2.76Å; V347-L366 HydrophobicContact CG2-CD1 3.72Å; V347-L366 HydrophobicContact CG2-CD2 4.01Å; V347-L366 HydrophobicContact CG2-CG 3.99Å; V347-L376 HydrophobicContact CG1-CD2 3.93Å; V347-L376 HydrophobicContact CG2-CD2 4.43Å; V347-V389 HydrophobicContact CG1-CG1 4.07Å; V347-V391 HydrophobicContact CG1-CG2 4.46Å; V347-V391 HydrophobicContact CG2-CG1 4.26Å; V347-V391 HydrophobicContact CG2-CG2 3.81Å
348	K	84.2	Confident	75.3	Confident	23 Å²	23	34.5 Å²	34.5	10%	0.1	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	133.2	-175.2	-67.8	169.2	-177.5	166.5	0	109.7	E324 L340 Y341 S346 W362 K363	E324-K348 IonicContact OE1-NZ 2.71Å; E324-K348 PolarHBondContact OE1-NZ 2.7Å; L340-K348 WeakPolarHBondContact CA-O 2.94Å; Y341-K348 HydrophobicContact CD1-CB 4.35Å; Y341-K348 HydrophobicContact CE1-CB 3.87Å; Y341-K348 HydrophobicContact CE2-CB 4.04Å; Y341-K348 HydrophobicContact CE2-CD 3.67Å; Y341-K348 HydrophobicContact CE2-CG 4.39Å; Y341-K348 PolarHBondContact N-O 2.73Å; Y341-K348 PolarHBondContact O-N 2.91Å; Y341-K348 WeakPolarHBondContact OH-CD 3.27Å; S346-K348 WeakPolarHBondContact OG-CE 3.49Å; K348-W362 WeakPolarHBondContact CA-O 3.44Å; K348-K363 HydrophobicContact CG-CB 4.24Å; K348-K363 HydrophobicContact CG-CD 4.43Å; K348-K363 HydrophobicContact CG-CG 3.92Å
349	L	79.9	Confident	75.2	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	116.6	169.8	-175.5	69.6	0	0	0	108	L332 F338 L340 Q361 W362 L404 F414	L332-L349 HydrophobicContact CD1-CD1 3.63Å; F338-L349 HydrophobicContact CB-CD1 3.62Å; F338-L349 HydrophobicContact CB-CG 4.21Å; F338-L349 HydrophobicContact CG-CD1 4.39Å; L340-L349 HydrophobicContact CB-CD1 3.92Å; L340-L349 HydrophobicContact CD1-CB 4.3Å; L340-L349 HydrophobicContact CD1-CD1 4.16Å; L349-Q361 PolarHBondContact O-N 2.89Å; L349-W362 HydrophobicContact CB-CB 4.12Å; L349-W362 HydrophobicContact CB-CE3 4.18Å; L349-W362 PolarHBondContact N-O 3.02Å; L349-W362 PolarHBondContact O-N 2.98Å; L349-L404 HydrophobicContact CD2-CD1 3.92Å; L349-F414 HydrophobicContact CD2-CB 4.26Å; L349-F414 HydrophobicContact CD2-CD1 4.03Å; L349-F414 HydrophobicContact CD2-CD2 3.37Å; L349-F414 HydrophobicContact CD2-CE1 4.18Å; L349-F414 HydrophobicContact CD2-CE2 3.54Å; L349-F414 HydrophobicContact CD2-CG 3.62Å; L349-F414 HydrophobicContact CD2-CZ 3.94Å
350	T	80	Confident	75	Confident	2 Å²	2	43 Å²	43	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	128.3	-172.4	-55	0	0	0	0	110.4	L321 F338 L339 Y341 V352 P358 I359	L321-T350 HydrophobicContact CD2-CG2 4.27Å; F338-T350 CarbonylContact C-O 3.54Å; F338-T350 VanDerWaalsContact CA-O 3.28Å; F338-T350 WeakPolarHBondContact CA-O 3.42Å; L339-T350 PolarHBondContact N-O 2.94Å; L339-T350 PolarHBondContact O-N 2.8Å; Y341-T350 WeakPolarHBondContact CE1-OG1 3.25Å; T350-V352 HydrophobicContact CG2-CG1 4.28Å; T350-V352 PolarHBondContact O-N 2.92Å; T350-P358 HydrophobicContact CG2-CB 3.71Å; T350-I359 CarbonylContact C-O 3.55Å; T350-I359 WeakPolarHBondContact CA-O 3.43Å
351	D	77.3	Confident	74.7	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.027	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	117.8	169.7	-171.8	-22.4	0	0	0	109.3	F338 R353 P358 I359 Q361	F338-D351 HydrophobicContact CD1-CB 3.96Å; F338-D351 HydrophobicContact CE1-CB 3.92Å; D351-R353 VanDerWaalsContact OD1-CB 3.29Å; D351-R353 WeakPolarHBondContact OD1-CB 3.4Å; D351-R353 WeakPolarHBondContact OD1-CG 3.32Å; D351-R353 IonicContact OD1-CZ 3.92Å; D351-R353 PolarHBondContact OD1-N 2.94Å; D351-R353 IonicContact OD1-NE 2.95Å; D351-R353 PolarHBondContact OD1-NE 2.79Å; D351-R353 IonicContact OD2-CZ 3.19Å; D351-R353 IonicContact OD2-NE 2.97Å; D351-R353 PolarHBondContact OD2-NE 2.83Å; D351-R353 IonicContact OD2-NH2 2.65Å; D351-R353 PolarHBondContact OD2-NH2 2.82Å; D351-P358 VanDerWaalsContact O-CA 3.31Å; D351-P358 WeakPolarHBondContact O-CA 3.49Å; D351-I359 HydrophobicContact CB-CB 4.35Å; D351-I359 PolarHBondContact N-O 3.26Å; D351-I359 PolarHBondContact O-N 3.31Å; D351-Q361 HydrophobicContact CB-CG 3.93Å
352	V	74.6	Confident	74.2	Confident	1 Å²	1	45 Å²	45	1%	0.006	23%	0.23	C	C	.	.			trans	-108.5	17.1	-176.4	-65.2	0	0	0	0	112.3	L308 T337 L339 T350 M354	L308-V352 HydrophobicContact CD1-CB 4.32Å; L308-V352 HydrophobicContact CD1-CG1 4.09Å; L308-V352 HydrophobicContact CD2-CG1 4.43Å; T337-V352 HydrophobicContact CG2-CG2 3.96Å; T337-V352 PolarHBondContact O-N 2.98Å; L339-V352 HydrophobicContact CB-CG1 3.56Å; L339-V352 HydrophobicContact CB-CG2 4.18Å; L339-V352 HydrophobicContact CD2-CG1 4.13Å; T350-V352 HydrophobicContact CG2-CG1 4.28Å; T350-V352 PolarHBondContact O-N 2.92Å; V352-M354 PolarHBondContact O-N 2.64Å
353	R	68.4	Low	74.3	Confident	80 Å²	80	49.8 Å²	49.8	30%	0.302	25%	0.251	S	S	.	.	S	Bend	trans	-64.1	-25.5	179.8	-67.9	176.4	-64.2	156.1	3.1	114	Y294 D351 P355	Y294-R353 HydrophobicContact CE2-CB 3.95Å; Y294-R353 HydrophobicContact CE2-CG 4.18Å; Y294-R353 VanDerWaalsContact CE2-O 3.25Å; Y294-R353 WeakPolarHBondContact CE2-O 3.48Å; Y294-R353 PolarHBondContact OH-O 2.86Å; Y294-R353 VanDerWaalsContact OH-O 3.04Å; D351-R353 VanDerWaalsContact OD1-CB 3.29Å; D351-R353 WeakPolarHBondContact OD1-CB 3.4Å; D351-R353 WeakPolarHBondContact OD1-CG 3.32Å; D351-R353 IonicContact OD1-CZ 3.92Å; D351-R353 PolarHBondContact OD1-N 2.94Å; D351-R353 IonicContact OD1-NE 2.95Å; D351-R353 PolarHBondContact OD1-NE 2.79Å; D351-R353 IonicContact OD2-CZ 3.19Å; D351-R353 IonicContact OD2-NE 2.97Å; D351-R353 PolarHBondContact OD2-NE 2.83Å; D351-R353 IonicContact OD2-NH2 2.65Å; D351-R353 PolarHBondContact OD2-NH2 2.82Å; R353-P355 WeakPolarHBondContact O-CD 3.44Å
354	M	66.5	Low	74.1	Confident	120 Å²	120	51.2 Å²	51.2	59%	0.591	26%	0.257	S	S	*	.	S	Bend	trans	-111.9	91.2	169	-63.2	-173.6	-177.5	0	0	107.6	V352 K356 A357	V352-M354 PolarHBondContact O-N 2.64Å; M354-K356 PolarHBondContact O-N 3Å; M354-A357 HydrophobicContact CB-CB 4.39Å; M354-A357 CarbonylContact O-C 3.56Å; M354-A357 PolarHBondContact O-N 2.91Å
355	P	63.5	Low	74.3	Confident	31 Å²	31	50.3 Å²	50.3	20%	0.201	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-21.5	-176.9	-27.9	34.6	0	0	0	114.3	C297 L308 L319 R353	C297-P355 HydrophobicContact CB-CG 4.32Å; L308-P355 HydrophobicContact CD1-CB 4.25Å; L319-P355 WeakPolarHBondContact CD2-O 3.34Å; R353-P355 WeakPolarHBondContact O-CD 3.44Å
356	K	67	Low	74.1	Confident	191 Å²	191	47.8 Å²	47.8	83%	0.83	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-17.7	176	-63.7	-173.8	177.4	-176.4	0	114.3	M354	M354-K356 PolarHBondContact O-N 3Å
357	A	67.2	Low	73	Confident	56 Å²	56	55.8 Å²	55.8	46%	0.463	28%	0.279	S	S	.	.	S	Bend	trans	-145.8	65.4	-176.8	0	0	0	0	0	110.6	M354	M354-A357 HydrophobicContact CB-CB 4.39Å; M354-A357 CarbonylContact O-C 3.56Å; M354-A357 PolarHBondContact O-N 2.91Å
358	P	71.7	Confident	71.6	Confident	36 Å²	36	58.4 Å²	58.4	23%	0.234	31%	0.306	C	S	.	.			trans	-66.2	141.9	179.3	28.2	-34.1	0	0	0	110.8	L319 L321 T350 D351	L319-P358 HydrophobicContact CD2-CG 3.6Å; L321-P358 HydrophobicContact CD2-CB 3.42Å; L321-P358 VanDerWaalsContact CD2-CB 3.42Å; L321-P358 HydrophobicContact CD2-CG 3.22Å; L321-P358 HydrophobicContact CG-CG 4.45Å; T350-P358 HydrophobicContact CG2-CB 3.71Å; D351-P358 VanDerWaalsContact O-CA 3.31Å; D351-P358 WeakPolarHBondContact O-CA 3.49Å
359	I	72.5	Confident	69.6	Low	94 Å²	94	63.8 Å²	63.8	48%	0.482	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	118.2	-174.7	-55.7	173.7	0	0	0	109.4	T350 D351 Q361	T350-I359 CarbonylContact C-O 3.55Å; T350-I359 WeakPolarHBondContact CA-O 3.43Å; D351-I359 HydrophobicContact CB-CB 4.35Å; D351-I359 PolarHBondContact N-O 3.26Å; D351-I359 PolarHBondContact O-N 3.31Å; I359-Q361 PolarHBondContact O-N 3.08Å; I359-Q361 VanDerWaalsContact O-N 3.17Å
360	I	79	Confident	68	Low	87 Å²	87	64.6 Å²	64.6	45%	0.446	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	114.7	173	-59.1	175.4	0	0	0	108	K363	I360-K363 HydrophobicContact CG2-CB 4.27Å
361	Q	75.5	Confident	66.4	Low	23 Å²	23	69.5 Å²	69.5	11%	0.107	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-31.2	178.8	-61.9	-60.3	-28	0	0	112	F338 L349 D351 I359 S412 F414	F338-Q361 HydrophobicContact CD1-CG 4.2Å; F338-Q361 HydrophobicContact CE1-CG 3.97Å; L349-Q361 PolarHBondContact O-N 2.89Å; D351-Q361 HydrophobicContact CB-CG 3.93Å; I359-Q361 PolarHBondContact O-N 3.08Å; I359-Q361 VanDerWaalsContact O-N 3.17Å; Q361-S412 VanDerWaalsContact CG-O 3.28Å; Q361-S412 WeakPolarHBondContact CG-O 3.24Å; Q361-S412 VanDerWaalsContact OE1-C 3.23Å; Q361-S412 PolarHBondContact OE1-O 2.79Å; Q361-F414 HydrophobicContact CB-CD2 3.99Å
362	W	74.5	Confident	65.2	Low	20 Å²	20	74.7 Å²	74.7	8%	0.076	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	144.7	178.7	175.7	83.7	0	0	0	110.3	V347 K348 L349 H364 V389 F402 L404 F414	V347-W362 HydrophobicContact CB-CZ3 4.22Å; V347-W362 HydrophobicContact CG1-CZ3 3.99Å; K348-W362 WeakPolarHBondContact CA-O 3.44Å; L349-W362 HydrophobicContact CB-CB 4.12Å; L349-W362 HydrophobicContact CB-CE3 4.18Å; L349-W362 PolarHBondContact N-O 3.02Å; L349-W362 PolarHBondContact O-N 2.98Å; W362-H364 HydrophobicContact CH2-CB 3.53Å; W362-H364 HydrophobicContact CZ2-CB 3.43Å; W362-H364 VanDerWaalsContact CZ2-CB 3.43Å; W362-H364 HydrophobicContact CZ3-CB 4.29Å; W362-V389 HydrophobicContact CH2-CB 4.42Å; W362-V389 HydrophobicContact CH2-CG1 4.4Å; W362-V389 HydrophobicContact CZ3-CB 4.36Å; W362-V389 HydrophobicContact CZ3-CG1 4.19Å; W362-V389 HydrophobicContact CZ3-CG2 4.18Å; W362-F402 HydrophobicContact CH2-CB 3.81Å; W362-F402 HydrophobicContact CH2-CD1 4.45Å; W362-F402 HydrophobicContact CH2-CD2 4.18Å; W362-F402 AromaticContact CH2-CG 3.88Å; W362-F402 HydrophobicContact CH2-CG 3.88Å; W362-F402 HydrophobicContact CZ2-CB 3.84Å; W362-F402 HydrophobicContact CZ2-CD1 4.34Å; W362-F402 HydrophobicContact CZ2-CG 4.08Å; W362-L404 HydrophobicContact CD2-CD1 4.39Å; W362-L404 HydrophobicContact CD2-CD2 3.59Å; W362-L404 HydrophobicContact CE3-CD1 4.43Å; W362-L404 HydrophobicContact CE3-CD2 4.26Å; W362-L404 HydrophobicContact CG-CD2 3.8Å; W362-L404 HydrophobicContact CH2-CD2 4.42Å; W362-L404 HydrophobicContact CZ2-CD2 3.79Å; W362-F414 HydrophobicContact CB-CB 4.2Å
363	K	80.8	Confident	64.4	Low	102 Å²	102	75 Å²	75	44%	0.443	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	141.9	175.5	175.1	-176.2	173.7	-166.4	0	108.5	V347 K348 I360	V347-K363 CarbonylContact O-C 3.44Å; V347-K363 WeakPolarHBondContact O-CA 3.48Å; K348-K363 HydrophobicContact CG-CB 4.24Å; K348-K363 HydrophobicContact CG-CD 4.43Å; K348-K363 HydrophobicContact CG-CG 3.92Å; I360-K363 HydrophobicContact CG2-CB 4.27Å
364	H	73.8	Confident	64	Low	30 Å²	30	73.6 Å²	73.6	14%	0.139	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	134.5	169.8	-165.2	82.8	0	0	0	110.1	S346 V347 W362 F402 H418	S346-H364 CarbonylContact C-O 3.55Å; S346-H364 WeakPolarHBondContact CA-O 3.36Å; S346-H364 WeakPolarHBondContact CB-O 3.19Å; V347-H364 PolarHBondContact N-O 3.28Å; V347-H364 PolarHBondContact O-N 2.76Å; W362-H364 HydrophobicContact CH2-CB 3.53Å; W362-H364 HydrophobicContact CZ2-CB 3.43Å; W362-H364 VanDerWaalsContact CZ2-CB 3.43Å; W362-H364 HydrophobicContact CZ3-CB 4.29Å; H364-F402 AromaticContact CD2-CD1 3.95Å; H364-F402 AromaticContact CD2-CE1 3.22Å; H364-F402 WeakPolarHBondContact CD2-CE1 3.07Å; H364-F402 AromaticContact CD2-CZ 3.59Å; H364-F402 AromaticContact CE1-CE1 3.82Å; H364-F402 AromaticContact CG-CE1 3.82Å; H364-F402 AromaticContact NE2-CE1 3.24Å; H364-F402 WeakPolarHBondContact NE2-CE1 3.31Å; H364-F402 AromaticContact NE2-CZ 3.94Å; H364-H418 AromaticContact CE1-CE1 3.49Å; H364-H418 PolarHBondContact CE1-CE1 3.42Å; H364-H418 VanDerWaalsContact CE1-CE1 3.49Å; H364-H418 AromaticContact ND1-CE1 3.6Å
365	M	73.7	Confident	63.6	Low	73 Å²	73	68.4 Å²	68.4	36%	0.36	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	130.6	172.5	-63	-162.7	-46.7	0	0	109.6	T345 W559	T345-M365 CarbonylContact O-C 3.41Å; T345-M365 WeakPolarHBondContact O-CA 3.44Å; M365-W559 HydrophobicContact CE-CG 4.46Å; M365-W559 HydrophobicContact CE-CZ2 4.45Å
366	L	66.6	Low	63.4	Low	27 Å²	27	67.6 Å²	67.6	14%	0.141	35%	0.353	C	S	.	.			trans	-84.1	118	174.7	-63.4	172.4	0	0	0	108.3	T345 V347 G368 A370 I373 V391 F402	T345-L366 PolarHBondContact O-N 3.22Å; V347-L366 HydrophobicContact CG2-CD1 3.72Å; V347-L366 HydrophobicContact CG2-CD2 4.01Å; V347-L366 HydrophobicContact CG2-CG 3.99Å; L366-G368 PolarHBondContact O-N 2.86Å; L366-A370 HydrophobicContact CB-CB 4.41Å; L366-A370 HydrophobicContact CD1-CB 4.03Å; L366-I373 HydrophobicContact CD1-CD1 3.21Å; L366-I373 HydrophobicContact CD1-CG1 4.18Å; L366-V391 HydrophobicContact CD1-CG1 4.47Å; L366-F402 HydrophobicContact CD2-CE2 4.2Å; L366-F402 HydrophobicContact CD2-CZ 3.95Å
367	L	56.3	Low	63.3	Low	170 Å²	170	58.9 Å²	58.9	89%	0.89	32%	0.316	S	S	*	.			trans	-80.3	115.3	174.1	-64.9	174	0	0	0	108.8
368	G	50	Low	63.2	Low	56 Å²	56	56.5 Å²	56.5	58%	0.577	30%	0.295	S	S	*	.	S	Bend	trans	119	159.2	-178.9	0	0	0	0	0	112.7	L366 A370	L366-G368 PolarHBondContact O-N 2.86Å; G368-A370 PolarHBondContact O-N 2.87Å
369	N	41.9	Very low	62.7	Low	135 Å²	135	55 Å²	55	72%	0.722	29%	0.285	S	S	*	.			trans	-70.1	78.9	175.9	-84.1	-27.7	0	0	0	109.6	K371	N369-K371 HydrophobicContact CB-CG 4.22Å; N369-K371 PolarHBondContact O-N 3.42Å
370	A	46.5	Very low	61.9	Low	17 Å²	17	53.9 Å²	53.9	14%	0.14	28%	0.28	C	S	.	.			trans	-74.4	59.5	172.1	0	0	0	0	0	109.5	L366 G368 Y372 I373	L366-A370 HydrophobicContact CB-CB 4.41Å; L366-A370 HydrophobicContact CD1-CB 4.03Å; G368-A370 PolarHBondContact O-N 2.87Å; A370-Y372 PolarHBondContact O-N 3.4Å; A370-I373 HydrophobicContact CB-CD1 4.12Å; A370-I373 HydrophobicContact CB-CG1 3.93Å
371	K	46.4	Very low	60.4	Low	106 Å²	106	51.9 Å²	51.9	46%	0.461	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-9.5	-173.5	-77.9	-173.1	173.3	-172.9	0	113.7	N369	N369-K371 HydrophobicContact CB-CG 4.22Å; N369-K371 PolarHBondContact O-N 3.42Å
372	Y	53.4	Low	59.1	Low	113 Å²	113	57.6 Å²	57.6	44%	0.443	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.8	69.1	-176.8	-56.9	-84.8	0	0	0	111	A370 D374 S393 R394 E395	A370-Y372 PolarHBondContact O-N 3.4Å; Y372-D374 PolarHBondContact O-N 3.24Å; Y372-S393 WeakPolarHBondContact O-CA 3.45Å; Y372-S393 PolarHBondContact O-OG 3.5Å; Y372-R394 PolarHBondContact O-N 2.81Å; Y372-E395 HydrophobicContact CD2-CB 4.3Å; Y372-E395 HydrophobicContact CD2-CG 3.35Å; Y372-E395 VanDerWaalsContact CD2-OE1 3.27Å; Y372-E395 WeakPolarHBondContact CD2-OE1 3.44Å; Y372-E395 WeakPolarHBondContact CD2-OE2 3.46Å; Y372-E395 HydrophobicContact CE2-CG 3.98Å; Y372-E395 WeakPolarHBondContact CE2-OE1 3.38Å; Y372-E395 WeakPolarHBondContact CE2-OE2 3.46Å; Y372-E395 HydrophobicContact CG-CG 3.97Å
373	I	57.5	Low	57.4	Low	7 Å²	7	61.7 Å²	61.7	4%	0.036	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	119.9	165.9	-54.5	165.5	0	0	0	107.1	S327 C328 A342 T343 L366 A370 L376 V391 A392	S327-I373 WeakPolarHBondContact CB-O 3.02Å; C328-I373 VanDerWaalsContact SG-CG2 3.56Å; A342-I373 HydrophobicContact CB-CB 4.37Å; A342-I373 HydrophobicContact CB-CD1 3.53Å; A342-I373 HydrophobicContact CB-CG2 4.03Å; T343-I373 VanDerWaalsContact O-CD1 3.26Å; T343-I373 WeakPolarHBondContact O-CD1 3.39Å; L366-I373 HydrophobicContact CD1-CD1 3.21Å; L366-I373 HydrophobicContact CD1-CG1 4.18Å; A370-I373 HydrophobicContact CB-CD1 4.12Å; A370-I373 HydrophobicContact CB-CG1 3.93Å; I373-L376 HydrophobicContact CG2-CD2 4.44Å; I373-V391 HydrophobicContact CD1-CG1 4.41Å; I373-V391 HydrophobicContact CG1-CG1 4.35Å; I373-V391 HydrophobicContact CG2-CG1 3.6Å; I373-A392 WeakPolarHBondContact CA-O 3.38Å
374	D	58.9	Low	55.8	Low	52 Å²	52	59.7 Å²	59.7	28%	0.278	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-40.6	-170.7	-171.2	75.2	0	0	0	112.1	Y372 A392 R394	Y372-D374 PolarHBondContact O-N 3.24Å; D374-A392 PolarHBondContact N-O 2.85Å; D374-R394 HydrophobicContact CB-CB 4.11Å
375	S	58.2	Low	55.1	Low	10 Å²	10	62.9 Å²	62.9	7%	0.07	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	145.7	-177.8	56.1	0	0	0	0	112.6	A392	S375-A392 PolarHBondContact O-N 3.34Å; S375-A392 VanDerWaalsContact O-N 3.13Å
376	L	60.9	Low	54.3	Low	14 Å²	14	61 Å²	61	7%	0.073	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.5	171	-67.8	165.9	0	0	0	107.8	C328 H330 L340 A342 V347 I373 I390 V391	C328-L376 VanDerWaalsContact SG-CD1 3.59Å; H330-L376 HydrophobicContact CB-CB 4.5Å; L340-L376 HydrophobicContact CD2-CB 3.92Å; L340-L376 HydrophobicContact CG-CB 4.19Å; L340-L376 HydrophobicContact CG-CD1 4.15Å; A342-L376 HydrophobicContact CB-CD1 3.61Å; A342-L376 HydrophobicContact CB-CD2 4.09Å; A342-L376 HydrophobicContact CB-CG 4.22Å; A342-L376 VanDerWaalsContact N-CD1 3.34Å; V347-L376 HydrophobicContact CG1-CD2 3.93Å; V347-L376 HydrophobicContact CG2-CD2 4.43Å; I373-L376 HydrophobicContact CG2-CD2 4.44Å; L376-I390 WeakPolarHBondContact CA-O 3.24Å; L376-V391 HydrophobicContact CD2-CB 4.26Å; L376-V391 HydrophobicContact CD2-CG1 4.18Å; L376-V391 HydrophobicContact CD2-CG2 3.74Å
377	C	64.9	Low	54.3	Low	8 Å²	8	61.2 Å²	61.2	5%	0.054	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	133	171.7	-173.3	0	0	0	0	107.8	V389 I390	C377-V389 CarbonylContact O-C 3.59Å; C377-V389 WeakPolarHBondContact O-CA 3.35Å; C377-I390 HydrophobicContact CB-CB 4.35Å; C377-I390 PolarHBondContact N-O 3.25Å; C377-I390 VanDerWaalsContact N-O 3.11Å; C377-I390 PolarHBondContact O-N 3.49Å
378	L	63.4	Low	54.8	Low	6 Å²	6	53.3 Å²	53.3	3%	0.031	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	114.9	158.6	-172.3	69.9	0	0	0	106	L332 L340 D380 R387 E388 V389 L404	L332-L378 HydrophobicContact CD1-CB 3.79Å; L332-L378 HydrophobicContact CD1-CD2 3.3Å; L332-L378 HydrophobicContact CD1-CG 4.17Å; L332-L378 HydrophobicContact CD2-CB 3.39Å; L332-L378 HydrophobicContact CD2-CD2 4.06Å; L332-L378 HydrophobicContact CD2-CG 4.35Å; L332-L378 HydrophobicContact CG-CB 4.2Å; L332-L378 HydrophobicContact CG-CD2 4.23Å; L340-L378 HydrophobicContact CD2-CB 4.46Å; L378-D380 PolarHBondContact O-N 2.8Å; L378-R387 HydrophobicContact CD1-CB 3.74Å; L378-R387 HydrophobicContact CD2-CB 4.47Å; L378-R387 HydrophobicContact CG-CB 4.08Å; L378-E388 CarbonylContact C-O 3.6Å; L378-E388 WeakPolarHBondContact CA-O 3.3Å; L378-V389 HydrophobicContact CD1-CG2 3.56Å; L378-L404 HydrophobicContact CD1-CD1 4.11Å
379	D	62.9	Low	55.9	Low	4 Å²	4	50.7 Å²	50.7	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	112.9	175.1	170.3	60.5	0	0	0	109.6	H381 E388 I390 R437	D379-H381 PolarHBondContact O-N 2.91Å; D379-H381 WeakPolarHBondContact OD1-CB 3.46Å; D379-H381 PolarHBondContact OD1-N 2.83Å; D379-H381 VanDerWaalsContact OD2-CB 3.3Å; D379-H381 WeakPolarHBondContact OD2-CB 3.44Å; D379-E388 HydrophobicContact CB-CB 4.24Å; D379-E388 PolarHBondContact N-O 3.39Å; D379-E388 PolarHBondContact O-N 3.08Å; D379-I390 HydrophobicContact CB-CD1 4.37Å; D379-R437 IonicContact OD1-NH1 3.1Å; D379-R437 PolarHBondContact OD1-NH1 3.4Å; D379-R437 VanDerWaalsContact OD1-NH1 3.17Å; D379-R437 IonicContact OD2-CZ 3.66Å; D379-R437 IonicContact OD2-NH1 3.72Å; D379-R437 PolarHBondContact OD2-NH1 2.85Å; D379-R437 IonicContact OD2-NH2 2.7Å; D379-R437 PolarHBondContact OD2-NH2 3.44Å
380	D	53.9	Low	57.1	Low	71 Å²	71	44.2 Å²	44.2	38%	0.38	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	13.2	179.1	-72.4	-26.2	0	0	0	112.7	L378 H382 R387	L378-D380 PolarHBondContact O-N 2.8Å; D380-H382 PolarHBondContact O-N 2.88Å; D380-R387 IonicContact OD1-CZ 4Å; D380-R387 IonicContact OD1-NE 2.77Å; D380-R387 IonicContact OD1-NH1 2.7Å; D380-R387 PolarHBondContact OD1-NH1 2.82Å
381	H	48.4	Very low	58.2	Low	46 Å²	46	43.9 Å²	43.9	21%	0.213	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	116.7	176.5	-164.8	-50	0	0	0	109.6	D379 L383 G463	D379-H381 PolarHBondContact O-N 2.91Å; D379-H381 WeakPolarHBondContact OD1-CB 3.46Å; D379-H381 PolarHBondContact OD1-N 2.83Å; D379-H381 VanDerWaalsContact OD2-CB 3.3Å; D379-H381 WeakPolarHBondContact OD2-CB 3.44Å; H381-L383 PolarHBondContact O-N 3.11Å; H381-G463 VanDerWaalsContact CD2-CA 3.47Å; H381-G463 WeakPolarHBondContact CD2-CA 3.25Å
382	H	48.9	Very low	59.1	Low	143 Å²	143	38.9 Å²	38.9	66%	0.662	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	56.1	179.7	-59.2	-75.4	0	0	0	113	D380 G384	D380-H382 PolarHBondContact O-N 2.88Å; H382-G384 PolarHBondContact O-N 3.13Å
383	L	38.9	Very low	59.5	Low	106 Å²	106	34.4 Å²	34.4	56%	0.555	19%	0.19	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	62.6	158.6	-73.7	170	0	0	0	108.2	H381	H381-L383 PolarHBondContact O-N 3.11Å
384	G	47.2	Very low	59.5	Low	59 Å²	59	38 Å²	38	61%	0.608	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.3	-126.4	-172.6	0	0	0	0	0	112.6	H382	H382-G384 PolarHBondContact O-N 3.13Å
385	Q	57.7	Low	59.1	Low	97 Å²	97	41.4 Å²	41.4	45%	0.453	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	0.4	-175.3	-78	-178.7	2.6	0	0	113.1	L405 Q406 P407	Q385-L405 HydrophobicContact CB-CD1 3.74Å; Q385-Q406 WeakPolarHBondContact CB-O 3.36Å; Q385-Q406 VanDerWaalsContact CG-O 3.26Å; Q385-Q406 WeakPolarHBondContact CG-O 3.45Å; Q385-Q406 PolarHBondContact O-N 3.29Å; Q385-P407 PolarHBondContact NE2-O 3.42Å; Q385-P407 PolarHBondContact OE1-O 3.24Å; Q385-P407 VanDerWaalsContact OE1-O 3.13Å
386	V	58.7	Low	58.9	Low	35 Å²	35	44.4 Å²	44.4	21%	0.212	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	121	-176.8	-177.3	0	0	0	0	109.7	P403 L404 L405 L417	V386-P403 HydrophobicContact CG1-CB 4.05Å; V386-L404 CarbonylContact C-O 3.45Å; V386-L404 VanDerWaalsContact CA-O 3.26Å; V386-L404 WeakPolarHBondContact CA-O 3.33Å; V386-L405 HydrophobicContact CG2-CD1 3.78Å; V386-L417 HydrophobicContact CG1-CD1 4.27Å; V386-L417 HydrophobicContact CG2-CD1 4.12Å
387	R	66.4	Low	58.6	Low	31 Å²	31	46.7 Å²	46.7	12%	0.117	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	163.3	168.6	-58.7	-167.6	-171.9	-163.5	13.7	109.8	D334 L378 D380 P403 L404 Q406	D334-R387 IonicContact OD2-CZ 3.66Å; D334-R387 VanDerWaalsContact OD2-CZ 3.24Å; D334-R387 IonicContact OD2-NH1 3.95Å; D334-R387 PolarHBondContact OD2-NH1 3.28Å; D334-R387 IonicContact OD2-NH2 2.67Å; D334-R387 PolarHBondContact OD2-NH2 3.39Å; L378-R387 HydrophobicContact CD1-CB 3.74Å; L378-R387 HydrophobicContact CD2-CB 4.47Å; L378-R387 HydrophobicContact CG-CB 4.08Å; D380-R387 IonicContact OD1-CZ 4Å; D380-R387 IonicContact OD1-NE 2.77Å; D380-R387 IonicContact OD1-NH1 2.7Å; D380-R387 PolarHBondContact OD1-NH1 2.82Å; R387-P403 CarbonylContact O-C 3.55Å; R387-P403 WeakPolarHBondContact O-CA 3.33Å; R387-L404 PolarHBondContact N-O 2.61Å; R387-L404 PolarHBondContact O-N 2.67Å; R387-Q406 VanDerWaalsContact CZ-OE1 3.25Å
388	E	67	Low	58.3	Low	4 Å²	4	49.2 Å²	49.2	2%	0.019	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.9	177.4	-65.1	-177.8	166.2	0	0	111.2	L378 D379 I390 F402 K421 R437	L378-E388 CarbonylContact C-O 3.6Å; L378-E388 WeakPolarHBondContact CA-O 3.3Å; D379-E388 HydrophobicContact CB-CB 4.24Å; D379-E388 PolarHBondContact N-O 3.39Å; D379-E388 PolarHBondContact O-N 3.08Å; E388-I390 PolarHBondContact O-N 3.35Å; E388-F402 WeakPolarHBondContact CA-O 3.19Å; E388-K421 WeakPolarHBondContact OE1-CD 3.19Å; E388-K421 WeakPolarHBondContact OE1-CE 3.43Å; E388-K421 IonicContact OE1-NZ 3.51Å; E388-K421 PolarHBondContact OE1-NZ 3.18Å; E388-R437 IonicContact OE1-NH2 3.81Å; E388-R437 IonicContact OE2-CZ 3.36Å; E388-R437 IonicContact OE2-NH2 3.63Å; E388-R437 PolarHBondContact OE2-NH2 3.03Å
389	V	71.2	Confident	58.2	Low	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	112.9	166.8	170.6	0	0	0	0	107.8	L340 V347 W362 C377 L378 V391 A401 F402 L404	L340-V389 HydrophobicContact CD1-CG1 4.07Å; L340-V389 HydrophobicContact CD1-CG2 4.15Å; L340-V389 HydrophobicContact CD2-CG1 4.07Å; L340-V389 HydrophobicContact CD2-CG2 4.19Å; V347-V389 HydrophobicContact CG1-CG1 4.07Å; W362-V389 HydrophobicContact CH2-CB 4.42Å; W362-V389 HydrophobicContact CH2-CG1 4.4Å; W362-V389 HydrophobicContact CZ3-CB 4.36Å; W362-V389 HydrophobicContact CZ3-CG1 4.19Å; W362-V389 HydrophobicContact CZ3-CG2 4.18Å; C377-V389 CarbonylContact O-C 3.59Å; C377-V389 WeakPolarHBondContact O-CA 3.35Å; L378-V389 HydrophobicContact CD1-CG2 3.56Å; V389-V391 HydrophobicContact CG1-CG2 3.95Å; V389-A401 CarbonylContact O-C 3.52Å; V389-A401 WeakPolarHBondContact O-CA 3.14Å; V389-F402 HydrophobicContact CB-CB 4.23Å; V389-F402 HydrophobicContact CG1-CD2 4.39Å; V389-F402 PolarHBondContact N-O 3.35Å; V389-F402 PolarHBondContact O-N 2.72Å; V389-L404 HydrophobicContact CG2-CD1 3.45Å; V389-L404 VanDerWaalsContact CG2-CD1 3.45Å; V389-L404 HydrophobicContact CG2-CG 4.06Å
390	I	67.6	Low	58.3	Low	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	125	176	-54.8	168.3	0	0	0	107.9	L376 C377 D379 E388 T400 F429 M457	L376-I390 WeakPolarHBondContact CA-O 3.24Å; C377-I390 HydrophobicContact CB-CB 4.35Å; C377-I390 PolarHBondContact N-O 3.25Å; C377-I390 VanDerWaalsContact N-O 3.11Å; C377-I390 PolarHBondContact O-N 3.49Å; D379-I390 HydrophobicContact CB-CD1 4.37Å; E388-I390 PolarHBondContact O-N 3.35Å; I390-T400 WeakPolarHBondContact CA-O 3.46Å; I390-F429 HydrophobicContact CB-CZ 4.49Å; I390-F429 HydrophobicContact CD1-CE1 4.07Å; I390-F429 HydrophobicContact CD1-CZ 3.78Å; I390-F429 HydrophobicContact CG1-CE1 4.5Å; I390-F429 HydrophobicContact CG1-CZ 3.9Å; I390-F429 HydrophobicContact CG2-CE1 3.84Å; I390-F429 HydrophobicContact CG2-CZ 3.78Å; I390-M457 HydrophobicContact CB-CE 4.33Å; I390-M457 HydrophobicContact CD1-CE 4.06Å; I390-M457 HydrophobicContact CG2-CE 3.71Å; I390-M457 HydrophobicContact CG2-SD 4.2Å
391	V	70.4	Confident	58.9	Low	9 Å²	9	46.6 Å²	46.6	6%	0.055	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	120.3	179	-174	0	0	0	0	107.5	V347 L366 I373 L376 V389 A399 T400 F402	V347-V391 HydrophobicContact CG1-CG2 4.46Å; V347-V391 HydrophobicContact CG2-CG1 4.26Å; V347-V391 HydrophobicContact CG2-CG2 3.81Å; L366-V391 HydrophobicContact CD1-CG1 4.47Å; I373-V391 HydrophobicContact CD1-CG1 4.41Å; I373-V391 HydrophobicContact CG1-CG1 4.35Å; I373-V391 HydrophobicContact CG2-CG1 3.6Å; L376-V391 HydrophobicContact CD2-CB 4.26Å; L376-V391 HydrophobicContact CD2-CG1 4.18Å; L376-V391 HydrophobicContact CD2-CG2 3.74Å; V389-V391 HydrophobicContact CG1-CG2 3.95Å; V391-A399 CarbonylContact O-C 3.51Å; V391-A399 WeakPolarHBondContact O-CA 3.07Å; V391-T400 PolarHBondContact N-O 3.46Å; V391-T400 PolarHBondContact O-N 2.91Å; V391-F402 HydrophobicContact CB-CE2 4.22Å; V391-F402 HydrophobicContact CG2-CD2 3.81Å; V391-F402 HydrophobicContact CG2-CE2 3.54Å
392	A	65.9	Low	60	Low	2 Å²	2	44.9 Å²	44.9	2%	0.017	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	133.8	178.4	0	0	0	0	0	112	I373 D374 S375 D398 M454 M457	I373-A392 WeakPolarHBondContact CA-O 3.38Å; D374-A392 PolarHBondContact N-O 2.85Å; S375-A392 PolarHBondContact O-N 3.34Å; S375-A392 VanDerWaalsContact O-N 3.13Å; A392-D398 WeakPolarHBondContact CA-O 3.29Å; A392-M454 HydrophobicContact CB-CE 3.18Å; A392-M457 HydrophobicContact CB-SD 4.46Å
393	S	61.6	Low	60.7	Low	18 Å²	18	38.3 Å²	38.3	13%	0.126	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	133.6	175.2	-176.2	0	0	0	0	111.3	Y372 T396 N397 D398	Y372-S393 WeakPolarHBondContact O-CA 3.45Å; Y372-S393 PolarHBondContact O-OG 3.5Å; S393-T396 WeakPolarHBondContact CB-OG1 3.32Å; S393-N397 WeakPolarHBondContact O-CA 3.28Å; S393-N397 PolarHBondContact O-N 3.34Å; S393-D398 PolarHBondContact N-O 3.49Å
394	R	56.1	Low	62	Low	84 Å²	84	33.3 Å²	33.3	32%	0.317	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-40.5	175.1	-173.2	171.6	177.4	-177.9	-1.1	113	M134 Y372 D374	M134-R394 PolarHBondContact SD-NH1 2.84Å; M134-R394 VanDerWaalsContact SD-NH1 3.4Å; M134-R394 PolarHBondContact SD-NH2 3.17Å; Y372-R394 PolarHBondContact O-N 2.81Å; D374-R394 HydrophobicContact CB-CB 4.11Å
395	E	52.1	Low	62.8	Low	122 Å²	122	32.7 Å²	32.7	57%	0.57	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-44.3	-173	-83.3	-165.9	156.6	0	0	112.6	Y372 N397	Y372-E395 HydrophobicContact CD2-CB 4.3Å; Y372-E395 HydrophobicContact CD2-CG 3.35Å; Y372-E395 VanDerWaalsContact CD2-OE1 3.27Å; Y372-E395 WeakPolarHBondContact CD2-OE1 3.44Å; Y372-E395 WeakPolarHBondContact CD2-OE2 3.46Å; Y372-E395 HydrophobicContact CE2-CG 3.98Å; Y372-E395 WeakPolarHBondContact CE2-OE1 3.38Å; Y372-E395 WeakPolarHBondContact CE2-OE2 3.46Å; Y372-E395 HydrophobicContact CG-CG 3.97Å; E395-N397 VanDerWaalsContact C-N 3.31Å
396	T	53.5	Low	63.1	Low	74 Å²	74	28.3 Å²	28.3	45%	0.454	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-12.1	-178	70.6	0	0	0	0	112.2	S393 D398	S393-T396 WeakPolarHBondContact CB-OG1 3.32Å; T396-D398 WeakPolarHBondContact CB-OD2 3.22Å; T396-D398 PolarHBondContact O-N 2.89Å; T396-D398 WeakPolarHBondContact OG1-CB 3.24Å; T396-D398 VanDerWaalsContact OG1-CG 3.26Å; T396-D398 PolarHBondContact OG1-N 3.32Å; T396-D398 PolarHBondContact OG1-OD2 3.5Å
397	N	54.5	Low	62.8	Low	62 Å²	62	29.4 Å²	29.4	33%	0.332	15%	0.153	S	C	.	.			trans	52.9	31.7	-170.5	-166.6	41.1	0	0	0	111.5	S393 E395 S425 V426	S393-N397 WeakPolarHBondContact O-CA 3.28Å; S393-N397 PolarHBondContact O-N 3.34Å; E395-N397 VanDerWaalsContact C-N 3.31Å; N397-S425 CarbonylContact O-C 3.55Å; N397-S425 WeakPolarHBondContact O-CA 3.45Å; N397-V426 WeakPolarHBondContact O-CG2 3.41Å; N397-V426 PolarHBondContact O-N 2.94Å; N397-V426 WeakPolarHBondContact OD1-CG2 3.28Å
398	D	58.1	Low	62.5	Low	60 Å²	60	29.1 Å²	29.1	32%	0.321	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	145	176.2	-62.1	-44.2	0	0	0	110.8	A392 S393 T396 C424	A392-D398 WeakPolarHBondContact CA-O 3.29Å; S393-D398 PolarHBondContact N-O 3.49Å; T396-D398 WeakPolarHBondContact CB-OD2 3.22Å; T396-D398 PolarHBondContact O-N 2.89Å; T396-D398 WeakPolarHBondContact OG1-CB 3.24Å; T396-D398 VanDerWaalsContact OG1-CG 3.26Å; T396-D398 PolarHBondContact OG1-N 3.32Å; T396-D398 PolarHBondContact OG1-OD2 3.5Å; D398-C424 CarbonylContact C-O 3.53Å; D398-C424 VanDerWaalsContact CA-O 3.24Å; D398-C424 WeakPolarHBondContact CA-O 3.25Å
399	A	60.7	Low	61.9	Low	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.6	166.5	0	0	0	0	0	109.7	V391 S423 C424 V426 F429	V391-A399 CarbonylContact O-C 3.51Å; V391-A399 WeakPolarHBondContact O-CA 3.07Å; A399-S423 WeakPolarHBondContact O-CA 3.44Å; A399-C424 PolarHBondContact N-O 2.83Å; A399-C424 PolarHBondContact O-N 3.46Å; A399-V426 HydrophobicContact CB-CG2 4.27Å; A399-F429 HydrophobicContact CB-CB 3.78Å; A399-F429 HydrophobicContact CB-CD1 3.9Å; A399-F429 HydrophobicContact CB-CD2 4.08Å; A399-F429 HydrophobicContact CB-CG 3.63Å
400	T	65.3	Low	61.2	Low	26 Å²	26	39.5 Å²	39.5	16%	0.16	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.2	173.4	-52.7	0	0	0	0	110.1	I390 V391 F402 P420 V422	I390-T400 WeakPolarHBondContact CA-O 3.46Å; V391-T400 PolarHBondContact N-O 3.46Å; V391-T400 PolarHBondContact O-N 2.91Å; T400-F402 HydrophobicContact CG2-CD2 4.3Å; T400-F402 HydrophobicContact CG2-CE1 3.89Å; T400-F402 HydrophobicContact CG2-CE2 3.57Å; T400-F402 HydrophobicContact CG2-CZ 3.35Å; T400-P420 HydrophobicContact CG2-CB 3.77Å; T400-P420 HydrophobicContact CG2-CG 4.39Å; T400-V422 VanDerWaalsContact CA-O 3.25Å; T400-V422 WeakPolarHBondContact CA-O 3.36Å
401	A	67.1	Low	60.6	Low	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.6	175.5	0	0	0	0	0	111.7	V389 P403 P420 K421 V422 F429	V389-A401 CarbonylContact O-C 3.52Å; V389-A401 WeakPolarHBondContact O-CA 3.14Å; A401-P403 WeakPolarHBondContact O-CD 3.1Å; A401-P420 CarbonylContact O-C 3.56Å; A401-P420 WeakPolarHBondContact O-CA 3.43Å; A401-P420 WeakPolarHBondContact O-CB 3.41Å; A401-K421 PolarHBondContact O-N 2.72Å; A401-V422 PolarHBondContact N-O 3.41Å; A401-F429 HydrophobicContact CB-CE2 3.76Å; A401-F429 HydrophobicContact CB-CZ 4.28Å
402	F	70.5	Confident	59.9	Low	11 Å²	11	42 Å²	42	5%	0.048	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	108	176.6	-58.1	-81.9	0	0	0	109.9	W362 H364 L366 E388 V389 V391 T400 L404 P420	W362-F402 HydrophobicContact CH2-CB 3.81Å; W362-F402 HydrophobicContact CH2-CD1 4.45Å; W362-F402 HydrophobicContact CH2-CD2 4.18Å; W362-F402 AromaticContact CH2-CG 3.88Å; W362-F402 HydrophobicContact CH2-CG 3.88Å; W362-F402 HydrophobicContact CZ2-CB 3.84Å; W362-F402 HydrophobicContact CZ2-CD1 4.34Å; W362-F402 HydrophobicContact CZ2-CG 4.08Å; H364-F402 AromaticContact CD2-CD1 3.95Å; H364-F402 AromaticContact CD2-CE1 3.22Å; H364-F402 WeakPolarHBondContact CD2-CE1 3.07Å; H364-F402 AromaticContact CD2-CZ 3.59Å; H364-F402 AromaticContact CE1-CE1 3.82Å; H364-F402 AromaticContact CG-CE1 3.82Å; H364-F402 AromaticContact NE2-CE1 3.24Å; H364-F402 WeakPolarHBondContact NE2-CE1 3.31Å; H364-F402 AromaticContact NE2-CZ 3.94Å; L366-F402 HydrophobicContact CD2-CE2 4.2Å; L366-F402 HydrophobicContact CD2-CZ 3.95Å; E388-F402 WeakPolarHBondContact CA-O 3.19Å; V389-F402 HydrophobicContact CB-CB 4.23Å; V389-F402 HydrophobicContact CG1-CD2 4.39Å; V389-F402 PolarHBondContact N-O 3.35Å; V389-F402 PolarHBondContact O-N 2.72Å; V391-F402 HydrophobicContact CB-CE2 4.22Å; V391-F402 HydrophobicContact CG2-CD2 3.81Å; V391-F402 HydrophobicContact CG2-CE2 3.54Å; T400-F402 HydrophobicContact CG2-CD2 4.3Å; T400-F402 HydrophobicContact CG2-CE1 3.89Å; T400-F402 HydrophobicContact CG2-CE2 3.57Å; T400-F402 HydrophobicContact CG2-CZ 3.35Å; F402-L404 PolarHBondContact O-N 3.47Å; F402-P420 HydrophobicContact CD1-CB 3.92Å; F402-P420 HydrophobicContact CE1-CB 3.86Å; F402-P420 HydrophobicContact CE1-CG 4.2Å
403	P	63.4	Low	59.5	Low	5 Å²	5	46.6 Å²	46.6	3%	0.032	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	129.1	173.3	28.9	-35.7	0	0	0	111.2	V386 R387 A401 L417 K421	V386-P403 HydrophobicContact CG1-CB 4.05Å; R387-P403 CarbonylContact O-C 3.55Å; R387-P403 WeakPolarHBondContact O-CA 3.33Å; A401-P403 WeakPolarHBondContact O-CD 3.1Å; P403-L417 HydrophobicContact CB-CB 4.1Å; P403-L417 HydrophobicContact CB-CD1 4.28Å; P403-L417 HydrophobicContact CG-CB 3.79Å; P403-L417 WeakPolarHBondContact CG-O 3.41Å; P403-L417 PolarHBondContact O-N 3.06Å; P403-K421 HydrophobicContact CB-CD 4.07Å; P403-K421 HydrophobicContact CB-CG 4.39Å; P403-K421 HydrophobicContact CG-CD 4.12Å; P403-K421 HydrophobicContact CG-CG 3.88Å
404	L	67.4	Low	59.6	Low	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	123.5	174.7	-57.9	-173.3	0	0	0	109.3	L349 W362 L378 V386 R387 V389 F402 F414 C415	L349-L404 HydrophobicContact CD2-CD1 3.92Å; W362-L404 HydrophobicContact CD2-CD1 4.39Å; W362-L404 HydrophobicContact CD2-CD2 3.59Å; W362-L404 HydrophobicContact CE3-CD1 4.43Å; W362-L404 HydrophobicContact CE3-CD2 4.26Å; W362-L404 HydrophobicContact CG-CD2 3.8Å; W362-L404 HydrophobicContact CH2-CD2 4.42Å; W362-L404 HydrophobicContact CZ2-CD2 3.79Å; L378-L404 HydrophobicContact CD1-CD1 4.11Å; V386-L404 CarbonylContact C-O 3.45Å; V386-L404 VanDerWaalsContact CA-O 3.26Å; V386-L404 WeakPolarHBondContact CA-O 3.33Å; R387-L404 PolarHBondContact N-O 2.61Å; R387-L404 PolarHBondContact O-N 2.67Å; V389-L404 HydrophobicContact CG2-CD1 3.45Å; V389-L404 VanDerWaalsContact CG2-CD1 3.45Å; V389-L404 HydrophobicContact CG2-CG 4.06Å; F402-L404 PolarHBondContact O-N 3.47Å; L404-F414 HydrophobicContact CB-CD1 3.98Å; L404-F414 HydrophobicContact CD1-CB 4.38Å; L404-F414 HydrophobicContact CD1-CD1 3.99Å; L404-F414 HydrophobicContact CD1-CG 4.36Å; L404-C415 CarbonylContact C-O 3.49Å
405	L	63.3	Low	59.8	Low	46 Å²	46	44.6 Å²	44.6	24%	0.241	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.2	167.5	-177.5	71.8	0	0	0	109.4	Q385 V386 C415 L417	Q385-L405 HydrophobicContact CB-CD1 3.74Å; V386-L405 HydrophobicContact CG2-CD1 3.78Å; L405-C415 HydrophobicContact CB-CB 4.25Å; L405-C415 PolarHBondContact N-O 2.79Å; L405-C415 PolarHBondContact O-N 2.81Å; L405-L417 HydrophobicContact CB-CD1 4.24Å; L405-L417 HydrophobicContact CB-CD2 4.33Å; L405-L417 HydrophobicContact CB-CG 4.2Å
406	Q	65.1	Low	60	Low	6 Å²	6	40.1 Å²	40.1	3%	0.028	23%	0.234	C	C	.	.			trans	-104	102.7	169.5	-163.8	-166.8	3.3	0	0	108.7	Q385 R387 S408 E409 A411 F414	Q385-Q406 WeakPolarHBondContact CB-O 3.36Å; Q385-Q406 VanDerWaalsContact CG-O 3.26Å; Q385-Q406 WeakPolarHBondContact CG-O 3.45Å; Q385-Q406 PolarHBondContact O-N 3.29Å; R387-Q406 VanDerWaalsContact CZ-OE1 3.25Å; Q406-S408 VanDerWaalsContact CD-O 3.29Å; Q406-S408 VanDerWaalsContact CG-O 3.3Å; Q406-S408 WeakPolarHBondContact CG-O 3.33Å; Q406-S408 PolarHBondContact NE2-O 3.17Å; Q406-S408 PolarHBondContact O-N 2.8Å; Q406-E409 PolarHBondContact NE2-O 2.8Å; Q406-A411 HydrophobicContact CG-CB 4.41Å; Q406-A411 PolarHBondContact NE2-O 2.81Å; Q406-F414 HydrophobicContact CB-CD1 3.93Å; Q406-F414 HydrophobicContact CB-CE1 3.76Å; Q406-F414 HydrophobicContact CG-CD1 4.1Å; Q406-F414 HydrophobicContact CG-CE1 3.71Å; Q406-F414 HydrophobicContact CG-CZ 4Å
407	P	52.5	Low	60.2	Low	57 Å²	57	40.3 Å²	40.3	37%	0.37	23%	0.232	S	C	.	.	S	Bend	trans	-58.2	-13.9	-169.6	-26.7	34.9	0	0	0	116.3	Q385 A411 L413	Q385-P407 PolarHBondContact NE2-O 3.42Å; Q385-P407 PolarHBondContact OE1-O 3.24Å; Q385-P407 VanDerWaalsContact OE1-O 3.13Å; P407-A411 HydrophobicContact CB-CB 4.28Å; P407-A411 HydrophobicContact CG-CB 4.47Å; P407-L413 WeakPolarHBondContact CD-O 3.15Å
408	S	59	Low	60.1	Low	26 Å²	26	43.1 Å²	43.1	18%	0.182	24%	0.242	C	C	.	.	S	Bend	trans	-162.9	162	163.4	63.8	0	0	0	0	108.5	Q406 N410 A411	Q406-S408 VanDerWaalsContact CD-O 3.29Å; Q406-S408 VanDerWaalsContact CG-O 3.3Å; Q406-S408 WeakPolarHBondContact CG-O 3.33Å; Q406-S408 PolarHBondContact NE2-O 3.17Å; Q406-S408 PolarHBondContact O-N 2.8Å; S408-N410 PolarHBondContact O-N 3.36Å; S408-N410 PolarHBondContact OG-N 2.86Å; S408-A411 WeakPolarHBondContact O-CB 3.43Å; S408-A411 PolarHBondContact O-N 2.99Å; S408-A411 PolarHBondContact OG-N 2.75Å
409	E	54.2	Low	59.5	Low	128 Å²	128	45.1 Å²	45.1	60%	0.598	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-24	172.8	-64.3	178.2	174.4	0	0	112.5	Q406	Q406-E409 PolarHBondContact NE2-O 2.8Å
410	N	56.3	Low	59.3	Low	94 Å²	94	47.5 Å²	47.5	50%	0.503	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	9.1	177.3	-65.8	-31.4	0	0	0	113.6	R336 S408	R336-N410 VanDerWaalsContact CZ-C 3.41Å; R336-N410 VanDerWaalsContact NH1-C 3.34Å; R336-N410 PolarHBondContact NH1-O 2.83Å; R336-N410 PolarHBondContact NH2-O 3.01Å; S408-N410 PolarHBondContact O-N 3.36Å; S408-N410 PolarHBondContact OG-N 2.86Å
411	A	56.4	Low	58.7	Low	17 Å²	17	50.9 Å²	50.9	14%	0.14	29%	0.287	C	S	.	.			trans	-82.7	134.4	171.1	0	0	0	0	0	108.9	R336 Q406 P407 S408	R336-A411 VanDerWaalsContact NH1-C 3.26Å; Q406-A411 HydrophobicContact CG-CB 4.41Å; Q406-A411 PolarHBondContact NE2-O 2.81Å; P407-A411 HydrophobicContact CB-CB 4.28Å; P407-A411 HydrophobicContact CG-CB 4.47Å; S408-A411 WeakPolarHBondContact O-CB 3.43Å; S408-A411 PolarHBondContact O-N 2.99Å; S408-A411 PolarHBondContact OG-N 2.75Å
412	S	54.4	Low	58	Low	44 Å²	44	51.7 Å²	51.7	31%	0.308	29%	0.292	S	S	.	.			trans	-79.5	-29.3	169.5	49.7	0	0	0	0	111.1	Q361 F414	Q361-S412 VanDerWaalsContact CG-O 3.28Å; Q361-S412 WeakPolarHBondContact CG-O 3.24Å; Q361-S412 VanDerWaalsContact OE1-C 3.23Å; Q361-S412 PolarHBondContact OE1-O 2.79Å; S412-F414 WeakPolarHBondContact O-CD2 3.35Å
413	L	58.8	Low	57.3	Low	99 Å²	99	55.3 Å²	55.3	52%	0.518	32%	0.318	S	S	.	.			trans	-75.5	127.3	-176.7	-165.4	79.9	0	0	0	110.9	P407	P407-L413 WeakPolarHBondContact CD-O 3.15Å
414	F	63.8	Low	56.5	Low	8 Å²	8	56.4 Å²	56.4	4%	0.035	33%	0.326	C	S	.	.			trans	-106.6	132.2	167.6	-70.4	-94.1	0	0	0	109.1	F338 L349 Q361 W362 L404 Q406 S412	F338-F414 HydrophobicContact CD1-CE2 4.06Å; F338-F414 HydrophobicContact CD2-CE2 4.1Å; F338-F414 HydrophobicContact CD2-CZ 4.18Å; F338-F414 AromaticContact CE1-CE2 3.76Å; F338-F414 HydrophobicContact CE1-CE2 3.76Å; F338-F414 AromaticContact CE2-CE2 3.77Å; F338-F414 HydrophobicContact CE2-CE2 3.77Å; F338-F414 AromaticContact CE2-CZ 3.91Å; F338-F414 HydrophobicContact CE2-CZ 3.91Å; F338-F414 HydrophobicContact CG-CE2 4.23Å; F338-F414 AromaticContact CZ-CE2 3.59Å; F338-F414 HydrophobicContact CZ-CE2 3.59Å; F338-F414 HydrophobicContact CZ-CZ 4.18Å; L349-F414 HydrophobicContact CD2-CB 4.26Å; L349-F414 HydrophobicContact CD2-CD1 4.03Å; L349-F414 HydrophobicContact CD2-CD2 3.37Å; L349-F414 HydrophobicContact CD2-CE1 4.18Å; L349-F414 HydrophobicContact CD2-CE2 3.54Å; L349-F414 HydrophobicContact CD2-CG 3.62Å; L349-F414 HydrophobicContact CD2-CZ 3.94Å; Q361-F414 HydrophobicContact CB-CD2 3.99Å; W362-F414 HydrophobicContact CB-CB 4.2Å; L404-F414 HydrophobicContact CB-CD1 3.98Å; L404-F414 HydrophobicContact CD1-CB 4.38Å; L404-F414 HydrophobicContact CD1-CD1 3.99Å; L404-F414 HydrophobicContact CD1-CG 4.36Å; Q406-F414 HydrophobicContact CB-CD1 3.93Å; Q406-F414 HydrophobicContact CB-CE1 3.76Å; Q406-F414 HydrophobicContact CG-CD1 4.1Å; Q406-F414 HydrophobicContact CG-CE1 3.71Å; Q406-F414 HydrophobicContact CG-CZ 4Å; S412-F414 WeakPolarHBondContact O-CD2 3.35Å
415	C	58.7	Low	55.7	Low	51 Å²	51	57.9 Å²	57.9	35%	0.345	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	116.1	173.7	-62.7	0	0	0	0	108.7	L404 L405 L417	L404-C415 CarbonylContact C-O 3.49Å; L405-C415 HydrophobicContact CB-CB 4.25Å; L405-C415 PolarHBondContact N-O 2.79Å; L405-C415 PolarHBondContact O-N 2.81Å; C415-L417 PolarHBondContact O-N 2.92Å
416	G	58	Low	55	Low	29 Å²	29	56.1 Å²	56.1	30%	0.299	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	126.7	173.1	0	0	0	0	0	110.5
417	L	56.1	Low	54.2	Low	77 Å²	77	60.4 Å²	60.4	40%	0.403	35%	0.347	S	S	.	.			trans	-89.5	111.6	169.8	-61.7	173.7	0	0	0	107	V386 P403 L405 C415	V386-L417 HydrophobicContact CG1-CD1 4.27Å; V386-L417 HydrophobicContact CG2-CD1 4.12Å; P403-L417 HydrophobicContact CB-CB 4.1Å; P403-L417 HydrophobicContact CB-CD1 4.28Å; P403-L417 HydrophobicContact CG-CB 3.79Å; P403-L417 WeakPolarHBondContact CG-O 3.41Å; P403-L417 PolarHBondContact O-N 3.06Å; L405-L417 HydrophobicContact CB-CD1 4.24Å; L405-L417 HydrophobicContact CB-CD2 4.33Å; L405-L417 HydrophobicContact CB-CG 4.2Å; C415-L417 PolarHBondContact O-N 2.92Å
418	H	53.7	Low	54	Low	121 Å²	121	61.5 Å²	61.5	56%	0.56	35%	0.35	S	S	*	.	S	Bend	trans	-90.1	148.7	174.4	-76	-93.8	0	0	0	110.7	H364	H364-H418 AromaticContact CE1-CE1 3.49Å; H364-H418 PolarHBondContact CE1-CE1 3.42Å; H364-H418 VanDerWaalsContact CE1-CE1 3.49Å; H364-H418 AromaticContact ND1-CE1 3.6Å
419	P	45.2	Very low	53.4	Low	103 Å²	103	60.3 Å²	60.3	67%	0.669	34%	0.341	S	S	*	.	S	Bend	cis	-80.2	171.7	-7.9	33.1	-34.9	0	0	0	113.1
420	P	55.8	Low	53.2	Low	49 Å²	49	55.2 Å²	55.2	32%	0.318	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-50.7	141.8	168.7	20.5	-32.3	0	0	0	111.2	T400 A401 F402	T400-P420 HydrophobicContact CG2-CB 3.77Å; T400-P420 HydrophobicContact CG2-CG 4.39Å; A401-P420 CarbonylContact O-C 3.56Å; A401-P420 WeakPolarHBondContact O-CA 3.43Å; A401-P420 WeakPolarHBondContact O-CB 3.41Å; F402-P420 HydrophobicContact CD1-CB 3.92Å; F402-P420 HydrophobicContact CE1-CB 3.86Å; F402-P420 HydrophobicContact CE1-CG 4.2Å
421	K	53	Low	52.8	Low	98 Å²	98	55.3 Å²	55.3	43%	0.426	32%	0.318	S	S	.	.	S	Bend	trans	-69.9	-36.5	-174	-85.7	176.6	178.7	179.6	0	112.6	E388 A401 P403 W432	E388-K421 WeakPolarHBondContact OE1-CD 3.19Å; E388-K421 WeakPolarHBondContact OE1-CE 3.43Å; E388-K421 IonicContact OE1-NZ 3.51Å; E388-K421 PolarHBondContact OE1-NZ 3.18Å; A401-K421 PolarHBondContact O-N 2.72Å; P403-K421 HydrophobicContact CB-CD 4.07Å; P403-K421 HydrophobicContact CB-CG 4.39Å; P403-K421 HydrophobicContact CG-CD 4.12Å; P403-K421 HydrophobicContact CG-CG 3.88Å; K421-W432 HydrophobicContact CD-CH2 4.47Å
422	V	53.2	Low	52.2	Low	17 Å²	17	57.2 Å²	57.2	10%	0.103	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	135.2	-173.6	-177.6	0	0	0	0	108.7	T400 A401 C424 F429 W432	T400-V422 VanDerWaalsContact CA-O 3.25Å; T400-V422 WeakPolarHBondContact CA-O 3.36Å; A401-V422 PolarHBondContact N-O 3.41Å; V422-C424 HydrophobicContact CG1-CB 4.16Å; V422-C424 WeakPolarHBondContact CG1-SG 3.44Å; V422-F429 HydrophobicContact CB-CD2 4.25Å; V422-F429 HydrophobicContact CG1-CD2 3.99Å; V422-W432 HydrophobicContact CG2-CD2 3.44Å; V422-W432 VanDerWaalsContact CG2-CD2 3.44Å; V422-W432 HydrophobicContact CG2-CE3 3.84Å; V422-W432 HydrophobicContact CG2-CG 3.86Å; V422-W432 HydrophobicContact CG2-CH2 4.05Å; V422-W432 HydrophobicContact CG2-CZ2 3.66Å; V422-W432 HydrophobicContact CG2-CZ3 4.12Å
423	S	55.7	Low	51.9	Low	87 Å²	87	55.2 Å²	55.2	61%	0.608	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.2	100	164	179.4	0	0	0	0	106.2	A399	A399-S423 WeakPolarHBondContact O-CA 3.44Å
424	C	46.8	Very low	51.1	Low	28 Å²	28	53.2 Å²	53.2	19%	0.189	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	177.7	-179.1	62.1	0	0	0	0	109.9	D398 A399 V422 D428 F429	D398-C424 CarbonylContact C-O 3.53Å; D398-C424 VanDerWaalsContact CA-O 3.24Å; D398-C424 WeakPolarHBondContact CA-O 3.25Å; A399-C424 PolarHBondContact N-O 2.83Å; A399-C424 PolarHBondContact O-N 3.46Å; V422-C424 HydrophobicContact CG1-CB 4.16Å; V422-C424 WeakPolarHBondContact CG1-SG 3.44Å; C424-D428 HydrophobicContact CB-CB 3.74Å; C424-D428 VanDerWaalsContact SG-C 3.53Å; C424-D428 VanDerWaalsContact SG-CB 3.54Å; C424-F429 VanDerWaalsContact SG-CA 3.52Å; C424-F429 PolarHBondContact SG-N 3.08Å
425	S	49.1	Very low	49.9	Very low	30 Å²	30	56.6 Å²	56.6	21%	0.21	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	151	172.7	73.8	0	0	0	0	110.6	N397 E427 D428 F429	N397-S425 CarbonylContact O-C 3.55Å; N397-S425 WeakPolarHBondContact O-CA 3.45Å; S425-E427 PolarHBondContact O-N 3.33Å; S425-D428 CarbonylContact O-C 3.47Å; S425-D428 PolarHBondContact O-N 3.16Å; S425-D428 WeakPolarHBondContact OG-CB 2.92Å; S425-D428 PolarHBondContact OG-N 2.7Å; S425-D428 VanDerWaalsContact OG-N 3.11Å; S425-D428 PolarHBondContact OG-OD2 2.94Å; S425-F429 WeakPolarHBondContact O-CB 3.43Å; S425-F429 PolarHBondContact O-N 2.82Å
426	V	49.9	Very low	49	Very low	9 Å²	9	59.8 Å²	59.8	6%	0.055	33%	0.334	C	S	.	.	H	α-helix	trans	-54.7	-37.7	176.7	171.8	0	0	0	0	111	N397 A399 F429 L430 M454	N397-V426 WeakPolarHBondContact O-CG2 3.41Å; N397-V426 PolarHBondContact O-N 2.94Å; N397-V426 WeakPolarHBondContact OD1-CG2 3.28Å; A399-V426 HydrophobicContact CB-CG2 4.27Å; V426-F429 PolarHBondContact O-N 3.17Å; V426-L430 HydrophobicContact CG1-CD1 4.1Å; V426-L430 HydrophobicContact CG1-CG 4.36Å; V426-L430 WeakPolarHBondContact O-CB 3.32Å; V426-L430 VanDerWaalsContact O-CG 3.27Å; V426-L430 WeakPolarHBondContact O-CG 3.34Å; V426-L430 PolarHBondContact O-N 2.84Å; V426-M454 HydrophobicContact CB-CE 4.18Å; V426-M454 HydrophobicContact CG1-CE 3.56Å; V426-M454 HydrophobicContact CG1-CG 3.85Å; V426-M454 HydrophobicContact CG1-SD 3.68Å; V426-M454 HydrophobicContact CG2-CE 3.46Å; V426-M454 VanDerWaalsContact CG2-CE 3.46Å
427	E	48.1	Very low	48.1	Very low	97 Å²	97	59.2 Å²	59.2	45%	0.453	32%	0.323	S	S	.	.	H	α-helix	trans	-62.1	-48.8	175.7	-65.8	-176.9	-177.8	0	0	111.5	S425 F429 L430 L431	S425-E427 PolarHBondContact O-N 3.33Å; E427-F429 VanDerWaalsContact C-N 3.26Å; E427-F429 PolarHBondContact O-N 3.06Å; E427-L430 PolarHBondContact O-N 3.24Å; E427-L431 WeakPolarHBondContact O-CB 3.34Å; E427-L431 VanDerWaalsContact O-CG 3.3Å; E427-L431 WeakPolarHBondContact O-CG 3.35Å; E427-L431 PolarHBondContact O-N 2.76Å
428	D	47.2	Very low	46.9	Very low	79 Å²	79	58 Å²	58	42%	0.422	32%	0.32	S	S	.	.	H	α-helix	trans	-65	-32.3	176.1	-67.7	-42.2	0	0	0	111.8	C424 S425 L431 W432	C424-D428 HydrophobicContact CB-CB 3.74Å; C424-D428 VanDerWaalsContact SG-C 3.53Å; C424-D428 VanDerWaalsContact SG-CB 3.54Å; S425-D428 CarbonylContact O-C 3.47Å; S425-D428 PolarHBondContact O-N 3.16Å; S425-D428 WeakPolarHBondContact OG-CB 2.92Å; S425-D428 PolarHBondContact OG-N 2.7Å; S425-D428 VanDerWaalsContact OG-N 3.11Å; S425-D428 PolarHBondContact OG-OD2 2.94Å; D428-L431 PolarHBondContact O-N 3.35Å; D428-W432 WeakPolarHBondContact O-CB 3.45Å; D428-W432 PolarHBondContact O-N 3.24Å
429	F	48.2	Very low	46	Very low	1 Å²	1	52.9 Å²	52.9	0%	0.004	30%	0.297	C	S	.	.	H	α-helix	trans	-69.1	-43.5	177.4	178.4	-100.3	0	0	0	110.9	I390 A399 A401 V422 C424 S425 V426 E427 W432 Q433 M457 L465	I390-F429 HydrophobicContact CB-CZ 4.49Å; I390-F429 HydrophobicContact CD1-CE1 4.07Å; I390-F429 HydrophobicContact CD1-CZ 3.78Å; I390-F429 HydrophobicContact CG1-CE1 4.5Å; I390-F429 HydrophobicContact CG1-CZ 3.9Å; I390-F429 HydrophobicContact CG2-CE1 3.84Å; I390-F429 HydrophobicContact CG2-CZ 3.78Å; A399-F429 HydrophobicContact CB-CB 3.78Å; A399-F429 HydrophobicContact CB-CD1 3.9Å; A399-F429 HydrophobicContact CB-CD2 4.08Å; A399-F429 HydrophobicContact CB-CG 3.63Å; A401-F429 HydrophobicContact CB-CE2 3.76Å; A401-F429 HydrophobicContact CB-CZ 4.28Å; V422-F429 HydrophobicContact CB-CD2 4.25Å; V422-F429 HydrophobicContact CG1-CD2 3.99Å; C424-F429 VanDerWaalsContact SG-CA 3.52Å; C424-F429 PolarHBondContact SG-N 3.08Å; S425-F429 WeakPolarHBondContact O-CB 3.43Å; S425-F429 PolarHBondContact O-N 2.82Å; V426-F429 PolarHBondContact O-N 3.17Å; E427-F429 VanDerWaalsContact C-N 3.26Å; E427-F429 PolarHBondContact O-N 3.06Å; F429-W432 HydrophobicContact CE2-CE3 4.33Å; F429-W432 HydrophobicContact CE2-CZ3 4.46Å; F429-W432 PolarHBondContact O-N 3.29Å; F429-Q433 HydrophobicContact CD1-CG 4.47Å; F429-Q433 HydrophobicContact CE1-CG 4Å; F429-Q433 HydrophobicContact CE2-CG 4.41Å; F429-Q433 HydrophobicContact CZ-CG 3.97Å; F429-Q433 VanDerWaalsContact CZ-NE2 3.28Å; F429-Q433 PolarHBondContact O-N 2.8Å; F429-M457 HydrophobicContact CE1-CE 4.41Å; F429-L465 HydrophobicContact CE1-CD2 4.32Å
430	L	49.3	Very low	45.5	Very low	22 Å²	22	48.1 Å²	48.1	12%	0.115	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-40.9	173.2	-68.9	172.6	0	0	0	110.9	V426 E427 Q433 Q434 M439 L465	V426-L430 HydrophobicContact CG1-CD1 4.1Å; V426-L430 HydrophobicContact CG1-CG 4.36Å; V426-L430 WeakPolarHBondContact O-CB 3.32Å; V426-L430 VanDerWaalsContact O-CG 3.27Å; V426-L430 WeakPolarHBondContact O-CG 3.34Å; V426-L430 PolarHBondContact O-N 2.84Å; E427-L430 PolarHBondContact O-N 3.24Å; L430-Q433 PolarHBondContact O-N 3.13Å; L430-Q434 WeakPolarHBondContact O-CB 3.26Å; L430-Q434 VanDerWaalsContact O-CG 3.26Å; L430-Q434 WeakPolarHBondContact O-CG 3.43Å; L430-Q434 PolarHBondContact O-N 3.21Å; L430-M439 HydrophobicContact CD2-CE 4.22Å; L430-L465 HydrophobicContact CD2-CD2 3.99Å
431	L	46.9	Very low	44.6	Very low	95 Å²	95	47.8 Å²	47.8	50%	0.497	27%	0.267	S	S	.	.	H	α-helix	trans	-65.1	-39.4	173.5	-71.8	171.7	0	0	0	112.2	E427 D428 Q434 A435	E427-L431 WeakPolarHBondContact O-CB 3.34Å; E427-L431 VanDerWaalsContact O-CG 3.3Å; E427-L431 WeakPolarHBondContact O-CG 3.35Å; E427-L431 PolarHBondContact O-N 2.76Å; D428-L431 PolarHBondContact O-N 3.35Å; L431-Q434 WeakPolarHBondContact O-CB 3.46Å; L431-Q434 PolarHBondContact O-N 2.7Å; L431-A435 WeakPolarHBondContact O-CB 3.47Å; L431-A435 PolarHBondContact O-N 2.85Å
432	W	45	Very low	43.8	Very low	58 Å²	58	44.7 Å²	44.7	22%	0.22	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-47.5	175.1	177.2	91.5	0	0	0	110.3	K421 V422 D428 F429 Q434 A435 H436	K421-W432 HydrophobicContact CD-CH2 4.47Å; V422-W432 HydrophobicContact CG2-CD2 3.44Å; V422-W432 VanDerWaalsContact CG2-CD2 3.44Å; V422-W432 HydrophobicContact CG2-CE3 3.84Å; V422-W432 HydrophobicContact CG2-CG 3.86Å; V422-W432 HydrophobicContact CG2-CH2 4.05Å; V422-W432 HydrophobicContact CG2-CZ2 3.66Å; V422-W432 HydrophobicContact CG2-CZ3 4.12Å; D428-W432 WeakPolarHBondContact O-CB 3.45Å; D428-W432 PolarHBondContact O-N 3.24Å; F429-W432 HydrophobicContact CE2-CE3 4.33Å; F429-W432 HydrophobicContact CE2-CZ3 4.46Å; F429-W432 PolarHBondContact O-N 3.29Å; W432-Q434 VanDerWaalsContact C-N 3.29Å; W432-Q434 PolarHBondContact O-N 3.34Å; W432-A435 PolarHBondContact O-N 3.17Å; W432-A435 VanDerWaalsContact O-N 3.09Å; W432-H436 AromaticContact CD1-CE1 3.26Å; W432-H436 AromaticContact CD1-ND1 3.53Å; W432-H436 AromaticContact CD1-NE2 3.9Å; W432-H436 AromaticContact CD2-ND1 3.9Å; W432-H436 AromaticContact CE2-CD2 3.88Å; W432-H436 AromaticContact CE2-CE1 3.86Å; W432-H436 AromaticContact CE2-CG 3.75Å; W432-H436 AromaticContact CE2-ND1 3.73Å; W432-H436 AromaticContact CE2-NE2 3.96Å; W432-H436 AromaticContact CG-CE1 3.96Å; W432-H436 AromaticContact CG-ND1 3.78Å; W432-H436 HydrophobicContact CZ2-CB 4.39Å; W432-H436 AromaticContact NE1-CD2 3.73Å; W432-H436 AromaticContact NE1-CE1 3.16Å; W432-H436 PolarHBondContact NE1-CE1 3.47Å; W432-H436 AromaticContact NE1-CG 3.83Å; W432-H436 AromaticContact NE1-ND1 3.47Å; W432-H436 PolarHBondContact NE1-ND1 3.32Å; W432-H436 AromaticContact NE1-NE2 3.32Å; W432-H436 PolarHBondContact NE1-NE2 3.02Å; W432-H436 WeakPolarHBondContact O-CB 3.41Å; W432-H436 PolarHBondContact O-N 2.82Å; W432-H436 PolarHBondContact O-ND1 3.41Å
433	Q	47.8	Very low	42.9	Very low	2 Å²	2	45.7 Å²	45.7	1%	0.009	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-40.1	173.9	-76	-155.6	-14.7	0	0	111.1	F429 L430 A435 H436 R437 M439	F429-Q433 HydrophobicContact CD1-CG 4.47Å; F429-Q433 HydrophobicContact CE1-CG 4Å; F429-Q433 HydrophobicContact CE2-CG 4.41Å; F429-Q433 HydrophobicContact CZ-CG 3.97Å; F429-Q433 VanDerWaalsContact CZ-NE2 3.28Å; F429-Q433 PolarHBondContact O-N 2.8Å; L430-Q433 PolarHBondContact O-N 3.13Å; Q433-A435 PolarHBondContact O-N 3.11Å; Q433-H436 PolarHBondContact O-N 2.82Å; Q433-R437 WeakPolarHBondContact O-CA 3.3Å; Q433-R437 VanDerWaalsContact O-CB 3.28Å; Q433-R437 WeakPolarHBondContact O-CB 3.3Å; Q433-R437 PolarHBondContact O-N 2.66Å; Q433-M439 HydrophobicContact CB-CG 4.26Å; Q433-M439 HydrophobicContact CB-SD 3.3Å; Q433-M439 WeakPolarHBondContact CB-SD 3.46Å
434	Q	42.9	Very low	42.1	Very low	56 Å²	56	46.3 Å²	46.3	26%	0.262	27%	0.265	S	S	.	.	H	α-helix	trans	-60.3	-36.3	175.2	-76.7	173.7	8.9	0	0	111.9	L430 L431 W432 M439	L430-Q434 WeakPolarHBondContact O-CB 3.26Å; L430-Q434 VanDerWaalsContact O-CG 3.26Å; L430-Q434 WeakPolarHBondContact O-CG 3.43Å; L430-Q434 PolarHBondContact O-N 3.21Å; L431-Q434 WeakPolarHBondContact O-CB 3.46Å; L431-Q434 PolarHBondContact O-N 2.7Å; W432-Q434 VanDerWaalsContact C-N 3.29Å; W432-Q434 PolarHBondContact O-N 3.34Å; Q434-M439 HydrophobicContact CB-CB 4.27Å; Q434-M439 HydrophobicContact CB-CG 4.49Å; Q434-M439 HydrophobicContact CB-SD 4.05Å; Q434-M439 HydrophobicContact CG-CB 3.64Å; Q434-M439 HydrophobicContact CG-CE 3.72Å; Q434-M439 HydrophobicContact CG-CG 4Å; Q434-M439 HydrophobicContact CG-SD 3.4Å; Q434-M439 WeakPolarHBondContact CG-SD 3.48Å; Q434-M439 PolarHBondContact N-SD 3.2Å
435	A	38	Very low	41.5	Very low	79 Å²	79	48.1 Å²	48.1	65%	0.653	28%	0.278	S	S	*	.	H	α-helix	trans	-79.8	-22.9	-180	0	0	0	0	0	113.6	L431 W432 Q433	L431-A435 WeakPolarHBondContact O-CB 3.47Å; L431-A435 PolarHBondContact O-N 2.85Å; W432-A435 PolarHBondContact O-N 3.17Å; W432-A435 VanDerWaalsContact O-N 3.09Å; Q433-A435 PolarHBondContact O-N 3.11Å
436	H	38.7	Very low	41	Very low	118 Å²	118	46.8 Å²	46.8	55%	0.546	27%	0.269	S	S	.	.	H	α-helix	trans	-112.4	-11	-172.9	-63.9	68.8	0	0	0	113.4	W432 Q433	W432-H436 AromaticContact CD1-CE1 3.26Å; W432-H436 AromaticContact CD1-ND1 3.53Å; W432-H436 AromaticContact CD1-NE2 3.9Å; W432-H436 AromaticContact CD2-ND1 3.9Å; W432-H436 AromaticContact CE2-CD2 3.88Å; W432-H436 AromaticContact CE2-CE1 3.86Å; W432-H436 AromaticContact CE2-CG 3.75Å; W432-H436 AromaticContact CE2-ND1 3.73Å; W432-H436 AromaticContact CE2-NE2 3.96Å; W432-H436 AromaticContact CG-CE1 3.96Å; W432-H436 AromaticContact CG-ND1 3.78Å; W432-H436 HydrophobicContact CZ2-CB 4.39Å; W432-H436 AromaticContact NE1-CD2 3.73Å; W432-H436 AromaticContact NE1-CE1 3.16Å; W432-H436 PolarHBondContact NE1-CE1 3.47Å; W432-H436 AromaticContact NE1-CG 3.83Å; W432-H436 AromaticContact NE1-ND1 3.47Å; W432-H436 PolarHBondContact NE1-ND1 3.32Å; W432-H436 AromaticContact NE1-NE2 3.32Å; W432-H436 PolarHBondContact NE1-NE2 3.02Å; W432-H436 WeakPolarHBondContact O-CB 3.41Å; W432-H436 PolarHBondContact O-N 2.82Å; W432-H436 PolarHBondContact O-ND1 3.41Å; Q433-H436 PolarHBondContact O-N 2.82Å
437	R	39.2	Very low	40.2	Very low	17 Å²	17	49.9 Å²	49.9	6%	0.064	28%	0.281	C	S	.	.	S	Bend	trans	-140	152.8	-177.4	-57.6	177	172.8	-138.1	-2.8	109.9	D379 E388 Q433 M439	D379-R437 IonicContact OD1-NH1 3.1Å; D379-R437 PolarHBondContact OD1-NH1 3.4Å; D379-R437 VanDerWaalsContact OD1-NH1 3.17Å; D379-R437 IonicContact OD2-CZ 3.66Å; D379-R437 IonicContact OD2-NH1 3.72Å; D379-R437 PolarHBondContact OD2-NH1 2.85Å; D379-R437 IonicContact OD2-NH2 2.7Å; D379-R437 PolarHBondContact OD2-NH2 3.44Å; E388-R437 IonicContact OE1-NH2 3.81Å; E388-R437 IonicContact OE2-CZ 3.36Å; E388-R437 IonicContact OE2-NH2 3.63Å; E388-R437 PolarHBondContact OE2-NH2 3.03Å; Q433-R437 WeakPolarHBondContact O-CA 3.3Å; Q433-R437 VanDerWaalsContact O-CB 3.28Å; Q433-R437 WeakPolarHBondContact O-CB 3.3Å; Q433-R437 PolarHBondContact O-N 2.66Å; R437-M439 PolarHBondContact O-N 3.39Å
438	P	32.1	Very low	39.3	Very low	52 Å²	52	53.4 Å²	53.4	34%	0.338	30%	0.298	S	S	.	.			trans	-67.1	86.4	168.5	28.3	-31.7	0	0	0	108.9
439	M	34	Very low	38.5	Very low	14 Å²	14	54.5 Å²	54.5	7%	0.069	30%	0.296	C	S	.	.			trans	-83.6	140.8	168.7	-77.4	-167.6	56	0	0	109.8	L430 Q433 Q434 R437 A441	L430-M439 HydrophobicContact CD2-CE 4.22Å; Q433-M439 HydrophobicContact CB-CG 4.26Å; Q433-M439 HydrophobicContact CB-SD 3.3Å; Q433-M439 WeakPolarHBondContact CB-SD 3.46Å; Q434-M439 HydrophobicContact CB-CB 4.27Å; Q434-M439 HydrophobicContact CB-CG 4.49Å; Q434-M439 HydrophobicContact CB-SD 4.05Å; Q434-M439 HydrophobicContact CG-CB 3.64Å; Q434-M439 HydrophobicContact CG-CE 3.72Å; Q434-M439 HydrophobicContact CG-CG 4Å; Q434-M439 HydrophobicContact CG-SD 3.4Å; Q434-M439 WeakPolarHBondContact CG-SD 3.48Å; Q434-M439 PolarHBondContact N-SD 3.2Å; R437-M439 PolarHBondContact O-N 3.39Å; M439-A441 PolarHBondContact O-N 3.03Å; M439-A441 VanDerWaalsContact O-N 3.16Å
440	A	35.9	Very low	37.6	Very low	3 Å²	3	55.5 Å²	55.5	3%	0.025	30%	0.301	C	S	.	.			trans	-51.6	119.2	168.9	0	0	0	0	0	110.6	Q182 L184 V442 I464	Q182-A440 CarbonylContact O-C 3.6Å; Q182-A440 WeakPolarHBondContact O-CA 3.05Å; L184-A440 HydrophobicContact CB-CB 4.05Å; L184-A440 HydrophobicContact CD1-CB 3.64Å; L184-A440 HydrophobicContact CG-CB 3.57Å; A440-V442 PolarHBondContact O-N 2.86Å; A440-I464 HydrophobicContact CB-CD1 4.28Å; A440-I464 HydrophobicContact CB-CG1 4.49Å; A440-I464 HydrophobicContact CB-CG2 3.71Å
441	A	35.3	Very low	36.6	Very low	41 Å²	41	59.4 Å²	59.4	34%	0.339	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-65.3	100.5	164.6	0	0	0	0	0	108	Q182 T183 M439 P443	Q182-A441 PolarHBondContact O-N 2.97Å; T183-A441 HydrophobicContact CG2-CB 3.74Å; M439-A441 PolarHBondContact O-N 3.03Å; M439-A441 VanDerWaalsContact O-N 3.16Å; A441-P443 WeakPolarHBondContact O-CD 3.42Å
442	V	36.6	Very low	35.9	Very low	33 Å²	33	57.1 Å²	57.1	20%	0.2	31%	0.312	C	S	.	.			trans	-73.4	125.4	176.2	-179	0	0	0	0	108.2	A440 L446 K447 F450	A440-V442 PolarHBondContact O-N 2.86Å; V442-L446 HydrophobicContact CG1-CB 3.29Å; V442-K447 HydrophobicContact CB-CG 4.1Å; V442-K447 HydrophobicContact CG1-CG 4.15Å; V442-K447 WeakPolarHBondContact O-CD 3.44Å; V442-K447 VanDerWaalsContact O-CE 3.3Å; V442-K447 WeakPolarHBondContact O-CE 3.4Å; V442-K447 WeakPolarHBondContact O-CG 3.46Å; V442-F450 HydrophobicContact CG1-CD2 3.53Å; V442-F450 HydrophobicContact CG1-CE2 3.87Å
443	P	35	Very low	35.2	Very low	39 Å²	39	56.1 Å²	56.1	25%	0.253	31%	0.313	S	S	.	.			trans	-51.3	145.2	176.5	-30.7	35.3	0	0	0	112.1	L184 A441 S445 L446 K447	L184-P443 VanDerWaalsContact O-CD 3.28Å; L184-P443 WeakPolarHBondContact O-CD 3.38Å; A441-P443 WeakPolarHBondContact O-CD 3.42Å; P443-S445 PolarHBondContact O-N 3.49Å; P443-L446 HydrophobicContact CB-CB 4.45Å; P443-L446 HydrophobicContact CB-CD1 4.19Å; P443-L446 HydrophobicContact CG-CD1 3.81Å; P443-L446 CarbonylContact O-C 3.43Å; P443-L446 WeakPolarHBondContact O-CA 3.32Å; P443-L446 WeakPolarHBondContact O-CB 3.28Å; P443-L446 PolarHBondContact O-N 2.76Å; P443-K447 PolarHBondContact O-N 2.86Å
444	P	37.8	Very low	34.4	Very low	99 Å²	99	56.9 Å²	56.9	64%	0.643	32%	0.317	S	S	*	.	H	α-helix	trans	-51.5	-32.9	179.8	-29.7	35.8	0	0	0	114.8	L446 K447 Q448	P444-L446 VanDerWaalsContact C-N 3.34Å; P444-K447 WeakPolarHBondContact O-CB 3.26Å; P444-K447 PolarHBondContact O-N 3.19Å; P444-Q448 WeakPolarHBondContact O-CG 3.37Å; P444-Q448 PolarHBondContact O-N 3.05Å
445	S	35.7	Very low	34.6	Very low	67 Å²	67	55.7 Å²	55.7	47%	0.469	31%	0.311	S	S	.	.	H	α-helix	trans	-67.7	-32.3	175	51.6	0	0	0	0	113.3	P443 R449	P443-S445 PolarHBondContact O-N 3.49Å; S445-R449 WeakPolarHBondContact O-CD 3.38Å; S445-R449 VanDerWaalsContact O-CG 3.26Å; S445-R449 WeakPolarHBondContact O-CG 3.44Å
446	L	36.8	Very low	34.9	Very low	2 Å²	2	52.3 Å²	52.3	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-84.9	-36	173.7	-78.6	161.5	0	0	0	110.6	F171 Q186 V442 P443 P444 Q448 R449 F450	F171-L446 HydrophobicContact CD1-CD1 4.38Å; F171-L446 HydrophobicContact CE1-CD1 3.71Å; F171-L446 HydrophobicContact CE1-CD2 3.78Å; F171-L446 HydrophobicContact CE1-CG 4.4Å; F171-L446 HydrophobicContact CZ-CD2 4.06Å; Q186-L446 HydrophobicContact CB-CD1 3.93Å; V442-L446 HydrophobicContact CG1-CB 3.29Å; P443-L446 HydrophobicContact CB-CB 4.45Å; P443-L446 HydrophobicContact CB-CD1 4.19Å; P443-L446 HydrophobicContact CG-CD1 3.81Å; P443-L446 CarbonylContact O-C 3.43Å; P443-L446 WeakPolarHBondContact O-CA 3.32Å; P443-L446 WeakPolarHBondContact O-CB 3.28Å; P443-L446 PolarHBondContact O-N 2.76Å; P444-L446 VanDerWaalsContact C-N 3.34Å; L446-Q448 VanDerWaalsContact C-N 3.29Å; L446-Q448 PolarHBondContact O-N 2.81Å; L446-R449 CarbonylContact O-C 3.43Å; L446-R449 VanDerWaalsContact O-CA 3.27Å; L446-R449 WeakPolarHBondContact O-CA 3.39Å; L446-R449 WeakPolarHBondContact O-CB 3.49Å; L446-R449 PolarHBondContact O-N 2.9Å; L446-F450 HydrophobicContact CB-CD2 3.8Å; L446-F450 HydrophobicContact CB-CE2 3.86Å; L446-F450 HydrophobicContact CD2-CD2 4.3Å; L446-F450 HydrophobicContact CD2-CE2 3.74Å; L446-F450 HydrophobicContact CG-CE2 4.28Å; L446-F450 WeakPolarHBondContact O-CB 3.49Å; L446-F450 WeakPolarHBondContact O-CD2 3.48Å; L446-F450 PolarHBondContact O-N 3.29Å
447	K	34.8	Very low	35.6	Very low	73 Å²	73	47 Å²	47	32%	0.317	26%	0.259	S	S	.	.	H	α-helix	trans	-51.9	-48.4	168.3	-83.6	-176.8	172.7	-175.3	0	110.9	V442 P443 P444 R449 F450 F451	V442-K447 HydrophobicContact CB-CG 4.1Å; V442-K447 HydrophobicContact CG1-CG 4.15Å; V442-K447 WeakPolarHBondContact O-CD 3.44Å; V442-K447 VanDerWaalsContact O-CE 3.3Å; V442-K447 WeakPolarHBondContact O-CE 3.4Å; V442-K447 WeakPolarHBondContact O-CG 3.46Å; P443-K447 PolarHBondContact O-N 2.86Å; P444-K447 WeakPolarHBondContact O-CB 3.26Å; P444-K447 PolarHBondContact O-N 3.19Å; K447-R449 PolarHBondContact O-N 2.82Å; K447-R449 VanDerWaalsContact O-N 3.13Å; K447-F450 PolarHBondContact O-N 2.72Å; K447-F451 HydrophobicContact CB-CD2 3.66Å; K447-F451 HydrophobicContact CB-CE2 3.27Å; K447-F451 HydrophobicContact CB-CZ 4.2Å; K447-F451 HydrophobicContact CD-CE2 3.72Å; K447-F451 HydrophobicContact CD-CZ 4.15Å; K447-F451 HydrophobicContact CG-CD2 4.17Å; K447-F451 HydrophobicContact CG-CE2 3.3Å; K447-F451 HydrophobicContact CG-CZ 3.77Å; K447-F451 WeakPolarHBondContact O-CB 3.27Å; K447-F451 WeakPolarHBondContact O-CD2 3.2Å; K447-F451 VanDerWaalsContact O-CG 3.25Å; K447-F451 WeakPolarHBondContact O-CG 3.11Å; K447-F451 PolarHBondContact O-N 3.1Å
448	Q	28.8	Very low	36.3	Very low	172 Å²	172	50.4 Å²	50.4	80%	0.804	27%	0.271	S	S	*	.	H	α-helix	trans	-62.9	-16.3	173.5	-74.3	178	-4.6	0	0	114.5	P444 L446	P444-Q448 WeakPolarHBondContact O-CG 3.37Å; P444-Q448 PolarHBondContact O-N 3.05Å; L446-Q448 VanDerWaalsContact C-N 3.29Å; L446-Q448 PolarHBondContact O-N 2.81Å
449	R	30.2	Very low	37.3	Very low	101 Å²	101	50 Å²	50	38%	0.381	27%	0.273	S	S	.	.	H	α-helix	trans	-101.3	-14.8	177	-66.8	169.7	176.9	-178	-3.3	113.7	Q186 S445 L446 K447	Q186-R449 VanDerWaalsContact OE1-NH1 3.16Å; S445-R449 WeakPolarHBondContact O-CD 3.38Å; S445-R449 VanDerWaalsContact O-CG 3.26Å; S445-R449 WeakPolarHBondContact O-CG 3.44Å; L446-R449 CarbonylContact O-C 3.43Å; L446-R449 VanDerWaalsContact O-CA 3.27Å; L446-R449 WeakPolarHBondContact O-CA 3.39Å; L446-R449 WeakPolarHBondContact O-CB 3.49Å; L446-R449 PolarHBondContact O-N 2.9Å; K447-R449 PolarHBondContact O-N 2.82Å; K447-R449 VanDerWaalsContact O-N 3.13Å
450	F	29.5	Very low	38.2	Very low	22 Å²	22	50 Å²	50	10%	0.096	27%	0.273	C	S	.	.	H	α-helix	trans	-109.7	-5	-175.1	-81.3	-67.4	0	0	0	113.3	F171 V442 L446 K447 V466 A467 D469	F171-F450 HydrophobicContact CZ-CE2 4.48Å; F171-F450 HydrophobicContact CZ-CZ 4.16Å; V442-F450 HydrophobicContact CG1-CD2 3.53Å; V442-F450 HydrophobicContact CG1-CE2 3.87Å; L446-F450 HydrophobicContact CB-CD2 3.8Å; L446-F450 HydrophobicContact CB-CE2 3.86Å; L446-F450 HydrophobicContact CD2-CD2 4.3Å; L446-F450 HydrophobicContact CD2-CE2 3.74Å; L446-F450 HydrophobicContact CG-CE2 4.28Å; L446-F450 WeakPolarHBondContact O-CB 3.49Å; L446-F450 WeakPolarHBondContact O-CD2 3.48Å; L446-F450 PolarHBondContact O-N 3.29Å; K447-F450 PolarHBondContact O-N 2.72Å; F450-V466 HydrophobicContact CE1-CG1 3.78Å; F450-V466 HydrophobicContact CZ-CG1 4.31Å; F450-A467 VanDerWaalsContact CD1-O 3.29Å; F450-A467 WeakPolarHBondContact CD1-O 3Å; F450-D469 WeakPolarHBondContact O-CB 3.39Å
451	F	28.1	Very low	39.2	Very low	104 Å²	104	57.5 Å²	57.5	46%	0.456	30%	0.3	S	S	.	.			trans	-112.6	104	-170.2	-72.4	-46.6	0	0	0	115.8	K447	K447-F451 HydrophobicContact CB-CD2 3.66Å; K447-F451 HydrophobicContact CB-CE2 3.27Å; K447-F451 HydrophobicContact CB-CZ 4.2Å; K447-F451 HydrophobicContact CD-CE2 3.72Å; K447-F451 HydrophobicContact CD-CZ 4.15Å; K447-F451 HydrophobicContact CG-CD2 4.17Å; K447-F451 HydrophobicContact CG-CE2 3.3Å; K447-F451 HydrophobicContact CG-CZ 3.77Å; K447-F451 WeakPolarHBondContact O-CB 3.27Å; K447-F451 WeakPolarHBondContact O-CD2 3.2Å; K447-F451 VanDerWaalsContact O-CG 3.25Å; K447-F451 WeakPolarHBondContact O-CG 3.11Å; K447-F451 PolarHBondContact O-N 3.1Å
452	A	31.3	Very low	39.8	Very low	48 Å²	48	58.3 Å²	58.3	40%	0.397	30%	0.297	S	S	.	.	S	Bend	trans	175.1	-153.6	161.5	0	0	0	0	0	109.5	M454 D469	A452-M454 PolarHBondContact O-N 2.84Å; A452-D469 WeakPolarHBondContact CA-OD1 3.3Å; A452-D469 WeakPolarHBondContact CA-OD2 3.39Å; A452-D469 HydrophobicContact CB-CB 4.16Å; A452-D469 WeakPolarHBondContact CB-OD1 3.47Å; A452-D469 WeakPolarHBondContact CB-OD2 3.47Å; A452-D469 PolarHBondContact N-OD2 2.8Å; A452-D469 WeakPolarHBondContact O-CB 3.18Å
453	S	30.4	Very low	40.2	Very low	36 Å²	36	57 Å²	57	25%	0.252	29%	0.29	S	S	.	.	S	Bend	trans	-50	117.2	-177	68.3	0	0	0	0	115.8	R455 D469 G471	S453-R455 PolarHBondContact O-N 2.78Å; S453-D469 WeakPolarHBondContact CA-OD1 3.47Å; S453-D469 VanDerWaalsContact N-CG 3.35Å; S453-D469 PolarHBondContact N-OD1 3.16Å; S453-D469 WeakPolarHBondContact O-CA 3.4Å; S453-G471 PolarHBondContact OG-O 2.79Å
454	M	32.3	Very low	41	Very low	18 Å²	18	55.2 Å²	55.2	9%	0.089	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	120.8	177.4	-67.1	-142.7	-85.5	0	0	111.1	A392 V426 A452 M457 A467 N468	A392-M454 HydrophobicContact CB-CE 3.18Å; V426-M454 HydrophobicContact CB-CE 4.18Å; V426-M454 HydrophobicContact CG1-CE 3.56Å; V426-M454 HydrophobicContact CG1-CG 3.85Å; V426-M454 HydrophobicContact CG1-SD 3.68Å; V426-M454 HydrophobicContact CG2-CE 3.46Å; V426-M454 VanDerWaalsContact CG2-CE 3.46Å; A452-M454 PolarHBondContact O-N 2.84Å; M454-M457 HydrophobicContact CE-CG 4.24Å; M454-M457 HydrophobicContact CE-SD 3.63Å; M454-M457 HydrophobicContact SD-CG 3.59Å; M454-M457 VanDerWaalsContact SD-CG 3.59Å; M454-M457 HydrophobicContact SD-SD 3.77Å; M454-A467 HydrophobicContact SD-CB 3.97Å; M454-N468 CarbonylContact C-O 3.5Å; M454-N468 WeakPolarHBondContact CA-O 3.19Å
455	R	46.3	Very low	41.6	Very low	32 Å²	32	51.1 Å²	51.1	12%	0.121	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	68.6	164.8	-64.3	-170.5	-171	-165	0.6	107.2	N139 C140 E197 S453 N468	N139-R455 PolarHBondContact OD1-O 2.81Å; C140-R455 HydrophobicContact CB-CB 3.88Å; C140-R455 PolarHBondContact N-O 3.1Å; C140-R455 VanDerWaalsContact SG-CD 3.6Å; E197-R455 IonicContact OE1-CZ 2.61Å; E197-R455 IonicContact OE1-NH1 2.66Å; E197-R455 PolarHBondContact OE1-NH1 2.9Å; E197-R455 IonicContact OE1-NH2 3.17Å; E197-R455 PolarHBondContact OE1-NH2 2.78Å; S453-R455 PolarHBondContact O-N 2.78Å; R455-N468 PolarHBondContact N-O 3.36Å
456	G	44.8	Very low	42.2	Very low	7 Å²	7	48.5 Å²	48.5	7%	0.072	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	103.4	138.9	179	0	0	0	0	0	115.6	N139 A467 N468	N139-G456 VanDerWaalsContact OD1-CA 3.31Å; N139-G456 WeakPolarHBondContact OD1-CA 3.27Å; G456-A467 WeakPolarHBondContact O-CA 3.49Å; G456-N468 PolarHBondContact O-N 3.14Å
457	M	53.5	Low	42.8	Very low	7 Å²	7	49 Å²	49	3%	0.034	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	139.1	170.4	-64.6	174.5	64.4	0	0	109	I390 A392 F429 M454 L465 A467	I390-M457 HydrophobicContact CB-CE 4.33Å; I390-M457 HydrophobicContact CD1-CE 4.06Å; I390-M457 HydrophobicContact CG2-CE 3.71Å; I390-M457 HydrophobicContact CG2-SD 4.2Å; A392-M457 HydrophobicContact CB-SD 4.46Å; F429-M457 HydrophobicContact CE1-CE 4.41Å; M454-M457 HydrophobicContact CE-CG 4.24Å; M454-M457 HydrophobicContact CE-SD 3.63Å; M454-M457 HydrophobicContact SD-CG 3.59Å; M454-M457 VanDerWaalsContact SD-CG 3.59Å; M454-M457 HydrophobicContact SD-SD 3.77Å; M457-L465 HydrophobicContact CB-CD1 4.3Å; M457-L465 HydrophobicContact CE-CD1 3.76Å; M457-L465 HydrophobicContact CE-CD2 3.34Å; M457-L465 HydrophobicContact CE-CG 4.03Å; M457-A467 HydrophobicContact CG-CB 4.42Å
458	R	54.1	Low	43.2	Very low	89 Å²	89	45.6 Å²	45.6	34%	0.336	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	130.3	175.5	-69.4	-66.2	-179.6	-101.3	14	109.8	N139 L141 V143 V466	N139-R458 PolarHBondContact ND2-NH1 2.82Å; N139-R458 PolarHBondContact ND2-NH2 2.78Å; L141-R458 HydrophobicContact CD2-CG 4.39Å; V143-R458 HydrophobicContact CB-CB 4.09Å; V143-R458 HydrophobicContact CB-CG 4.33Å; V143-R458 HydrophobicContact CG2-CB 3.93Å; V143-R458 HydrophobicContact CG2-CG 4.16Å; R458-V466 PolarHBondContact N-O 3.36Å; R458-V466 PolarHBondContact O-N 3.12Å
459	A	52.6	Low	44	Very low	44 Å²	44	38 Å²	38	36%	0.364	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	135.6	170.6	0	0	0	0	0	109.6	I464	A459-I464 CarbonylContact C-O 3.55Å; A459-I464 WeakPolarHBondContact CA-O 2.71Å
460	L	53.4	Low	44.2	Very low	13 Å²	13	33.4 Å²	33.4	7%	0.068	17%	0.17	C	C	.	.			trans	-81.3	162.4	166	-61	-179.2	0	0	0	109.8	V143 E145 V153 I173 L184 H462 G463 I464 V466	V143-L460 HydrophobicContact CG1-CD2 3.44Å; V143-L460 VanDerWaalsContact CG1-CD2 3.44Å; E145-L460 HydrophobicContact CB-CD2 4.47Å; V153-L460 HydrophobicContact CG1-CD1 4.21Å; V153-L460 HydrophobicContact CG1-CD2 3.86Å; V153-L460 HydrophobicContact CG2-CD1 3.68Å; V153-L460 HydrophobicContact CG2-CD2 4.09Å; I173-L460 HydrophobicContact CD1-CD1 4.15Å; L184-L460 HydrophobicContact CD2-CD1 4.38Å; L460-H462 PolarHBondContact O-N 2.84Å; L460-H462 VanDerWaalsContact O-N 3.1Å; L460-G463 PolarHBondContact O-N 3.04Å; L460-I464 HydrophobicContact CB-CB 4.13Å; L460-I464 HydrophobicContact CD1-CB 3.93Å; L460-I464 HydrophobicContact CD1-CD1 4.09Å; L460-I464 HydrophobicContact CD1-CG2 4.06Å; L460-I464 HydrophobicContact CG-CB 4.26Å; L460-I464 PolarHBondContact N-O 2.98Å; L460-V466 HydrophobicContact CD1-CG2 4.3Å; L460-V466 HydrophobicContact CG-CG2 4.29Å
461	R	56.4	Low	44.2	Very low	160 Å²	160	33.9 Å²	33.9	60%	0.604	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.3	178.8	-61.5	178.6	-179	170.9	1.1	112.7	E145 G463	E145-R461 WeakPolarHBondContact OE1-CD 3.2Å; E145-R461 VanDerWaalsContact OE2-CB 3.24Å; E145-R461 WeakPolarHBondContact OE2-CB 3.01Å; E145-R461 VanDerWaalsContact OE2-CG 3.32Å; E145-R461 WeakPolarHBondContact OE2-CG 3.13Å; E145-R461 PolarHBondContact OE2-N 2.71Å; R461-G463 PolarHBondContact O-N 3.13Å
462	H	47.7	Very low	44.2	Very low	59 Å²	59	34.3 Å²	34.3	27%	0.273	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	0.7	176.7	-59.5	81.7	0	0	0	113.5	E145 P150 L460 I464	E145-H462 IonicContact OE1-CE1 3.24Å; E145-H462 PolarHBondContact OE1-CE1 2.76Å; E145-H462 IonicContact OE1-ND1 2.7Å; E145-H462 PolarHBondContact OE1-ND1 3.38Å; E145-H462 IonicContact OE2-ND1 2.8Å; P150-H462 PolarHBondContact O-CE1 3.05Å; L460-H462 PolarHBondContact O-N 2.84Å; L460-H462 VanDerWaalsContact O-N 3.1Å; H462-I464 VanDerWaalsContact C-N 3.29Å; H462-I464 HydrophobicContact CB-CD1 4.08Å; H462-I464 HydrophobicContact CB-CG1 4.22Å
463	G	46	Very low	43.8	Very low	5 Å²	5	39.1 Å²	39.1	5%	0.052	21%	0.207	C	C	.	.	S	Bend	trans	80.6	9.8	-176.8	0	0	0	0	0	114.4	H381 L460 R461	H381-G463 VanDerWaalsContact CD2-CA 3.47Å; H381-G463 WeakPolarHBondContact CD2-CA 3.25Å; L460-G463 PolarHBondContact O-N 3.04Å; R461-G463 PolarHBondContact O-N 3.13Å
464	I	49.9	Very low	43.6	Very low	2 Å²	2	44.1 Å²	44.1	1%	0.01	22%	0.221	C	C	.	.			trans	-78.5	121.3	175.7	-60.8	163.9	0	0	0	108.5	I173 Q182 L184 A440 A459 L460 H462 V466	I173-I464 HydrophobicContact CD1-CD1 3.95Å; I173-I464 HydrophobicContact CG1-CD1 4.21Å; I173-I464 HydrophobicContact CG2-CD1 4.09Å; Q182-I464 HydrophobicContact CB-CD1 4.2Å; L184-I464 HydrophobicContact CD1-CG2 4.16Å; A440-I464 HydrophobicContact CB-CD1 4.28Å; A440-I464 HydrophobicContact CB-CG1 4.49Å; A440-I464 HydrophobicContact CB-CG2 3.71Å; A459-I464 CarbonylContact C-O 3.55Å; A459-I464 WeakPolarHBondContact CA-O 2.71Å; L460-I464 HydrophobicContact CB-CB 4.13Å; L460-I464 HydrophobicContact CD1-CB 3.93Å; L460-I464 HydrophobicContact CD1-CD1 4.09Å; L460-I464 HydrophobicContact CD1-CG2 4.06Å; L460-I464 HydrophobicContact CG-CB 4.26Å; L460-I464 PolarHBondContact N-O 2.98Å; H462-I464 VanDerWaalsContact C-N 3.29Å; H462-I464 HydrophobicContact CB-CD1 4.08Å; H462-I464 HydrophobicContact CB-CG1 4.22Å; I464-V466 HydrophobicContact CG2-CG2 4.33Å
465	L	50.3	Low	43.3	Very low	13 Å²	13	50.1 Å²	50.1	7%	0.068	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	122.9	172.7	-171	74.8	0	0	0	110.5	F429 L430 M457	F429-L465 HydrophobicContact CE1-CD2 4.32Å; L430-L465 HydrophobicContact CD2-CD2 3.99Å; M457-L465 HydrophobicContact CB-CD1 4.3Å; M457-L465 HydrophobicContact CE-CD1 3.76Å; M457-L465 HydrophobicContact CE-CD2 3.34Å; M457-L465 HydrophobicContact CE-CG 4.03Å
466	V	50.2	Low	42.2	Very low	11 Å²	11	56.6 Å²	56.6	7%	0.067	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.2	172.2	-172.6	0	0	0	0	108.2	L141 V143 L184 F450 R458 L460 I464	L141-V466 HydrophobicContact CD2-CB 4.41Å; L141-V466 HydrophobicContact CD2-CG1 3.93Å; V143-V466 HydrophobicContact CG2-CB 4.2Å; V143-V466 HydrophobicContact CG2-CG1 4.1Å; L184-V466 HydrophobicContact CD1-CG2 4.21Å; F450-V466 HydrophobicContact CE1-CG1 3.78Å; F450-V466 HydrophobicContact CZ-CG1 4.31Å; R458-V466 PolarHBondContact N-O 3.36Å; R458-V466 PolarHBondContact O-N 3.12Å; L460-V466 HydrophobicContact CD1-CG2 4.3Å; L460-V466 HydrophobicContact CG-CG2 4.29Å; I464-V466 HydrophobicContact CG2-CG2 4.33Å
467	A	47.9	Very low	41.2	Very low	14 Å²	14	62.4 Å²	62.4	12%	0.116	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.5	173.4	0	0	0	0	0	108.8	F450 M454 G456 M457	F450-A467 VanDerWaalsContact CD1-O 3.29Å; F450-A467 WeakPolarHBondContact CD1-O 3Å; M454-A467 HydrophobicContact SD-CB 3.97Å; G456-A467 WeakPolarHBondContact O-CA 3.49Å; M457-A467 HydrophobicContact CG-CB 4.42Å
468	N	44.7	Very low	40	Very low	1 Å²	1	65.9 Å²	65.9	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	143.1	171.4	-174.9	27.8	0	0	0	109.2	C140 L141 M454 R455 G456 V470	C140-N468 PolarHBondContact O-ND2 3.23Å; L141-N468 HydrophobicContact CB-CB 3.46Å; L141-N468 VanDerWaalsContact CB-CB 3.46Å; L141-N468 HydrophobicContact CD1-CB 4.01Å; L141-N468 HydrophobicContact CD2-CB 3.84Å; L141-N468 HydrophobicContact CG-CB 3.91Å; M454-N468 CarbonylContact C-O 3.5Å; M454-N468 WeakPolarHBondContact CA-O 3.19Å; R455-N468 PolarHBondContact N-O 3.36Å; G456-N468 PolarHBondContact O-N 3.14Å; N468-V470 VanDerWaalsContact ND2-CG2 3.32Å; N468-V470 WeakPolarHBondContact ND2-CG2 3.41Å
469	D	45	Very low	38.7	Very low	13 Å²	13	68 Å²	68	7%	0.07	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	135.9	166.2	162.9	54.7	0	0	0	111.2	F450 A452 S453	F450-D469 WeakPolarHBondContact O-CB 3.39Å; A452-D469 WeakPolarHBondContact CA-OD1 3.3Å; A452-D469 WeakPolarHBondContact CA-OD2 3.39Å; A452-D469 HydrophobicContact CB-CB 4.16Å; A452-D469 WeakPolarHBondContact CB-OD1 3.47Å; A452-D469 WeakPolarHBondContact CB-OD2 3.47Å; A452-D469 PolarHBondContact N-OD2 2.8Å; A452-D469 WeakPolarHBondContact O-CB 3.18Å; S453-D469 WeakPolarHBondContact CA-OD1 3.47Å; S453-D469 VanDerWaalsContact N-CG 3.35Å; S453-D469 PolarHBondContact N-OD1 3.16Å; S453-D469 WeakPolarHBondContact O-CA 3.4Å
470	V	34.6	Very low	37.3	Very low	3 Å²	3	69.3 Å²	69.3	2%	0.018	36%	0.364	C	S	.	.			trans	-134	102.5	168	-158.4	0	0	0	0	113	C140 A158 A163 N468	C140-V470 HydrophobicContact CB-CG2 4.26Å; A158-V470 HydrophobicContact CB-CG2 4.19Å; A158-V470 WeakPolarHBondContact O-CG2 3.28Å; A163-V470 HydrophobicContact CB-CB 4.14Å; A163-V470 HydrophobicContact CB-CG1 3.3Å; N468-V470 VanDerWaalsContact ND2-CG2 3.32Å; N468-V470 WeakPolarHBondContact ND2-CG2 3.41Å
471	G	29.5	Very low	35.9	Very low	33 Å²	33	76.5 Å²	76.5	34%	0.34	40%	0.397	S	S	.	.			trans	82.7	141	159.9	0	0	0	0	0	114.4	S453	S453-G471 PolarHBondContact OG-O 2.79Å
472	D	27.6	Very low	34.6	Very low	113 Å²	113	78 Å²	78	60%	0.604	41%	0.411	S	S	*	.			cis	-148.7	168.3	19	-115.1	-28.3	0	0	0	108.8	Y474	D472-Y474 PolarHBondContact O-N 3.4Å
473	L	23.6	Very low	33.7	Very low	149 Å²	149	80.4 Å²	80.4	78%	0.78	43%	0.433	S	S	*	.	S	Bend	trans	-53.2	35.3	177.1	-94.7	146.6	0	0	0	117.6
474	Y	25.6	Very low	33	Very low	140 Å²	140	85.6 Å²	85.6	55%	0.549	46%	0.46	S	S	.	.	S	Bend	trans	-93.6	-9.4	-176.6	-120.6	-90.2	0	0	0	116	C125 D472	C125-Y474 VanDerWaalsContact SG-CE2 3.55Å; C125-Y474 PolarHBondContact SG-OH 2.77Å; D472-Y474 PolarHBondContact O-N 3.4Å
475	F	25.4	Very low	32.2	Very low	145 Å²	145	89.3 Å²	89.3	64%	0.636	49%	0.486	S	S	*	.	S	Bend	trans	-126.8	10.3	-175.5	-91.5	-90.3	0	0	0	117.3	N477 T478	F475-N477 PolarHBondContact O-N 3.38Å; F475-T478 WeakPolarHBondContact CD1-OG1 3.26Å; F475-T478 HydrophobicContact CE1-CG2 4.24Å; F475-T478 WeakPolarHBondContact CE1-OG1 3.3Å
476	Q	24.6	Very low	31.3	Very low	168 Å²	168	91.4 Å²	91.4	79%	0.785	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-2.4	161.4	-83.4	-169.9	-9.3	0	0	113.6
477	N	23.6	Very low	30.5	Very low	129 Å²	129	96.7 Å²	96.7	69%	0.69	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	5	-176.4	-83.6	-23.5	0	0	0	116	F475	F475-N477 PolarHBondContact O-N 3.38Å
478	T	26.3	Very low	29.7	Very low	80 Å²	80	103.9 Å²	103.9	49%	0.491	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.2	-20.5	177.3	-2.1	0	0	0	0	113.3	F475 G480	F475-T478 WeakPolarHBondContact CD1-OG1 3.26Å; F475-T478 HydrophobicContact CE1-CG2 4.24Å; F475-T478 WeakPolarHBondContact CE1-OG1 3.3Å; T478-G480 PolarHBondContact O-N 3.44Å
479	I	26.8	Very low	29.2	Very low	134 Å²	134	108.6 Å²	108.6	69%	0.687	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	51.2	163.5	-48.7	178.7	0	0	0	109.1
480	G	23.6	Very low	28.9	Very low	70 Å²	70	114.7 Å²	114.7	72%	0.722	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	1.3	164.1	0	0	0	0	0	112	T478	T478-G480 PolarHBondContact O-N 3.44Å
481	Q	25.2	Very low	28.8	Very low	165 Å²	165	117.5 Å²	117.5	77%	0.771	63%	0.63	S	S	*	*	S	Bend	trans	-94.8	118.3	172.9	-70.2	-170	-0.4	0	0	109.4	C483	Q481-C483 VanDerWaalsContact C-N 3.26Å; Q481-C483 PolarHBondContact O-N 3.42Å
482	Q	27.8	Very low	29	Very low	191 Å²	191	120.3 Å²	120.3	89%	0.893	63%	0.633	S	S	*	*			trans	-54.5	89.7	166.9	-70.1	173.9	-21.8	0	0	108.9	N484	Q482-N484 PolarHBondContact O-N 3.29Å
483	C	29.8	Very low	29.3	Very low	109 Å²	109	121.3 Å²	121.3	74%	0.736	63%	0.634	S	S	*	*			trans	-57.1	110.9	161.4	-94.4	0	0	0	0	106.1	Q481 S485	Q481-C483 VanDerWaalsContact C-N 3.26Å; Q481-C483 PolarHBondContact O-N 3.42Å; C483-S485 PolarHBondContact O-N 3.42Å
484	N	30.9	Very low	29.9	Very low	115 Å²	115	118.7 Å²	118.7	62%	0.615	62%	0.62	S	S	*	*			trans	-64.6	99.5	-168.6	-155.5	-2.8	0	0	0	107.2	Q482 A486 M487	Q482-N484 PolarHBondContact O-N 3.29Å; N484-A486 PolarHBondContact O-N 3.16Å; N484-M487 PolarHBondContact O-N 3.26Å
485	S	33.3	Very low	30.1	Very low	80 Å²	80	120 Å²	120	56%	0.559	62%	0.624	S	S	*	*	H	α-helix	trans	-52	-20.6	-177.6	61.2	0	0	0	0	112.8	C483 N489	C483-S485 PolarHBondContact O-N 3.42Å; S485-N489 WeakPolarHBondContact O-CB 3.47Å; S485-N489 PolarHBondContact O-N 3.08Å; S485-N489 PolarHBondContact O-ND2 3.5Å; S485-N489 VanDerWaalsContact O-ND2 3.08Å
486	A	32	Very low	30.4	Very low	57 Å²	57	116.3 Å²	116.3	47%	0.471	61%	0.611	S	S	.	*	H	α-helix	trans	-62.5	-39.4	171.3	0	0	0	0	0	114.3	N484 K490	N484-A486 PolarHBondContact O-N 3.16Å; A486-K490 VanDerWaalsContact O-CB 3.25Å; A486-K490 WeakPolarHBondContact O-CB 3.29Å; A486-K490 PolarHBondContact O-N 2.76Å; A486-K490 VanDerWaalsContact O-N 3.1Å
487	M	32.8	Very low	30.8	Very low	122 Å²	122	112.9 Å²	112.9	60%	0.601	61%	0.605	S	S	*	*	H	α-helix	trans	-73.3	-42.6	177.2	-102.4	-175.1	73.2	0	0	111.4	N484 K490 A491 F577	N484-M487 PolarHBondContact O-N 3.26Å; M487-K490 PolarHBondContact O-N 3.11Å; M487-A491 WeakPolarHBondContact O-CB 3.36Å; M487-A491 PolarHBondContact O-N 3.04Å; M487-F577 HydrophobicContact CE-CE1 4.21Å; M487-F577 HydrophobicContact CE-CZ 4.34Å
488	Y	30.6	Very low	31.1	Very low	164 Å²	164	115.7 Å²	115.7	64%	0.643	61%	0.606	S	S	*	*	H	α-helix	trans	-61.6	-48.9	175.6	-116.1	-85	0	0	0	110.9	K490 A491 F492	Y488-K490 VanDerWaalsContact C-N 3.29Å; Y488-K490 PolarHBondContact O-N 2.72Å; Y488-A491 PolarHBondContact O-N 3.18Å; Y488-F492 WeakPolarHBondContact O-CB 3.42Å; Y488-F492 PolarHBondContact O-N 2.79Å
489	N	35.3	Very low	31.2	Very low	100 Å²	100	118.5 Å²	118.5	54%	0.535	61%	0.609	S	S	.	*	H	α-helix	trans	-61.5	-35.6	177.4	-73.1	-24.7	0	0	0	112.7	S485 E493	S485-N489 WeakPolarHBondContact O-CB 3.47Å; S485-N489 PolarHBondContact O-N 3.08Å; S485-N489 PolarHBondContact O-ND2 3.5Å; S485-N489 VanDerWaalsContact O-ND2 3.08Å; N489-E493 VanDerWaalsContact O-CB 3.28Å; N489-E493 WeakPolarHBondContact O-CB 3.37Å; N489-E493 WeakPolarHBondContact O-CG 3.5Å; N489-E493 PolarHBondContact O-N 3.21Å
490	K	37.9	Very low	31.2	Very low	142 Å²	142	121.2 Å²	121.2	62%	0.617	62%	0.619	S	S	*	*	H	α-helix	trans	-74.6	-38	178.8	-151.5	173.7	-169.9	-176.7	0	112.3	A486 M487 Y488 F492 I494	A486-K490 VanDerWaalsContact O-CB 3.25Å; A486-K490 WeakPolarHBondContact O-CB 3.29Å; A486-K490 PolarHBondContact O-N 2.76Å; A486-K490 VanDerWaalsContact O-N 3.1Å; M487-K490 PolarHBondContact O-N 3.11Å; Y488-K490 VanDerWaalsContact C-N 3.29Å; Y488-K490 PolarHBondContact O-N 2.72Å; K490-F492 VanDerWaalsContact C-N 3.34Å; K490-I494 WeakPolarHBondContact O-CB 3.25Å; K490-I494 WeakPolarHBondContact O-CD1 3.5Å; K490-I494 WeakPolarHBondContact O-CG1 3.19Å; K490-I494 PolarHBondContact O-N 3.01Å
491	A	32.2	Very low	31.4	Very low	61 Å²	61	126.9 Å²	126.9	50%	0.504	62%	0.62	S	S	.	*	H	α-helix	trans	-65.9	-38.5	171.8	0	0	0	0	0	111.5	M487 Y488 I494 W495	M487-A491 WeakPolarHBondContact O-CB 3.36Å; M487-A491 PolarHBondContact O-N 3.04Å; Y488-A491 PolarHBondContact O-N 3.18Å; A491-I494 PolarHBondContact O-N 3.32Å; A491-W495 WeakPolarHBondContact O-CB 3.5Å; A491-W495 PolarHBondContact O-N 3.47Å
492	F	33.6	Very low	31.6	Very low	93 Å²	93	123.4 Å²	123.4	41%	0.408	61%	0.614	S	S	.	*	H	α-helix	trans	-73.8	-35	177.6	-141.6	-98.4	0	0	0	112.8	F98 Y488 K490 W495 N496	F98-F492 AromaticContact CD1-CE1 3.64Å; F98-F492 HydrophobicContact CD1-CE1 3.64Å; F98-F492 HydrophobicContact CD1-CZ 4.1Å; F98-F492 AromaticContact CE1-CE1 3.34Å; F98-F492 HydrophobicContact CE1-CE1 3.34Å; F98-F492 AromaticContact CE1-CZ 3.6Å; F98-F492 HydrophobicContact CE1-CZ 3.6Å; F98-F492 HydrophobicContact CZ-CE1 4.09Å; Y488-F492 WeakPolarHBondContact O-CB 3.42Å; Y488-F492 PolarHBondContact O-N 2.79Å; K490-F492 VanDerWaalsContact C-N 3.34Å; F492-W495 PolarHBondContact O-N 3.34Å; F492-N496 WeakPolarHBondContact CD1-ND2 3.18Å; F492-N496 VanDerWaalsContact CE1-ND2 3.29Å; F492-N496 WeakPolarHBondContact CE1-ND2 3.27Å; F492-N496 WeakPolarHBondContact O-CB 3.49Å; F492-N496 PolarHBondContact O-N 2.88Å
493	E	34.8	Very low	31.6	Very low	134 Å²	134	117.1 Å²	117.1	63%	0.626	60%	0.595	S	S	*	*	H	α-helix	trans	-64	-40.5	168.7	-88.3	-179.3	157.9	0	0	111.5	N489 S497	N489-E493 VanDerWaalsContact O-CB 3.28Å; N489-E493 WeakPolarHBondContact O-CB 3.37Å; N489-E493 WeakPolarHBondContact O-CG 3.5Å; N489-E493 PolarHBondContact O-N 3.21Å; E493-S497 WeakPolarHBondContact O-CB 3.22Å; E493-S497 PolarHBondContact O-N 2.69Å; E493-S497 PolarHBondContact O-OG 2.81Å
494	I	34.9	Very low	31.6	Very low	94 Å²	94	114.5 Å²	114.5	48%	0.482	58%	0.577	S	S	.	*	H	α-helix	trans	-66.2	-40.1	174.8	-69.8	165.3	0	0	0	110.9	K490 A491 S497 R498	K490-I494 WeakPolarHBondContact O-CB 3.25Å; K490-I494 WeakPolarHBondContact O-CD1 3.5Å; K490-I494 WeakPolarHBondContact O-CG1 3.19Å; K490-I494 PolarHBondContact O-N 3.01Å; A491-I494 PolarHBondContact O-N 3.32Å; I494-S497 PolarHBondContact O-OG 3.4Å; I494-R498 WeakPolarHBondContact O-CB 3.38Å; I494-R498 WeakPolarHBondContact O-CG 3.49Å; I494-R498 PolarHBondContact O-N 3.16Å
495	W	30.5	Very low	31.7	Very low	168 Å²	168	112.8 Å²	112.8	64%	0.636	58%	0.579	S	S	*	*	H	α-helix	trans	-67.3	-50.2	177.6	-167.9	-84.3	0	0	0	111.9	A491 F492 S497 R498 Y499	A491-W495 WeakPolarHBondContact O-CB 3.5Å; A491-W495 PolarHBondContact O-N 3.47Å; F492-W495 PolarHBondContact O-N 3.34Å; W495-S497 PolarHBondContact O-N 3.3Å; W495-R498 PolarHBondContact O-N 3.28Å; W495-Y499 HydrophobicContact CD2-CD2 4.23Å; W495-Y499 HydrophobicContact CD2-CE2 4.35Å; W495-Y499 HydrophobicContact CE3-CE2 4.47Å; W495-Y499 HydrophobicContact CG-CD2 4.31Å; W495-Y499 VanDerWaalsContact O-CD2 3.27Å; W495-Y499 WeakPolarHBondContact O-CD2 3.27Å; W495-Y499 PolarHBondContact O-N 2.74Å; W495-Y499 VanDerWaalsContact O-N 3.16Å
496	N	32.1	Very low	31.7	Very low	66 Å²	66	113.6 Å²	113.6	35%	0.353	58%	0.58	S	S	.	*	H	α-helix	trans	-72.3	-25.8	-179.2	-75.7	-27	0	0	0	113.8	F492 R498	F492-N496 WeakPolarHBondContact CD1-ND2 3.18Å; F492-N496 VanDerWaalsContact CE1-ND2 3.29Å; F492-N496 WeakPolarHBondContact CE1-ND2 3.27Å; F492-N496 WeakPolarHBondContact O-CB 3.49Å; F492-N496 PolarHBondContact O-N 2.88Å; N496-R498 VanDerWaalsContact C-N 3.29Å
497	S	33.6	Very low	31.8	Very low	96 Å²	96	114.2 Å²	114.2	67%	0.671	58%	0.576	S	S	*	*	H	α-helix	trans	-76.7	-15.2	173.1	60.6	0	0	0	0	113.6	E493 I494 W495	E493-S497 WeakPolarHBondContact O-CB 3.22Å; E493-S497 PolarHBondContact O-N 2.69Å; E493-S497 PolarHBondContact O-OG 2.81Å; I494-S497 PolarHBondContact O-OG 3.4Å; W495-S497 PolarHBondContact O-N 3.3Å
498	R	28.6	Very low	31.6	Very low	188 Å²	188	112.8 Å²	112.8	71%	0.709	57%	0.57	S	S	*	*	H	α-helix	trans	-103.1	-17.3	178.9	-71.8	-170.4	177.4	-165.8	1.6	114.4	I494 W495 N496	I494-R498 WeakPolarHBondContact O-CB 3.38Å; I494-R498 WeakPolarHBondContact O-CG 3.49Å; I494-R498 PolarHBondContact O-N 3.16Å; W495-R498 PolarHBondContact O-N 3.28Å; N496-R498 VanDerWaalsContact C-N 3.29Å
499	Y	27.9	Very low	31.7	Very low	139 Å²	139	110.3 Å²	110.3	55%	0.545	57%	0.568	S	S	.	*			trans	-134	83.7	-174.2	-56.7	-70.6	0	0	0	112.2	W495 Y501	W495-Y499 HydrophobicContact CD2-CD2 4.23Å; W495-Y499 HydrophobicContact CD2-CE2 4.35Å; W495-Y499 HydrophobicContact CE3-CE2 4.47Å; W495-Y499 HydrophobicContact CG-CD2 4.31Å; W495-Y499 VanDerWaalsContact O-CD2 3.27Å; W495-Y499 WeakPolarHBondContact O-CD2 3.27Å; W495-Y499 PolarHBondContact O-N 2.74Å; W495-Y499 VanDerWaalsContact O-N 3.16Å; Y499-Y501 PolarHBondContact O-N 3.45Å
500	E	28.2	Very low	31.5	Very low	192 Å²	192	109.5 Å²	109.5	90%	0.897	56%	0.563	S	S	*	*			trans	-77	96.5	163.4	-102.9	-175.2	161.9	0	0	109.4
501	Y	27.4	Very low	31.1	Very low	188 Å²	188	110 Å²	110	74%	0.737	57%	0.565	S	S	*	*			trans	-102.9	97.7	163	-106.2	-92.4	0	0	0	109.6	R97 Y499	R97-Y501 PolarHBondContact NH2-O 2.65Å; Y499-Y501 PolarHBondContact O-N 3.45Å
502	S	29.1	Very low	31	Very low	93 Å²	93	115.6 Å²	115.6	65%	0.65	58%	0.575	S	S	*	*			trans	-107.5	91.6	157.2	66.1	0	0	0	0	107.9
503	A	27.2	Very low	31	Very low	59 Å²	59	117.8 Å²	117.8	49%	0.488	59%	0.591	S	S	.	*			trans	-91.3	105.9	164.6	0	0	0	0	0	107.2	D507	A503-D507 HydrophobicContact CB-CB 4.49Å
504	S	31.6	Very low	30.8	Very low	53 Å²	53	121.4 Å²	121.4	37%	0.371	60%	0.599	S	S	.	*			trans	-67.7	157.5	164.9	72.1	0	0	0	0	109.4	V506 D507 L508	S504-V506 PolarHBondContact O-N 2.73Å; S504-V506 PolarHBondContact OG-N 2.64Å; S504-D507 VanDerWaalsContact CB-OD2 3.3Å; S504-D507 WeakPolarHBondContact CB-OD2 3.37Å; S504-D507 PolarHBondContact N-OD2 3.19Å; S504-D507 WeakPolarHBondContact O-CA 3.41Å; S504-D507 WeakPolarHBondContact O-CB 3.39Å; S504-D507 PolarHBondContact O-N 3.38Å; S504-D507 PolarHBondContact OG-N 3.01Å; S504-D507 VanDerWaalsContact OG-N 3.11Å; S504-D507 PolarHBondContact OG-OD2 3.31Å; S504-L508 PolarHBondContact O-N 2.78Å; S504-L508 VanDerWaalsContact O-N 3.13Å
505	A	31.3	Very low	30.6	Very low	80 Å²	80	125.8 Å²	125.8	66%	0.661	61%	0.614	S	S	*	*	H	α-helix	trans	-57.2	-19.1	172.1	0	0	0	0	0	112.6	N509	A505-N509 PolarHBondContact O-N 2.74Å; A505-N509 PolarHBondContact O-ND2 3.09Å
506	V	35.2	Very low	30.8	Very low	96 Å²	96	121.4 Å²	121.4	58%	0.582	61%	0.609	S	S	*	*	H	α-helix	trans	-76.8	-36.9	171.3	-173.5	0	0	0	0	111	S504 N509 I510	S504-V506 PolarHBondContact O-N 2.73Å; S504-V506 PolarHBondContact OG-N 2.64Å; V506-N509 PolarHBondContact O-N 2.88Å; V506-I510 HydrophobicContact CG1-CD1 3.74Å; V506-I510 HydrophobicContact CG1-CG1 4.32Å; V506-I510 WeakPolarHBondContact O-CB 3.2Å; V506-I510 WeakPolarHBondContact O-CG1 3.49Å; V506-I510 PolarHBondContact O-N 3.4Å
507	D	32.1	Very low	30.6	Very low	71 Å²	71	127.1 Å²	127.1	38%	0.38	63%	0.634	S	S	.	*	H	α-helix	trans	-70.4	-33.7	177.3	-61.5	-50.5	0	0	0	112.9	A503 S504 I510 F511	A503-D507 HydrophobicContact CB-CB 4.49Å; S504-D507 VanDerWaalsContact CB-OD2 3.3Å; S504-D507 WeakPolarHBondContact CB-OD2 3.37Å; S504-D507 PolarHBondContact N-OD2 3.19Å; S504-D507 WeakPolarHBondContact O-CA 3.41Å; S504-D507 WeakPolarHBondContact O-CB 3.39Å; S504-D507 PolarHBondContact O-N 3.38Å; S504-D507 PolarHBondContact OG-N 3.01Å; S504-D507 VanDerWaalsContact OG-N 3.11Å; S504-D507 PolarHBondContact OG-OD2 3.31Å; D507-I510 PolarHBondContact O-N 3.43Å; D507-F511 VanDerWaalsContact O-CB 3.32Å; D507-F511 WeakPolarHBondContact O-CB 3.43Å; D507-F511 PolarHBondContact O-N 2.9Å
508	L	30	Very low	30.6	Very low	92 Å²	92	126 Å²	126	48%	0.482	63%	0.626	S	S	.	*	H	α-helix	trans	-64.1	-42.8	170.8	-93.1	151.5	0	0	0	111.3	S504 F511 Y512	S504-L508 PolarHBondContact O-N 2.78Å; S504-L508 VanDerWaalsContact O-N 3.13Å; L508-F511 WeakPolarHBondContact O-CB 3.42Å; L508-F511 PolarHBondContact O-N 2.88Å; L508-Y512 HydrophobicContact CD2-CE2 4.29Å; L508-Y512 WeakPolarHBondContact O-CD2 3.34Å; L508-Y512 PolarHBondContact O-N 2.83Å
509	N	32.1	Very low	30.8	Very low	111 Å²	111	123.7 Å²	123.7	59%	0.594	63%	0.628	S	S	*	*	H	α-helix	trans	-71	-33.2	175	-76.9	-26.4	0	0	0	112.6	A505 V506 F511 Y512 D513	A505-N509 PolarHBondContact O-N 2.74Å; A505-N509 PolarHBondContact O-ND2 3.09Å; V506-N509 PolarHBondContact O-N 2.88Å; N509-F511 VanDerWaalsContact C-N 3.33Å; N509-Y512 PolarHBondContact O-N 2.97Å; N509-D513 WeakPolarHBondContact O-CB 3.14Å; N509-D513 PolarHBondContact O-N 2.73Å
510	I	31.9	Very low	30.9	Very low	84 Å²	84	122.4 Å²	122.4	43%	0.431	63%	0.629	S	S	.	*	H	α-helix	trans	-68.6	-32.8	172.6	-69.9	167	0	0	0	111.3	V506 D507 Y512 D513 R514	V506-I510 HydrophobicContact CG1-CD1 3.74Å; V506-I510 HydrophobicContact CG1-CG1 4.32Å; V506-I510 WeakPolarHBondContact O-CB 3.2Å; V506-I510 WeakPolarHBondContact O-CG1 3.49Å; V506-I510 PolarHBondContact O-N 3.4Å; D507-I510 PolarHBondContact O-N 3.43Å; I510-Y512 VanDerWaalsContact C-N 3.31Å; I510-Y512 PolarHBondContact O-N 2.85Å; I510-D513 PolarHBondContact O-N 2.71Å; I510-R514 PolarHBondContact O-N 2.88Å; I510-R514 VanDerWaalsContact O-N 3.08Å
511	F	28.1	Very low	31	Very low	151 Å²	151	119.2 Å²	119.2	66%	0.662	62%	0.617	S	S	*	*	H	α-helix	trans	-65.5	-33.6	174.7	-159.3	-90.8	0	0	0	112.2	D507 L508 N509	D507-F511 VanDerWaalsContact O-CB 3.32Å; D507-F511 WeakPolarHBondContact O-CB 3.43Å; D507-F511 PolarHBondContact O-N 2.9Å; L508-F511 WeakPolarHBondContact O-CB 3.42Å; L508-F511 PolarHBondContact O-N 2.88Å; N509-F511 VanDerWaalsContact C-N 3.33Å
512	Y	31.3	Very low	31.2	Very low	179 Å²	179	118.2 Å²	118.2	70%	0.702	62%	0.619	S	S	*	*	H	α-helix	trans	-84.7	-22	175.6	-72.9	-66.8	0	0	0	114.4	L508 N509 I510	L508-Y512 HydrophobicContact CD2-CE2 4.29Å; L508-Y512 WeakPolarHBondContact O-CD2 3.34Å; L508-Y512 PolarHBondContact O-N 2.83Å; N509-Y512 PolarHBondContact O-N 2.97Å; I510-Y512 VanDerWaalsContact C-N 3.31Å; I510-Y512 PolarHBondContact O-N 2.85Å
513	D	33.8	Very low	31.4	Very low	140 Å²	140	119.1 Å²	119.1	75%	0.749	61%	0.609	S	S	*	*	H	α-helix	trans	-113.4	-11.5	-167.1	-141.8	10.6	0	0	0	114.6	N509 I510	N509-D513 WeakPolarHBondContact O-CB 3.14Å; N509-D513 PolarHBondContact O-N 2.73Å; I510-D513 PolarHBondContact O-N 2.71Å
514	R	29	Very low	31.8	Very low	210 Å²	210	119.8 Å²	119.8	79%	0.792	61%	0.608	S	S	*	*			trans	-151.7	76.2	179.8	-66.4	-171	-179.5	179.3	0.3	114.9	I510	I510-R514 PolarHBondContact O-N 2.88Å; I510-R514 VanDerWaalsContact O-N 3.08Å
515	K	32.4	Very low	32.2	Very low	185 Å²	185	122.9 Å²	122.9	80%	0.804	63%	0.627	S	S	*	*	S	Bend	trans	-137.1	135.1	145.2	-81.2	-165	177.3	179	0	110.2
516	S	33.6	Very low	32.6	Very low	76 Å²	76	127.7 Å²	127.7	53%	0.531	63%	0.628	S	S	.	*			trans	-55.7	140.8	-166.4	48.1	0	0	0	0	113	S518	S516-S518 PolarHBondContact O-N 2.98Å; S516-S518 PolarHBondContact OG-OG 2.83Å
517	Q	29.4	Very low	32.6	Very low	186 Å²	186	126.3 Å²	126.3	87%	0.869	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	7.8	172	-74	175.6	-28.6	0	0	115.1
518	S	32.4	Very low	32.8	Very low	72 Å²	72	125.4 Å²	125.4	50%	0.503	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.5	-21.8	-173.9	58.9	0	0	0	0	114.7	S516	S516-S518 PolarHBondContact O-N 2.98Å; S516-S518 PolarHBondContact OG-OG 2.83Å
519	D	32.8	Very low	33.3	Very low	141 Å²	141	121.7 Å²	121.7	75%	0.754	60%	0.595	S	S	*	*	S	Bend	trans	-114.3	6.6	-168.2	-60.9	0.6	0	0	0	112.9
520	I	29.8	Very low	33.4	Very low	111 Å²	111	117.1 Å²	117.1	57%	0.569	57%	0.573	S	S	*	*	S	Bend	trans	-83.7	122	171.5	-60.5	172.6	0	0	0	106.5	H522	I520-H522 PolarHBondContact O-N 3.35Å
521	I	31.2	Very low	33.5	Very low	125 Å²	125	118.1 Å²	118.1	64%	0.641	59%	0.586	S	S	*	*			trans	-27.4	111.7	168	-63.8	171.4	0	0	0	108.2	Y523	I521-Y523 HydrophobicContact CB-CE2 4.49Å; I521-Y523 HydrophobicContact CG2-CD1 4.47Å; I521-Y523 HydrophobicContact CG2-CE1 4.34Å; I521-Y523 WeakPolarHBondContact O-CD2 3.49Å; I521-Y523 PolarHBondContact O-N 2.85Å
522	H	31.2	Very low	33.7	Very low	167 Å²	167	118 Å²	118	77%	0.773	59%	0.586	S	S	*	*			trans	-65.7	81.2	175.2	-78.9	-29	0	0	0	107.7	I520	I520-H522 PolarHBondContact O-N 3.35Å
523	Y	32.4	Very low	33.6	Very low	113 Å²	113	112.5 Å²	112.5	44%	0.443	58%	0.583	S	S	.	*			trans	-51.7	134.4	161.1	-70	-66.5	0	0	0	106.4	I521 M527 V528	I521-Y523 HydrophobicContact CB-CE2 4.49Å; I521-Y523 HydrophobicContact CG2-CD1 4.47Å; I521-Y523 HydrophobicContact CG2-CE1 4.34Å; I521-Y523 WeakPolarHBondContact O-CD2 3.49Å; I521-Y523 PolarHBondContact O-N 2.85Å; Y523-M527 HydrophobicContact CD1-CE 3.51Å; Y523-M527 HydrophobicContact CD1-CG 4.3Å; Y523-M527 HydrophobicContact CD1-SD 3.44Å; Y523-M527 WeakPolarHBondContact CD1-SD 3.3Å; Y523-M527 HydrophobicContact CE1-CE 3.62Å; Y523-M527 HydrophobicContact CE1-SD 4.15Å; Y523-M527 HydrophobicContact CG-CE 4.45Å; Y523-M527 HydrophobicContact CG-SD 4.23Å; Y523-V528 WeakPolarHBondContact O-CG2 3.38Å
524	P	36.7	Very low	33.9	Very low	73 Å²	73	111.4 Å²	111.4	47%	0.474	58%	0.577	S	S	.	*			trans	-45.5	139.7	178.7	-27.8	32.1	0	0	0	109.3	R526 M527 V528	P524-R526 CarbonylContact O-C 3.57Å; P524-R526 PolarHBondContact O-N 3.11Å; P524-M527 HydrophobicContact CB-CB 4.31Å; P524-M527 HydrophobicContact CG-CB 4.4Å; P524-M527 WeakPolarHBondContact O-CA 3.49Å; P524-M527 WeakPolarHBondContact O-CB 3.34Å; P524-M527 PolarHBondContact O-N 2.69Å; P524-V528 PolarHBondContact O-N 3.01Å
525	P	39.5	Very low	34.2	Very low	117 Å²	117	103.6 Å²	103.6	76%	0.76	55%	0.55	S	S	*	*	H	α-helix	trans	-50	-27.4	178.7	-29	34	0	0	0	112.8	A529	P525-A529 WeakPolarHBondContact O-CA 2.95Å; P525-A529 WeakPolarHBondContact O-CB 3.32Å; P525-A529 PolarHBondContact O-N 3.38Å
526	R	38.8	Very low	34.3	Very low	182 Å²	182	98.6 Å²	98.6	69%	0.687	54%	0.537	S	S	*	.	H	α-helix	trans	-70.4	-37.4	171.6	-71.6	-175.4	167.9	-175.1	-3.8	114.8	P524 A529 A530 I535 F540	P524-R526 CarbonylContact O-C 3.57Å; P524-R526 PolarHBondContact O-N 3.11Å; R526-A529 PolarHBondContact O-N 2.97Å; R526-A530 WeakPolarHBondContact O-CB 3.43Å; R526-A530 PolarHBondContact O-N 3.19Å; R526-I535 HydrophobicContact CB-CD1 4.22Å; R526-I535 HydrophobicContact CG-CD1 4.1Å; R526-F540 HydrophobicContact CB-CD2 4.43Å
527	M	36.6	Very low	34.2	Very low	67 Å²	67	99 Å²	99	33%	0.33	53%	0.533	S	S	.	.	H	α-helix	trans	-73.9	-37.3	173.6	-170.7	171.6	172.2	0	0	110.6	Y523 P524 A530 C531 F540	Y523-M527 HydrophobicContact CD1-CE 3.51Å; Y523-M527 HydrophobicContact CD1-CG 4.3Å; Y523-M527 HydrophobicContact CD1-SD 3.44Å; Y523-M527 WeakPolarHBondContact CD1-SD 3.3Å; Y523-M527 HydrophobicContact CE1-CE 3.62Å; Y523-M527 HydrophobicContact CE1-SD 4.15Å; Y523-M527 HydrophobicContact CG-CE 4.45Å; Y523-M527 HydrophobicContact CG-SD 4.23Å; P524-M527 HydrophobicContact CB-CB 4.31Å; P524-M527 HydrophobicContact CG-CB 4.4Å; P524-M527 WeakPolarHBondContact O-CA 3.49Å; P524-M527 WeakPolarHBondContact O-CB 3.34Å; P524-M527 PolarHBondContact O-N 2.69Å; M527-A530 PolarHBondContact O-N 3.4Å; M527-C531 VanDerWaalsContact O-CB 3.3Å; M527-C531 WeakPolarHBondContact O-CB 3.29Å; M527-C531 PolarHBondContact O-N 2.93Å; M527-C531 PolarHBondContact O-SG 3.37Å; M527-F540 HydrophobicContact CB-CE2 4.08Å; M527-F540 HydrophobicContact CB-CZ 4.26Å; M527-F540 HydrophobicContact CG-CZ 4.32Å
528	V	35.9	Very low	34.3	Very low	51 Å²	51	91.1 Å²	91.1	31%	0.309	50%	0.501	S	S	.	.	H	α-helix	trans	-64	-42	168.5	179	0	0	0	0	111.1	Y523 P524 C531 K532	Y523-V528 WeakPolarHBondContact O-CG2 3.38Å; P524-V528 PolarHBondContact O-N 3.01Å; V528-C531 CarbonylContact O-C 3.16Å; V528-C531 PolarHBondContact O-N 3.41Å; V528-K532 HydrophobicContact CG1-CD 3.94Å; V528-K532 HydrophobicContact CG1-CG 4.33Å; V528-K532 VanDerWaalsContact O-CB 3.22Å; V528-K532 WeakPolarHBondContact O-CB 3.49Å; V528-K532 WeakPolarHBondContact O-CG 3.43Å; V528-K532 PolarHBondContact O-N 2.86Å
529	A	40	Very low	34.8	Very low	15 Å²	15	92.7 Å²	92.7	12%	0.124	50%	0.503	C	S	.	.	H	α-helix	trans	-68.5	-34.8	176.1	0	0	0	0	0	112.1	P525 R526 K532 G533 D534 I535	P525-A529 WeakPolarHBondContact O-CA 2.95Å; P525-A529 WeakPolarHBondContact O-CB 3.32Å; P525-A529 PolarHBondContact O-N 3.38Å; R526-A529 PolarHBondContact O-N 2.97Å; A529-K532 PolarHBondContact O-N 3.06Å; A529-G533 CarbonylContact O-C 3.49Å; A529-G533 PolarHBondContact O-N 3.48Å; A529-D534 HydrophobicContact CB-CB 4Å; A529-D534 PolarHBondContact O-N 3.13Å; A529-I535 HydrophobicContact CB-CD1 3.56Å; A529-I535 HydrophobicContact CB-CG1 3.78Å; A529-I535 PolarHBondContact O-N 3.22Å
530	A	34.5	Very low	35	Very low	14 Å²	14	88.5 Å²	88.5	12%	0.116	48%	0.479	C	S	.	.	H	α-helix	trans	-68.3	-42	171.8	0	0	0	0	0	111.5	R526 M527 K532 G533 L537 F540	R526-A530 WeakPolarHBondContact O-CB 3.43Å; R526-A530 PolarHBondContact O-N 3.19Å; M527-A530 PolarHBondContact O-N 3.4Å; A530-K532 VanDerWaalsContact C-N 3.32Å; A530-K532 PolarHBondContact O-N 2.86Å; A530-G533 PolarHBondContact O-N 3.45Å; A530-L537 HydrophobicContact CB-CD1 4.43Å; A530-F540 HydrophobicContact CB-CB 4.27Å; A530-F540 HydrophobicContact CB-CD2 4.27Å; A530-F540 HydrophobicContact CB-CG 4.21Å
531	C	33.5	Very low	35.2	Very low	106 Å²	106	87.5 Å²	87.5	72%	0.716	47%	0.474	S	S	*	.	H	α-helix	trans	-70.2	-24.9	173.7	-67.6	0	0	0	0	113.3	M527 V528	M527-C531 VanDerWaalsContact O-CB 3.3Å; M527-C531 WeakPolarHBondContact O-CB 3.29Å; M527-C531 PolarHBondContact O-N 2.93Å; M527-C531 PolarHBondContact O-SG 3.37Å; V528-C531 CarbonylContact O-C 3.16Å; V528-C531 PolarHBondContact O-N 3.41Å
532	K	32.6	Very low	35.7	Very low	149 Å²	149	85.4 Å²	85.4	65%	0.648	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-9.6	172.8	-77.2	179	178.8	-177.5	0	113.6	V528 A529 A530 D534	V528-K532 HydrophobicContact CG1-CD 3.94Å; V528-K532 HydrophobicContact CG1-CG 4.33Å; V528-K532 VanDerWaalsContact O-CB 3.22Å; V528-K532 WeakPolarHBondContact O-CB 3.49Å; V528-K532 WeakPolarHBondContact O-CG 3.43Å; V528-K532 PolarHBondContact O-N 2.86Å; A529-K532 PolarHBondContact O-N 3.06Å; A530-K532 VanDerWaalsContact C-N 3.32Å; A530-K532 PolarHBondContact O-N 2.86Å; K532-D534 VanDerWaalsContact C-N 3.31Å
533	G	29.1	Very low	36	Very low	62 Å²	62	79.2 Å²	79.2	64%	0.639	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	7.3	-176	0	0	0	0	0	114.9	A529 A530 I535	A529-G533 CarbonylContact O-C 3.49Å; A529-G533 PolarHBondContact O-N 3.48Å; A530-G533 PolarHBondContact O-N 3.45Å; G533-I535 VanDerWaalsContact C-N 3.29Å; G533-I535 PolarHBondContact O-N 3.01Å
534	D	40.2	Very low	36	Very low	118 Å²	118	79.9 Å²	79.9	63%	0.631	47%	0.467	S	S	*	.	S	Bend	trans	-74.2	-19.3	178.2	-64.9	-38.6	0	0	0	112.5	A529 K532	A529-D534 HydrophobicContact CB-CB 4Å; A529-D534 PolarHBondContact O-N 3.13Å; K532-D534 VanDerWaalsContact C-N 3.31Å
535	I	35.8	Very low	36.3	Very low	46 Å²	46	84.3 Å²	84.3	24%	0.236	49%	0.487	C	S	.	.	S	Bend	trans	-127.8	127.1	175.4	-54.6	173.3	0	0	0	108	R526 A529 G533 L537 N539	R526-I535 HydrophobicContact CB-CD1 4.22Å; R526-I535 HydrophobicContact CG-CD1 4.1Å; A529-I535 HydrophobicContact CB-CD1 3.56Å; A529-I535 HydrophobicContact CB-CG1 3.78Å; A529-I535 PolarHBondContact O-N 3.22Å; G533-I535 VanDerWaalsContact C-N 3.29Å; G533-I535 PolarHBondContact O-N 3.01Å; I535-L537 PolarHBondContact O-N 2.9Å; I535-N539 HydrophobicContact CG2-CB 3.77Å
536	P	33.9	Very low	36.4	Very low	79 Å²	79	83.4 Å²	83.4	51%	0.513	48%	0.475	S	S	.	.			trans	-53.4	131.8	171.4	-23.1	31.8	0	0	0	110	G538 N539 F540	P536-G538 PolarHBondContact O-N 3.33Å; P536-N539 HydrophobicContact CB-CB 4.41Å; P536-N539 WeakPolarHBondContact O-CA 3.4Å; P536-N539 WeakPolarHBondContact O-CB 3.45Å; P536-N539 PolarHBondContact O-N 2.93Å; P536-F540 PolarHBondContact O-N 3.12Å
537	L	32.1	Very low	36.4	Very low	86 Å²	86	81 Å²	81	45%	0.45	47%	0.471	S	S	.	.	H	α-helix	trans	-54.9	-31	179	-157.5	78.6	0	0	0	111.5	A530 I535 N539 F540 L541	A530-L537 HydrophobicContact CB-CD1 4.43Å; I535-L537 PolarHBondContact O-N 2.9Å; L537-N539 PolarHBondContact O-N 3.27Å; L537-F540 WeakPolarHBondContact O-CB 2.88Å; L537-F540 PolarHBondContact O-N 3.19Å; L537-F540 VanDerWaalsContact O-N 3.14Å; L537-L541 HydrophobicContact CD2-CD1 4.22Å; L537-L541 HydrophobicContact CG-CD1 4.15Å; L537-L541 WeakPolarHBondContact O-CB 3.25Å; L537-L541 WeakPolarHBondContact O-CG 3.35Å; L537-L541 PolarHBondContact O-N 3.18Å
538	G	31.5	Very low	36.4	Very low	19 Å²	19	83.9 Å²	83.9	20%	0.196	49%	0.487	C	S	.	.	H	α-helix	trans	-61.5	-34.2	170.9	0	0	0	0	0	114.3	P536 S542	P536-G538 PolarHBondContact O-N 3.33Å; G538-S542 WeakPolarHBondContact O-CB 3.11Å; G538-S542 PolarHBondContact O-N 3.13Å; G538-S542 PolarHBondContact O-OG 2.8Å
539	N	42.2	Very low	36.7	Very low	105 Å²	105	87 Å²	87	56%	0.561	50%	0.502	S	S	*	.	H	α-helix	trans	-78.6	-21.1	172.8	-76	-9.9	0	0	0	113	I535 P536 L537 S542	I535-N539 HydrophobicContact CG2-CB 3.77Å; P536-N539 HydrophobicContact CB-CB 4.41Å; P536-N539 WeakPolarHBondContact O-CA 3.4Å; P536-N539 WeakPolarHBondContact O-CB 3.45Å; P536-N539 PolarHBondContact O-N 2.93Å; L537-N539 PolarHBondContact O-N 3.27Å; N539-S542 WeakPolarHBondContact CA-OG 3.37Å
540	F	36.5	Very low	36.8	Very low	54 Å²	54	88.9 Å²	88.9	24%	0.237	51%	0.512	C	S	.	.	H	α-helix	trans	-76.8	-41.3	170.9	179.1	-100.7	0	0	0	111.4	R526 M527 A530 P536 L537 I546	R526-F540 HydrophobicContact CB-CD2 4.43Å; M527-F540 HydrophobicContact CB-CE2 4.08Å; M527-F540 HydrophobicContact CB-CZ 4.26Å; M527-F540 HydrophobicContact CG-CZ 4.32Å; A530-F540 HydrophobicContact CB-CB 4.27Å; A530-F540 HydrophobicContact CB-CD2 4.27Å; A530-F540 HydrophobicContact CB-CG 4.21Å; P536-F540 PolarHBondContact O-N 3.12Å; L537-F540 WeakPolarHBondContact O-CB 2.88Å; L537-F540 PolarHBondContact O-N 3.19Å; L537-F540 VanDerWaalsContact O-N 3.14Å; F540-I546 HydrophobicContact CE1-CD1 4.5Å; F540-I546 HydrophobicContact CZ-CD1 4.26Å
541	L	34.5	Very low	37	Very low	89 Å²	89	92.4 Å²	92.4	47%	0.466	53%	0.528	S	S	.	.	H	α-helix	trans	-83.7	-27	-177.9	-65.2	171.5	0	0	0	113.8	L537 G543	L537-L541 HydrophobicContact CD2-CD1 4.22Å; L537-L541 HydrophobicContact CG-CD1 4.15Å; L537-L541 WeakPolarHBondContact O-CB 3.25Å; L537-L541 WeakPolarHBondContact O-CG 3.35Å; L537-L541 PolarHBondContact O-N 3.18Å; L541-G543 VanDerWaalsContact C-N 3.29Å
542	S	41.1	Very low	37.2	Very low	82 Å²	82	93.3 Å²	93.3	57%	0.573	52%	0.522	S	S	*	.	S	Bend	trans	-81.1	-8.2	174.5	59.6	0	0	0	0	113.7	G538 N539 T544	G538-S542 WeakPolarHBondContact O-CB 3.11Å; G538-S542 PolarHBondContact O-N 3.13Å; G538-S542 PolarHBondContact O-OG 2.8Å; N539-S542 WeakPolarHBondContact CA-OG 3.37Å; S542-T544 PolarHBondContact O-N 2.77Å
543	G	39.1	Very low	37.6	Very low	36 Å²	36	91.1 Å²	91.1	37%	0.371	51%	0.514	S	S	.	.	S	Bend	trans	-73.2	94.4	169.5	0	0	0	0	0	109.7	L541 D545	L541-G543 VanDerWaalsContact C-N 3.29Å; G543-D545 PolarHBondContact O-N 2.91Å
544	T	31.9	Very low	38.1	Very low	127 Å²	127	94 Å²	94	78%	0.779	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-35.6	107.8	171.4	50.7	0	0	0	0	112	S542	S542-T544 PolarHBondContact O-N 2.77Å
545	D	42.2	Very low	38	Very low	167 Å²	167	93.3 Å²	93.3	89%	0.893	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	167.9	-4.8	152.8	-86.8	-15.2	0	0	0	113.3	G543	G543-D545 PolarHBondContact O-N 2.91Å
546	I	41.5	Very low	38.2	Very low	97 Å²	97	96.1 Å²	96.1	50%	0.497	52%	0.522	S	S	.	.			trans	-109.5	98	176.9	-53.1	177.3	0	0	0	110	F540 L551	F540-I546 HydrophobicContact CE1-CD1 4.5Å; F540-I546 HydrophobicContact CZ-CD1 4.26Å; I546-L551 HydrophobicContact CG2-CD1 3.64Å
547	Q	38.6	Very low	38.7	Very low	131 Å²	131	97.9 Å²	97.9	61%	0.612	52%	0.522	S	S	*	.			trans	-76.5	127.1	165.8	-75.4	-178	-23.3	0	0	108.9	D549 V550 L551	Q547-D549 PolarHBondContact O-N 2.79Å; Q547-V550 HydrophobicContact CB-CB 4.19Å; Q547-V550 HydrophobicContact CB-CG2 3.74Å; Q547-V550 WeakPolarHBondContact O-CB 3.38Å; Q547-V550 PolarHBondContact O-N 3.16Å; Q547-L551 PolarHBondContact O-N 2.9Å
548	I	38.3	Very low	38.9	Very low	128 Å²	128	99.2 Å²	99.2	66%	0.656	53%	0.526	S	S	*	.	H	α-helix	trans	-54.6	-40.8	179.4	-68.8	171.8	0	0	0	110.8	V550 L551 E552	I548-V550 VanDerWaalsContact C-N 3.26Å; I548-V550 PolarHBondContact O-N 2.74Å; I548-L551 WeakPolarHBondContact O-CB 3.27Å; I548-L551 PolarHBondContact O-N 2.84Å; I548-E552 PolarHBondContact O-N 3.46Å
549	D	41.9	Very low	39.1	Very low	116 Å²	116	104.2 Å²	104.2	62%	0.62	54%	0.539	S	S	*	.	H	α-helix	trans	-60	-35.3	177.9	-45	-17.8	0	0	0	112.2	Q547 L551 E553	Q547-D549 PolarHBondContact O-N 2.79Å; D549-L551 VanDerWaalsContact C-N 3.34Å; D549-E553 VanDerWaalsContact O-CB 3.32Å; D549-E553 WeakPolarHBondContact O-CB 3.08Å; D549-E553 PolarHBondContact O-N 2.8Å
550	V	42.5	Very low	39	Very low	55 Å²	55	102.2 Å²	102.2	33%	0.333	53%	0.533	S	S	.	.	H	α-helix	trans	-72	-31.4	176.8	176.3	0	0	0	0	110.8	Q547 I548 Q554	Q547-V550 HydrophobicContact CB-CB 4.19Å; Q547-V550 HydrophobicContact CB-CG2 3.74Å; Q547-V550 WeakPolarHBondContact O-CB 3.38Å; Q547-V550 PolarHBondContact O-N 3.16Å; I548-V550 VanDerWaalsContact C-N 3.26Å; I548-V550 PolarHBondContact O-N 2.74Å; V550-Q554 HydrophobicContact CG1-CG 4.29Å; V550-Q554 VanDerWaalsContact O-CB 3.23Å; V550-Q554 WeakPolarHBondContact O-CB 3.41Å; V550-Q554 VanDerWaalsContact O-CG 3.22Å; V550-Q554 WeakPolarHBondContact O-CG 3.41Å; V550-Q554 PolarHBondContact O-N 2.95Å
551	L	37.5	Very low	39.1	Very low	89 Å²	89	106.2 Å²	106.2	47%	0.466	55%	0.552	S	S	.	*	H	α-helix	trans	-72.9	-41.8	177.6	-142.2	109.5	0	0	0	111.3	I546 Q547 I548 D549 Q554 L555	I546-L551 HydrophobicContact CG2-CD1 3.64Å; Q547-L551 PolarHBondContact O-N 2.9Å; I548-L551 WeakPolarHBondContact O-CB 3.27Å; I548-L551 PolarHBondContact O-N 2.84Å; D549-L551 VanDerWaalsContact C-N 3.34Å; L551-Q554 PolarHBondContact O-N 3.47Å; L551-L555 HydrophobicContact CD2-CD1 4.34Å; L551-L555 WeakPolarHBondContact O-CB 3.34Å; L551-L555 VanDerWaalsContact O-CG 3.29Å; L551-L555 WeakPolarHBondContact O-CG 3.26Å; L551-L555 PolarHBondContact O-N 2.92Å
552	E	37.9	Very low	39.1	Very low	125 Å²	125	107.2 Å²	107.2	58%	0.584	55%	0.554	S	S	*	*	H	α-helix	trans	-63	-46.4	171	-80.4	-168.9	149	0	0	111.3	I548 Q554 L555 D556	I548-E552 PolarHBondContact O-N 3.46Å; E552-Q554 VanDerWaalsContact C-N 3.33Å; E552-Q554 PolarHBondContact O-N 2.86Å; E552-L555 PolarHBondContact O-N 3.3Å; E552-D556 WeakPolarHBondContact O-CB 3.37Å; E552-D556 PolarHBondContact O-N 2.92Å
553	E	42.2	Very low	38.7	Very low	102 Å²	102	106.1 Å²	106.1	48%	0.477	55%	0.547	S	S	.	.	H	α-helix	trans	-64.5	-35.8	178.2	-164	-169.2	172	0	0	112.2	D549 K557	D549-E553 VanDerWaalsContact O-CB 3.32Å; D549-E553 WeakPolarHBondContact O-CB 3.08Å; D549-E553 PolarHBondContact O-N 2.8Å; E553-K557 HydrophobicContact CG-CD 4.45Å; E553-K557 VanDerWaalsContact O-CB 3.27Å; E553-K557 WeakPolarHBondContact O-CB 3.28Å; E553-K557 WeakPolarHBondContact O-CG 3.47Å; E553-K557 PolarHBondContact O-N 2.76Å; E553-K557 WeakPolarHBondContact OE1-CE 3.36Å; E553-K557 IonicContact OE1-NZ 2.64Å; E553-K557 PolarHBondContact OE1-NZ 2.79Å
554	Q	38.4	Very low	38.6	Very low	122 Å²	122	108.6 Å²	108.6	57%	0.57	56%	0.555	S	S	*	*	H	α-helix	trans	-70.2	-39.7	175.2	-79.7	-171.2	2.5	0	0	112.3	V550 L551 E552 K557 Q558	V550-Q554 HydrophobicContact CG1-CG 4.29Å; V550-Q554 VanDerWaalsContact O-CB 3.23Å; V550-Q554 WeakPolarHBondContact O-CB 3.41Å; V550-Q554 VanDerWaalsContact O-CG 3.22Å; V550-Q554 WeakPolarHBondContact O-CG 3.41Å; V550-Q554 PolarHBondContact O-N 2.95Å; L551-Q554 PolarHBondContact O-N 3.47Å; E552-Q554 VanDerWaalsContact C-N 3.33Å; E552-Q554 PolarHBondContact O-N 2.86Å; Q554-K557 PolarHBondContact O-N 2.87Å; Q554-Q558 WeakPolarHBondContact O-CB 3.43Å; Q554-Q558 PolarHBondContact O-N 3.14Å
555	L	38	Very low	38.8	Very low	104 Å²	104	107.5 Å²	107.5	55%	0.545	55%	0.548	S	S	.	.	H	α-helix	trans	-64.5	-44.2	174.3	-75.9	165.9	0	0	0	111.1	L551 E552 Q558 W559	L551-L555 HydrophobicContact CD2-CD1 4.34Å; L551-L555 WeakPolarHBondContact O-CB 3.34Å; L551-L555 VanDerWaalsContact O-CG 3.29Å; L551-L555 WeakPolarHBondContact O-CG 3.26Å; L551-L555 PolarHBondContact O-N 2.92Å; E552-L555 PolarHBondContact O-N 3.3Å; L555-Q558 PolarHBondContact O-N 2.84Å; L555-W559 VanDerWaalsContact O-CB 3.26Å; L555-W559 WeakPolarHBondContact O-CB 3.28Å; L555-W559 PolarHBondContact O-N 2.95Å
556	D	41.2	Very low	38.6	Very low	105 Å²	105	104.4 Å²	104.4	56%	0.561	53%	0.531	S	S	*	.	H	α-helix	trans	-65.1	-41.1	175.6	-83	-10	0	0	0	111.8	E552 W559 S560	E552-D556 WeakPolarHBondContact O-CB 3.37Å; E552-D556 PolarHBondContact O-N 2.92Å; D556-W559 PolarHBondContact O-N 2.78Å; D556-S560 WeakPolarHBondContact O-CB 3.25Å; D556-S560 PolarHBondContact O-N 2.99Å
557	K	43.9	Very low	38.3	Very low	117 Å²	117	104.8 Å²	104.8	51%	0.509	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-46	175	-83.6	177.5	-175	160.7	0	112	E553 Q554 W559 S560 H561	E553-K557 HydrophobicContact CG-CD 4.45Å; E553-K557 VanDerWaalsContact O-CB 3.27Å; E553-K557 WeakPolarHBondContact O-CB 3.28Å; E553-K557 WeakPolarHBondContact O-CG 3.47Å; E553-K557 PolarHBondContact O-N 2.76Å; E553-K557 WeakPolarHBondContact OE1-CE 3.36Å; E553-K557 IonicContact OE1-NZ 2.64Å; E553-K557 PolarHBondContact OE1-NZ 2.79Å; Q554-K557 PolarHBondContact O-N 2.87Å; K557-W559 VanDerWaalsContact C-N 3.29Å; K557-W559 PolarHBondContact O-N 3.32Å; K557-S560 WeakPolarHBondContact CA-OG 3.38Å; K557-S560 PolarHBondContact O-N 3.31Å; K557-S560 PolarHBondContact O-OG 3.16Å; K557-H561 PolarHBondContact O-N 3.1Å
558	Q	36.5	Very low	38	Very low	114 Å²	114	101.8 Å²	101.8	53%	0.533	53%	0.528	S	S	.	.	H	α-helix	trans	-63.3	-40.4	179.3	-165.8	174.3	-7.9	0	0	110.5	Q554 L555 H561 E562	Q554-Q558 WeakPolarHBondContact O-CB 3.43Å; Q554-Q558 PolarHBondContact O-N 3.14Å; L555-Q558 PolarHBondContact O-N 2.84Å; Q558-H561 PolarHBondContact O-N 3.19Å; Q558-E562 PolarHBondContact NE2-OE1 2.87Å; Q558-E562 WeakPolarHBondContact O-CB 3.21Å; Q558-E562 WeakPolarHBondContact O-CG 3.22Å; Q558-E562 PolarHBondContact O-N 3.36Å
559	W	35.8	Very low	37.7	Very low	123 Å²	123	100.4 Å²	100.4	47%	0.466	52%	0.521	S	S	.	.	H	α-helix	trans	-68.5	-36.9	174.1	-161.7	-79.1	0	0	0	113.2	M365 L555 D556 K557 H561 E562 S563	M365-W559 HydrophobicContact CE-CG 4.46Å; M365-W559 HydrophobicContact CE-CZ2 4.45Å; L555-W559 VanDerWaalsContact O-CB 3.26Å; L555-W559 WeakPolarHBondContact O-CB 3.28Å; L555-W559 PolarHBondContact O-N 2.95Å; D556-W559 PolarHBondContact O-N 2.78Å; K557-W559 VanDerWaalsContact C-N 3.29Å; K557-W559 PolarHBondContact O-N 3.32Å; W559-H561 VanDerWaalsContact C-N 3.27Å; W559-H561 PolarHBondContact O-N 3.22Å; W559-E562 PolarHBondContact O-N 2.82Å; W559-S563 WeakPolarHBondContact O-CB 3.39Å; W559-S563 PolarHBondContact O-N 3.03Å; W559-S563 PolarHBondContact O-OG 3.22Å
560	S	40.3	Very low	37.2	Very low	63 Å²	63	96.8 Å²	96.8	44%	0.441	51%	0.511	S	S	.	.	H	α-helix	trans	-63.9	-36.1	173.2	76	0	0	0	0	111.3	D556 K557 S563 T564	D556-S560 WeakPolarHBondContact O-CB 3.25Å; D556-S560 PolarHBondContact O-N 2.99Å; K557-S560 WeakPolarHBondContact CA-OG 3.38Å; K557-S560 PolarHBondContact O-N 3.31Å; K557-S560 PolarHBondContact O-OG 3.16Å; S560-S563 WeakPolarHBondContact CA-OG 3.28Å; S560-S563 PolarHBondContact O-OG 3.46Å; S560-T564 VanDerWaalsContact O-CG2 3.31Å; S560-T564 WeakPolarHBondContact O-CG2 3.3Å; S560-T564 PolarHBondContact O-N 3.4Å; S560-T564 VanDerWaalsContact O-N 3.13Å; S560-T564 PolarHBondContact O-OG1 2.74Å
561	H	38.1	Very low	36.7	Very low	139 Å²	139	100.7 Å²	100.7	64%	0.644	53%	0.525	S	S	*	.	H	α-helix	trans	-73.9	-42.7	178.5	-145.3	39.5	0	0	0	111.4	K557 Q558 W559 T564 V565	K557-H561 PolarHBondContact O-N 3.1Å; Q558-H561 PolarHBondContact O-N 3.19Å; W559-H561 VanDerWaalsContact C-N 3.27Å; W559-H561 PolarHBondContact O-N 3.22Å; H561-T564 PolarHBondContact O-N 2.78Å; H561-T564 PolarHBondContact O-OG1 3.3Å; H561-V565 WeakPolarHBondContact O-CG2 3.41Å; H561-V565 PolarHBondContact O-N 2.96Å
562	E	34.3	Very low	36.3	Very low	109 Å²	109	101.1 Å²	101.1	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-68.3	-37	176	-71.9	175.7	-168.3	0	0	112.2	Q558 W559 V565	Q558-E562 PolarHBondContact NE2-OE1 2.87Å; Q558-E562 WeakPolarHBondContact O-CB 3.21Å; Q558-E562 WeakPolarHBondContact O-CG 3.22Å; Q558-E562 PolarHBondContact O-N 3.36Å; W559-E562 PolarHBondContact O-N 2.82Å; E562-V565 PolarHBondContact O-N 3.22Å
563	S	33	Very low	36	Very low	59 Å²	59	99.9 Å²	99.9	41%	0.413	52%	0.524	S	S	.	.	H	α-helix	trans	-70.6	-29.8	176.5	59.7	0	0	0	0	113.3	W559 S560 V565 D566	W559-S563 WeakPolarHBondContact O-CB 3.39Å; W559-S563 PolarHBondContact O-N 3.03Å; W559-S563 PolarHBondContact O-OG 3.22Å; S560-S563 WeakPolarHBondContact CA-OG 3.28Å; S560-S563 PolarHBondContact O-OG 3.46Å; S563-V565 VanDerWaalsContact C-N 3.27Å; S563-V565 PolarHBondContact O-N 2.82Å; S563-D566 PolarHBondContact O-N 2.77Å
564	T	36.2	Very low	35.5	Very low	88 Å²	88	98.6 Å²	98.6	54%	0.54	53%	0.526	S	S	.	.	H	α-helix	trans	-71.2	-17	171.6	52.1	0	0	0	0	114.5	S560 H561	S560-T564 VanDerWaalsContact O-CG2 3.31Å; S560-T564 WeakPolarHBondContact O-CG2 3.3Å; S560-T564 PolarHBondContact O-N 3.4Å; S560-T564 VanDerWaalsContact O-N 3.13Å; S560-T564 PolarHBondContact O-OG1 2.74Å; H561-T564 PolarHBondContact O-N 2.78Å; H561-T564 PolarHBondContact O-OG1 3.3Å
565	V	37.2	Very low	35.2	Very low	105 Å²	105	96.8 Å²	96.8	64%	0.636	53%	0.527	S	S	*	.	H	α-helix	trans	-84.7	-18.7	178.7	177.9	0	0	0	0	111.4	H561 E562 S563	H561-V565 WeakPolarHBondContact O-CG2 3.41Å; H561-V565 PolarHBondContact O-N 2.96Å; E562-V565 PolarHBondContact O-N 3.22Å; S563-V565 VanDerWaalsContact C-N 3.27Å; S563-V565 PolarHBondContact O-N 2.82Å
566	D	36.4	Very low	34.7	Very low	102 Å²	102	96.1 Å²	96.1	55%	0.545	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	6.3	-175.2	-121.1	-9.9	0	0	0	115.3	S563 S568 L569	S563-D566 PolarHBondContact O-N 2.77Å; D566-S568 PolarHBondContact O-N 2.85Å; D566-S568 VanDerWaalsContact O-N 3.08Å; D566-L569 PolarHBondContact O-N 2.77Å
567	D	35.7	Very low	34.2	Very low	105 Å²	105	98.4 Å²	98.4	56%	0.561	54%	0.535	S	S	*	.	H	α-helix	trans	-59.3	-19.2	168.6	-91.4	-19.3	0	0	0	112.5	Q571	D567-Q571 VanDerWaalsContact O-CB 3.29Å; D567-Q571 WeakPolarHBondContact O-CB 3.47Å; D567-Q571 VanDerWaalsContact O-CG 3.27Å; D567-Q571 WeakPolarHBondContact O-CG 3.38Å; D567-Q571 PolarHBondContact O-N 3.06Å
568	S	33.7	Very low	33.4	Very low	67 Å²	67	98.1 Å²	98.1	47%	0.469	54%	0.543	S	S	.	.	H	α-helix	trans	-69.4	-29.9	174.5	66.7	0	0	0	0	113	D566 I572	D566-S568 PolarHBondContact O-N 2.85Å; D566-S568 VanDerWaalsContact O-N 3.08Å; S568-I572 WeakPolarHBondContact O-CB 3.32Å; S568-I572 WeakPolarHBondContact O-CD1 3.17Å; S568-I572 WeakPolarHBondContact O-CG1 3.32Å; S568-I572 PolarHBondContact O-N 2.76Å; S568-I572 VanDerWaalsContact O-N 3.08Å
569	L	30.2	Very low	33	Very low	100 Å²	100	99.8 Å²	99.8	52%	0.524	56%	0.556	S	S	.	*	H	α-helix	trans	-80.8	-39	177.7	-135.9	90.4	0	0	0	111.7	D566 I572 I573	D566-L569 PolarHBondContact O-N 2.77Å; L569-I572 PolarHBondContact O-N 3.21Å; L569-I573 WeakPolarHBondContact O-CG1 3.44Å; L569-I573 PolarHBondContact O-N 3.08Å
570	G	32.2	Very low	32.6	Very low	39 Å²	39	102.4 Å²	102.4	40%	0.402	57%	0.573	S	S	.	*	H	α-helix	trans	-66.3	-35	174.1	0	0	0	0	0	113	S574	G570-S574 WeakPolarHBondContact O-CB 3.18Å; G570-S574 PolarHBondContact O-N 3.15Å; G570-S574 PolarHBondContact O-OG 3.21Å
571	Q	31.8	Very low	32	Very low	137 Å²	137	109.4 Å²	109.4	64%	0.64	62%	0.619	S	S	*	*	H	α-helix	trans	-74.8	-33.7	172.1	-74.5	-179.2	6.5	0	0	112.8	D567 S575	D567-Q571 VanDerWaalsContact O-CB 3.29Å; D567-Q571 WeakPolarHBondContact O-CB 3.47Å; D567-Q571 VanDerWaalsContact O-CG 3.27Å; D567-Q571 WeakPolarHBondContact O-CG 3.38Å; D567-Q571 PolarHBondContact O-N 3.06Å; Q571-S575 WeakPolarHBondContact O-CB 3.44Å; Q571-S575 PolarHBondContact O-N 2.87Å; Q571-S575 PolarHBondContact O-OG 2.86Å
572	I	29.6	Very low	31.7	Very low	99 Å²	99	107.9 Å²	107.9	51%	0.508	62%	0.618	S	S	.	*	H	α-helix	trans	-66.7	-44.4	174	-73.9	165.8	0	0	0	110.7	S568 L569 S575 C576	S568-I572 WeakPolarHBondContact O-CB 3.32Å; S568-I572 WeakPolarHBondContact O-CD1 3.17Å; S568-I572 WeakPolarHBondContact O-CG1 3.32Å; S568-I572 PolarHBondContact O-N 2.76Å; S568-I572 VanDerWaalsContact O-N 3.08Å; L569-I572 PolarHBondContact O-N 3.21Å; I572-S575 WeakPolarHBondContact CA-OG 3.25Å; I572-S575 PolarHBondContact O-N 3.33Å; I572-S575 PolarHBondContact O-OG 3.19Å; I572-C576 PolarHBondContact O-N 2.93Å; I572-C576 PolarHBondContact O-SG 3Å; I572-C576 VanDerWaalsContact O-SG 3.36Å
573	I	31.3	Very low	31.6	Very low	99 Å²	99	107.8 Å²	107.8	51%	0.508	62%	0.624	S	S	.	*	H	α-helix	trans	-68.1	-41.2	177.2	-65.5	168.9	0	0	0	110.6	L569 S575 C576 F577	L569-I573 WeakPolarHBondContact O-CG1 3.44Å; L569-I573 PolarHBondContact O-N 3.08Å; I573-S575 VanDerWaalsContact C-N 3.34Å; I573-S575 PolarHBondContact O-N 3.37Å; I573-C576 PolarHBondContact O-N 3.32Å; I573-C576 VanDerWaalsContact O-N 3.16Å; I573-F577 WeakPolarHBondContact O-CD2 3.39Å
574	S	32.6	Very low	31.5	Very low	75 Å²	75	110.6 Å²	110.6	52%	0.524	64%	0.635	S	S	.	*	H	α-helix	trans	-67.6	-31.5	175.8	-57.4	0	0	0	0	113	G570 C576 F577 V578	G570-S574 WeakPolarHBondContact O-CB 3.18Å; G570-S574 PolarHBondContact O-N 3.15Å; G570-S574 PolarHBondContact O-OG 3.21Å; S574-C576 PolarHBondContact O-N 3.31Å; S574-F577 PolarHBondContact O-N 2.71Å; S574-V578 PolarHBondContact O-N 3.31Å
575	S	31.1	Very low	31.2	Very low	83 Å²	83	111.9 Å²	111.9	58%	0.58	64%	0.641	S	S	*	*	H	α-helix	trans	-73.2	-14.2	173.9	74.2	0	0	0	0	113.9	Q571 I572 I573	Q571-S575 WeakPolarHBondContact O-CB 3.44Å; Q571-S575 PolarHBondContact O-N 2.87Å; Q571-S575 PolarHBondContact O-OG 2.86Å; I572-S575 WeakPolarHBondContact CA-OG 3.25Å; I572-S575 PolarHBondContact O-N 3.33Å; I572-S575 PolarHBondContact O-OG 3.19Å; I573-S575 VanDerWaalsContact C-N 3.34Å; I573-S575 PolarHBondContact O-N 3.37Å
576	C	28.5	Very low	30.9	Very low	91 Å²	91	112.3 Å²	112.3	62%	0.615	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-7.7	173.2	-73.1	0	0	0	0	113.4	I572 I573 S574	I572-C576 PolarHBondContact O-N 2.93Å; I572-C576 PolarHBondContact O-SG 3Å; I572-C576 VanDerWaalsContact O-SG 3.36Å; I573-C576 PolarHBondContact O-N 3.32Å; I573-C576 VanDerWaalsContact O-N 3.16Å; S574-C576 PolarHBondContact O-N 3.31Å
577	F	30.6	Very low	30.5	Very low	152 Å²	152	113 Å²	113	67%	0.667	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	5.7	-177.4	-74.4	-76.7	0	0	0	115	M487 I573 S574	M487-F577 HydrophobicContact CE-CE1 4.21Å; M487-F577 HydrophobicContact CE-CZ 4.34Å; I573-F577 WeakPolarHBondContact O-CD2 3.39Å; S574-F577 PolarHBondContact O-N 2.71Å
578	V	26.2	Very low	30.1	Very low	111 Å²	111	113.6 Å²	113.6	67%	0.673	65%	0.654	S	S	*	*			trans	-128.6	86.8	172.3	-173.1	0	0	0	0	109.5	S574	S574-V578 PolarHBondContact O-N 3.31Å
579	D	28.2	Very low	29.8	Very low	150 Å²	150	117.2 Å²	117.2	80%	0.802	67%	0.668	S	S	*	*			trans	-170.7	126.7	142.3	-104.4	-21.1	0	0	0	110.9
580	Q	27.1	Very low	29.8	Very low	178 Å²	178	118.6 Å²	118.6	83%	0.832	68%	0.68	S	S	*	*			trans	96.3	91.5	162.2	-54.9	178.1	14.6	0	0	119
581	C	28.5	Very low	29.6	Very low	209 Å²	209	125.8 Å²	125.8	100%	1.412	71%	0.706	S	S	*	*			trans	90.4	0	147.1	-62.1	0	0	0	0	120

Retrieved 581 of 581 residues in 275.1 ms (Link to these results)

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