A0A077ZB27_TRITR Loading...

PAN 1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZB27, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 362 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	50.9	Low	48.3	Very low	239 Å²	239	143.4 Å²	143.4	100%	1.177	74%	0.737	S	S	*	*				0	44.7	0	-153.9	171.9	83.4	0	0	112.6
2	M	49.8	Very low	48	Very low	166 Å²	166	139.7 Å²	139.7	82%	0.818	73%	0.731	S	S	*	*			trans	-163.3	-18.6	163.8	-122.9	-173.2	90.9	0	0	112.3
3	I	52.4	Low	48.3	Very low	151 Å²	151	135.2 Å²	135.2	77%	0.774	72%	0.719	S	S	*	*	S	Bend	trans	-87.2	-16.9	-178	-64.5	169.2	0	0	0	113.2
4	L	49.6	Very low	48.7	Very low	153 Å²	153	133.7 Å²	133.7	80%	0.801	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-10.2	-179.7	-120	84.4	0	0	0	114.8
5	L	47.6	Very low	49.2	Very low	134 Å²	134	132.6 Å²	132.6	70%	0.702	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-9.8	-176.6	-124.2	94.3	0	0	0	114.3	T8	L5-T8 PolarHBondContact O-OG1 3Å
6	M	46.2	Very low	49.9	Very low	152 Å²	152	134.9 Å²	134.9	75%	0.749	70%	0.702	S	S	*	*	S	Bend	trans	-90.6	-16.1	-178.2	-71.1	-68.5	-178.1	0	0	113.4
7	L	46.7	Very low	50.9	Low	131 Å²	131	133.4 Å²	133.4	69%	0.686	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-16.9	179.4	-77.7	162.3	0	0	0	113.4
8	T	47.5	Very low	51.9	Low	102 Å²	102	131.1 Å²	131.1	63%	0.626	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-14.8	-179.8	48.9	0	0	0	0	113.6	L5	L5-T8 PolarHBondContact O-OG1 3Å
9	I	49.8	Very low	52.6	Low	116 Å²	116	129.7 Å²	129.7	60%	0.595	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-21.1	177.7	-57	176.2	0	0	0	111.4	Y11	I9-Y11 PolarHBondContact O-N 2.88Å
10	G	43	Very low	53.4	Low	41 Å²	41	128 Å²	128	42%	0.423	67%	0.667	S	S	.	*	H	α-helix	trans	-74.3	-21.3	179.8	0	0	0	0	0	115.7
11	Y	47.9	Very low	54.2	Low	192 Å²	192	126.9 Å²	126.9	75%	0.753	66%	0.661	S	S	*	*	H	α-helix	trans	-84.1	-16.9	-177	-92.1	-90	0	0	0	114.1	I9	I9-Y11 PolarHBondContact O-N 2.88Å
12	C	44.1	Very low	54.8	Low	99 Å²	99	122.5 Å²	122.5	67%	0.669	64%	0.636	S	S	*	*	H	α-helix	trans	-82.5	-23.2	-179.5	-131.3	0	0	0	0	113
13	S	52.3	Low	55.7	Low	82 Å²	82	119.1 Å²	119.1	57%	0.573	62%	0.62	S	S	*	*	H	α-helix	trans	-84.8	-27.5	-179.6	-47.6	0	0	0	0	113.5	L17	S13-L17 PolarHBondContact O-N 3.13Å
14	L	53.5	Low	56	Low	114 Å²	114	116.3 Å²	116.3	60%	0.597	61%	0.606	S	S	*	*	H	α-helix	trans	-70	-33.2	179.5	-112.6	87.1	0	0	0	112.9	L17 L18	L14-L17 PolarHBondContact O-N 3.33Å; L14-L18 PolarHBondContact O-N 2.86Å
15	N	56.9	Low	56.3	Low	117 Å²	117	112.2 Å²	112.2	63%	0.626	59%	0.59	S	S	*	*	H	α-helix	trans	-70.3	-33	178.5	-93.2	-28.3	0	0	0	112.8	L19	N15-L19 WeakPolarHBondContact O-CB 3.25Å; N15-L19 PolarHBondContact O-N 3.25Å
16	Y	60.4	Low	56.3	Low	169 Å²	169	110.4 Å²	110.4	66%	0.663	59%	0.588	S	S	*	*	H	α-helix	trans	-69.3	-35.7	173.5	-94.8	-87.1	0	0	0	112.4	L19 L20	Y16-L19 PolarHBondContact O-N 2.89Å; Y16-L20 WeakPolarHBondContact O-CB 3.45Å; Y16-L20 PolarHBondContact O-N 2.78Å
17	L	66.9	Low	56.8	Low	110 Å²	110	107.4 Å²	107.4	58%	0.576	58%	0.578	S	S	*	*	H	α-helix	trans	-70.1	-39.2	177	-158.5	77.1	0	0	0	111.7	S13 L14 L20 L21	S13-L17 PolarHBondContact O-N 3.13Å; L14-L17 PolarHBondContact O-N 3.33Å; L17-L20 PolarHBondContact O-N 3.28Å; L17-L21 WeakPolarHBondContact O-CB 3.29Å; L17-L21 VanDerWaalsContact O-CG 3.29Å; L17-L21 WeakPolarHBondContact O-CG 3.42Å; L17-L21 PolarHBondContact O-N 3.49Å
18	L	68	Low	56.9	Low	92 Å²	92	107.5 Å²	107.5	48%	0.482	58%	0.578	S	S	.	*	H	α-helix	trans	-65.1	-39	172.4	-102	140.8	0	0	0	112.3	L14 L21 F22	L14-L18 PolarHBondContact O-N 2.86Å; L18-L21 PolarHBondContact O-N 3.35Å; L18-F22 WeakPolarHBondContact O-CB 3.34Å; L18-F22 PolarHBondContact O-N 2.71Å
19	L	66.5	Low	56.9	Low	104 Å²	104	113.3 Å²	113.3	55%	0.545	59%	0.589	S	S	.	*	H	α-helix	trans	-66.2	-42.6	174.6	-158.9	81.6	0	0	0	111.5	N15 Y16 F22 I23	N15-L19 WeakPolarHBondContact O-CB 3.25Å; N15-L19 PolarHBondContact O-N 3.25Å; Y16-L19 PolarHBondContact O-N 2.89Å; L19-F22 PolarHBondContact O-N 2.77Å; L19-I23 HydrophobicContact CG-CD1 4.41Å; L19-I23 VanDerWaalsContact O-CG1 3.27Å; L19-I23 WeakPolarHBondContact O-CG1 3.34Å; L19-I23 PolarHBondContact O-N 3.28Å
20	L	68.7	Low	56.9	Low	95 Å²	95	112.6 Å²	112.6	50%	0.497	59%	0.585	S	S	.	*	H	α-helix	trans	-64.9	-39.3	174.7	-89.5	159.7	0	0	0	112.2	Y16 L17 I23 L24	Y16-L20 WeakPolarHBondContact O-CB 3.45Å; Y16-L20 PolarHBondContact O-N 2.78Å; L17-L20 PolarHBondContact O-N 3.28Å; L20-I23 PolarHBondContact O-N 3.43Å; L20-L24 WeakPolarHBondContact O-CB 3.4Å; L20-L24 PolarHBondContact O-N 3.44Å
21	L	69.6	Low	56.5	Low	106 Å²	106	114.2 Å²	114.2	56%	0.555	60%	0.601	S	S	*	*	H	α-helix	trans	-66.5	-37.1	173.8	-76.3	168.5	0	0	0	111.8	L17 L18 L24 S25	L17-L21 WeakPolarHBondContact O-CB 3.29Å; L17-L21 VanDerWaalsContact O-CG 3.29Å; L17-L21 WeakPolarHBondContact O-CG 3.42Å; L17-L21 PolarHBondContact O-N 3.49Å; L18-L21 PolarHBondContact O-N 3.35Å; L21-L24 PolarHBondContact O-N 3.3Å; L21-S25 VanDerWaalsContact O-CB 3.32Å; L21-S25 WeakPolarHBondContact O-CB 3.23Å; L21-S25 PolarHBondContact O-N 3.09Å; L21-S25 PolarHBondContact O-OG 2.94Å
22	F	64.1	Low	56	Low	147 Å²	147	109.2 Å²	109.2	65%	0.645	60%	0.6	S	S	*	*	H	α-helix	trans	-63.1	-46.4	172.2	-110.7	-89.7	0	0	0	111.3	L18 L19 S25 C26	L18-F22 WeakPolarHBondContact O-CB 3.34Å; L18-F22 PolarHBondContact O-N 2.71Å; L19-F22 PolarHBondContact O-N 2.77Å; F22-S25 PolarHBondContact O-N 3.18Å; F22-S25 PolarHBondContact O-OG 2.91Å; F22-C26 WeakPolarHBondContact O-CB 3.38Å; F22-C26 PolarHBondContact O-N 3.26Å; F22-C26 VanDerWaalsContact O-N 3.07Å
23	I	68.3	Low	55.6	Low	94 Å²	94	109.9 Å²	109.9	48%	0.482	61%	0.606	S	S	.	*	H	α-helix	trans	-63.7	-43.8	176.9	-65.7	166.7	0	0	0	110.5	L19 L20 S25 C26 V27	L19-I23 HydrophobicContact CG-CD1 4.41Å; L19-I23 VanDerWaalsContact O-CG1 3.27Å; L19-I23 WeakPolarHBondContact O-CG1 3.34Å; L19-I23 PolarHBondContact O-N 3.28Å; L20-I23 PolarHBondContact O-N 3.43Å; I23-S25 PolarHBondContact O-N 3.28Å; I23-C26 WeakPolarHBondContact O-CB 3.4Å; I23-C26 PolarHBondContact O-N 2.75Å; I23-V27 HydrophobicContact CG2-CG2 4.41Å; I23-V27 WeakPolarHBondContact O-CG2 3.33Å; I23-V27 PolarHBondContact O-N 3.37Å
24	L	57.8	Low	54.5	Low	92 Å²	92	113.9 Å²	113.9	48%	0.482	62%	0.62	S	S	.	*	H	α-helix	trans	-63.9	-39.9	177	-119.8	86	0	0	0	111.9	L20 L21 C26 V27 L28	L20-L24 WeakPolarHBondContact O-CB 3.4Å; L20-L24 PolarHBondContact O-N 3.44Å; L21-L24 PolarHBondContact O-N 3.3Å; L24-C26 PolarHBondContact O-N 3.09Å; L24-V27 PolarHBondContact O-N 3.09Å; L24-L28 HydrophobicContact CB-CD1 4.43Å; L24-L28 HydrophobicContact CD2-CD1 3.84Å; L24-L28 HydrophobicContact CG-CD1 4.06Å; L24-L28 WeakPolarHBondContact O-CB 3.12Å; L24-L28 PolarHBondContact O-N 3.43Å
25	S	56.1	Low	53.4	Low	68 Å²	68	119.4 Å²	119.4	48%	0.476	63%	0.634	S	S	.	*	H	α-helix	trans	-65.2	-30.3	176.7	77.9	0	0	0	0	112.4	L21 F22 I23	L21-S25 VanDerWaalsContact O-CB 3.32Å; L21-S25 WeakPolarHBondContact O-CB 3.23Å; L21-S25 PolarHBondContact O-N 3.09Å; L21-S25 PolarHBondContact O-OG 2.94Å; F22-S25 PolarHBondContact O-N 3.18Å; F22-S25 PolarHBondContact O-OG 2.91Å; I23-S25 PolarHBondContact O-N 3.28Å
26	C	48.7	Very low	52.1	Low	95 Å²	95	120.2 Å²	120.2	64%	0.642	63%	0.632	S	S	*	*	H	α-helix	trans	-75	-34.9	175	-132.2	0	0	0	0	111.8	F22 I23 L24	F22-C26 WeakPolarHBondContact O-CB 3.38Å; F22-C26 PolarHBondContact O-N 3.26Å; F22-C26 VanDerWaalsContact O-N 3.07Å; I23-C26 WeakPolarHBondContact O-CB 3.4Å; I23-C26 PolarHBondContact O-N 2.75Å; L24-C26 PolarHBondContact O-N 3.09Å
27	V	56.8	Low	50.7	Low	90 Å²	90	116.7 Å²	116.7	55%	0.545	63%	0.63	S	S	.	*	H	α-helix	trans	-82.2	-34.7	-179.8	176.4	0	0	0	0	112.5	I23 L24 R29 I30	I23-V27 HydrophobicContact CG2-CG2 4.41Å; I23-V27 WeakPolarHBondContact O-CG2 3.33Å; I23-V27 PolarHBondContact O-N 3.37Å; L24-V27 PolarHBondContact O-N 3.09Å; V27-R29 PolarHBondContact O-N 3.06Å; V27-I30 WeakPolarHBondContact O-CB 3.37Å; V27-I30 WeakPolarHBondContact O-CG1 3.13Å; V27-I30 PolarHBondContact O-N 3.21Å
28	L	49	Very low	48.9	Very low	132 Å²	132	117 Å²	117	69%	0.691	64%	0.636	S	S	*	*	H	α-helix	trans	-77	-14.4	-178.7	-93.2	136.6	0	0	0	114.7	L24 I30	L24-L28 HydrophobicContact CB-CD1 4.43Å; L24-L28 HydrophobicContact CD2-CD1 3.84Å; L24-L28 HydrophobicContact CG-CD1 4.06Å; L24-L28 WeakPolarHBondContact O-CB 3.12Å; L24-L28 PolarHBondContact O-N 3.43Å; L28-I30 PolarHBondContact O-N 3.11Å
29	R	47.4	Very low	46.9	Very low	224 Å²	224	118 Å²	118	85%	0.845	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	8	170.8	-83.7	-173.6	178.5	-161.6	1	114.2	V27	V27-R29 PolarHBondContact O-N 3.06Å
30	I	49	Very low	45.2	Very low	102 Å²	102	120.7 Å²	120.7	52%	0.523	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.6	-8.6	-177.5	-64.1	-178.2	0	0	0	113.1	V27 L28 K36	V27-I30 WeakPolarHBondContact O-CB 3.37Å; V27-I30 WeakPolarHBondContact O-CG1 3.13Å; V27-I30 PolarHBondContact O-N 3.21Å; L28-I30 PolarHBondContact O-N 3.11Å; I30-K36 VanDerWaalsContact CG2-NZ 3.3Å
31	G	35	Very low	43.1	Very low	74 Å²	74	121.6 Å²	121.6	76%	0.763	67%	0.672	S	S	*	*	S	Bend	trans	-112.9	63	-178.1	0	0	0	0	0	114.7
32	A	37.9	Very low	41.4	Very low	88 Å²	88	122 Å²	122	73%	0.727	67%	0.666	S	S	*	*	S	Bend	trans	-170.7	125.6	157.6	0	0	0	0	0	111
33	S	34.1	Very low	39.9	Very low	113 Å²	113	121.6 Å²	121.6	79%	0.79	67%	0.67	S	S	*	*			trans	78.2	121.5	166.4	-149.6	0	0	0	0	117.8
34	L	30.2	Very low	38.2	Very low	166 Å²	166	126 Å²	126	87%	0.869	68%	0.68	S	S	*	*	S	Bend	trans	-60.3	143.8	175.4	-72.2	97	0	0	0	111.2
35	Y	31	Very low	37.1	Very low	229 Å²	229	126.8 Å²	126.8	90%	0.898	68%	0.68	S	S	*	*			trans	92.5	78.2	-174	-78.5	-95.1	0	0	0	116
36	K	29	Very low	36.1	Very low	135 Å²	135	129.5 Å²	129.5	59%	0.587	69%	0.694	S	S	*	*			trans	-92	127.2	164.4	-77.8	-176.4	176.8	-178.7	0	110.8	I30	I30-K36 VanDerWaalsContact CG2-NZ 3.3Å
37	P	30.4	Very low	35.6	Very low	94 Å²	94	126.9 Å²	126.9	61%	0.61	68%	0.676	S	S	*	*			trans	-70.3	138.7	165.6	29.9	-30.2	0	0	0	109.1	C39	P37-C39 PolarHBondContact O-N 2.79Å
38	V	29	Very low	34.4	Very low	116 Å²	116	127.3 Å²	127.3	70%	0.703	69%	0.689	S	S	*	*			trans	-62.4	104.2	170.7	177.1	0	0	0	0	107.8	Q40	V38-Q40 VanDerWaalsContact C-N 3.35Å; V38-Q40 PolarHBondContact O-N 3.44Å
39	C	27.1	Very low	33.9	Very low	113 Å²	113	126 Å²	126	76%	0.764	68%	0.682	S	S	*	*			trans	-66.1	95.6	167	-73.6	0	0	0	0	108.1	P37 C41	P37-C39 PolarHBondContact O-N 2.79Å; C39-C41 PolarHBondContact O-N 3.36Å
40	Q	30.3	Very low	33.1	Very low	162 Å²	162	118.6 Å²	118.6	76%	0.757	68%	0.675	S	S	*	*			trans	-71.7	99.7	167.3	-147.4	169	15.4	0	0	107	V38 R42	V38-Q40 VanDerWaalsContact C-N 3.35Å; V38-Q40 PolarHBondContact O-N 3.44Å; Q40-R42 PolarHBondContact O-N 2.78Å
41	C	25.4	Very low	32.5	Very low	113 Å²	113	123.9 Å²	123.9	76%	0.764	70%	0.698	S	S	*	*			trans	-61.4	104.1	173.2	-69.6	0	0	0	0	108.1	C39	C39-C41 PolarHBondContact O-N 3.36Å
42	R	33.6	Very low	32.8	Very low	114 Å²	114	123.3 Å²	123.3	43%	0.43	68%	0.682	S	S	.	*			trans	-69	128.1	157.1	-78.5	-175.2	172.6	-135.8	-5.3	106.4	Q40 W44	Q40-R42 PolarHBondContact O-N 2.78Å; R42-W44 HydrophobicContact CB-CD2 4.37Å; R42-W44 HydrophobicContact CB-CH2 4.27Å; R42-W44 HydrophobicContact CB-CZ2 3.85Å; R42-W44 PolarHBondContact O-N 2.88Å; R42-W44 PolarHBondContact O-NE1 2.85Å; R42-W44 VanDerWaalsContact O-NE1 3.1Å
43	I	31.4	Very low	33.5	Very low	139 Å²	139	126.5 Å²	126.5	71%	0.713	68%	0.682	S	S	*	*			trans	-70.2	113.9	170	-63.3	171.7	0	0	0	105.6	F45	I43-F45 HydrophobicContact CG2-CD2 4.22Å; I43-F45 HydrophobicContact CG2-CE1 4.45Å; I43-F45 HydrophobicContact CG2-CE2 3.66Å; I43-F45 HydrophobicContact CG2-CZ 3.79Å
44	W	33.5	Very low	34.5	Very low	187 Å²	187	122.3 Å²	122.3	71%	0.708	65%	0.652	S	S	*	*			trans	-91.4	118.3	179.7	-55	102.4	0	0	0	108.1	R42 V46	R42-W44 HydrophobicContact CB-CD2 4.37Å; R42-W44 HydrophobicContact CB-CH2 4.27Å; R42-W44 HydrophobicContact CB-CZ2 3.85Å; R42-W44 PolarHBondContact O-N 2.88Å; R42-W44 PolarHBondContact O-NE1 2.85Å; R42-W44 VanDerWaalsContact O-NE1 3.1Å; W44-V46 PolarHBondContact O-N 3.13Å
45	F	35.2	Very low	35.7	Very low	109 Å²	109	122.3 Å²	122.3	48%	0.478	65%	0.652	S	S	.	*			trans	-91.2	98.7	174.1	-79.3	-71.3	0	0	0	109.8	I43 S47 E85	I43-F45 HydrophobicContact CG2-CD2 4.22Å; I43-F45 HydrophobicContact CG2-CE1 4.45Å; I43-F45 HydrophobicContact CG2-CE2 3.66Å; I43-F45 HydrophobicContact CG2-CZ 3.79Å; F45-S47 PolarHBondContact O-N 2.9Å; F45-E85 HydrophobicContact CD1-CB 4.3Å; F45-E85 HydrophobicContact CD1-CG 3.16Å; F45-E85 HydrophobicContact CD2-CG 3.9Å; F45-E85 HydrophobicContact CE1-CB 4.48Å; F45-E85 HydrophobicContact CE1-CG 3.09Å; F45-E85 HydrophobicContact CE2-CG 3.83Å; F45-E85 WeakPolarHBondContact CE2-OE1 3.41Å; F45-E85 HydrophobicContact CG-CG 3.58Å; F45-E85 HydrophobicContact CZ-CG 3.44Å; F45-E85 VanDerWaalsContact CZ-CG 3.44Å; F45-E85 WeakPolarHBondContact CZ-OE1 3.01Å
46	V	35.3	Very low	36.9	Very low	125 Å²	125	113.8 Å²	113.8	76%	0.758	62%	0.621	S	S	*	*			trans	-82.4	94.6	164.1	-178.5	0	0	0	0	106.8	W44 A48	W44-V46 PolarHBondContact O-N 3.13Å; V46-A48 PolarHBondContact O-N 2.94Å
47	S	37.1	Very low	38	Very low	40 Å²	40	114.6 Å²	114.6	28%	0.28	63%	0.631	S	S	.	*			trans	-76.3	107	170	-51.7	0	0	0	0	108.4	F45 L49	F45-S47 PolarHBondContact O-N 2.9Å; S47-L49 VanDerWaalsContact C-N 3.28Å; S47-L49 PolarHBondContact O-N 3.5Å
48	A	31.3	Very low	39.4	Very low	98 Å²	98	113.1 Å²	113.1	81%	0.81	61%	0.614	S	S	*	*			trans	-72.5	78.4	172.2	0	0	0	0	0	110.6	V46	V46-A48 PolarHBondContact O-N 2.94Å
49	L	37.9	Very low	41.6	Very low	106 Å²	106	110.3 Å²	110.3	56%	0.555	59%	0.591	S	S	*	*			trans	-138.9	109.7	174.8	-78.4	168.7	0	0	0	111.4	S47 S89	S47-L49 VanDerWaalsContact C-N 3.28Å; S47-L49 PolarHBondContact O-N 3.5Å; L49-S89 VanDerWaalsContact CD1-OG 3.28Å; L49-S89 WeakPolarHBondContact CD1-OG 3.16Å
50	G	31.7	Very low	44.4	Very low	67 Å²	67	106.9 Å²	106.9	69%	0.691	56%	0.563	S	S	*	*			trans	13	118.7	160	0	0	0	0	0	120.9	S52	G50-S52 VanDerWaalsContact C-N 3.28Å; G50-S52 PolarHBondContact O-N 2.66Å
51	E	35.2	Very low	46.8	Very low	213 Å²	213	100.6 Å²	100.6	100%	0.995	53%	0.533	S	S	*	.			trans	44.9	32.1	134.1	-128.1	170.8	-152.1	0	0	119.3
52	S	42.1	Very low	49.9	Very low	62 Å²	62	100.2 Å²	100.2	43%	0.434	52%	0.516	S	S	.	.			trans	-100.3	138.1	161.4	62.8	0	0	0	0	109.8	G50 C54	G50-S52 VanDerWaalsContact C-N 3.28Å; G50-S52 PolarHBondContact O-N 2.66Å; S52-C54 PolarHBondContact O-N 2.85Å
53	E	52.3	Low	52.4	Low	155 Å²	155	95.6 Å²	95.6	72%	0.724	50%	0.5	S	S	*	.	S	Bend	trans	-49.1	18.8	-170	-71.8	179.1	146	0	0	119.3	Q142	E53-Q142 PolarHBondContact OE2-NE2 3.17Å; E53-Q142 VanDerWaalsContact OE2-NE2 3.14Å
54	C	55.9	Low	55.2	Low	25 Å²	25	92.1 Å²	92.1	17%	0.169	49%	0.486	C	S	.	.			trans	-102.8	91.2	178.3	-90.1	0	0	0	0	112.4	S52 H56 W59 C140	S52-C54 PolarHBondContact O-N 2.85Å; C54-H56 PolarHBondContact O-N 2.88Å; C54-H56 VanDerWaalsContact O-N 3.14Å; C54-W59 HydrophobicContact CB-CD2 4.47Å; C54-W59 HydrophobicContact CB-CZ2 3.99Å; C54-W59 PolarHBondContact O-NE1 2.75Å; C54-C140 HydrophobicContact CB-CB 4.22Å; C54-C140 WeakPolarHBondContact CB-SG 3.35Å; C54-C140 VanDerWaalsContact SG-CA 3.53Å; C54-C140 WeakPolarHBondContact SG-CB 3.14Å; C54-C140 CovalentContact SG-SG 2Å; C54-C140 PolarHBondContact SG-SG 2.9Å
55	L	54.3	Low	58	Low	166 Å²	166	87.1 Å²	87.1	87%	0.869	47%	0.473	S	S	*	.			trans	-79.4	22.8	-179	-87.8	143.6	0	0	0	114.7
56	H	56.8	Low	60.6	Low	51 Å²	51	85.1 Å²	85.1	24%	0.236	46%	0.464	C	S	.	.			trans	-120.7	140.6	-169.8	-61.3	-41.3	0	0	0	113.4	C54 W58 W59 R188	C54-H56 PolarHBondContact O-N 2.88Å; C54-H56 VanDerWaalsContact O-N 3.14Å; H56-W58 HydrophobicContact CB-CD2 4.45Å; H56-W58 HydrophobicContact CB-CZ2 3.88Å; H56-W58 AromaticContact CD2-CZ2 3.97Å; H56-W58 AromaticContact CG-CZ2 3.79Å; H56-W58 PolarHBondContact O-N 2.75Å; H56-W58 VanDerWaalsContact O-N 3.14Å; H56-W59 PolarHBondContact O-NE1 2.77Å; H56-R188 PolarHBondContact CD2-O 2.85Å; H56-R188 WeakPolarHBondContact NE2-CA 3.41Å; H56-R188 PolarHBondContact NE2-O 2.89Å
57	D	52.7	Low	63.3	Low	152 Å²	152	81.9 Å²	81.9	81%	0.813	44%	0.441	S	S	*	.	S	Bend	trans	-70.5	-5.7	-179.8	-60.8	-40.7	0	0	0	113.9
58	W	59.3	Low	65.8	Low	63 Å²	63	80.2 Å²	80.2	24%	0.239	43%	0.429	C	S	.	.			trans	-126.1	83.3	-173.5	50	-85.6	0	0	0	110.5	H56 R188 H189	H56-W58 HydrophobicContact CB-CD2 4.45Å; H56-W58 HydrophobicContact CB-CZ2 3.88Å; H56-W58 AromaticContact CD2-CZ2 3.97Å; H56-W58 AromaticContact CG-CZ2 3.79Å; H56-W58 PolarHBondContact O-N 2.75Å; H56-W58 VanDerWaalsContact O-N 3.14Å; W58-R188 WeakPolarHBondContact CH2-O 3.38Å; W58-R188 WeakPolarHBondContact CZ2-O 3.34Å; W58-H189 HydrophobicContact CH2-CB 3.2Å; W58-H189 HydrophobicContact CZ2-CB 3.47Å; W58-H189 VanDerWaalsContact CZ2-CB 3.47Å; W58-H189 HydrophobicContact CZ3-CB 4.06Å
59	W	76.1	Confident	68.3	Low	57 Å²	57	77.8 Å²	77.8	22%	0.216	41%	0.409	C	S	.	.			trans	-82.4	-26.6	178.9	-65.3	-1	0	0	0	113.1	C54 H56 A92 N138 G139	C54-W59 HydrophobicContact CB-CD2 4.47Å; C54-W59 HydrophobicContact CB-CZ2 3.99Å; C54-W59 PolarHBondContact O-NE1 2.75Å; H56-W59 PolarHBondContact O-NE1 2.77Å; W59-A92 HydrophobicContact CE3-CB 3.8Å; W59-A92 HydrophobicContact CZ3-CB 3.93Å; W59-N138 CarbonylContact O-C 3.58Å; W59-N138 WeakPolarHBondContact O-CA 3.2Å; W59-N138 PolarHBondContact O-OD1 2.86Å; W59-G139 PolarHBondContact O-N 2.87Å
60	F	85	Confident	70.3	Confident	40 Å²	40	75.5 Å²	75.5	18%	0.175	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	127.5	-173.4	-69.2	-83.7	0	0	0	113.5	L88 C91 A92 V101 E137 N138	F60-L88 HydrophobicContact CB-CD1 4.14Å; F60-L88 HydrophobicContact CB-CD2 4.23Å; F60-L88 HydrophobicContact CD1-CD2 3.72Å; F60-L88 HydrophobicContact CD2-CB 3.85Å; F60-L88 HydrophobicContact CD2-CD1 4.07Å; F60-L88 HydrophobicContact CD2-CD2 4.02Å; F60-L88 HydrophobicContact CD2-CG 4.17Å; F60-L88 HydrophobicContact CE1-CD2 4.03Å; F60-L88 HydrophobicContact CE2-CB 3.79Å; F60-L88 HydrophobicContact CE2-CD2 4.33Å; F60-L88 HydrophobicContact CE2-CG 4.49Å; F60-L88 WeakPolarHBondContact CE2-O 3.45Å; F60-L88 HydrophobicContact CG-CB 4.43Å; F60-L88 HydrophobicContact CG-CD1 4.15Å; F60-L88 HydrophobicContact CG-CD2 3.71Å; F60-L88 HydrophobicContact CG-CG 4.29Å; F60-L88 HydrophobicContact CZ-CB 4.31Å; F60-L88 HydrophobicContact CZ-CD2 4.34Å; F60-L88 WeakPolarHBondContact CZ-O 3.43Å; F60-C91 HydrophobicContact CE1-CB 4.02Å; F60-C91 HydrophobicContact CZ-CB 3.73Å; F60-A92 HydrophobicContact CE2-CB 4.26Å; F60-A92 HydrophobicContact CZ-CB 4.44Å; F60-V101 HydrophobicContact CE1-CG2 4.3Å; F60-E137 CarbonylContact C-O 3.56Å; F60-E137 VanDerWaalsContact CA-O 3.25Å; F60-E137 WeakPolarHBondContact CA-O 3.45Å; F60-N138 HydrophobicContact CD1-CB 4.18Å; F60-N138 HydrophobicContact CE1-CB 3.65Å; F60-N138 HydrophobicContact CZ-CB 4.29Å
61	E	81.7	Confident	72.2	Confident	31 Å²	31	73.6 Å²	73.6	15%	0.145	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	118.8	168.2	-172.3	-175.7	-172.9	0	0	110.2	R117 Y136 E137 T208	E61-R117 IonicContact OE2-NH2 3.92Å; E61-Y136 CarbonylContact O-C 3.55Å; E61-Y136 VanDerWaalsContact O-CA 3.27Å; E61-Y136 WeakPolarHBondContact O-CA 3.43Å; E61-E137 PolarHBondContact N-O 3Å; E61-E137 PolarHBondContact O-N 2.82Å; E61-T208 VanDerWaalsContact OE1-CG2 3.27Å; E61-T208 WeakPolarHBondContact OE1-CG2 3.45Å; E61-T208 WeakPolarHBondContact OE2-CG2 3Å
62	R	88.7	Confident	74.1	Confident	105 Å²	105	68.4 Å²	68.4	40%	0.396	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	125.6	170.9	-176.8	179.4	170.2	-122.7	-1.8	111.4	D134 L135 Y136	R62-D134 HydrophobicContact CG-CB 4.41Å; R62-D134 IonicContact CZ-OD2 3.71Å; R62-D134 IonicContact NE-OD2 2.85Å; R62-D134 PolarHBondContact NE-OD2 3.17Å; R62-D134 IonicContact NH2-OD1 2.91Å; R62-D134 IonicContact NH2-OD2 3.84Å; R62-D134 PolarHBondContact NH2-OD2 2.69Å; R62-L135 CarbonylContact C-O 3.55Å; R62-Y136 HydrophobicContact CB-CD1 3.86Å; R62-Y136 HydrophobicContact CB-CE1 3.66Å; R62-Y136 HydrophobicContact CG-CD1 4.21Å; R62-Y136 HydrophobicContact CG-CE1 3.69Å
63	I	87.3	Confident	75.4	Confident	17 Å²	17	68.4 Å²	68.4	9%	0.087	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	105	169.9	-52.5	151.9	0	0	0	107.2	K66 L135 E137	I63-K66 HydrophobicContact CG2-CB 4.13Å; I63-K66 HydrophobicContact CG2-CG 3.53Å; I63-L135 HydrophobicContact CB-CB 4.3Å; I63-L135 HydrophobicContact CD1-CB 4.39Å; I63-L135 HydrophobicContact CD1-CD2 3.83Å; I63-L135 HydrophobicContact CD1-CG 4.29Å; I63-L135 PolarHBondContact N-O 2.82Å; I63-L135 PolarHBondContact O-N 3.36Å; I63-E137 HydrophobicContact CD1-CG 3.59Å; I63-E137 WeakPolarHBondContact CD1-OE2 3.5Å
64	P	90.1	Very high	76.9	Confident	66 Å²	66	61.6 Å²	61.6	43%	0.429	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	152.2	-175.7	30.1	-34.9	0	0	0	111.4	K66 D134	P64-K66 VanDerWaalsContact C-N 3.33Å; P64-K66 PolarHBondContact O-N 3.04Å; P64-D134 VanDerWaalsContact CA-OD1 3.32Å; P64-D134 WeakPolarHBondContact CA-OD1 3.46Å
65	N	92.2	Very high	78.4	Confident	81 Å²	81	62.7 Å²	62.7	43%	0.433	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	40.4	170.5	-53.2	-30.9	0	0	0	114.3	G129 A130 S131 T133 D134	N65-G129 WeakPolarHBondContact O-CA 3.13Å; N65-A130 CarbonylContact C-O 3.5Å; N65-A130 WeakPolarHBondContact CA-O 3.27Å; N65-A130 PolarHBondContact O-N 2.85Å; N65-S131 PolarHBondContact OD1-O 2.71Å; N65-S131 VanDerWaalsContact OD1-O 3.13Å; N65-T133 CarbonylContact C-O 3.58Å; N65-T133 VanDerWaalsContact C-O 3.31Å; N65-T133 WeakPolarHBondContact CA-O 3.42Å; N65-T133 PolarHBondContact N-O 3.41Å; N65-T133 VanDerWaalsContact N-O 3.08Å; N65-D134 PolarHBondContact N-OD1 2.9Å
66	K	90.6	Very high	80	Confident	68 Å²	68	58.1 Å²	58.1	30%	0.296	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	143.2	-178.7	-74.3	-63	-171.2	173.8	0	111	I63 P64 I128 T133 L135	I63-K66 HydrophobicContact CG2-CB 4.13Å; I63-K66 HydrophobicContact CG2-CG 3.53Å; P64-K66 VanDerWaalsContact C-N 3.33Å; P64-K66 PolarHBondContact O-N 3.04Å; K66-I128 WeakPolarHBondContact CA-O 3.47Å; K66-I128 WeakPolarHBondContact CD-O 3.49Å; K66-T133 PolarHBondContact N-O 3.44Å; K66-T133 CarbonylContact O-C 3.46Å; K66-T133 WeakPolarHBondContact O-CG2 3.3Å; K66-L135 HydrophobicContact CB-CB 4.06Å
67	Q	91.3	Very high	81.7	Confident	56 Å²	56	57 Å²	57	26%	0.262	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	164.1	173.7	74.6	-178.5	16.3	0	0	111	Q102 F127 I128 A130 T133	Q67-Q102 HydrophobicContact CB-CG 4.46Å; Q67-F127 CarbonylContact O-C 3.54Å; Q67-F127 VanDerWaalsContact O-CA 3.29Å; Q67-F127 WeakPolarHBondContact O-CA 3.3Å; Q67-I128 HydrophobicContact CG-CD1 4.25Å; Q67-I128 HydrophobicContact CG-CG1 3.7Å; Q67-I128 PolarHBondContact N-O 2.96Å; Q67-I128 PolarHBondContact O-N 3.01Å; Q67-A130 HydrophobicContact CB-CB 3.86Å; Q67-A130 HydrophobicContact CG-CB 3.5Å; Q67-T133 HydrophobicContact CB-CG2 3.78Å
68	I	88.9	Confident	83.6	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.026	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	129	171.4	-159.7	157.3	0	0	0	110.1	V70 A71 F74 L113 I126 F127	I68-V70 VanDerWaalsContact C-N 3.31Å; I68-V70 PolarHBondContact O-N 3.14Å; I68-A71 VanDerWaalsContact CG2-CA 3.45Å; I68-A71 HydrophobicContact CG2-CB 3.64Å; I68-F74 HydrophobicContact CD1-CB 3.86Å; I68-F74 HydrophobicContact CD1-CD2 3.19Å; I68-F74 HydrophobicContact CD1-CE2 3.88Å; I68-F74 HydrophobicContact CD1-CG 3.71Å; I68-F74 HydrophobicContact CG1-CD2 4Å; I68-F74 HydrophobicContact CG1-CE2 4.44Å; I68-L113 HydrophobicContact CB-CD1 4.26Å; I68-L113 HydrophobicContact CD1-CD1 4.24Å; I68-L113 HydrophobicContact CG2-CD1 4.07Å; I68-L113 HydrophobicContact CG2-CD2 4.2Å; I68-I126 CarbonylContact C-O 3.58Å; I68-I126 WeakPolarHBondContact CA-O 3.38Å; I68-I126 HydrophobicContact CD1-CG2 3.81Å; I68-I126 HydrophobicContact CG1-CG2 3.61Å; I68-F127 HydrophobicContact CB-CD1 4.42Å; I68-F127 HydrophobicContact CB-CE1 4.32Å; I68-F127 HydrophobicContact CD1-CE1 4.03Å; I68-F127 HydrophobicContact CD1-CZ 4.13Å; I68-F127 HydrophobicContact CG1-CE1 4.3Å
69	A	84.9	Confident	85.2	Confident	48 Å²	48	51.2 Å²	51.2	40%	0.397	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-32.2	-178	0	0	0	0	0	112.3	I126 I128	A69-I126 PolarHBondContact N-O 2.94Å; A69-I128 HydrophobicContact CB-CD1 3.91Å; A69-I128 HydrophobicContact CB-CG1 4.14Å; A69-I128 HydrophobicContact CB-CG2 4.06Å
70	V	78.6	Confident	86.1	Confident	57 Å²	57	53.4 Å²	53.4	35%	0.345	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125	71.2	-178.2	-164.9	0	0	0	0	109.7	I68 S72 L73 F74	I68-V70 VanDerWaalsContact C-N 3.31Å; I68-V70 PolarHBondContact O-N 3.14Å; V70-S72 VanDerWaalsContact C-N 3.29Å; V70-S72 PolarHBondContact O-N 2.85Å; V70-L73 HydrophobicContact CB-CD1 4.23Å; V70-L73 HydrophobicContact CG1-CB 4.18Å; V70-L73 HydrophobicContact CG1-CD1 3.63Å; V70-L73 HydrophobicContact CG1-CG 3.66Å; V70-L73 PolarHBondContact O-N 3.3Å; V70-F74 WeakPolarHBondContact O-CD2 3.37Å
71	A	72.6	Confident	86.4	Confident	27 Å²	27	54 Å²	54	22%	0.223	33%	0.325	C	S	.	.	H	α-helix	trans	-57.8	-39.5	-176.1	0	0	0	0	0	113.2	I68 L73 F74 T75 L111	I68-A71 VanDerWaalsContact CG2-CA 3.45Å; I68-A71 HydrophobicContact CG2-CB 3.64Å; A71-L73 PolarHBondContact O-N 2.78Å; A71-F74 PolarHBondContact O-N 2.9Å; A71-T75 WeakPolarHBondContact O-CB 3.01Å; A71-T75 PolarHBondContact O-N 3.28Å; A71-T75 PolarHBondContact O-OG1 2.63Å; A71-L111 HydrophobicContact CB-CD1 3.87Å
72	S	74.7	Confident	86.8	Confident	105 Å²	105	58.6 Å²	58.6	73%	0.734	34%	0.341	S	S	*	.	H	α-helix	trans	-54.1	-25.1	-178.2	56.5	0	0	0	0	114.7	V70	V70-S72 VanDerWaalsContact C-N 3.29Å; V70-S72 PolarHBondContact O-N 2.85Å
73	L	70.5	Confident	87	Confident	62 Å²	62	55.5 Å²	55.5	33%	0.325	34%	0.336	S	S	.	.	H	α-helix	trans	-80.5	-27	-180	-78.4	-173.4	0	0	0	113.3	V70 A71 I288 N289	V70-L73 HydrophobicContact CB-CD1 4.23Å; V70-L73 HydrophobicContact CG1-CB 4.18Å; V70-L73 HydrophobicContact CG1-CD1 3.63Å; V70-L73 HydrophobicContact CG1-CG 3.66Å; V70-L73 PolarHBondContact O-N 3.3Å; A71-L73 PolarHBondContact O-N 2.78Å; L73-I288 HydrophobicContact CD2-CG2 4.41Å; L73-N289 WeakPolarHBondContact CB-ND2 3.36Å; L73-N289 WeakPolarHBondContact O-CB 3.26Å; L73-N289 PolarHBondContact O-ND2 3.35Å
74	F	82.9	Confident	87.2	Confident	12 Å²	12	55.7 Å²	55.7	5%	0.053	34%	0.338	C	S	.	.	H	α-helix	trans	-122.2	-10.9	-170	-53.6	-74	0	0	0	113.2	I68 V70 A71 L76 L113 S114 A115 I126 L269 N289	I68-F74 HydrophobicContact CD1-CB 3.86Å; I68-F74 HydrophobicContact CD1-CD2 3.19Å; I68-F74 HydrophobicContact CD1-CE2 3.88Å; I68-F74 HydrophobicContact CD1-CG 3.71Å; I68-F74 HydrophobicContact CG1-CD2 4Å; I68-F74 HydrophobicContact CG1-CE2 4.44Å; V70-F74 WeakPolarHBondContact O-CD2 3.37Å; A71-F74 PolarHBondContact O-N 2.9Å; F74-L76 PolarHBondContact O-N 3.02Å; F74-L113 HydrophobicContact CB-CD2 4.38Å; F74-L113 CarbonylContact O-C 3.11Å; F74-L113 WeakPolarHBondContact O-CA 3.4Å; F74-S114 PolarHBondContact O-N 3.02Å; F74-S114 PolarHBondContact O-OG 2.58Å; F74-A115 HydrophobicContact CB-CB 4.04Å; F74-A115 HydrophobicContact CD1-CB 3.56Å; F74-A115 HydrophobicContact CE1-CB 4.16Å; F74-A115 HydrophobicContact CG-CB 3.85Å; F74-I126 HydrophobicContact CE2-CG2 4.07Å; F74-L269 HydrophobicContact CD1-CD1 3.81Å; F74-L269 HydrophobicContact CE1-CD1 3.73Å; F74-N289 HydrophobicContact CD1-CB 4.08Å; F74-N289 HydrophobicContact CE1-CB 4.06Å; F74-N289 VanDerWaalsContact CE1-CG 3.48Å; F74-N289 VanDerWaalsContact CE1-OD1 3.27Å; F74-N289 WeakPolarHBondContact CE1-OD1 3.47Å
75	T	87.9	Confident	87.3	Confident	48 Å²	48	55.2 Å²	55.2	29%	0.294	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	118.1	179.3	-62	0	0	0	0	111.2	A71 L111 L112	A71-T75 WeakPolarHBondContact O-CB 3.01Å; A71-T75 PolarHBondContact O-N 3.28Å; A71-T75 PolarHBondContact O-OG1 2.63Å; T75-L111 HydrophobicContact CG2-CD2 4.37Å; T75-L112 CarbonylContact C-O 3.51Å; T75-L112 WeakPolarHBondContact CA-O 3.21Å
76	L	87.6	Confident	87.2	Confident	69 Å²	69	55.3 Å²	55.3	36%	0.361	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-39.9	168.9	-63.8	171.6	0	0	0	111.1	F74 C98 L112	F74-L76 PolarHBondContact O-N 3.02Å; L76-C98 HydrophobicContact CD1-CB 3.99Å; L76-L112 HydrophobicContact CB-CB 4.36Å; L76-L112 WeakPolarHBondContact CB-O 3.45Å; L76-L112 PolarHBondContact N-O 3.26Å
77	S	91.7	Very high	87.4	Confident	27 Å²	27	52.1 Å²	52.1	19%	0.189	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	148.6	175.8	54.2	0	0	0	0	111.2	R94 L112	S77-R94 PolarHBondContact OG-NH1 2.76Å; S77-L112 PolarHBondContact O-N 2.96Å; S77-L112 WeakPolarHBondContact OG-CD1 3.43Å
78	A	93.4	Very high	87.4	Confident	60 Å²	60	50.1 Å²	50.1	50%	0.496	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	133.7	169.3	0	0	0	0	0	109.4	C110 L111	A78-C110 CarbonylContact C-O 3.44Å; A78-C110 WeakPolarHBondContact CA-O 3.31Å; A78-L111 HydrophobicContact CB-CD2 3.59Å
79	I	93.7	Very high	87.5	Confident	34 Å²	34	50.6 Å²	50.6	17%	0.174	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	124.2	-179.8	-47.4	172.4	0	0	0	107.4	R82 E90 C110 L112	I79-R82 HydrophobicContact CG2-CB 4.17Å; I79-R82 HydrophobicContact CG2-CG 3.38Å; I79-E90 HydrophobicContact CD1-CB 4.11Å; I79-E90 HydrophobicContact CD1-CG 4.12Å; I79-C110 HydrophobicContact CB-CB 4.27Å; I79-C110 PolarHBondContact N-O 3.3Å; I79-C110 PolarHBondContact O-N 2.74Å; I79-L112 HydrophobicContact CD1-CD1 4.14Å; I79-L112 HydrophobicContact CD1-CG 4.23Å
80	V	93.5	Very high	87.7	Confident	104 Å²	104	51 Å²	51	63%	0.63	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	143.4	-176	-177.3	0	0	0	0	110	R82 E109	V80-R82 VanDerWaalsContact C-N 3.32Å; V80-R82 PolarHBondContact O-N 2.83Å; V80-E109 HydrophobicContact CG2-CG 4.23Å
81	G	91.8	Very high	88.3	Confident	52 Å²	52	48.3 Å²	48.3	54%	0.536	29%	0.286	S	S	.	.	S	Bend	trans	77.9	14.5	173.8	0	0	0	0	0	114.5	K108	G81-K108 PolarHBondContact N-O 3.07Å
82	R	89.6	Confident	89	Confident	127 Å²	127	47.6 Å²	47.6	48%	0.479	28%	0.28	S	S	.	.			trans	-98.3	155.3	176.5	-68.9	-65.6	-178.3	-149.5	-3.5	111.4	I79 V80 E86	I79-R82 HydrophobicContact CG2-CB 4.17Å; I79-R82 HydrophobicContact CG2-CG 3.38Å; V80-R82 VanDerWaalsContact C-N 3.32Å; V80-R82 PolarHBondContact O-N 2.83Å; R82-E86 VanDerWaalsContact CA-OE2 3.26Å; R82-E86 WeakPolarHBondContact CA-OE2 3.28Å; R82-E86 HydrophobicContact CB-CB 4.1Å; R82-E86 WeakPolarHBondContact CB-OE2 3.03Å; R82-E86 VanDerWaalsContact CD-CD 3.48Å; R82-E86 WeakPolarHBondContact CD-OE2 3.45Å; R82-E86 IonicContact NH1-OE1 3.42Å
83	S	92.6	Very high	89.5	Confident	41 Å²	41	48.9 Å²	48.9	29%	0.287	27%	0.272	S	S	.	.			trans	-73.5	163.3	171.6	86.9	0	0	0	0	111	E85 E86 C87	S83-E85 WeakPolarHBondContact CB-OE2 3.38Å; S83-E85 PolarHBondContact O-N 3.18Å; S83-E85 PolarHBondContact OG-N 3.38Å; S83-E85 PolarHBondContact OG-OE2 2.83Å; S83-E86 PolarHBondContact N-OE2 2.95Å; S83-E86 PolarHBondContact O-N 3.04Å; S83-E86 PolarHBondContact OG-N 3.02Å; S83-C87 PolarHBondContact O-N 3.43Å; S83-C87 PolarHBondContact O-SG 2.77Å
84	V	93.3	Very high	90.1	Very high	21 Å²	21	50.3 Å²	50.3	13%	0.127	27%	0.273	C	S	.	.	H	α-helix	trans	-55.8	-43.3	176.2	176.1	0	0	0	0	109.6	E86 C87 L88 Y103 Y136	V84-E86 PolarHBondContact O-N 3.35Å; V84-C87 WeakPolarHBondContact O-CB 3.41Å; V84-C87 PolarHBondContact O-N 3.33Å; V84-C87 VanDerWaalsContact O-N 3.11Å; V84-L88 HydrophobicContact CG1-CD1 4.04Å; V84-L88 HydrophobicContact CG1-CG 4.12Å; V84-L88 VanDerWaalsContact O-CG 3.3Å; V84-L88 WeakPolarHBondContact O-CG 3.2Å; V84-L88 PolarHBondContact O-N 2.81Å; V84-Y103 HydrophobicContact CB-CD2 4.48Å; V84-Y103 HydrophobicContact CB-CE2 4.45Å; V84-Y103 HydrophobicContact CG2-CD1 3.65Å; V84-Y103 HydrophobicContact CG2-CD2 3.8Å; V84-Y103 HydrophobicContact CG2-CE1 3.51Å; V84-Y103 HydrophobicContact CG2-CE2 3.7Å; V84-Y103 HydrophobicContact CG2-CG 3.79Å; V84-Y136 HydrophobicContact CG1-CE1 3.86Å; V84-Y136 HydrophobicContact CG1-CE2 3.98Å
85	E	90.7	Very high	89.6	Confident	56 Å²	56	50.8 Å²	50.8	26%	0.262	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-43.7	-175.9	-56.8	70	-135	0	0	112.3	F45 S83 C87 L88 S89	F45-E85 HydrophobicContact CD1-CB 4.3Å; F45-E85 HydrophobicContact CD1-CG 3.16Å; F45-E85 HydrophobicContact CD2-CG 3.9Å; F45-E85 HydrophobicContact CE1-CB 4.48Å; F45-E85 HydrophobicContact CE1-CG 3.09Å; F45-E85 HydrophobicContact CE2-CG 3.83Å; F45-E85 WeakPolarHBondContact CE2-OE1 3.41Å; F45-E85 HydrophobicContact CG-CG 3.58Å; F45-E85 HydrophobicContact CZ-CG 3.44Å; F45-E85 VanDerWaalsContact CZ-CG 3.44Å; F45-E85 WeakPolarHBondContact CZ-OE1 3.01Å; S83-E85 WeakPolarHBondContact CB-OE2 3.38Å; S83-E85 PolarHBondContact O-N 3.18Å; S83-E85 PolarHBondContact OG-N 3.38Å; S83-E85 PolarHBondContact OG-OE2 2.83Å; E85-C87 VanDerWaalsContact C-N 3.28Å; E85-C87 PolarHBondContact O-N 3.47Å; E85-L88 PolarHBondContact O-N 3.18Å; E85-S89 WeakPolarHBondContact O-CB 3.38Å; E85-S89 PolarHBondContact O-N 2.68Å
86	E	91.4	Very high	88.9	Confident	82 Å²	82	55.9 Å²	55.9	38%	0.383	30%	0.3	S	S	.	.	H	α-helix	trans	-61.1	-41.6	175.2	-68.6	177.1	125.5	0	0	110.3	R82 S83 V84 S89 E90	R82-E86 VanDerWaalsContact CA-OE2 3.26Å; R82-E86 WeakPolarHBondContact CA-OE2 3.28Å; R82-E86 HydrophobicContact CB-CB 4.1Å; R82-E86 WeakPolarHBondContact CB-OE2 3.03Å; R82-E86 VanDerWaalsContact CD-CD 3.48Å; R82-E86 WeakPolarHBondContact CD-OE2 3.45Å; R82-E86 IonicContact NH1-OE1 3.42Å; S83-E86 PolarHBondContact N-OE2 2.95Å; S83-E86 PolarHBondContact O-N 3.04Å; S83-E86 PolarHBondContact OG-N 3.02Å; V84-E86 PolarHBondContact O-N 3.35Å; E86-S89 PolarHBondContact O-N 2.93Å; E86-E90 WeakPolarHBondContact O-CG 3.05Å; E86-E90 PolarHBondContact O-N 3.02Å
87	C	93.3	Very high	88.5	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.007	30%	0.302	C	S	.	.	H	α-helix	trans	-68.9	-38.8	179.4	-62.3	0	0	0	0	113.1	S83 V84 E85 E90 C91 V101 C110	S83-C87 PolarHBondContact O-N 3.43Å; S83-C87 PolarHBondContact O-SG 2.77Å; V84-C87 WeakPolarHBondContact O-CB 3.41Å; V84-C87 PolarHBondContact O-N 3.33Å; V84-C87 VanDerWaalsContact O-N 3.11Å; E85-C87 VanDerWaalsContact C-N 3.28Å; E85-C87 PolarHBondContact O-N 3.47Å; C87-E90 PolarHBondContact O-N 3.09Å; C87-C91 PolarHBondContact O-N 3.23Å; C87-V101 HydrophobicContact CB-CG1 4.09Å; C87-C110 HydrophobicContact CB-CB 3.54Å; C87-C110 WeakPolarHBondContact CB-SG 3.42Å; C87-C110 WeakPolarHBondContact SG-CB 2.82Å; C87-C110 CovalentContact SG-SG 2Å; C87-C110 PolarHBondContact SG-SG 3.24Å
88	L	92.3	Very high	88.3	Confident	15 Å²	15	54.5 Å²	54.5	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-65.3	-40.6	173	-63.1	-173	0	0	0	111.3	F60 V84 E85 C91 A92 V101 Y136	F60-L88 HydrophobicContact CB-CD1 4.14Å; F60-L88 HydrophobicContact CB-CD2 4.23Å; F60-L88 HydrophobicContact CD1-CD2 3.72Å; F60-L88 HydrophobicContact CD2-CB 3.85Å; F60-L88 HydrophobicContact CD2-CD1 4.07Å; F60-L88 HydrophobicContact CD2-CD2 4.02Å; F60-L88 HydrophobicContact CD2-CG 4.17Å; F60-L88 HydrophobicContact CE1-CD2 4.03Å; F60-L88 HydrophobicContact CE2-CB 3.79Å; F60-L88 HydrophobicContact CE2-CD2 4.33Å; F60-L88 HydrophobicContact CE2-CG 4.49Å; F60-L88 WeakPolarHBondContact CE2-O 3.45Å; F60-L88 HydrophobicContact CG-CB 4.43Å; F60-L88 HydrophobicContact CG-CD1 4.15Å; F60-L88 HydrophobicContact CG-CD2 3.71Å; F60-L88 HydrophobicContact CG-CG 4.29Å; F60-L88 HydrophobicContact CZ-CB 4.31Å; F60-L88 HydrophobicContact CZ-CD2 4.34Å; F60-L88 WeakPolarHBondContact CZ-O 3.43Å; V84-L88 HydrophobicContact CG1-CD1 4.04Å; V84-L88 HydrophobicContact CG1-CG 4.12Å; V84-L88 VanDerWaalsContact O-CG 3.3Å; V84-L88 WeakPolarHBondContact O-CG 3.2Å; V84-L88 PolarHBondContact O-N 2.81Å; E85-L88 PolarHBondContact O-N 3.18Å; L88-C91 PolarHBondContact O-N 2.89Å; L88-A92 WeakPolarHBondContact O-CB 3.06Å; L88-A92 PolarHBondContact O-N 3.45Å; L88-V101 HydrophobicContact CD2-CB 4.14Å; L88-V101 HydrophobicContact CD2-CG2 4.01Å; L88-Y136 HydrophobicContact CD1-CD1 4.11Å; L88-Y136 HydrophobicContact CD1-CE1 4.47Å; L88-Y136 HydrophobicContact CD2-CD1 3.99Å; L88-Y136 HydrophobicContact CD2-CD2 4.41Å; L88-Y136 HydrophobicContact CD2-CG 3.75Å
89	S	89.6	Confident	87.9	Confident	15 Å²	15	52.7 Å²	52.7	11%	0.105	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-44.4	174.9	-176.5	0	0	0	0	111.9	L49 E85 E86 C91 A92 K93	L49-S89 VanDerWaalsContact CD1-OG 3.28Å; L49-S89 WeakPolarHBondContact CD1-OG 3.16Å; E85-S89 WeakPolarHBondContact O-CB 3.38Å; E85-S89 PolarHBondContact O-N 2.68Å; E86-S89 PolarHBondContact O-N 2.93Å; S89-C91 VanDerWaalsContact C-N 3.33Å; S89-C91 PolarHBondContact O-N 3.48Å; S89-A92 PolarHBondContact O-N 3.04Å; S89-K93 WeakPolarHBondContact O-CG 3.43Å; S89-K93 PolarHBondContact O-N 2.82Å
90	E	90.1	Very high	87.8	Confident	57 Å²	57	51.1 Å²	51.1	27%	0.266	27%	0.266	S	S	.	.	H	α-helix	trans	-64.1	-36.8	176.5	-73.3	-57.3	126.8	0	0	112.7	I79 E86 C87 K93 L112	I79-E90 HydrophobicContact CD1-CB 4.11Å; I79-E90 HydrophobicContact CD1-CG 4.12Å; E86-E90 WeakPolarHBondContact O-CG 3.05Å; E86-E90 PolarHBondContact O-N 3.02Å; C87-E90 PolarHBondContact O-N 3.09Å; E90-K93 IonicContact OE1-NZ 2.79Å; E90-K93 PolarHBondContact OE1-NZ 2Å; E90-L112 HydrophobicContact CB-CD1 4.04Å
91	C	91	Very high	87.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-67.2	-41.4	173	-171.3	0	0	0	0	112.2	F60 C87 L88 S89 K93 R94 A95 C98 V101 L112	F60-C91 HydrophobicContact CE1-CB 4.02Å; F60-C91 HydrophobicContact CZ-CB 3.73Å; C87-C91 PolarHBondContact O-N 3.23Å; L88-C91 PolarHBondContact O-N 2.89Å; S89-C91 VanDerWaalsContact C-N 3.33Å; S89-C91 PolarHBondContact O-N 3.48Å; C91-K93 PolarHBondContact O-N 3.23Å; C91-R94 CarbonylContact O-C 3.43Å; C91-R94 WeakPolarHBondContact O-CA 2.83Å; C91-R94 PolarHBondContact O-N 2.95Å; C91-A95 PolarHBondContact O-N 3.29Å; C91-C98 VanDerWaalsContact CA-SG 3.5Å; C91-C98 HydrophobicContact CB-CB 4.04Å; C91-C98 WeakPolarHBondContact CB-SG 3.38Å; C91-C98 WeakPolarHBondContact SG-CB 3.27Å; C91-C98 CovalentContact SG-SG 2.04Å; C91-C98 PolarHBondContact SG-SG 2.81Å; C91-V101 HydrophobicContact CB-CG2 3.42Å; C91-V101 VanDerWaalsContact CB-CG2 3.42Å; C91-L112 HydrophobicContact CB-CD2 4.1Å
92	A	86.5	Confident	88	Confident	11 Å²	11	44.3 Å²	44.3	9%	0.091	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-41.8	178.9	0	0	0	0	0	112.2	W59 F60 L88 S89 R94 A95	W59-A92 HydrophobicContact CE3-CB 3.8Å; W59-A92 HydrophobicContact CZ3-CB 3.93Å; F60-A92 HydrophobicContact CE2-CB 4.26Å; F60-A92 HydrophobicContact CZ-CB 4.44Å; L88-A92 WeakPolarHBondContact O-CB 3.06Å; L88-A92 PolarHBondContact O-N 3.45Å; S89-A92 PolarHBondContact O-N 3.04Å; A92-R94 PolarHBondContact O-N 3.37Å; A92-A95 WeakPolarHBondContact O-CB 3.49Å; A92-A95 PolarHBondContact O-N 3.29Å; A92-A95 VanDerWaalsContact O-N 3.09Å
93	K	85.2	Confident	88.3	Confident	133 Å²	133	39.3 Å²	39.3	58%	0.578	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.2	172.1	-68.6	172.3	-168	171.4	0	113	S89 E90 C91	S89-K93 WeakPolarHBondContact O-CG 3.43Å; S89-K93 PolarHBondContact O-N 2.82Å; E90-K93 IonicContact OE1-NZ 2.79Å; E90-K93 PolarHBondContact OE1-NZ 2Å; C91-K93 PolarHBondContact O-N 3.23Å
94	R	83.3	Confident	88.5	Confident	91 Å²	91	38.3 Å²	38.3	34%	0.343	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	30	-179.8	-58.7	-178.5	-170.2	177.8	7.9	112.1	S77 C91 A92 H96 T97 C98	S77-R94 PolarHBondContact OG-NH1 2.76Å; C91-R94 CarbonylContact O-C 3.43Å; C91-R94 WeakPolarHBondContact O-CA 2.83Å; C91-R94 PolarHBondContact O-N 2.95Å; A92-R94 PolarHBondContact O-N 3.37Å; R94-H96 PolarHBondContact O-N 2.84Å; R94-T97 PolarHBondContact O-N 3.47Å; R94-T97 PolarHBondContact O-OG1 2.04Å; R94-C98 HydrophobicContact CB-CB 3.96Å; R94-C98 PolarHBondContact O-N 2.79Å
95	A	73.4	Confident	88.5	Confident	22 Å²	22	40.8 Å²	40.8	18%	0.182	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-30.9	-173	0	0	0	0	0	115.1	C91 A92 T97 K99	C91-A95 PolarHBondContact O-N 3.29Å; A92-A95 WeakPolarHBondContact O-CB 3.49Å; A92-A95 PolarHBondContact O-N 3.29Å; A92-A95 VanDerWaalsContact O-N 3.09Å; A95-T97 PolarHBondContact O-N 2.89Å; A95-K99 PolarHBondContact O-NZ 3.24Å
96	H	72.5	Confident	88.6	Confident	155 Å²	155	43.7 Å²	43.7	72%	0.718	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-36.2	176	-56.5	-62.2	0	0	0	113.1	R94 K99	R94-H96 PolarHBondContact O-N 2.84Å; H96-K99 PolarHBondContact O-NZ 3.36Å
97	T	80.4	Confident	88.7	Confident	68 Å²	68	42.4 Å²	42.4	42%	0.417	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-40.7	-176.4	55.3	0	0	0	0	113.2	R94 A95 K99 S114	R94-T97 PolarHBondContact O-N 3.47Å; R94-T97 PolarHBondContact O-OG1 2.04Å; A95-T97 PolarHBondContact O-N 2.89Å; T97-K99 PolarHBondContact O-N 2.79Å; T97-S114 WeakPolarHBondContact O-CA 3.01Å
98	C	87.4	Confident	88.8	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.			trans	-80.8	115	-177.7	-169.9	0	0	0	0	111.6	L76 C91 R94 N138	L76-C98 HydrophobicContact CD1-CB 3.99Å; C91-C98 VanDerWaalsContact CA-SG 3.5Å; C91-C98 HydrophobicContact CB-CB 4.04Å; C91-C98 WeakPolarHBondContact CB-SG 3.38Å; C91-C98 WeakPolarHBondContact SG-CB 3.27Å; C91-C98 CovalentContact SG-SG 2.04Å; C91-C98 PolarHBondContact SG-SG 2.81Å; R94-C98 HydrophobicContact CB-CB 3.96Å; R94-C98 PolarHBondContact O-N 2.79Å; C98-N138 PolarHBondContact O-ND2 3.46Å
99	K	85	Confident	88.9	Confident	22 Å²	22	50.3 Å²	50.3	10%	0.096	25%	0.253	C	S	.	.			trans	-106.6	-23.6	-177.6	-54.2	-56.2	174.7	-166.5	0	112.9	A95 H96 T97 L113 S114 T119 N138 W291	A95-K99 PolarHBondContact O-NZ 3.24Å; H96-K99 PolarHBondContact O-NZ 3.36Å; T97-K99 PolarHBondContact O-N 2.79Å; K99-L113 PolarHBondContact N-O 3.02Å; K99-S114 VanDerWaalsContact CG-O 3.27Å; K99-S114 WeakPolarHBondContact CG-O 3.43Å; K99-T119 HydrophobicContact CB-CG2 4.45Å; K99-T119 HydrophobicContact CG-CG2 4.34Å; K99-N138 WeakPolarHBondContact O-CB 3.42Å; K99-N138 PolarHBondContact O-N 3.25Å; K99-W291 HydrophobicContact CD-CZ2 4.47Å; K99-W291 HydrophobicContact CG-CZ2 3.94Å
100	S	90.6	Very high	89.2	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	167.2	170.3	69.1	0	0	0	0	112.2	L113 A115 Y136	S100-L113 PolarHBondContact N-O 2.83Å; S100-L113 WeakPolarHBondContact O-CB 3.24Å; S100-L113 PolarHBondContact O-N 3.39Å; S100-L113 WeakPolarHBondContact OG-CB 3.48Å; S100-L113 WeakPolarHBondContact OG-CD1 3.27Å; S100-A115 WeakPolarHBondContact CB-O 3.32Å; S100-A115 PolarHBondContact OG-O 3.39Å; S100-Y136 CarbonylContact C-O 3.59Å; S100-Y136 WeakPolarHBondContact CA-O 3.44Å; S100-Y136 WeakPolarHBondContact CB-O 3.35Å
101	V	94.2	Very high	89.4	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.9	172.7	-177.3	0	0	0	0	108.6	F60 C87 L88 C91 C110 L111 L112 L135 Y136	F60-V101 HydrophobicContact CE1-CG2 4.3Å; C87-V101 HydrophobicContact CB-CG1 4.09Å; L88-V101 HydrophobicContact CD2-CB 4.14Å; L88-V101 HydrophobicContact CD2-CG2 4.01Å; C91-V101 HydrophobicContact CB-CG2 3.42Å; C91-V101 VanDerWaalsContact CB-CG2 3.42Å; V101-C110 HydrophobicContact CG1-CB 4.38Å; V101-L111 CarbonylContact C-O 3.45Å; V101-L111 WeakPolarHBondContact CA-O 3.18Å; V101-L112 HydrophobicContact CB-CD2 4.44Å; V101-L112 HydrophobicContact CG1-CD2 4.06Å; V101-L112 HydrophobicContact CG2-CD2 3.72Å; V101-L135 CarbonylContact O-C 3.48Å; V101-L135 WeakPolarHBondContact O-CA 3.42Å; V101-Y136 PolarHBondContact N-O 3.45Å; V101-Y136 PolarHBondContact O-N 2.86Å
102	Q	95.4	Very high	89.5	Confident	12 Å²	12	47.7 Å²	47.7	6%	0.056	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.8	166.7	179.7	-178.9	-60.6	0	0	108.7	Q67 C110 L111 L113 T133 L135	Q67-Q102 HydrophobicContact CB-CG 4.46Å; Q102-C110 CarbonylContact O-C 3.51Å; Q102-C110 VanDerWaalsContact O-CA 3.31Å; Q102-C110 WeakPolarHBondContact O-CA 3.34Å; Q102-L111 HydrophobicContact CB-CB 4.17Å; Q102-L111 PolarHBondContact N-O 3.19Å; Q102-L111 PolarHBondContact O-N 3.39Å; Q102-L113 HydrophobicContact CB-CD1 4.01Å; Q102-T133 HydrophobicContact CG-CG2 3.16Å; Q102-L135 HydrophobicContact CB-CD1 4.38Å
103	Y	96.2	Very high	89.8	Confident	22 Å²	22	47.1 Å²	47.1	9%	0.086	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	118.3	179.6	-173.8	-93.9	0	0	0	110.9	V84 K105 E109 C110 T133 D134	V84-Y103 HydrophobicContact CB-CD2 4.48Å; V84-Y103 HydrophobicContact CB-CE2 4.45Å; V84-Y103 HydrophobicContact CG2-CD1 3.65Å; V84-Y103 HydrophobicContact CG2-CD2 3.8Å; V84-Y103 HydrophobicContact CG2-CE1 3.51Å; V84-Y103 HydrophobicContact CG2-CE2 3.7Å; V84-Y103 HydrophobicContact CG2-CG 3.79Å; Y103-K105 HydrophobicContact CD1-CG 4.33Å; Y103-K105 HydrophobicContact CE1-CG 4.44Å; Y103-E109 WeakPolarHBondContact CA-O 3.34Å; Y103-C110 WeakPolarHBondContact CD2-SG 3.41Å; Y103-C110 VanDerWaalsContact CE2-SG 3.58Å; Y103-T133 WeakPolarHBondContact O-CA 3.26Å; Y103-D134 PolarHBondContact N-O 3.21Å; Y103-D134 PolarHBondContact O-N 2.87Å
104	T	95.8	Very high	89.8	Confident	21 Å²	21	41.3 Å²	41.3	13%	0.129	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	118.1	174.4	-61.3	0	0	0	0	109.5	T106 S107 K108 E109 D132	T104-T106 PolarHBondContact O-N 2.95Å; T104-S107 WeakPolarHBondContact CB-OG 3.39Å; T104-S107 VanDerWaalsContact CG2-OG 3.23Å; T104-S107 WeakPolarHBondContact CG2-OG 3.06Å; T104-K108 WeakPolarHBondContact O-CA 2.92Å; T104-K108 PolarHBondContact O-N 3.18Å; T104-E109 PolarHBondContact N-O 3.11Å; T104-E109 PolarHBondContact O-N 3.15Å; T104-D132 WeakPolarHBondContact CG2-OD2 3.45Å
105	K	93.7	Very high	89.7	Confident	73 Å²	73	37 Å²	37	32%	0.317	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-39.8	-169.4	-61.5	161.3	-171.7	152.6	0	112	Y103 S131 D132 D134	Y103-K105 HydrophobicContact CD1-CG 4.33Å; Y103-K105 HydrophobicContact CE1-CG 4.44Å; K105-S131 PolarHBondContact NZ-O 3.31Å; K105-D132 WeakPolarHBondContact CB-OD1 3.03Å; K105-D132 WeakPolarHBondContact CG-O 3.3Å; K105-D132 PolarHBondContact N-O 2.94Å; K105-D134 WeakPolarHBondContact CE-OD1 3.3Å; K105-D134 WeakPolarHBondContact CE-OD2 3.48Å; K105-D134 IonicContact NZ-OD1 2.85Å; K105-D134 PolarHBondContact NZ-OD1 3.14Å; K105-D134 IonicContact NZ-OD2 3.03Å; K105-D134 PolarHBondContact NZ-OD2 3.14Å
106	T	93.3	Very high	90	Very high	117 Å²	117	36 Å²	36	72%	0.718	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-46	-176.5	-59.2	0	0	0	0	112.1	T104 D132	T104-T106 PolarHBondContact O-N 2.95Å; T106-D132 WeakPolarHBondContact CB-OD2 3.34Å; T106-D132 PolarHBondContact N-OD1 3.24Å; T106-D132 PolarHBondContact N-OD2 2.74Å; T106-D132 VanDerWaalsContact N-OD2 3.14Å; T106-D132 PolarHBondContact OG1-OD1 3.3Å; T106-D132 PolarHBondContact OG1-OD2 3.17Å
107	S	93.8	Very high	90.3	Very high	54 Å²	54	30.3 Å²	30.3	38%	0.378	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-11.8	-178.6	58.3	0	0	0	0	114.1	T104 E109	T104-S107 WeakPolarHBondContact CB-OG 3.39Å; T104-S107 VanDerWaalsContact CG2-OG 3.23Å; T104-S107 WeakPolarHBondContact CG2-OG 3.06Å; S107-E109 PolarHBondContact O-N 3.13Å; S107-E109 WeakPolarHBondContact OG-CB 3.33Å; S107-E109 PolarHBondContact OG-N 3.26Å
108	K	95.1	Very high	89.7	Confident	118 Å²	118	27.6 Å²	27.6	51%	0.513	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	40.7	-167.3	-55.7	-176.2	-180	179.7	0	111.4	G81 T104	G81-K108 PolarHBondContact N-O 3.07Å; T104-K108 WeakPolarHBondContact O-CA 2.92Å; T104-K108 PolarHBondContact O-N 3.18Å
109	E	94.9	Very high	88.8	Confident	65 Å²	65	27.8 Å²	27.8	30%	0.304	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	131.9	177.8	-178	177.3	-164.4	0	0	110	V80 Y103 T104 S107 L111	V80-E109 HydrophobicContact CG2-CG 4.23Å; Y103-E109 WeakPolarHBondContact CA-O 3.34Å; T104-E109 PolarHBondContact N-O 3.11Å; T104-E109 PolarHBondContact O-N 3.15Å; S107-E109 PolarHBondContact O-N 3.13Å; S107-E109 WeakPolarHBondContact OG-CB 3.33Å; S107-E109 PolarHBondContact OG-N 3.26Å; E109-L111 HydrophobicContact CG-CD2 4.21Å
110	C	94.8	Very high	87.9	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	120.1	177	-54.8	0	0	0	0	109.8	A78 I79 C87 V101 Q102 Y103	A78-C110 CarbonylContact C-O 3.44Å; A78-C110 WeakPolarHBondContact CA-O 3.31Å; I79-C110 HydrophobicContact CB-CB 4.27Å; I79-C110 PolarHBondContact N-O 3.3Å; I79-C110 PolarHBondContact O-N 2.74Å; C87-C110 HydrophobicContact CB-CB 3.54Å; C87-C110 WeakPolarHBondContact CB-SG 3.42Å; C87-C110 WeakPolarHBondContact SG-CB 2.82Å; C87-C110 CovalentContact SG-SG 2Å; C87-C110 PolarHBondContact SG-SG 3.24Å; V101-C110 HydrophobicContact CG1-CB 4.38Å; Q102-C110 CarbonylContact O-C 3.51Å; Q102-C110 VanDerWaalsContact O-CA 3.31Å; Q102-C110 WeakPolarHBondContact O-CA 3.34Å; Y103-C110 WeakPolarHBondContact CD2-SG 3.41Å; Y103-C110 VanDerWaalsContact CE2-SG 3.58Å
111	L	95.2	Very high	86.3	Confident	16 Å²	16	29.8 Å²	29.8	8%	0.084	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	116.2	167.4	-49.8	178.4	0	0	0	108.1	A71 T75 A78 V101 Q102 E109 L113	A71-L111 HydrophobicContact CB-CD1 3.87Å; T75-L111 HydrophobicContact CG2-CD2 4.37Å; A78-L111 HydrophobicContact CB-CD2 3.59Å; V101-L111 CarbonylContact C-O 3.45Å; V101-L111 WeakPolarHBondContact CA-O 3.18Å; Q102-L111 HydrophobicContact CB-CB 4.17Å; Q102-L111 PolarHBondContact N-O 3.19Å; Q102-L111 PolarHBondContact O-N 3.39Å; E109-L111 HydrophobicContact CG-CD2 4.21Å; L111-L113 HydrophobicContact CB-CD2 4.03Å
112	L	93.4	Very high	85	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.5	168.9	-55.4	-165.7	0	0	0	107.8	T75 L76 S77 I79 E90 C91 V101	T75-L112 CarbonylContact C-O 3.51Å; T75-L112 WeakPolarHBondContact CA-O 3.21Å; L76-L112 HydrophobicContact CB-CB 4.36Å; L76-L112 WeakPolarHBondContact CB-O 3.45Å; L76-L112 PolarHBondContact N-O 3.26Å; S77-L112 PolarHBondContact O-N 2.96Å; S77-L112 WeakPolarHBondContact OG-CD1 3.43Å; I79-L112 HydrophobicContact CD1-CD1 4.14Å; I79-L112 HydrophobicContact CD1-CG 4.23Å; E90-L112 HydrophobicContact CB-CD1 4.04Å; C91-L112 HydrophobicContact CB-CD2 4.1Å; V101-L112 HydrophobicContact CB-CD2 4.44Å; V101-L112 HydrophobicContact CG1-CD2 4.06Å; V101-L112 HydrophobicContact CG2-CD2 3.72Å
113	L	91.5	Very high	83.6	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.6	-171.5	-57.2	177.3	0	0	0	111.2	I68 F74 K99 S100 Q102 L111 A115 L135	I68-L113 HydrophobicContact CB-CD1 4.26Å; I68-L113 HydrophobicContact CD1-CD1 4.24Å; I68-L113 HydrophobicContact CG2-CD1 4.07Å; I68-L113 HydrophobicContact CG2-CD2 4.2Å; F74-L113 HydrophobicContact CB-CD2 4.38Å; F74-L113 CarbonylContact O-C 3.11Å; F74-L113 WeakPolarHBondContact O-CA 3.4Å; K99-L113 PolarHBondContact N-O 3.02Å; S100-L113 PolarHBondContact N-O 2.83Å; S100-L113 WeakPolarHBondContact O-CB 3.24Å; S100-L113 PolarHBondContact O-N 3.39Å; S100-L113 WeakPolarHBondContact OG-CB 3.48Å; S100-L113 WeakPolarHBondContact OG-CD1 3.27Å; Q102-L113 HydrophobicContact CB-CD1 4.01Å; L111-L113 HydrophobicContact CB-CD2 4.03Å; L113-A115 PolarHBondContact O-N 3.35Å; L113-L135 HydrophobicContact CD1-CD1 3.98Å
114	S	85.5	Confident	82.4	Confident	10 Å²	10	38.9 Å²	38.9	7%	0.07	21%	0.208	C	C	.	.	S	Bend	trans	-77.8	0.9	171.3	67.4	0	0	0	0	113.4	F74 T97 K99 W291	F74-S114 PolarHBondContact O-N 3.02Å; F74-S114 PolarHBondContact O-OG 2.58Å; T97-S114 WeakPolarHBondContact O-CA 3.01Å; K99-S114 VanDerWaalsContact CG-O 3.27Å; K99-S114 WeakPolarHBondContact CG-O 3.43Å; S114-W291 WeakPolarHBondContact O-CZ2 3.47Å; S114-W291 PolarHBondContact O-NE1 3.29Å
115	A	81.9	Confident	81.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.229	C	C	.	.			trans	-127.8	153.7	-175.5	0	0	0	0	0	111.6	F74 S100 L113 T119 V120 L269	F74-A115 HydrophobicContact CB-CB 4.04Å; F74-A115 HydrophobicContact CD1-CB 3.56Å; F74-A115 HydrophobicContact CE1-CB 4.16Å; F74-A115 HydrophobicContact CG-CB 3.85Å; S100-A115 WeakPolarHBondContact CB-O 3.32Å; S100-A115 PolarHBondContact OG-O 3.39Å; L113-A115 PolarHBondContact O-N 3.35Å; A115-T119 VanDerWaalsContact CA-OG1 3.3Å; A115-T119 WeakPolarHBondContact CA-OG1 3.34Å; A115-V120 HydrophobicContact CB-CG1 3.9Å; A115-L269 HydrophobicContact CB-CD1 3.38Å
116	S	80.1	Confident	80.5	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.021	22%	0.221	C	C	.	.			trans	-136.1	175.9	163.1	78.9	0	0	0	0	109.1	A118 T119 V120 F127	S116-A118 PolarHBondContact O-N 3.33Å; S116-A118 PolarHBondContact OG-N 2.9Å; S116-T119 PolarHBondContact N-OG1 2.83Å; S116-T119 PolarHBondContact O-N 3.44Å; S116-T119 PolarHBondContact O-OG1 3.11Å; S116-T119 WeakPolarHBondContact OG-CG2 3.5Å; S116-V120 PolarHBondContact O-N 3.18Å; S116-F127 VanDerWaalsContact C-CE2 3.48Å; S116-F127 VanDerWaalsContact C-CZ 3.44Å; S116-F127 WeakPolarHBondContact O-CE2 3.37Å
117	R	78.1	Confident	80	Confident	35 Å²	35	33 Å²	33	13%	0.132	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-30.5	176.8	-66.1	176.6	-57.3	160.3	3.2	112.2	E61 T119 P123 F127 E137	E61-R117 IonicContact OE2-NH2 3.92Å; R117-T119 VanDerWaalsContact C-N 3.31Å; R117-P123 HydrophobicContact CB-CB 4.08Å; R117-P123 HydrophobicContact CG-CB 4.32Å; R117-F127 HydrophobicContact CB-CD2 4.42Å; R117-F127 HydrophobicContact CB-CE2 4.44Å; R117-F127 HydrophobicContact CG-CB 4.39Å; R117-F127 HydrophobicContact CG-CD2 3.71Å; R117-F127 HydrophobicContact CG-CE2 4.05Å; R117-F127 HydrophobicContact CG-CG 3.96Å; R117-E137 WeakPolarHBondContact CB-OE1 3.46Å; R117-E137 WeakPolarHBondContact CG-OE1 3.32Å; R117-E137 IonicContact CZ-OE2 3.45Å; R117-E137 PolarHBondContact N-OE1 3.01Å; R117-E137 IonicContact NE-OE1 3.17Å; R117-E137 PolarHBondContact NE-OE1 3.34Å; R117-E137 VanDerWaalsContact NE-OE1 3.08Å; R117-E137 IonicContact NE-OE2 3.84Å; R117-E137 PolarHBondContact NE-OE2 3.04Å; R117-E137 IonicContact NH2-OE2 3.83Å; R117-E137 PolarHBondContact NH2-OE2 2.81Å
118	A	67.9	Low	79.8	Confident	11 Å²	11	33.6 Å²	33.6	9%	0.091	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-17.2	179.4	0	0	0	0	0	113.6	S116 W143 W236	S116-A118 PolarHBondContact O-N 3.33Å; S116-A118 PolarHBondContact OG-N 2.9Å; A118-W143 HydrophobicContact CB-CZ2 3.87Å; A118-W236 HydrophobicContact CB-CH2 4.13Å; A118-W236 HydrophobicContact CB-CZ2 3.71Å
119	T	68.2	Low	79.5	Confident	4 Å²	4	30.6 Å²	30.6	3%	0.025	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-20.2	-171.8	69.4	0	0	0	0	113.9	K99 A115 S116 R117 W291	K99-T119 HydrophobicContact CB-CG2 4.45Å; K99-T119 HydrophobicContact CG-CG2 4.34Å; A115-T119 VanDerWaalsContact CA-OG1 3.3Å; A115-T119 WeakPolarHBondContact CA-OG1 3.34Å; S116-T119 PolarHBondContact N-OG1 2.83Å; S116-T119 PolarHBondContact O-N 3.44Å; S116-T119 PolarHBondContact O-OG1 3.11Å; S116-T119 WeakPolarHBondContact OG-CG2 3.5Å; R117-T119 VanDerWaalsContact C-N 3.31Å; T119-W291 VanDerWaalsContact CB-CZ2 3.44Å; T119-W291 HydrophobicContact CG2-CH2 3.3Å; T119-W291 HydrophobicContact CG2-CZ2 3.54Å
120	V	67	Low	79.4	Confident	4 Å²	4	28.3 Å²	28.3	2%	0.024	18%	0.181	C	C	.	.	S	Bend	trans	-91.3	151.3	-179.8	-59.9	0	0	0	0	110.8	A115 S116 P123 I126 F127 L269	A115-V120 HydrophobicContact CB-CG1 3.9Å; S116-V120 PolarHBondContact O-N 3.18Å; V120-P123 HydrophobicContact CG2-CB 3.88Å; V120-I126 HydrophobicContact CB-CD1 3.66Å; V120-I126 HydrophobicContact CG1-CD1 3.96Å; V120-I126 HydrophobicContact CG1-CG2 4.39Å; V120-I126 HydrophobicContact CG2-CD1 4.02Å; V120-F127 HydrophobicContact CG1-CE2 4.09Å; V120-F127 HydrophobicContact CG2-CD2 4.13Å; V120-F127 HydrophobicContact CG2-CE2 3.64Å; V120-L269 HydrophobicContact CG1-CD1 4.23Å
121	S	57.4	Low	79.2	Confident	59 Å²	59	33.4 Å²	33.4	41%	0.413	22%	0.216	S	C	.	.	S	Bend	trans	-64.6	-50.3	177.8	53.1	0	0	0	0	111.4	P123 V241	S121-P123 WeakPolarHBondContact O-CD 3.37Å; S121-V241 WeakPolarHBondContact O-CG2 3.21Å
122	Q	65.1	Low	79.2	Confident	103 Å²	103	35 Å²	35	48%	0.481	23%	0.225	S	C	.	.			trans	-120.8	82.9	-173.3	-66.3	177.4	-1.2	0	0	111	N124 G125 I126 V241	Q122-N124 VanDerWaalsContact C-N 3.28Å; Q122-N124 PolarHBondContact O-N 3.45Å; Q122-G125 PolarHBondContact O-N 3.35Å; Q122-I126 PolarHBondContact O-N 3.3Å; Q122-V241 HydrophobicContact CG-CG1 4.28Å; Q122-V241 HydrophobicContact CG-CG2 3.77Å
123	P	67.5	Low	79.2	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.032	23%	0.226	C	C	.	.	H	α-helix	trans	-62.7	-32.8	-174.4	23.4	-33	0	0	0	113.1	R117 V120 S121 G125 I126 F127 H237	R117-P123 HydrophobicContact CB-CB 4.08Å; R117-P123 HydrophobicContact CG-CB 4.32Å; V120-P123 HydrophobicContact CG2-CB 3.88Å; S121-P123 WeakPolarHBondContact O-CD 3.37Å; P123-G125 VanDerWaalsContact C-N 3.32Å; P123-G125 PolarHBondContact O-N 3.38Å; P123-I126 PolarHBondContact O-N 2.89Å; P123-F127 HydrophobicContact CB-CD2 4.18Å; P123-F127 WeakPolarHBondContact O-CB 2.84Å; P123-F127 PolarHBondContact O-N 2Å; P123-H237 WeakPolarHBondContact CD-O 3.07Å; P123-H237 WeakPolarHBondContact CG-O 3.3Å
124	N	70.4	Confident	79.3	Confident	119 Å²	119	35.4 Å²	35.4	64%	0.636	23%	0.227	S	C	*	.	H	α-helix	trans	-68.1	-27	-176.3	-66.6	-19.4	0	0	0	114.1	Q122	Q122-N124 VanDerWaalsContact C-N 3.28Å; Q122-N124 PolarHBondContact O-N 3.45Å
125	G	70.7	Confident	79.6	Confident	56 Å²	56	35 Å²	35	58%	0.577	22%	0.224	S	C	*	.	H	α-helix	trans	-88.7	-21.7	175.6	0	0	0	0	0	113.5	Q122 P123	Q122-G125 PolarHBondContact O-N 3.35Å; P123-G125 VanDerWaalsContact C-N 3.32Å; P123-G125 PolarHBondContact O-N 3.38Å
126	I	78.3	Confident	80.1	Confident	26 Å²	26	36.1 Å²	36.1	13%	0.133	23%	0.229	C	C	.	.	H	α-helix	trans	-95.1	-38.7	-177.1	-66.8	166.5	0	0	0	111	I68 A69 F74 V120 Q122 P123	I68-I126 CarbonylContact C-O 3.58Å; I68-I126 WeakPolarHBondContact CA-O 3.38Å; I68-I126 HydrophobicContact CD1-CG2 3.81Å; I68-I126 HydrophobicContact CG1-CG2 3.61Å; A69-I126 PolarHBondContact N-O 2.94Å; F74-I126 HydrophobicContact CE2-CG2 4.07Å; V120-I126 HydrophobicContact CB-CD1 3.66Å; V120-I126 HydrophobicContact CG1-CD1 3.96Å; V120-I126 HydrophobicContact CG1-CG2 4.39Å; V120-I126 HydrophobicContact CG2-CD1 4.02Å; Q122-I126 PolarHBondContact O-N 3.3Å; P123-I126 PolarHBondContact O-N 2.89Å
127	F	84.3	Confident	80.4	Confident	6 Å²	6	36.7 Å²	36.7	3%	0.026	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	98.1	-178.6	-64.4	-81	0	0	0	111.1	Q67 I68 S116 R117 V120 P123 L135	Q67-F127 CarbonylContact O-C 3.54Å; Q67-F127 VanDerWaalsContact O-CA 3.29Å; Q67-F127 WeakPolarHBondContact O-CA 3.3Å; I68-F127 HydrophobicContact CB-CD1 4.42Å; I68-F127 HydrophobicContact CB-CE1 4.32Å; I68-F127 HydrophobicContact CD1-CE1 4.03Å; I68-F127 HydrophobicContact CD1-CZ 4.13Å; I68-F127 HydrophobicContact CG1-CE1 4.3Å; S116-F127 VanDerWaalsContact C-CE2 3.48Å; S116-F127 VanDerWaalsContact C-CZ 3.44Å; S116-F127 WeakPolarHBondContact O-CE2 3.37Å; R117-F127 HydrophobicContact CB-CD2 4.42Å; R117-F127 HydrophobicContact CB-CE2 4.44Å; R117-F127 HydrophobicContact CG-CB 4.39Å; R117-F127 HydrophobicContact CG-CD2 3.71Å; R117-F127 HydrophobicContact CG-CE2 4.05Å; R117-F127 HydrophobicContact CG-CG 3.96Å; V120-F127 HydrophobicContact CG1-CE2 4.09Å; V120-F127 HydrophobicContact CG2-CD2 4.13Å; V120-F127 HydrophobicContact CG2-CE2 3.64Å; P123-F127 HydrophobicContact CB-CD2 4.18Å; P123-F127 WeakPolarHBondContact O-CB 2.84Å; P123-F127 PolarHBondContact O-N 2Å; F127-L135 HydrophobicContact CD1-CD2 3.54Å; F127-L135 HydrophobicContact CE1-CD1 4.14Å; F127-L135 HydrophobicContact CE1-CD2 3.58Å; F127-L135 HydrophobicContact CG-CD2 4.44Å
128	I	88	Confident	80.6	Confident	65 Å²	65	35.1 Å²	35.1	33%	0.333	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	161.4	-174.8	61.5	172.3	0	0	0	111.6	K66 Q67 A69	K66-I128 WeakPolarHBondContact CA-O 3.47Å; K66-I128 WeakPolarHBondContact CD-O 3.49Å; Q67-I128 HydrophobicContact CG-CD1 4.25Å; Q67-I128 HydrophobicContact CG-CG1 3.7Å; Q67-I128 PolarHBondContact N-O 2.96Å; Q67-I128 PolarHBondContact O-N 3.01Å; A69-I128 HydrophobicContact CB-CD1 3.91Å; A69-I128 HydrophobicContact CB-CG1 4.14Å; A69-I128 HydrophobicContact CB-CG2 4.06Å
129	G	89.2	Confident	80.9	Confident	56 Å²	56	36 Å²	36	58%	0.577	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	137.6	173.7	0	0	0	0	0	111.7	N65	N65-G129 WeakPolarHBondContact O-CA 3.13Å
130	A	92	Very high	80.9	Confident	17 Å²	17	36.7 Å²	36.7	14%	0.14	24%	0.24	C	C	.	.			trans	-153.4	115.7	174.5	0	0	0	0	0	110.5	N65 Q67 D132 T133	N65-A130 CarbonylContact C-O 3.5Å; N65-A130 WeakPolarHBondContact CA-O 3.27Å; N65-A130 PolarHBondContact O-N 2.85Å; Q67-A130 HydrophobicContact CB-CB 3.86Å; Q67-A130 HydrophobicContact CG-CB 3.5Å; A130-D132 VanDerWaalsContact C-N 3.3Å; A130-D132 PolarHBondContact O-N 3.24Å; A130-T133 PolarHBondContact O-N 3.32Å
131	S	91.7	Very high	80.5	Confident	106 Å²	106	36.9 Å²	36.9	74%	0.741	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-30.7	-172.1	46.7	0	0	0	0	114.7	N65 K105	N65-S131 PolarHBondContact OD1-O 2.71Å; N65-S131 VanDerWaalsContact OD1-O 3.13Å; K105-S131 PolarHBondContact NZ-O 3.31Å
132	D	94.2	Very high	80.3	Confident	51 Å²	51	41.1 Å²	41.1	27%	0.273	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-0	-177.1	-166.1	46.4	0	0	0	114	T104 K105 T106 A130	T104-D132 WeakPolarHBondContact CG2-OD2 3.45Å; K105-D132 WeakPolarHBondContact CB-OD1 3.03Å; K105-D132 WeakPolarHBondContact CG-O 3.3Å; K105-D132 PolarHBondContact N-O 2.94Å; T106-D132 WeakPolarHBondContact CB-OD2 3.34Å; T106-D132 PolarHBondContact N-OD1 3.24Å; T106-D132 PolarHBondContact N-OD2 2.74Å; T106-D132 VanDerWaalsContact N-OD2 3.14Å; T106-D132 PolarHBondContact OG1-OD1 3.3Å; T106-D132 PolarHBondContact OG1-OD2 3.17Å; A130-D132 VanDerWaalsContact C-N 3.3Å; A130-D132 PolarHBondContact O-N 3.24Å
133	T	93.9	Very high	79.6	Confident	4 Å²	4	40 Å²	40	3%	0.025	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.5	-169.3	-52.1	0	0	0	0	110.9	N65 K66 Q67 Q102 Y103 A130	N65-T133 CarbonylContact C-O 3.58Å; N65-T133 VanDerWaalsContact C-O 3.31Å; N65-T133 WeakPolarHBondContact CA-O 3.42Å; N65-T133 PolarHBondContact N-O 3.41Å; N65-T133 VanDerWaalsContact N-O 3.08Å; K66-T133 PolarHBondContact N-O 3.44Å; K66-T133 CarbonylContact O-C 3.46Å; K66-T133 WeakPolarHBondContact O-CG2 3.3Å; Q67-T133 HydrophobicContact CB-CG2 3.78Å; Q102-T133 HydrophobicContact CG-CG2 3.16Å; Y103-T133 WeakPolarHBondContact O-CA 3.26Å; A130-T133 PolarHBondContact O-N 3.32Å
134	D	93.9	Very high	78.7	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	141.5	170.5	-64.1	-24.7	0	0	0	110.1	R62 P64 N65 Y103 K105 Y136	R62-D134 HydrophobicContact CG-CB 4.41Å; R62-D134 IonicContact CZ-OD2 3.71Å; R62-D134 IonicContact NE-OD2 2.85Å; R62-D134 PolarHBondContact NE-OD2 3.17Å; R62-D134 IonicContact NH2-OD1 2.91Å; R62-D134 IonicContact NH2-OD2 3.84Å; R62-D134 PolarHBondContact NH2-OD2 2.69Å; P64-D134 VanDerWaalsContact CA-OD1 3.32Å; P64-D134 WeakPolarHBondContact CA-OD1 3.46Å; N65-D134 PolarHBondContact N-OD1 2.9Å; Y103-D134 PolarHBondContact N-O 3.21Å; Y103-D134 PolarHBondContact O-N 2.87Å; K105-D134 WeakPolarHBondContact CE-OD1 3.3Å; K105-D134 WeakPolarHBondContact CE-OD2 3.48Å; K105-D134 IonicContact NZ-OD1 2.85Å; K105-D134 PolarHBondContact NZ-OD1 3.14Å; K105-D134 IonicContact NZ-OD2 3.03Å; K105-D134 PolarHBondContact NZ-OD2 3.14Å; D134-Y136 HydrophobicContact CB-CE2 3.78Å
135	L	92.4	Very high	77.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	136.7	173.7	-173.8	72.6	0	0	0	109.2	R62 I63 K66 V101 Q102 L113 F127 E137	R62-L135 CarbonylContact C-O 3.55Å; I63-L135 HydrophobicContact CB-CB 4.3Å; I63-L135 HydrophobicContact CD1-CB 4.39Å; I63-L135 HydrophobicContact CD1-CD2 3.83Å; I63-L135 HydrophobicContact CD1-CG 4.29Å; I63-L135 PolarHBondContact N-O 2.82Å; I63-L135 PolarHBondContact O-N 3.36Å; K66-L135 HydrophobicContact CB-CB 4.06Å; V101-L135 CarbonylContact O-C 3.48Å; V101-L135 WeakPolarHBondContact O-CA 3.42Å; Q102-L135 HydrophobicContact CB-CD1 4.38Å; L113-L135 HydrophobicContact CD1-CD1 3.98Å; F127-L135 HydrophobicContact CD1-CD2 3.54Å; F127-L135 HydrophobicContact CE1-CD1 4.14Å; F127-L135 HydrophobicContact CE1-CD2 3.58Å; F127-L135 HydrophobicContact CG-CD2 4.44Å; L135-E137 HydrophobicContact CD2-CG 4.27Å; L135-E137 HydrophobicContact CG-CG 4.46Å
136	Y	91.9	Very high	76.5	Confident	25 Å²	25	39.3 Å²	39.3	10%	0.098	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	110.1	177.1	-64.7	-98.7	0	0	0	108.9	E61 R62 V84 L88 S100 V101 D134	E61-Y136 CarbonylContact O-C 3.55Å; E61-Y136 VanDerWaalsContact O-CA 3.27Å; E61-Y136 WeakPolarHBondContact O-CA 3.43Å; R62-Y136 HydrophobicContact CB-CD1 3.86Å; R62-Y136 HydrophobicContact CB-CE1 3.66Å; R62-Y136 HydrophobicContact CG-CD1 4.21Å; R62-Y136 HydrophobicContact CG-CE1 3.69Å; V84-Y136 HydrophobicContact CG1-CE1 3.86Å; V84-Y136 HydrophobicContact CG1-CE2 3.98Å; L88-Y136 HydrophobicContact CD1-CD1 4.11Å; L88-Y136 HydrophobicContact CD1-CE1 4.47Å; L88-Y136 HydrophobicContact CD2-CD1 3.99Å; L88-Y136 HydrophobicContact CD2-CD2 4.41Å; L88-Y136 HydrophobicContact CD2-CG 3.75Å; S100-Y136 CarbonylContact C-O 3.59Å; S100-Y136 WeakPolarHBondContact CA-O 3.44Å; S100-Y136 WeakPolarHBondContact CB-O 3.35Å; V101-Y136 PolarHBondContact N-O 3.45Å; V101-Y136 PolarHBondContact O-N 2.86Å; D134-Y136 HydrophobicContact CB-CE2 3.78Å
137	E	86.7	Confident	74.8	Confident	14 Å²	14	40.8 Å²	40.8	7%	0.065	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	129.5	-178.1	-66.9	-172.4	147.9	0	0	111	F60 E61 I63 R117 L135 G139	F60-E137 CarbonylContact C-O 3.56Å; F60-E137 VanDerWaalsContact CA-O 3.25Å; F60-E137 WeakPolarHBondContact CA-O 3.45Å; E61-E137 PolarHBondContact N-O 3Å; E61-E137 PolarHBondContact O-N 2.82Å; I63-E137 HydrophobicContact CD1-CG 3.59Å; I63-E137 WeakPolarHBondContact CD1-OE2 3.5Å; R117-E137 WeakPolarHBondContact CB-OE1 3.46Å; R117-E137 WeakPolarHBondContact CG-OE1 3.32Å; R117-E137 IonicContact CZ-OE2 3.45Å; R117-E137 PolarHBondContact N-OE1 3.01Å; R117-E137 IonicContact NE-OE1 3.17Å; R117-E137 PolarHBondContact NE-OE1 3.34Å; R117-E137 VanDerWaalsContact NE-OE1 3.08Å; R117-E137 IonicContact NE-OE2 3.84Å; R117-E137 PolarHBondContact NE-OE2 3.04Å; R117-E137 IonicContact NH2-OE2 3.83Å; R117-E137 PolarHBondContact NH2-OE2 2.81Å; L135-E137 HydrophobicContact CD2-CG 4.27Å; L135-E137 HydrophobicContact CG-CG 4.46Å; E137-G139 PolarHBondContact O-N 2.78Å
138	N	82.4	Confident	72.8	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.011	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	104.7	179.9	-170.9	-1	0	0	0	109.8	W59 F60 C98 K99 C140	W59-N138 CarbonylContact O-C 3.58Å; W59-N138 WeakPolarHBondContact O-CA 3.2Å; W59-N138 PolarHBondContact O-OD1 2.86Å; F60-N138 HydrophobicContact CD1-CB 4.18Å; F60-N138 HydrophobicContact CE1-CB 3.65Å; F60-N138 HydrophobicContact CZ-CB 4.29Å; C98-N138 PolarHBondContact O-ND2 3.46Å; K99-N138 WeakPolarHBondContact O-CB 3.42Å; K99-N138 PolarHBondContact O-N 3.25Å; N138-C140 PolarHBondContact O-N 3.24Å; N138-C140 WeakPolarHBondContact OD1-CB 3.49Å; N138-C140 PolarHBondContact OD1-N 2.86Å
139	G	73.7	Confident	70.9	Confident	30 Å²	30	48.4 Å²	48.4	31%	0.309	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-7.6	175.7	0	0	0	0	0	113.7	W59 E137	W59-G139 PolarHBondContact O-N 2.87Å; E137-G139 PolarHBondContact O-N 2.78Å
140	C	67.4	Low	69	Low	19 Å²	19	48.3 Å²	48.3	13%	0.128	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-10.2	-170.6	-110.6	0	0	0	0	114.8	C54 N138 Q142	C54-C140 HydrophobicContact CB-CB 4.22Å; C54-C140 WeakPolarHBondContact CB-SG 3.35Å; C54-C140 VanDerWaalsContact SG-CA 3.53Å; C54-C140 WeakPolarHBondContact SG-CB 3.14Å; C54-C140 CovalentContact SG-SG 2Å; C54-C140 PolarHBondContact SG-SG 2.9Å; N138-C140 PolarHBondContact O-N 3.24Å; N138-C140 WeakPolarHBondContact OD1-CB 3.49Å; N138-C140 PolarHBondContact OD1-N 2.86Å; C140-Q142 PolarHBondContact O-N 3.17Å
141	S	59.6	Low	67.2	Low	8 Å²	8	56.8 Å²	56.8	6%	0.056	32%	0.321	C	S	.	.	S	Bend	trans	-66	124.2	173	50.5	0	0	0	0	109.1	W143	S141-W143 WeakPolarHBondContact O-CZ3 2.98Å; S141-W143 PolarHBondContact O-N 2.82Å; S141-W143 VanDerWaalsContact OG-CH2 3.3Å; S141-W143 WeakPolarHBondContact OG-CH2 2.83Å; S141-W143 WeakPolarHBondContact OG-CZ3 3.25Å
142	Q	52.1	Low	65.8	Low	147 Å²	147	52.5 Å²	52.5	69%	0.687	29%	0.291	S	S	*	.			trans	-52.9	103.9	175.9	-67.4	176	2.4	0	0	109.1	E53 C140	E53-Q142 PolarHBondContact OE2-NE2 3.17Å; E53-Q142 VanDerWaalsContact OE2-NE2 3.14Å; C140-Q142 PolarHBondContact O-N 3.17Å
143	W	51.9	Low	64.5	Low	79 Å²	79	52.9 Å²	52.9	30%	0.299	30%	0.297	S	S	.	.			trans	-68.6	129.3	167.5	-102.4	-101.3	0	0	0	106.3	A118 S141 A145 L190	A118-W143 HydrophobicContact CB-CZ2 3.87Å; S141-W143 WeakPolarHBondContact O-CZ3 2.98Å; S141-W143 PolarHBondContact O-N 2.82Å; S141-W143 VanDerWaalsContact OG-CH2 3.3Å; S141-W143 WeakPolarHBondContact OG-CH2 2.83Å; S141-W143 WeakPolarHBondContact OG-CZ3 3.25Å; W143-A145 PolarHBondContact O-N 2.82Å; W143-L190 HydrophobicContact CB-CD1 4.27Å; W143-L190 HydrophobicContact CD2-CB 4.35Å; W143-L190 HydrophobicContact CD2-CD2 3.9Å; W143-L190 HydrophobicContact CG-CB 4.31Å; W143-L190 HydrophobicContact CG-CD1 3.89Å; W143-L190 HydrophobicContact CG-CD2 4.05Å; W143-L190 HydrophobicContact CG-CG 4.3Å; W143-L190 HydrophobicContact CZ2-CD2 4.22Å
144	P	47.9	Very low	63.6	Low	61 Å²	61	53.5 Å²	53.5	40%	0.396	30%	0.3	S	S	.	.			trans	-56.5	133.4	174.4	24.8	-33.1	0	0	0	107.6	I146 L267	P144-I146 VanDerWaalsContact O-CG1 3.32Å; P144-I146 WeakPolarHBondContact O-CG1 3.34Å; P144-I146 PolarHBondContact O-N 3.34Å; P144-L267 HydrophobicContact CB-CD1 4.33Å; P144-L267 HydrophobicContact CB-CD2 4.34Å; P144-L267 HydrophobicContact CG-CD1 3.44Å; P144-L267 VanDerWaalsContact CG-CD1 3.44Å; P144-L267 HydrophobicContact CG-CD2 3.61Å; P144-L267 HydrophobicContact CG-CG 4.14Å
145	A	45.8	Very low	62.8	Low	74 Å²	74	61.9 Å²	61.9	61%	0.612	33%	0.331	S	S	*	.			trans	-49	102	-179.5	0	0	0	0	0	110	W143 A147	W143-A145 PolarHBondContact O-N 2.82Å; A145-A147 PolarHBondContact O-N 3.04Å
146	I	49.5	Very low	62.1	Low	32 Å²	32	66.3 Å²	66.3	16%	0.164	36%	0.358	C	S	.	.	H	α-helix	trans	-64.3	-30.8	-172.5	-62.5	-175.8	0	0	0	109.6	P144 S148 K149 M150 C152 L184 L190	P144-I146 VanDerWaalsContact O-CG1 3.32Å; P144-I146 WeakPolarHBondContact O-CG1 3.34Å; P144-I146 PolarHBondContact O-N 3.34Å; I146-S148 PolarHBondContact O-N 3.38Å; I146-K149 PolarHBondContact O-N 2.58Å; I146-M150 HydrophobicContact CG2-CB 3.76Å; I146-M150 HydrophobicContact CG2-CG 4.41Å; I146-M150 HydrophobicContact CG2-SD 4.13Å; I146-M150 PolarHBondContact O-N 2.76Å; I146-C152 HydrophobicContact CG2-CB 4.46Å; I146-C152 WeakPolarHBondContact CG2-SG 3.18Å; I146-L184 HydrophobicContact CG2-CD2 4.46Å; I146-L190 HydrophobicContact CD1-CD1 3.28Å; I146-L190 HydrophobicContact CG1-CD1 4.45Å
147	A	41.4	Very low	61.5	Low	57 Å²	57	66.6 Å²	66.6	47%	0.471	37%	0.369	S	S	.	.	H	α-helix	trans	-52	-29.7	-175.5	0	0	0	0	0	115.7	A145 L184	A145-A147 PolarHBondContact O-N 3.04Å; A147-L184 WeakPolarHBondContact CB-O 3.29Å
148	S	42.9	Very low	61	Low	99 Å²	99	74.6 Å²	74.6	69%	0.692	40%	0.4	S	S	*	.	H	α-helix	trans	-104.6	-16.2	-174.9	59.7	0	0	0	0	114.9	I146	I146-S148 PolarHBondContact O-N 3.38Å
149	K	48.5	Very low	60.4	Low	132 Å²	132	75.2 Å²	75.2	57%	0.574	41%	0.406	S	S	*	.	H	α-helix	trans	-127.1	-7.9	-167.3	-66.4	-175.7	-178.8	-178.7	0	115.3	I146 I248	I146-K149 PolarHBondContact O-N 2.58Å; K149-I248 HydrophobicContact CB-CD1 4.11Å
150	M	49.5	Very low	59.8	Low	53 Å²	53	79.7 Å²	79.7	26%	0.261	42%	0.422	S	S	.	.			trans	-127.5	121.8	-174.9	-155.3	166.1	154.2	0	0	110.3	I146 C152 C244	I146-M150 HydrophobicContact CG2-CB 3.76Å; I146-M150 HydrophobicContact CG2-CG 4.41Å; I146-M150 HydrophobicContact CG2-SD 4.13Å; I146-M150 PolarHBondContact O-N 2.76Å; M150-C152 WeakPolarHBondContact CG-SG 3.23Å; M150-C152 PolarHBondContact O-N 2.97Å; M150-C244 HydrophobicContact CE-CB 3.61Å; M150-C244 WeakPolarHBondContact CE-SG 3.41Å
151	K	54.4	Low	59.8	Low	195 Å²	195	80.4 Å²	80.4	85%	0.848	43%	0.426	S	S	*	.			trans	-73.4	72.6	168.3	-74.6	-173.9	179	-179.6	0	109.3
152	C	61	Low	60.2	Low	17 Å²	17	80.8 Å²	80.8	12%	0.115	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-77	121.4	173.7	-73.4	0	0	0	0	110	I146 M150 L184 L233	I146-C152 HydrophobicContact CG2-CB 4.46Å; I146-C152 WeakPolarHBondContact CG2-SG 3.18Å; M150-C152 WeakPolarHBondContact CG-SG 3.23Å; M150-C152 PolarHBondContact O-N 2.97Å; C152-L184 HydrophobicContact CB-CD2 4.05Å; C152-L233 HydrophobicContact CB-CD2 3.69Å
153	S	68.1	Low	61	Low	59 Å²	59	74.2 Å²	74.2	41%	0.413	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-95.8	134.1	167.6	53.4	0	0	0	0	110.2	E234	S153-E234 PolarHBondContact O-N 3.19Å; S153-E234 PolarHBondContact OG-OE2 3.05Å
154	F	75.3	Confident	61.7	Low	17 Å²	17	72.1 Å²	72.1	8%	0.075	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135	166.5	-72.5	-100.4	0	0	0	108.9	T156 Q180 C183 L184 Y194 R232 L233	F154-T156 PolarHBondContact O-N 3.24Å; F154-Q180 HydrophobicContact CD2-CG 3.51Å; F154-Q180 HydrophobicContact CE2-CG 3.66Å; F154-Q180 HydrophobicContact CG-CG 4.23Å; F154-Q180 HydrophobicContact CZ-CG 4.49Å; F154-C183 HydrophobicContact CZ-CB 4.2Å; F154-L184 HydrophobicContact CE2-CD1 4.16Å; F154-L184 HydrophobicContact CE2-CD2 3.63Å; F154-L184 HydrophobicContact CE2-CG 3.74Å; F154-L184 HydrophobicContact CZ-CD2 4.11Å; F154-L184 HydrophobicContact CZ-CG 4.29Å; F154-Y194 HydrophobicContact CB-CE1 4.15Å; F154-Y194 AromaticContact CD1-CD1 3.76Å; F154-Y194 HydrophobicContact CD1-CD1 3.76Å; F154-Y194 AromaticContact CD1-CE1 3.57Å; F154-Y194 HydrophobicContact CD1-CE1 3.57Å; F154-Y194 HydrophobicContact CD2-CE1 4.29Å; F154-Y194 AromaticContact CE1-CD1 3.72Å; F154-Y194 HydrophobicContact CE1-CD1 3.72Å; F154-Y194 AromaticContact CE1-CE1 3.96Å; F154-Y194 HydrophobicContact CE1-CE1 3.96Å; F154-Y194 HydrophobicContact CG-CD1 4.36Å; F154-Y194 AromaticContact CG-CE1 3.74Å; F154-Y194 HydrophobicContact CG-CE1 3.74Å; F154-Y194 HydrophobicContact CZ-CD1 4.29Å; F154-Y194 HydrophobicContact CZ-CE1 4.47Å; F154-R232 CarbonylContact C-O 3.52Å; F154-R232 WeakPolarHBondContact CA-O 3.17Å; F154-R232 VanDerWaalsContact CD1-C 3.5Å; F154-L233 HydrophobicContact CD1-CD2 4.02Å; F154-L233 HydrophobicContact CD1-CG 4.06Å; F154-L233 HydrophobicContact CD2-CD2 3.81Å; F154-L233 HydrophobicContact CE1-CB 4.46Å; F154-L233 HydrophobicContact CE1-CD2 3.7Å; F154-L233 HydrophobicContact CE1-CG 3.56Å; F154-L233 HydrophobicContact CE2-CD2 3.47Å; F154-L233 VanDerWaalsContact CE2-CD2 3.47Å; F154-L233 HydrophobicContact CE2-CG 4.25Å; F154-L233 HydrophobicContact CG-CD2 4.09Å; F154-L233 HydrophobicContact CZ-CD1 4.46Å; F154-L233 HydrophobicContact CZ-CD2 3.4Å; F154-L233 VanDerWaalsContact CZ-CD2 3.4Å; F154-L233 HydrophobicContact CZ-CG 3.67Å
155	R	76.9	Confident	62.8	Low	180 Å²	180	73.6 Å²	73.6	68%	0.679	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	110.3	161.3	-162.2	171.2	173.9	-170.2	-1.7	106.8	G231 R232 E234	R155-G231 WeakPolarHBondContact O-CA 3.45Å; R155-R232 PolarHBondContact N-O 3.35Å; R155-R232 PolarHBondContact O-N 3.44Å; R155-E234 HydrophobicContact CB-CG 3.55Å; R155-E234 HydrophobicContact CG-CG 4.34Å
156	T	78.1	Confident	64.5	Low	92 Å²	92	75.1 Å²	75.1	56%	0.564	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	131.6	175.1	55.6	0	0	0	0	109.9	F154 L230	F154-T156 PolarHBondContact O-N 3.24Å; T156-L230 CarbonylContact C-O 3.57Å; T156-L230 VanDerWaalsContact CA-O 3.26Å; T156-L230 WeakPolarHBondContact CA-O 3.45Å
157	G	78.8	Confident	66	Low	31 Å²	31	76.1 Å²	76.1	32%	0.32	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	173.8	171.4	0	0	0	0	0	110.7	L230	G157-L230 PolarHBondContact N-O 3.02Å; G157-L230 PolarHBondContact O-N 3.02Å
158	Y	75.1	Confident	68.1	Low	183 Å²	183	74.2 Å²	74.2	72%	0.718	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.1	175.2	-61.7	-90.1	0	0	0	108.7	V228 H229	Y158-V228 CarbonylContact C-O 3.38Å; Y158-V228 WeakPolarHBondContact CA-O 3.36Å; Y158-H229 AromaticContact CD1-ND1 3.94Å; Y158-H229 AromaticContact CE1-CE1 3.29Å; Y158-H229 WeakPolarHBondContact CE1-CE1 3.47Å; Y158-H229 AromaticContact CE1-ND1 3.37Å; Y158-H229 WeakPolarHBondContact CE1-ND1 3.27Å
159	G	69.9	Low	70.4	Confident	14 Å²	14	75.6 Å²	75.6	14%	0.144	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	161.3	172.5	0	0	0	0	0	110.7	V228	G159-V228 PolarHBondContact N-O 2.91Å; G159-V228 WeakPolarHBondContact O-CB 3.37Å; G159-V228 PolarHBondContact O-N 3.03Å
160	L	62.6	Low	72.6	Confident	124 Å²	124	74.2 Å²	74.2	65%	0.649	36%	0.361	S	S	*	.	S	Bend	trans	-102.9	6.9	173.1	-64.5	175.6	0	0	0	112.1	S222	L160-S222 PolarHBondContact O-OG 2.02Å
161	T	65.7	Low	74.7	Confident	35 Å²	35	75.1 Å²	75.1	22%	0.215	37%	0.369	C	S	.	.	S	Bend	trans	-140.5	144.4	-169.1	51.5	0	0	0	0	111.3	M219	T161-M219 HydrophobicContact CG2-CB 4.26Å; T161-M219 HydrophobicContact CG2-SD 4.43Å; T161-M219 PolarHBondContact OG1-SD 3.23Å
162	V	68.3	Low	76.5	Confident	15 Å²	15	74 Å²	74	9%	0.091	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	137.4	173.9	-178.3	0	0	0	0	108.7	A164 V197 Y204 V228	V162-A164 PolarHBondContact O-N 3.29Å; V162-V197 HydrophobicContact CG2-CG2 3.69Å; V162-Y204 HydrophobicContact CG1-CD2 3.92Å; V162-Y204 HydrophobicContact CG1-CE1 4.19Å; V162-Y204 HydrophobicContact CG1-CE2 3.44Å; V162-Y204 VanDerWaalsContact CG1-CE2 3.44Å; V162-Y204 HydrophobicContact CG1-CG 4.48Å; V162-V228 HydrophobicContact CG2-CG2 4.48Å
163	P	68.9	Low	78.1	Confident	10 Å²	10	73.4 Å²	73.4	7%	0.065	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	129.3	173.1	25.7	-35.8	0	0	0	110.1	L165 A195 Y204 I206 M212	P163-L165 PolarHBondContact O-N 3.27Å; P163-A195 VanDerWaalsContact CD-CB 3.46Å; P163-A195 HydrophobicContact CG-CB 3.62Å; P163-Y204 HydrophobicContact CG-CG 4.35Å; P163-I206 HydrophobicContact CB-CD1 3.94Å; P163-I206 HydrophobicContact CG-CD1 3.93Å; P163-M212 HydrophobicContact CB-CE 4.07Å
164	A	66.9	Low	79.4	Confident	34 Å²	34	74 Å²	74	28%	0.281	37%	0.371	S	S	.	.	S	Bend	trans	-72.5	-16.4	176.5	0	0	0	0	0	113	V162 F218	V162-A164 PolarHBondContact O-N 3.29Å; A164-F218 HydrophobicContact CB-CB 3.88Å; A164-F218 WeakPolarHBondContact CB-O 3.38Å
165	L	71	Confident	80.3	Confident	93 Å²	93	74.9 Å²	74.9	49%	0.487	38%	0.38	S	S	.	.			trans	-125.3	123.3	-180	-63.3	172.8	0	0	0	108.8	P163	P163-L165 PolarHBondContact O-N 3.27Å
166	Y	82	Confident	81	Confident	105 Å²	105	67 Å²	67	41%	0.412	35%	0.353	S	S	.	.			trans	-147.5	152.9	178.1	58.2	-94.2	0	0	0	108.2	R169 Y204	Y166-R169 HydrophobicContact CD2-CB 4.15Å; Y166-R169 HydrophobicContact CE2-CB 3.67Å; Y166-Y204 AromaticContact CD1-CD1 3.5Å; Y166-Y204 HydrophobicContact CD1-CD1 3.5Å; Y166-Y204 AromaticContact CD1-CE1 3.93Å; Y166-Y204 HydrophobicContact CD1-CE1 3.93Å; Y166-Y204 HydrophobicContact CD1-CG 4.46Å; Y166-Y204 AromaticContact CD2-CD1 3.93Å; Y166-Y204 HydrophobicContact CD2-CD1 3.93Å; Y166-Y204 AromaticContact CE1-CD1 3.81Å; Y166-Y204 HydrophobicContact CE1-CD1 3.81Å; Y166-Y204 AromaticContact CE1-CE1 3.75Å; Y166-Y204 HydrophobicContact CE1-CE1 3.75Å; Y166-Y204 HydrophobicContact CE2-CD1 4.21Å; Y166-Y204 HydrophobicContact CE2-CE1 4.45Å; Y166-Y204 AromaticContact CG-CD1 3.57Å; Y166-Y204 HydrophobicContact CG-CD1 3.57Å; Y166-Y204 HydrophobicContact CG-CE1 4.35Å; Y166-Y204 HydrophobicContact CG-CG 4.42Å
167	D	80.1	Confident	81.7	Confident	54 Å²	54	68.4 Å²	68.4	29%	0.289	35%	0.352	S	S	.	.	S	Bend	trans	-89.9	-33.1	179.2	-54.6	-59.8	0	0	0	111.3	H189 L205 I206 H207	D167-H189 IonicContact OD2-CD2 3.69Å; D167-L205 PolarHBondContact N-O 3.2Å; D167-I206 VanDerWaalsContact OD2-CA 3.32Å; D167-I206 WeakPolarHBondContact OD2-CA 3.14Å; D167-H207 IonicContact OD1-CE1 3.79Å; D167-H207 PolarHBondContact OD1-CE1 2.99Å; D167-H207 IonicContact OD1-CG 3.02Å; D167-H207 IonicContact OD1-ND1 2.63Å; D167-H207 PolarHBondContact OD1-ND1 3.48Å; D167-H207 WeakPolarHBondContact OD2-CB 3.21Å; D167-H207 IonicContact OD2-CE1 3.9Å; D167-H207 IonicContact OD2-CG 3Å; D167-H207 PolarHBondContact OD2-N 3.08Å; D167-H207 IonicContact OD2-ND1 2.71Å; D167-H207 PolarHBondContact OD2-ND1 2.91Å
168	E	87.1	Confident	82.4	Confident	16 Å²	16	71 Å²	71	8%	0.075	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	136.4	-174.8	-175.1	165.9	-171.9	0	0	111.2	R170 R188 H189 Y204 L205	E168-R170 HydrophobicContact CG-CG 4.41Å; E168-R170 IonicContact OE1-CZ 3.26Å; E168-R170 IonicContact OE1-NE 3.57Å; E168-R170 PolarHBondContact OE1-NE 3.33Å; E168-R170 IonicContact OE1-NH2 3.27Å; E168-R170 PolarHBondContact OE1-NH2 3.14Å; E168-R188 IonicContact OE1-NH1 3.36Å; E168-H189 IonicContact OE2-CE1 3.72Å; E168-H189 PolarHBondContact OE2-CE1 2.85Å; E168-H189 IonicContact OE2-ND1 2.66Å; E168-Y204 CarbonylContact O-C 3.49Å; E168-Y204 WeakPolarHBondContact O-CA 3.12Å; E168-L205 HydrophobicContact CB-CB 4.15Å; E168-L205 HydrophobicContact CB-CD1 4.3Å; E168-L205 HydrophobicContact CB-CG 4.41Å; E168-L205 HydrophobicContact CG-CD1 4.36Å; E168-L205 PolarHBondContact N-O 3.5Å; E168-L205 PolarHBondContact O-N 3.44Å
169	R	90.9	Very high	83.3	Confident	128 Å²	128	62.2 Å²	62.2	48%	0.483	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	121.7	175.8	-179.2	179	176.1	-102.2	-2.3	108.9	Y166 V202 C203 Y204	Y166-R169 HydrophobicContact CD2-CB 4.15Å; Y166-R169 HydrophobicContact CE2-CB 3.67Å; R169-V202 HydrophobicContact CG-CG1 3.6Å; R169-C203 CarbonylContact C-O 3.59Å; R169-C203 WeakPolarHBondContact CA-O 3.27Å; R169-Y204 HydrophobicContact CB-CD1 4.31Å; R169-Y204 HydrophobicContact CB-CE1 4.37Å; R169-Y204 HydrophobicContact CG-CD1 4.19Å; R169-Y204 HydrophobicContact CG-CE1 3.87Å
170	R	93.2	Very high	84.3	Confident	103 Å²	103	63.7 Å²	63.7	39%	0.389	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.4	173.5	-62.8	-64.3	-172	140.1	-0.6	109	E168 V173 L182 V202 C203	E168-R170 HydrophobicContact CG-CG 4.41Å; E168-R170 IonicContact OE1-CZ 3.26Å; E168-R170 IonicContact OE1-NE 3.57Å; E168-R170 PolarHBondContact OE1-NE 3.33Å; E168-R170 IonicContact OE1-NH2 3.27Å; E168-R170 PolarHBondContact OE1-NH2 3.14Å; R170-V173 HydrophobicContact CB-CG2 3.79Å; R170-L182 HydrophobicContact CB-CD1 4.29Å; R170-L182 HydrophobicContact CG-CD1 4.32Å; R170-V202 WeakPolarHBondContact O-CA 3.44Å; R170-C203 HydrophobicContact CB-CB 4.21Å; R170-C203 PolarHBondContact N-O 3.28Å; R170-C203 PolarHBondContact O-N 3.49Å
171	T	93.6	Very high	85.6	Confident	73 Å²	73	62.9 Å²	62.9	45%	0.448	32%	0.318	S	S	.	.			trans	-88.6	165.3	173.4	51.5	0	0	0	0	110.2	V173 V202	T171-V173 PolarHBondContact O-N 2.92Å; T171-V202 HydrophobicContact CG2-CG2 4.45Å
172	E	92.8	Very high	86.8	Confident	170 Å²	170	63.3 Å²	63.3	79%	0.794	32%	0.318	S	S	*	.	S	Bend	trans	61.2	27.3	174.3	-55.9	174.6	-165	0	0	114.3	A174 R201	E172-A174 PolarHBondContact O-N 2.86Å; E172-R201 PolarHBondContact N-O 2.84Å
173	V	95.6	Very high	87.8	Confident	5 Å²	5	62.7 Å²	62.7	3%	0.03	32%	0.315	C	S	.	.			trans	-79.2	124.3	175.6	-179.2	0	0	0	0	108.6	R170 T171 S175 Q178 C179 L182 Y196 R201 C203	R170-V173 HydrophobicContact CB-CG2 3.79Å; T171-V173 PolarHBondContact O-N 2.92Å; V173-S175 WeakPolarHBondContact CG1-O 3.39Å; V173-Q178 HydrophobicContact CG1-CB 3.87Å; V173-Q178 HydrophobicContact CG1-CG 4.05Å; V173-C179 HydrophobicContact CG1-CB 4.04Å; V173-L182 HydrophobicContact CG1-CD1 4.21Å; V173-L182 HydrophobicContact CG2-CD1 3.7Å; V173-Y196 HydrophobicContact CB-CD2 4.38Å; V173-Y196 HydrophobicContact CB-CE2 4.03Å; V173-Y196 HydrophobicContact CG1-CD2 4.25Å; V173-Y196 HydrophobicContact CG1-CE2 4.09Å; V173-Y196 VanDerWaalsContact O-CE2 3.26Å; V173-Y196 WeakPolarHBondContact O-CE2 3.38Å; V173-Y196 PolarHBondContact O-OH 3.43Å; V173-R201 PolarHBondContact N-O 2.69Å; V173-R201 WeakPolarHBondContact O-CB 3.41Å; V173-C203 HydrophobicContact CB-CB 3.99Å; V173-C203 HydrophobicContact CG1-CB 4.14Å; V173-C203 HydrophobicContact CG2-CB 3.59Å
174	A	94.4	Very high	88.4	Confident	71 Å²	71	63.4 Å²	63.4	59%	0.587	32%	0.318	S	S	*	.			trans	-71.3	-32.3	-171.6	0	0	0	0	0	113.2	E172 Y196	E172-A174 PolarHBondContact O-N 2.86Å; A174-Y196 PolarHBondContact O-OH 3.23Å
175	S	94.1	Very high	89.2	Confident	36 Å²	36	65.3 Å²	65.3	25%	0.252	33%	0.329	S	S	.	.			trans	-154.4	163.8	-173.9	73.9	0	0	0	0	113.7	V173 Q177 Q178 C179	V173-S175 WeakPolarHBondContact CG1-O 3.39Å; S175-Q177 VanDerWaalsContact CB-OE1 3.25Å; S175-Q177 PolarHBondContact O-N 2.95Å; S175-Q177 PolarHBondContact OG-N 2.95Å; S175-Q177 PolarHBondContact OG-OE1 2.87Å; S175-Q178 PolarHBondContact O-N 3.46Å; S175-Q178 PolarHBondContact OG-N 2.74Å; S175-Q178 VanDerWaalsContact OG-N 3.15Å; S175-C179 PolarHBondContact O-N 3.31Å
176	S	92	Very high	89.6	Confident	16 Å²	16	62.1 Å²	62.1	11%	0.112	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-31.9	173.4	58.2	0	0	0	0	112.1	C179 Q180	S176-C179 WeakPolarHBondContact O-CB 3.17Å; S176-C179 PolarHBondContact O-N 2.87Å; S176-Q180 PolarHBondContact O-N 2.73Å
177	Q	92.5	Very high	89.1	Confident	120 Å²	120	62.8 Å²	62.8	56%	0.561	34%	0.335	S	S	*	.	H	α-helix	trans	-67	-39.6	174.7	-61.3	84.6	-5.4	0	0	111.5	S175 C179 Q180 Q181	S175-Q177 VanDerWaalsContact CB-OE1 3.25Å; S175-Q177 PolarHBondContact O-N 2.95Å; S175-Q177 PolarHBondContact OG-N 2.95Å; S175-Q177 PolarHBondContact OG-OE1 2.87Å; Q177-C179 VanDerWaalsContact C-N 3.34Å; Q177-Q180 WeakPolarHBondContact O-CB 3.27Å; Q177-Q180 PolarHBondContact O-N 3.42Å; Q177-Q181 WeakPolarHBondContact O-CG 3.49Å; Q177-Q181 PolarHBondContact O-N 3.21Å
178	Q	94.4	Very high	88.5	Confident	85 Å²	85	66.9 Å²	66.9	40%	0.397	35%	0.346	S	S	.	.	H	α-helix	trans	-66	-40.4	174	-170.6	-176.8	17.7	0	0	110.8	V173 S175 Q180 Q181 L182	V173-Q178 HydrophobicContact CG1-CB 3.87Å; V173-Q178 HydrophobicContact CG1-CG 4.05Å; S175-Q178 PolarHBondContact O-N 3.46Å; S175-Q178 PolarHBondContact OG-N 2.74Å; S175-Q178 VanDerWaalsContact OG-N 3.15Å; Q178-Q180 VanDerWaalsContact C-N 3.32Å; Q178-Q180 PolarHBondContact O-N 3.37Å; Q178-Q181 PolarHBondContact O-N 3.08Å; Q178-Q181 VanDerWaalsContact O-N 3.17Å; Q178-L182 HydrophobicContact CG-CD1 4.48Å; Q178-L182 WeakPolarHBondContact O-CG 3.17Å; Q178-L182 PolarHBondContact O-N 2.77Å
179	C	93.8	Very high	87.7	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-60	-41.6	174.2	-172.6	0	0	0	0	112.2	V173 S175 S176 Q177 Q181 L182 C183 Y194 Y196 C203	V173-C179 HydrophobicContact CG1-CB 4.04Å; S175-C179 PolarHBondContact O-N 3.31Å; S176-C179 WeakPolarHBondContact O-CB 3.17Å; S176-C179 PolarHBondContact O-N 2.87Å; Q177-C179 VanDerWaalsContact C-N 3.34Å; C179-Q181 PolarHBondContact O-N 2.83Å; C179-L182 WeakPolarHBondContact O-CB 3.16Å; C179-L182 PolarHBondContact O-N 2.76Å; C179-C183 PolarHBondContact O-N 3.45Å; C179-Y194 HydrophobicContact CB-CD2 4.08Å; C179-Y194 HydrophobicContact CB-CE2 4.48Å; C179-Y194 WeakPolarHBondContact SG-CD2 3.47Å; C179-Y196 HydrophobicContact CB-CD2 4.25Å; C179-Y196 HydrophobicContact CB-CG 4.33Å; C179-C203 WeakPolarHBondContact CA-SG 3.45Å; C179-C203 HydrophobicContact CB-CB 3.73Å; C179-C203 WeakPolarHBondContact CB-SG 3.46Å; C179-C203 WeakPolarHBondContact SG-CB 3.32Å; C179-C203 CovalentContact SG-SG 2.02Å; C179-C203 PolarHBondContact SG-SG 3.27Å
180	Q	90.9	Very high	86.8	Confident	44 Å²	44	61.8 Å²	61.8	21%	0.206	33%	0.329	C	S	.	.	H	α-helix	trans	-59.6	-44.9	172.6	-178.3	-177.1	-25.6	0	0	112.1	F154 S176 Q177 Q178 L182 C183 L184 Y194	F154-Q180 HydrophobicContact CD2-CG 3.51Å; F154-Q180 HydrophobicContact CE2-CG 3.66Å; F154-Q180 HydrophobicContact CG-CG 4.23Å; F154-Q180 HydrophobicContact CZ-CG 4.49Å; S176-Q180 PolarHBondContact O-N 2.73Å; Q177-Q180 WeakPolarHBondContact O-CB 3.27Å; Q177-Q180 PolarHBondContact O-N 3.42Å; Q178-Q180 VanDerWaalsContact C-N 3.32Å; Q178-Q180 PolarHBondContact O-N 3.37Å; Q180-L182 VanDerWaalsContact C-N 3.35Å; Q180-C183 WeakPolarHBondContact O-CB 3.29Å; Q180-C183 PolarHBondContact O-N 2.87Å; Q180-L184 HydrophobicContact CG-CD1 4.35Å; Q180-L184 WeakPolarHBondContact O-CG 3.42Å; Q180-L184 PolarHBondContact O-N 3.23Å; Q180-Y194 HydrophobicContact CB-CD1 4.23Å; Q180-Y194 HydrophobicContact CB-CE1 3.55Å; Q180-Y194 HydrophobicContact CG-CE1 3.76Å
181	Q	89.6	Confident	86.1	Confident	108 Å²	108	57.2 Å²	57.2	51%	0.505	31%	0.313	S	S	.	.	H	α-helix	trans	-66.2	-37.5	177.9	-68.8	-58.7	-32.3	0	0	112.1	Q177 Q178 C179 C183 L184 S185	Q177-Q181 WeakPolarHBondContact O-CG 3.49Å; Q177-Q181 PolarHBondContact O-N 3.21Å; Q178-Q181 PolarHBondContact O-N 3.08Å; Q178-Q181 VanDerWaalsContact O-N 3.17Å; C179-Q181 PolarHBondContact O-N 2.83Å; Q181-C183 VanDerWaalsContact C-N 3.29Å; Q181-C183 PolarHBondContact O-N 2.67Å; Q181-L184 PolarHBondContact O-N 3.01Å; Q181-S185 VanDerWaalsContact O-CB 3.32Å; Q181-S185 WeakPolarHBondContact O-CB 3.46Å; Q181-S185 PolarHBondContact O-N 3.33Å; Q181-S185 PolarHBondContact O-OG 2.95Å
182	L	91.4	Very high	85.4	Confident	43 Å²	43	53.8 Å²	53.8	23%	0.225	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-39.5	172.7	-71.5	168.5	0	0	0	111.4	R170 V173 Q178 C179 Q180 S186 L205	R170-L182 HydrophobicContact CB-CD1 4.29Å; R170-L182 HydrophobicContact CG-CD1 4.32Å; V173-L182 HydrophobicContact CG1-CD1 4.21Å; V173-L182 HydrophobicContact CG2-CD1 3.7Å; Q178-L182 HydrophobicContact CG-CD1 4.48Å; Q178-L182 WeakPolarHBondContact O-CG 3.17Å; Q178-L182 PolarHBondContact O-N 2.77Å; C179-L182 WeakPolarHBondContact O-CB 3.16Å; C179-L182 PolarHBondContact O-N 2.76Å; Q180-L182 VanDerWaalsContact C-N 3.35Å; L182-S186 PolarHBondContact O-N 3.27Å; L182-L205 HydrophobicContact CB-CD1 4.47Å; L182-L205 HydrophobicContact CB-CD2 4.39Å
183	C	87.9	Confident	85	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.02	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-51.7	172.7	-172.2	0	0	0	0	111	F154 C179 Q180 Q181 S185 S186 C191 Y194 L205	F154-C183 HydrophobicContact CZ-CB 4.2Å; C179-C183 PolarHBondContact O-N 3.45Å; Q180-C183 WeakPolarHBondContact O-CB 3.29Å; Q180-C183 PolarHBondContact O-N 2.87Å; Q181-C183 VanDerWaalsContact C-N 3.29Å; Q181-C183 PolarHBondContact O-N 2.67Å; C183-S185 VanDerWaalsContact C-N 3.3Å; C183-S185 PolarHBondContact O-N 2.86Å; C183-S186 WeakPolarHBondContact O-CB 3.42Å; C183-S186 PolarHBondContact O-N 2.78Å; C183-C191 WeakPolarHBondContact CA-SG 3.33Å; C183-C191 HydrophobicContact CB-CB 3.93Å; C183-C191 WeakPolarHBondContact CB-SG 3.32Å; C183-C191 VanDerWaalsContact O-CB 3.29Å; C183-C191 WeakPolarHBondContact O-CB 3.43Å; C183-C191 VanDerWaalsContact SG-C 3.55Å; C183-C191 WeakPolarHBondContact SG-CB 3.45Å; C183-C191 PolarHBondContact SG-O 2.88Å; C183-C191 CovalentContact SG-SG 2.02Å; C183-C191 PolarHBondContact SG-SG 3.43Å; C183-Y194 HydrophobicContact CB-CD1 4.29Å; C183-L205 HydrophobicContact CB-CD2 3.88Å
184	L	83.2	Confident	84.7	Confident	25 Å²	25	45.6 Å²	45.6	13%	0.131	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-33.8	-178.9	-71.8	172.8	0	0	0	114	I146 A147 C152 F154 Q180 Q181	I146-L184 HydrophobicContact CG2-CD2 4.46Å; A147-L184 WeakPolarHBondContact CB-O 3.29Å; C152-L184 HydrophobicContact CB-CD2 4.05Å; F154-L184 HydrophobicContact CE2-CD1 4.16Å; F154-L184 HydrophobicContact CE2-CD2 3.63Å; F154-L184 HydrophobicContact CE2-CG 3.74Å; F154-L184 HydrophobicContact CZ-CD2 4.11Å; F154-L184 HydrophobicContact CZ-CG 4.29Å; Q180-L184 HydrophobicContact CG-CD1 4.35Å; Q180-L184 WeakPolarHBondContact O-CG 3.42Å; Q180-L184 PolarHBondContact O-N 3.23Å; Q181-L184 PolarHBondContact O-N 3.01Å
185	S	83	Confident	84.4	Confident	74 Å²	74	42.2 Å²	42.2	52%	0.517	23%	0.225	S	C	.	.	H	α-helix	trans	-92.6	0.4	-179.4	59.9	0	0	0	0	113.9	Q181 C183 S187	Q181-S185 VanDerWaalsContact O-CB 3.32Å; Q181-S185 WeakPolarHBondContact O-CB 3.46Å; Q181-S185 PolarHBondContact O-N 3.33Å; Q181-S185 PolarHBondContact O-OG 2.95Å; C183-S185 VanDerWaalsContact C-N 3.3Å; C183-S185 PolarHBondContact O-N 2.86Å; S185-S187 PolarHBondContact O-N 3.36Å; S185-S187 VanDerWaalsContact O-N 3.17Å
186	S	79.7	Confident	84.3	Confident	26 Å²	26	41 Å²	41	18%	0.182	22%	0.215	C	C	.	.			trans	-62.1	119	177.7	-175.5	0	0	0	0	110	L182 C183 H189	L182-S186 PolarHBondContact O-N 3.27Å; C183-S186 WeakPolarHBondContact O-CB 3.42Å; C183-S186 PolarHBondContact O-N 2.78Å; S186-H189 PolarHBondContact OG-CE1 3.34Å; S186-H189 PolarHBondContact OG-ND1 3.44Å; S186-H189 PolarHBondContact OG-O 3.26Å
187	S	70.8	Confident	84.2	Confident	119 Å²	119	40.3 Å²	40.3	83%	0.832	21%	0.21	S	C	*	.	S	Bend	trans	-93.2	-12.3	173	57.1	0	0	0	0	112.7	S185	S185-S187 PolarHBondContact O-N 3.36Å; S185-S187 VanDerWaalsContact O-N 3.17Å
188	R	67.7	Low	84	Confident	139 Å²	139	36.5 Å²	36.5	53%	0.525	20%	0.195	S	C	.	.	S	Bend	trans	-80.5	-34.6	-176	-65.9	-176.8	173.8	-175.9	-4	112.2	H56 W58 E168	H56-R188 PolarHBondContact CD2-O 2.85Å; H56-R188 WeakPolarHBondContact NE2-CA 3.41Å; H56-R188 PolarHBondContact NE2-O 2.89Å; W58-R188 WeakPolarHBondContact CH2-O 3.38Å; W58-R188 WeakPolarHBondContact CZ2-O 3.34Å; E168-R188 IonicContact OE1-NH1 3.36Å
189	H	70	Confident	83.7	Confident	10 Å²	10	36.7 Å²	36.7	5%	0.046	20%	0.202	C	C	.	.	S	Bend	trans	-150.5	154.3	-179.8	55.9	-81.5	0	0	0	109.5	W58 D167 E168 S186 C191 L205 H207	W58-H189 HydrophobicContact CH2-CB 3.2Å; W58-H189 HydrophobicContact CZ2-CB 3.47Å; W58-H189 VanDerWaalsContact CZ2-CB 3.47Å; W58-H189 HydrophobicContact CZ3-CB 4.06Å; D167-H189 IonicContact OD2-CD2 3.69Å; E168-H189 IonicContact OE2-CE1 3.72Å; E168-H189 PolarHBondContact OE2-CE1 2.85Å; E168-H189 IonicContact OE2-ND1 2.66Å; S186-H189 PolarHBondContact OG-CE1 3.34Å; S186-H189 PolarHBondContact OG-ND1 3.44Å; S186-H189 PolarHBondContact OG-O 3.26Å; H189-C191 VanDerWaalsContact C-N 3.28Å; H189-C191 PolarHBondContact O-N 3.26Å; H189-L205 WeakPolarHBondContact NE2-CB 3.34Å; H189-H207 HydrophobicContact CB-CB 4.36Å
190	L	71.9	Confident	83.5	Confident	28 Å²	28	39.6 Å²	39.6	15%	0.147	22%	0.222	C	C	.	.			trans	-66.9	92.8	166.8	176.5	64.4	0	0	0	108.4	W143 I146 T192 H207 W236	W143-L190 HydrophobicContact CB-CD1 4.27Å; W143-L190 HydrophobicContact CD2-CB 4.35Å; W143-L190 HydrophobicContact CD2-CD2 3.9Å; W143-L190 HydrophobicContact CG-CB 4.31Å; W143-L190 HydrophobicContact CG-CD1 3.89Å; W143-L190 HydrophobicContact CG-CD2 4.05Å; W143-L190 HydrophobicContact CG-CG 4.3Å; W143-L190 HydrophobicContact CZ2-CD2 4.22Å; I146-L190 HydrophobicContact CD1-CD1 3.28Å; I146-L190 HydrophobicContact CG1-CD1 4.45Å; L190-T192 HydrophobicContact CD2-CG2 4.18Å; L190-T192 HydrophobicContact CG-CG2 3.92Å; L190-T192 PolarHBondContact O-N 3.16Å; L190-H207 WeakPolarHBondContact O-CA 2.86Å; L190-H207 VanDerWaalsContact O-CB 3.27Å; L190-H207 WeakPolarHBondContact O-CB 3.41Å; L190-W236 HydrophobicContact CD2-CZ2 3.68Å
191	C	79.9	Confident	83.6	Confident	7 Å²	7	44.9 Å²	44.9	5%	0.047	24%	0.24	C	C	.	.			trans	-73.2	118.6	176.4	-177.3	0	0	0	0	109.9	C183 H189 A193	C183-C191 WeakPolarHBondContact CA-SG 3.33Å; C183-C191 HydrophobicContact CB-CB 3.93Å; C183-C191 WeakPolarHBondContact CB-SG 3.32Å; C183-C191 VanDerWaalsContact O-CB 3.29Å; C183-C191 WeakPolarHBondContact O-CB 3.43Å; C183-C191 VanDerWaalsContact SG-C 3.55Å; C183-C191 WeakPolarHBondContact SG-CB 3.45Å; C183-C191 PolarHBondContact SG-O 2.88Å; C183-C191 CovalentContact SG-SG 2.02Å; C183-C191 PolarHBondContact SG-SG 3.43Å; H189-C191 VanDerWaalsContact C-N 3.28Å; H189-C191 PolarHBondContact O-N 3.26Å; C191-A193 PolarHBondContact SG-O 2.95Å
192	T	78.3	Confident	83.8	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.217	C	C	.	.			trans	-110.6	-16.7	-178.1	65.9	0	0	0	0	112.9	L190 I206 H207 G209 L233 W236	L190-T192 HydrophobicContact CD2-CG2 4.18Å; L190-T192 HydrophobicContact CG-CG2 3.92Å; L190-T192 PolarHBondContact O-N 3.16Å; T192-I206 PolarHBondContact N-O 2.74Å; T192-I206 PolarHBondContact OG1-O 2.74Å; T192-H207 WeakPolarHBondContact CB-O 3.02Å; T192-H207 WeakPolarHBondContact CG2-O 3.4Å; T192-H207 PolarHBondContact OG1-O 3.35Å; T192-G209 PolarHBondContact OG1-N 3.06Å; T192-L233 WeakPolarHBondContact O-CB 3.41Å; T192-L233 WeakPolarHBondContact O-CG 3.42Å; T192-L233 PolarHBondContact O-N 3.23Å; T192-W236 HydrophobicContact CG2-CD2 3.69Å; T192-W236 HydrophobicContact CG2-CE3 4.32Å; T192-W236 HydrophobicContact CG2-CG 4.01Å; T192-W236 HydrophobicContact CG2-CH2 4.35Å; T192-W236 HydrophobicContact CG2-CZ2 3.69Å; T192-W236 VanDerWaalsContact CG2-NE1 3.33Å
193	A	84.1	Confident	83.9	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.008	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	157.1	173.9	0	0	0	0	0	111.1	C191 I206 G231 R232	C191-A193 PolarHBondContact SG-O 2.95Å; A193-I206 HydrophobicContact CB-CB 4.15Å; A193-I206 HydrophobicContact CB-CD1 4.38Å; A193-I206 PolarHBondContact N-O 2.9Å; A193-I206 WeakPolarHBondContact O-CB 3.49Å; A193-I206 PolarHBondContact O-N 3.18Å; A193-G231 CarbonylContact C-O 3.6Å; A193-G231 WeakPolarHBondContact CA-O 3.42Å; A193-G231 WeakPolarHBondContact CB-O 3.35Å; A193-R232 HydrophobicContact CB-CB 4.47Å
194	Y	88.5	Confident	84	Confident	3 Å²	3	39 Å²	39	1%	0.012	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	153.5	172.1	69	-94.3	0	0	0	110.9	F154 C179 Q180 C183 Y204 L230 G231	F154-Y194 HydrophobicContact CB-CE1 4.15Å; F154-Y194 AromaticContact CD1-CD1 3.76Å; F154-Y194 HydrophobicContact CD1-CD1 3.76Å; F154-Y194 AromaticContact CD1-CE1 3.57Å; F154-Y194 HydrophobicContact CD1-CE1 3.57Å; F154-Y194 HydrophobicContact CD2-CE1 4.29Å; F154-Y194 AromaticContact CE1-CD1 3.72Å; F154-Y194 HydrophobicContact CE1-CD1 3.72Å; F154-Y194 AromaticContact CE1-CE1 3.96Å; F154-Y194 HydrophobicContact CE1-CE1 3.96Å; F154-Y194 HydrophobicContact CG-CD1 4.36Å; F154-Y194 AromaticContact CG-CE1 3.74Å; F154-Y194 HydrophobicContact CG-CE1 3.74Å; F154-Y194 HydrophobicContact CZ-CD1 4.29Å; F154-Y194 HydrophobicContact CZ-CE1 4.47Å; C179-Y194 HydrophobicContact CB-CD2 4.08Å; C179-Y194 HydrophobicContact CB-CE2 4.48Å; C179-Y194 WeakPolarHBondContact SG-CD2 3.47Å; Q180-Y194 HydrophobicContact CB-CD1 4.23Å; Q180-Y194 HydrophobicContact CB-CE1 3.55Å; Q180-Y194 HydrophobicContact CG-CE1 3.76Å; C183-Y194 HydrophobicContact CB-CD1 4.29Å; Y194-Y204 CarbonylContact C-O 3.6Å; Y194-Y204 WeakPolarHBondContact CA-O 3.48Å; Y194-L230 WeakPolarHBondContact O-CA 3.44Å; Y194-G231 VanDerWaalsContact CE1-CA 3.49Å; Y194-G231 PolarHBondContact N-O 3.37Å; Y194-G231 PolarHBondContact O-N 3.39Å
195	A	89.8	Confident	84.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122.4	169.6	0	0	0	0	0	109.6	P163 C203 Y204 V228 H229 L230	P163-A195 VanDerWaalsContact CD-CB 3.46Å; P163-A195 HydrophobicContact CG-CB 3.62Å; A195-C203 CarbonylContact O-C 3.54Å; A195-C203 WeakPolarHBondContact O-CA 3.38Å; A195-Y204 HydrophobicContact CB-CD2 4.37Å; A195-Y204 PolarHBondContact N-O 2.63Å; A195-Y204 WeakPolarHBondContact O-CD2 3.44Å; A195-Y204 PolarHBondContact O-N 2.68Å; A195-V228 HydrophobicContact CB-CG1 3.99Å; A195-H229 CarbonylContact C-O 3.56Å; A195-H229 WeakPolarHBondContact CA-O 3.29Å; A195-L230 HydrophobicContact CB-CD2 3.51Å
196	Y	91.5	Very high	84.3	Confident	11 Å²	11	34.5 Å²	34.5	4%	0.043	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	120.5	177.9	174.6	-110.3	0	0	0	110.6	V173 A174 C179 T198 V202 C203 V228 H229	V173-Y196 HydrophobicContact CB-CD2 4.38Å; V173-Y196 HydrophobicContact CB-CE2 4.03Å; V173-Y196 HydrophobicContact CG1-CD2 4.25Å; V173-Y196 HydrophobicContact CG1-CE2 4.09Å; V173-Y196 VanDerWaalsContact O-CE2 3.26Å; V173-Y196 WeakPolarHBondContact O-CE2 3.38Å; V173-Y196 PolarHBondContact O-OH 3.43Å; A174-Y196 PolarHBondContact O-OH 3.23Å; C179-Y196 HydrophobicContact CB-CD2 4.25Å; C179-Y196 HydrophobicContact CB-CG 4.33Å; Y196-T198 HydrophobicContact CD1-CG2 4.23Å; Y196-T198 HydrophobicContact CE1-CG2 3.93Å; Y196-V202 WeakPolarHBondContact CA-O 3.38Å; Y196-C203 HydrophobicContact CD2-CB 4.38Å; Y196-V228 CarbonylContact O-C 3.53Å; Y196-V228 WeakPolarHBondContact O-CA 3.1Å; Y196-H229 HydrophobicContact CD1-CB 4.5Å; Y196-H229 AromaticContact CD1-CD2 3.94Å; Y196-H229 PolarHBondContact N-O 3.26Å; Y196-H229 PolarHBondContact O-N 2.98Å
197	V	90	Very high	84.2	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	113.7	176.8	-176.4	0	0	0	0	108.6	V162 T199 S200 R201 V202 Y204 D226 V228	V162-V197 HydrophobicContact CG2-CG2 3.69Å; V197-T199 WeakPolarHBondContact CG1-OG1 2.95Å; V197-T199 PolarHBondContact O-N 2.9Å; V197-S200 WeakPolarHBondContact CB-OG 3.32Å; V197-S200 WeakPolarHBondContact CG1-OG 3.27Å; V197-R201 WeakPolarHBondContact O-CA 3.04Å; V197-R201 PolarHBondContact O-N 3.45Å; V197-V202 PolarHBondContact N-O 3.06Å; V197-V202 PolarHBondContact O-N 2.83Å; V197-Y204 HydrophobicContact CG2-CD2 4.32Å; V197-Y204 HydrophobicContact CG2-CE2 3.73Å; V197-D226 HydrophobicContact CG1-CB 3.98Å; V197-V228 HydrophobicContact CG2-CG1 4.49Å; V197-V228 HydrophobicContact CG2-CG2 4.21Å
198	T	88.4	Confident	84.1	Confident	40 Å²	40	30 Å²	30	25%	0.245	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-41.5	-174.4	54.2	0	0	0	0	113.2	Y196 Q227 H229	Y196-T198 HydrophobicContact CD1-CG2 4.23Å; Y196-T198 HydrophobicContact CE1-CG2 3.93Å; T198-Q227 HydrophobicContact CG2-CB 4.36Å; T198-Q227 WeakPolarHBondContact CG2-O 3.14Å; T198-Q227 PolarHBondContact N-O 2.88Å; T198-Q227 PolarHBondContact OG1-O 3.17Å; T198-H229 WeakPolarHBondContact CG2-CD2 3.38Å; T198-H229 WeakPolarHBondContact CG2-NE2 3.45Å
199	T	87.4	Confident	83.6	Confident	88 Å²	88	23.5 Å²	23.5	54%	0.54	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-44	-174.8	51.2	0	0	0	0	112.1	V197 D226	V197-T199 WeakPolarHBondContact CG1-OG1 2.95Å; V197-T199 PolarHBondContact O-N 2.9Å; T199-D226 WeakPolarHBondContact CB-OD1 2.85Å; T199-D226 VanDerWaalsContact CG2-OD1 3.3Å; T199-D226 WeakPolarHBondContact CG2-OD1 3.13Å; T199-D226 PolarHBondContact OG1-OD1 2.79Å
200	S	89.7	Confident	82.9	Confident	61 Å²	61	25.1 Å²	25.1	43%	0.427	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-6.2	-178.9	59.7	0	0	0	0	114.1	V197 V202	V197-S200 WeakPolarHBondContact CB-OG 3.32Å; V197-S200 WeakPolarHBondContact CG1-OG 3.27Å; S200-V202 WeakPolarHBondContact O-CG2 3.2Å; S200-V202 PolarHBondContact O-N 2.82Å; S200-V202 WeakPolarHBondContact OG-CG2 3.01Å
201	R	93.4	Very high	81.9	Confident	156 Å²	156	24.4 Å²	24.4	59%	0.589	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	39.1	-175.1	-64.1	-175.3	-179.3	176.6	-0.3	112.5	E172 V173 V197	E172-R201 PolarHBondContact N-O 2.84Å; V173-R201 PolarHBondContact N-O 2.69Å; V173-R201 WeakPolarHBondContact O-CB 3.41Å; V197-R201 WeakPolarHBondContact O-CA 3.04Å; V197-R201 PolarHBondContact O-N 3.45Å
202	V	93.2	Very high	80.3	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.024	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129	-179.2	-177.3	0	0	0	0	109.8	R169 R170 T171 Y196 V197 S200 Y204	R169-V202 HydrophobicContact CG-CG1 3.6Å; R170-V202 WeakPolarHBondContact O-CA 3.44Å; T171-V202 HydrophobicContact CG2-CG2 4.45Å; Y196-V202 WeakPolarHBondContact CA-O 3.38Å; V197-V202 PolarHBondContact N-O 3.06Å; V197-V202 PolarHBondContact O-N 2.83Å; S200-V202 WeakPolarHBondContact O-CG2 3.2Å; S200-V202 PolarHBondContact O-N 2.82Å; S200-V202 WeakPolarHBondContact OG-CG2 3.01Å; V202-Y204 HydrophobicContact CB-CE2 4.08Å; V202-Y204 HydrophobicContact CG1-CD2 4.17Å; V202-Y204 HydrophobicContact CG1-CE1 3.96Å; V202-Y204 HydrophobicContact CG1-CE2 3.54Å; V202-Y204 VanDerWaalsContact CG1-CZ 3.44Å
203	C	93.3	Very high	78.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129.7	173.5	175.7	0	0	0	0	109.7	R169 R170 V173 C179 A195 Y196 L205	R169-C203 CarbonylContact C-O 3.59Å; R169-C203 WeakPolarHBondContact CA-O 3.27Å; R170-C203 HydrophobicContact CB-CB 4.21Å; R170-C203 PolarHBondContact N-O 3.28Å; R170-C203 PolarHBondContact O-N 3.49Å; V173-C203 HydrophobicContact CB-CB 3.99Å; V173-C203 HydrophobicContact CG1-CB 4.14Å; V173-C203 HydrophobicContact CG2-CB 3.59Å; C179-C203 WeakPolarHBondContact CA-SG 3.45Å; C179-C203 HydrophobicContact CB-CB 3.73Å; C179-C203 WeakPolarHBondContact CB-SG 3.46Å; C179-C203 WeakPolarHBondContact SG-CB 3.32Å; C179-C203 CovalentContact SG-SG 2.02Å; C179-C203 PolarHBondContact SG-SG 3.27Å; A195-C203 CarbonylContact O-C 3.54Å; A195-C203 WeakPolarHBondContact O-CA 3.38Å; Y196-C203 HydrophobicContact CD2-CB 4.38Å; C203-L205 VanDerWaalsContact SG-CD2 3.51Å
204	Y	91.2	Very high	76.7	Confident	25 Å²	25	40.4 Å²	40.4	10%	0.098	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124.7	174.2	-58.8	-85.1	0	0	0	108.2	V162 P163 Y166 E168 R169 Y194 A195 V197 V202	V162-Y204 HydrophobicContact CG1-CD2 3.92Å; V162-Y204 HydrophobicContact CG1-CE1 4.19Å; V162-Y204 HydrophobicContact CG1-CE2 3.44Å; V162-Y204 VanDerWaalsContact CG1-CE2 3.44Å; V162-Y204 HydrophobicContact CG1-CG 4.48Å; P163-Y204 HydrophobicContact CG-CG 4.35Å; Y166-Y204 AromaticContact CD1-CD1 3.5Å; Y166-Y204 HydrophobicContact CD1-CD1 3.5Å; Y166-Y204 AromaticContact CD1-CE1 3.93Å; Y166-Y204 HydrophobicContact CD1-CE1 3.93Å; Y166-Y204 HydrophobicContact CD1-CG 4.46Å; Y166-Y204 AromaticContact CD2-CD1 3.93Å; Y166-Y204 HydrophobicContact CD2-CD1 3.93Å; Y166-Y204 AromaticContact CE1-CD1 3.81Å; Y166-Y204 HydrophobicContact CE1-CD1 3.81Å; Y166-Y204 AromaticContact CE1-CE1 3.75Å; Y166-Y204 HydrophobicContact CE1-CE1 3.75Å; Y166-Y204 HydrophobicContact CE2-CD1 4.21Å; Y166-Y204 HydrophobicContact CE2-CE1 4.45Å; Y166-Y204 AromaticContact CG-CD1 3.57Å; Y166-Y204 HydrophobicContact CG-CD1 3.57Å; Y166-Y204 HydrophobicContact CG-CE1 4.35Å; Y166-Y204 HydrophobicContact CG-CG 4.42Å; E168-Y204 CarbonylContact O-C 3.49Å; E168-Y204 WeakPolarHBondContact O-CA 3.12Å; R169-Y204 HydrophobicContact CB-CD1 4.31Å; R169-Y204 HydrophobicContact CB-CE1 4.37Å; R169-Y204 HydrophobicContact CG-CD1 4.19Å; R169-Y204 HydrophobicContact CG-CE1 3.87Å; Y194-Y204 CarbonylContact C-O 3.6Å; Y194-Y204 WeakPolarHBondContact CA-O 3.48Å; A195-Y204 HydrophobicContact CB-CD2 4.37Å; A195-Y204 PolarHBondContact N-O 2.63Å; A195-Y204 WeakPolarHBondContact O-CD2 3.44Å; A195-Y204 PolarHBondContact O-N 2.68Å; V197-Y204 HydrophobicContact CG2-CD2 4.32Å; V197-Y204 HydrophobicContact CG2-CE2 3.73Å; V202-Y204 HydrophobicContact CB-CE2 4.08Å; V202-Y204 HydrophobicContact CG1-CD2 4.17Å; V202-Y204 HydrophobicContact CG1-CE1 3.96Å; V202-Y204 HydrophobicContact CG1-CE2 3.54Å; V202-Y204 VanDerWaalsContact CG1-CZ 3.44Å
205	L	88.6	Confident	74.8	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	140.1	176.3	-51.4	-176.4	0	0	0	109.5	D167 E168 L182 C183 H189 C203	D167-L205 PolarHBondContact N-O 3.2Å; E168-L205 HydrophobicContact CB-CB 4.15Å; E168-L205 HydrophobicContact CB-CD1 4.3Å; E168-L205 HydrophobicContact CB-CG 4.41Å; E168-L205 HydrophobicContact CG-CD1 4.36Å; E168-L205 PolarHBondContact N-O 3.5Å; E168-L205 PolarHBondContact O-N 3.44Å; L182-L205 HydrophobicContact CB-CD1 4.47Å; L182-L205 HydrophobicContact CB-CD2 4.39Å; C183-L205 HydrophobicContact CB-CD2 3.88Å; H189-L205 WeakPolarHBondContact NE2-CB 3.34Å; C203-L205 VanDerWaalsContact SG-CD2 3.51Å
206	I	84.1	Confident	72.6	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	126.4	-169	-47.7	169.1	0	0	0	109.1	P163 D167 T192 A193 T208 M212	P163-I206 HydrophobicContact CB-CD1 3.94Å; P163-I206 HydrophobicContact CG-CD1 3.93Å; D167-I206 VanDerWaalsContact OD2-CA 3.32Å; D167-I206 WeakPolarHBondContact OD2-CA 3.14Å; T192-I206 PolarHBondContact N-O 2.74Å; T192-I206 PolarHBondContact OG1-O 2.74Å; A193-I206 HydrophobicContact CB-CB 4.15Å; A193-I206 HydrophobicContact CB-CD1 4.38Å; A193-I206 PolarHBondContact N-O 2.9Å; A193-I206 WeakPolarHBondContact O-CB 3.49Å; A193-I206 PolarHBondContact O-N 3.18Å; I206-T208 WeakPolarHBondContact CG2-O 3.33Å; I206-M212 HydrophobicContact CD1-CE 4.49Å; I206-M212 HydrophobicContact CD1-SD 3.96Å
207	H	76.6	Confident	70.2	Confident	41 Å²	41	57.3 Å²	57.3	19%	0.19	28%	0.278	C	S	.	.	S	Bend	trans	-83.9	-24.7	177	74.8	-82.3	0	0	0	113.1	D167 H189 L190 T192	D167-H207 IonicContact OD1-CE1 3.79Å; D167-H207 PolarHBondContact OD1-CE1 2.99Å; D167-H207 IonicContact OD1-CG 3.02Å; D167-H207 IonicContact OD1-ND1 2.63Å; D167-H207 PolarHBondContact OD1-ND1 3.48Å; D167-H207 WeakPolarHBondContact OD2-CB 3.21Å; D167-H207 IonicContact OD2-CE1 3.9Å; D167-H207 IonicContact OD2-CG 3Å; D167-H207 PolarHBondContact OD2-N 3.08Å; D167-H207 IonicContact OD2-ND1 2.71Å; D167-H207 PolarHBondContact OD2-ND1 2.91Å; H189-H207 HydrophobicContact CB-CB 4.36Å; L190-H207 WeakPolarHBondContact O-CA 2.86Å; L190-H207 VanDerWaalsContact O-CB 3.27Å; L190-H207 WeakPolarHBondContact O-CB 3.41Å; T192-H207 WeakPolarHBondContact CB-O 3.02Å; T192-H207 WeakPolarHBondContact CG2-O 3.4Å; T192-H207 PolarHBondContact OG1-O 3.35Å
208	T	68.9	Low	68	Low	10 Å²	10	61.4 Å²	61.4	6%	0.061	30%	0.295	C	S	.	.			trans	-99.5	104.7	179.9	67.7	0	0	0	0	111.8	E61 I206 S211	E61-T208 VanDerWaalsContact OE1-CG2 3.27Å; E61-T208 WeakPolarHBondContact OE1-CG2 3.45Å; E61-T208 WeakPolarHBondContact OE2-CG2 3Å; I206-T208 WeakPolarHBondContact CG2-O 3.33Å; T208-S211 VanDerWaalsContact OG1-CB 3.3Å; T208-S211 WeakPolarHBondContact OG1-CB 3.46Å; T208-S211 PolarHBondContact OG1-OG 2.65Å
209	G	57.4	Low	66.2	Low	1 Å²	1	63.9 Å²	63.9	1%	0.01	31%	0.305	C	S	.	.	S	Bend	trans	-72.7	-33.6	175.4	0	0	0	0	0	113.2	T192 R232	T192-G209 PolarHBondContact OG1-N 3.06Å; G209-R232 PolarHBondContact O-NE 3.42Å; G209-R232 VanDerWaalsContact O-NE 3.12Å; G209-R232 PolarHBondContact O-NH2 2.67Å
210	D	55.1	Low	64.6	Low	44 Å²	44	66.3 Å²	66.3	24%	0.235	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-21.8	-174.5	-90	21.2	0	0	0	114.1	M212 E213 E214 R232 H237	D210-M212 PolarHBondContact O-N 2.94Å; D210-E213 PolarHBondContact O-N 2.81Å; D210-E214 PolarHBondContact O-N 3.45Å; D210-R232 IonicContact OD1-CZ 3.53Å; D210-R232 IonicContact OD1-NH2 3Å; D210-R232 PolarHBondContact OD1-NH2 2.71Å; D210-H237 IonicContact OD1-CD2 3.17Å; D210-H237 PolarHBondContact OD1-CD2 3.08Å; D210-H237 IonicContact OD1-CE1 3.21Å; D210-H237 IonicContact OD1-CG 3.45Å; D210-H237 IonicContact OD1-NE2 2.83Å; D210-H237 PolarHBondContact OD1-NE2 2.9Å; D210-H237 VanDerWaalsContact OD1-NE2 3.17Å; D210-H237 IonicContact OD2-CD2 2.82Å; D210-H237 PolarHBondContact OD2-CD2 2.88Å; D210-H237 VanDerWaalsContact OD2-CD2 3.26Å; D210-H237 IonicContact OD2-CE1 3.08Å; D210-H237 PolarHBondContact OD2-CE1 3.3Å; D210-H237 IonicContact OD2-CG 2.69Å; D210-H237 VanDerWaalsContact OD2-CG 3.27Å; D210-H237 IonicContact OD2-ND1 2.83Å; D210-H237 PolarHBondContact OD2-ND1 3.43Å; D210-H237 IonicContact OD2-NE2 3.47Å; D210-H237 PolarHBondContact OD2-NE2 3.44Å
211	S	49.9	Very low	62.6	Low	14 Å²	14	74.2 Å²	74.2	10%	0.098	33%	0.331	C	S	.	.	H	α-helix	trans	-68.2	-17.9	179.3	96.8	0	0	0	0	112.7	T208 E213 R215	T208-S211 VanDerWaalsContact OG1-CB 3.3Å; T208-S211 WeakPolarHBondContact OG1-CB 3.46Å; T208-S211 PolarHBondContact OG1-OG 2.65Å; S211-E213 VanDerWaalsContact C-N 3.33Å; S211-E213 PolarHBondContact O-N 2.87Å; S211-R215 VanDerWaalsContact CB-CZ 3.43Å; S211-R215 WeakPolarHBondContact O-CA 3.46Å; S211-R215 WeakPolarHBondContact O-CB 3.42Å; S211-R215 WeakPolarHBondContact O-CG 3.42Å; S211-R215 PolarHBondContact O-N 2.97Å; S211-R215 PolarHBondContact OG-NH1 2.89Å
212	M	47.1	Very low	60.5	Low	55 Å²	55	68.5 Å²	68.5	27%	0.271	32%	0.315	S	S	.	.	H	α-helix	trans	-70.2	-28.1	176.9	-61.3	-154.9	76.3	0	0	113.2	P163 I206 D210 L230	P163-M212 HydrophobicContact CB-CE 4.07Å; I206-M212 HydrophobicContact CD1-CE 4.49Å; I206-M212 HydrophobicContact CD1-SD 3.96Å; D210-M212 PolarHBondContact O-N 2.94Å; M212-L230 HydrophobicContact CE-CD2 4.2Å
213	E	44	Very low	58.3	Low	115 Å²	115	75.3 Å²	75.3	54%	0.537	36%	0.357	S	S	.	.	H	α-helix	trans	-91.8	-44.1	-177.5	-148.5	102.1	-148.7	0	0	111.8	D210 S211 R215 R232	D210-E213 PolarHBondContact O-N 2.81Å; S211-E213 VanDerWaalsContact C-N 3.33Å; S211-E213 PolarHBondContact O-N 2.87Å; E213-R215 VanDerWaalsContact C-N 3.34Å; E213-R232 IonicContact OE2-NH1 2.68Å; E213-R232 PolarHBondContact OE2-NH1 3.22Å
214	E	43.5	Very low	56.2	Low	173 Å²	173	81.5 Å²	81.5	81%	0.808	39%	0.388	S	S	*	.	H	α-helix	trans	-72	-27.9	174.9	-83.3	-175.6	158.9	0	0	112.2	D210	D210-E214 PolarHBondContact O-N 3.45Å
215	R	47.7	Very low	54.6	Low	68 Å²	68	91.9 Å²	91.9	26%	0.257	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	46.4	177.9	-48.2	176.7	-178.1	151.8	7.2	112.9	S211 E213 V217 F218	S211-R215 VanDerWaalsContact CB-CZ 3.43Å; S211-R215 WeakPolarHBondContact O-CA 3.46Å; S211-R215 WeakPolarHBondContact O-CB 3.42Å; S211-R215 WeakPolarHBondContact O-CG 3.42Å; S211-R215 PolarHBondContact O-N 2.97Å; S211-R215 PolarHBondContact OG-NH1 2.89Å; E213-R215 VanDerWaalsContact C-N 3.34Å; R215-V217 PolarHBondContact O-N 3.31Å; R215-F218 PolarHBondContact O-N 2.95Å
216	R	43.6	Very low	53.5	Low	186 Å²	186	92.7 Å²	92.7	70%	0.702	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-12.7	157.9	-74.9	-175.2	-164.2	149	5.8	113.2	M219	R216-M219 HydrophobicContact CG-CE 4.47Å
217	V	40.9	Very low	53.1	Low	116 Å²	116	98.3 Å²	98.3	70%	0.703	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-14.4	-176.2	-173.6	0	0	0	0	114.6	R215	R215-V217 PolarHBondContact O-N 3.31Å
218	F	44.3	Very low	53.4	Low	86 Å²	86	96.4 Å²	96.4	38%	0.377	45%	0.448	S	S	.	.			trans	-134.8	70.8	176.3	-77.6	-86.9	0	0	0	112	A164 R215	A164-F218 HydrophobicContact CB-CB 3.88Å; A164-F218 WeakPolarHBondContact CB-O 3.38Å; R215-F218 PolarHBondContact O-N 2.95Å
219	M	51.1	Low	54.3	Low	92 Å²	92	97.6 Å²	97.6	45%	0.453	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	118.7	160.3	-63.9	-168.6	-139.7	0	0	107.1	T161 R216 R221	T161-M219 HydrophobicContact CG2-CB 4.26Å; T161-M219 HydrophobicContact CG2-SD 4.43Å; T161-M219 PolarHBondContact OG1-SD 3.23Å; R216-M219 HydrophobicContact CG-CE 4.47Å; M219-R221 PolarHBondContact O-N 3.23Å
220	Q	51.9	Low	55.7	Low	139 Å²	139	99.5 Å²	99.5	65%	0.65	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	114.9	167.6	-95.3	-177.9	-20.7	0	0	106.4	S222	Q220-S222 PolarHBondContact O-N 3.46Å
221	R	48.6	Very low	57	Low	227 Å²	227	97.5 Å²	97.5	86%	0.857	45%	0.453	S	S	*	.			trans	-67.5	85.7	170.7	-159.6	177.5	-166.1	178.7	3.5	106.1	M219 T223	M219-R221 PolarHBondContact O-N 3.23Å; R221-T223 PolarHBondContact O-N 3.15Å; R221-T223 VanDerWaalsContact O-N 3.14Å
222	S	48.5	Very low	58.4	Low	36 Å²	36	100.2 Å²	100.2	25%	0.252	46%	0.461	S	S	.	.			trans	-58.6	119	166.2	46.2	0	0	0	0	105.9	L160 Q220 M224	L160-S222 PolarHBondContact O-OG 2.02Å; Q220-S222 PolarHBondContact O-N 3.46Å; S222-M224 PolarHBondContact O-N 3.49Å; S222-M224 VanDerWaalsContact O-N 3.09Å
223	T	46.9	Very low	59.5	Low	148 Å²	148	98.2 Å²	98.2	91%	0.908	45%	0.451	S	S	*	.	S	Bend	trans	-69.1	1.5	177.5	43.7	0	0	0	0	112.4	R221	R221-T223 PolarHBondContact O-N 3.15Å; R221-T223 VanDerWaalsContact O-N 3.14Å
224	M	50.2	Low	60.2	Low	130 Å²	130	95.9 Å²	95.9	64%	0.64	44%	0.44	S	S	*	.	S	Bend	trans	-101.1	137.8	171	-64.2	-149	-170.6	0	0	110.3	S222 D226	S222-M224 PolarHBondContact O-N 3.49Å; S222-M224 VanDerWaalsContact O-N 3.09Å; M224-D226 PolarHBondContact O-N 3.49Å
225	R	57.3	Low	60.4	Low	242 Å²	242	90.8 Å²	90.8	91%	0.913	42%	0.418	S	S	*	.			trans	-68	61.8	166.5	-70.3	-176	-168.1	172.3	3.6	109.7	Q227	R225-Q227 PolarHBondContact O-N 2.98Å
226	D	65.9	Low	60.3	Low	20 Å²	20	89.9 Å²	89.9	11%	0.107	42%	0.415	C	S	.	.			trans	-75.5	125.7	175.2	-71.2	-30.5	0	0	0	108.1	V197 T199 M224 V228	V197-D226 HydrophobicContact CG1-CB 3.98Å; T199-D226 WeakPolarHBondContact CB-OD1 2.85Å; T199-D226 VanDerWaalsContact CG2-OD1 3.3Å; T199-D226 WeakPolarHBondContact CG2-OD1 3.13Å; T199-D226 PolarHBondContact OG1-OD1 2.79Å; M224-D226 PolarHBondContact O-N 3.49Å; D226-V228 HydrophobicContact CB-CG2 4.49Å; D226-V228 PolarHBondContact O-N 2.85Å
227	Q	75.6	Confident	60.3	Low	122 Å²	122	82 Å²	82	57%	0.57	39%	0.386	S	S	*	.			trans	-74.5	108.7	171	-67.6	-177	-5.3	0	0	107.7	T198 R225	T198-Q227 HydrophobicContact CG2-CB 4.36Å; T198-Q227 WeakPolarHBondContact CG2-O 3.14Å; T198-Q227 PolarHBondContact N-O 2.88Å; T198-Q227 PolarHBondContact OG1-O 3.17Å; R225-Q227 PolarHBondContact O-N 2.98Å
228	V	83.6	Confident	60	Low	0 Å²	0	80.5 Å²	80.5	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	115.9	177.8	-172.5	0	0	0	0	108.5	Y158 G159 V162 A195 Y196 V197 D226 L230	Y158-V228 CarbonylContact C-O 3.38Å; Y158-V228 WeakPolarHBondContact CA-O 3.36Å; G159-V228 PolarHBondContact N-O 2.91Å; G159-V228 WeakPolarHBondContact O-CB 3.37Å; G159-V228 PolarHBondContact O-N 3.03Å; V162-V228 HydrophobicContact CG2-CG2 4.48Å; A195-V228 HydrophobicContact CB-CG1 3.99Å; Y196-V228 CarbonylContact O-C 3.53Å; Y196-V228 WeakPolarHBondContact O-CA 3.1Å; V197-V228 HydrophobicContact CG2-CG1 4.49Å; V197-V228 HydrophobicContact CG2-CG2 4.21Å; D226-V228 HydrophobicContact CB-CG2 4.49Å; D226-V228 PolarHBondContact O-N 2.85Å; V228-L230 HydrophobicContact CG1-CD2 3.89Å; V228-L230 HydrophobicContact CG1-CG 4.19Å; V228-L230 PolarHBondContact O-N 3.17Å
229	H	87.6	Confident	59.5	Low	36 Å²	36	76.8 Å²	76.8	17%	0.167	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	115.1	168.6	-65.6	-97.1	0	0	0	108.6	Y158 A195 Y196 T198	Y158-H229 AromaticContact CD1-ND1 3.94Å; Y158-H229 AromaticContact CE1-CE1 3.29Å; Y158-H229 WeakPolarHBondContact CE1-CE1 3.47Å; Y158-H229 AromaticContact CE1-ND1 3.37Å; Y158-H229 WeakPolarHBondContact CE1-ND1 3.27Å; A195-H229 CarbonylContact C-O 3.56Å; A195-H229 WeakPolarHBondContact CA-O 3.29Å; Y196-H229 HydrophobicContact CD1-CB 4.5Å; Y196-H229 AromaticContact CD1-CD2 3.94Å; Y196-H229 PolarHBondContact N-O 3.26Å; Y196-H229 PolarHBondContact O-N 2.98Å; T198-H229 WeakPolarHBondContact CG2-CD2 3.38Å; T198-H229 WeakPolarHBondContact CG2-NE2 3.45Å
230	L	86.2	Confident	58.7	Low	41 Å²	41	74.9 Å²	74.9	22%	0.215	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.1	176	-64.9	170.8	0	0	0	108.2	T156 G157 Y194 A195 M212 V228	T156-L230 CarbonylContact C-O 3.57Å; T156-L230 VanDerWaalsContact CA-O 3.26Å; T156-L230 WeakPolarHBondContact CA-O 3.45Å; G157-L230 PolarHBondContact N-O 3.02Å; G157-L230 PolarHBondContact O-N 3.02Å; Y194-L230 WeakPolarHBondContact O-CA 3.44Å; A195-L230 HydrophobicContact CB-CD2 3.51Å; M212-L230 HydrophobicContact CE-CD2 4.2Å; V228-L230 HydrophobicContact CG1-CD2 3.89Å; V228-L230 HydrophobicContact CG1-CG 4.19Å; V228-L230 PolarHBondContact O-N 3.17Å
231	G	83.1	Confident	57.7	Low	2 Å²	2	70.2 Å²	70.2	2%	0.021	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.3	166.7	0	0	0	0	0	109.3	R155 A193 Y194	R155-G231 WeakPolarHBondContact O-CA 3.45Å; A193-G231 CarbonylContact C-O 3.6Å; A193-G231 WeakPolarHBondContact CA-O 3.42Å; A193-G231 WeakPolarHBondContact CB-O 3.35Å; Y194-G231 VanDerWaalsContact CE1-CA 3.49Å; Y194-G231 PolarHBondContact N-O 3.37Å; Y194-G231 PolarHBondContact O-N 3.39Å
232	R	78.2	Confident	56.7	Low	71 Å²	71	66 Å²	66	27%	0.268	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	133.3	170.8	-177.2	173.6	175.4	-174.4	0.5	108.3	F154 R155 A193 G209 D210 E213 E234	F154-R232 CarbonylContact C-O 3.52Å; F154-R232 WeakPolarHBondContact CA-O 3.17Å; F154-R232 VanDerWaalsContact CD1-C 3.5Å; R155-R232 PolarHBondContact N-O 3.35Å; R155-R232 PolarHBondContact O-N 3.44Å; A193-R232 HydrophobicContact CB-CB 4.47Å; G209-R232 PolarHBondContact O-NE 3.42Å; G209-R232 VanDerWaalsContact O-NE 3.12Å; G209-R232 PolarHBondContact O-NH2 2.67Å; D210-R232 IonicContact OD1-CZ 3.53Å; D210-R232 IonicContact OD1-NH2 3Å; D210-R232 PolarHBondContact OD1-NH2 2.71Å; E213-R232 IonicContact OE2-NH1 2.68Å; E213-R232 PolarHBondContact OE2-NH1 3.22Å; R232-E234 PolarHBondContact O-N 3.13Å
233	L	70.9	Confident	55.8	Low	13 Å²	13	71.3 Å²	71.3	7%	0.068	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	119.9	174	-78.2	177.3	0	0	0	108.8	C152 F154 T192 N235 W236	C152-L233 HydrophobicContact CB-CD2 3.69Å; F154-L233 HydrophobicContact CD1-CD2 4.02Å; F154-L233 HydrophobicContact CD1-CG 4.06Å; F154-L233 HydrophobicContact CD2-CD2 3.81Å; F154-L233 HydrophobicContact CE1-CB 4.46Å; F154-L233 HydrophobicContact CE1-CD2 3.7Å; F154-L233 HydrophobicContact CE1-CG 3.56Å; F154-L233 HydrophobicContact CE2-CD2 3.47Å; F154-L233 VanDerWaalsContact CE2-CD2 3.47Å; F154-L233 HydrophobicContact CE2-CG 4.25Å; F154-L233 HydrophobicContact CG-CD2 4.09Å; F154-L233 HydrophobicContact CZ-CD1 4.46Å; F154-L233 HydrophobicContact CZ-CD2 3.4Å; F154-L233 VanDerWaalsContact CZ-CD2 3.4Å; F154-L233 HydrophobicContact CZ-CG 3.67Å; T192-L233 WeakPolarHBondContact O-CB 3.41Å; T192-L233 WeakPolarHBondContact O-CG 3.42Å; T192-L233 PolarHBondContact O-N 3.23Å; L233-N235 PolarHBondContact O-N 2.74Å; L233-N235 VanDerWaalsContact O-N 3.13Å; L233-W236 HydrophobicContact CB-CB 4.43Å; L233-W236 PolarHBondContact O-N 3.5Å
234	E	58.4	Low	55.1	Low	66 Å²	66	65.2 Å²	65.2	31%	0.308	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	126	-178.8	-92.2	-169.4	165	0	0	108.7	S153 R155 R232 W236 A239	S153-E234 PolarHBondContact O-N 3.19Å; S153-E234 PolarHBondContact OG-OE2 3.05Å; R155-E234 HydrophobicContact CB-CG 3.55Å; R155-E234 HydrophobicContact CG-CG 4.34Å; R232-E234 PolarHBondContact O-N 3.13Å; E234-W236 PolarHBondContact O-N 3.49Å; E234-A239 WeakPolarHBondContact O-CB 3.39Å
235	N	48.2	Very low	54.5	Low	66 Å²	66	64.3 Å²	64.3	35%	0.353	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	64	30.7	176.7	-50.5	-57.7	0	0	0	114.1	L233 H237 N238 A239	L233-N235 PolarHBondContact O-N 2.74Å; L233-N235 VanDerWaalsContact O-N 3.13Å; N235-H237 CarbonylContact O-C 3.55Å; N235-H237 PolarHBondContact O-N 2.97Å; N235-N238 HydrophobicContact CB-CB 3.95Å; N235-N238 CarbonylContact O-C 3.21Å; N235-N238 PolarHBondContact O-N 2.86Å; N235-A239 HydrophobicContact CB-CB 3.5Å; N235-A239 WeakPolarHBondContact O-CA 3.45Å; N235-A239 WeakPolarHBondContact O-CB 3.45Å; N235-A239 PolarHBondContact O-N 2.51Å
236	W	45.8	Very low	53.9	Low	48 Å²	48	57.2 Å²	57.2	18%	0.182	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	-28.3	-178.5	-162.8	67.7	0	0	0	115.4	A118 L190 T192 L233 E234	A118-W236 HydrophobicContact CB-CH2 4.13Å; A118-W236 HydrophobicContact CB-CZ2 3.71Å; L190-W236 HydrophobicContact CD2-CZ2 3.68Å; T192-W236 HydrophobicContact CG2-CD2 3.69Å; T192-W236 HydrophobicContact CG2-CE3 4.32Å; T192-W236 HydrophobicContact CG2-CG 4.01Å; T192-W236 HydrophobicContact CG2-CH2 4.35Å; T192-W236 HydrophobicContact CG2-CZ2 3.69Å; T192-W236 VanDerWaalsContact CG2-NE1 3.33Å; L233-W236 HydrophobicContact CB-CB 4.43Å; L233-W236 PolarHBondContact O-N 3.5Å; E234-W236 PolarHBondContact O-N 3.49Å
237	H	43.5	Very low	53.1	Low	22 Å²	22	59.1 Å²	59.1	10%	0.102	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-17.5	170.3	-70.7	-107.5	0	0	0	116.8	P123 D210 N235	P123-H237 WeakPolarHBondContact CD-O 3.07Å; P123-H237 WeakPolarHBondContact CG-O 3.3Å; D210-H237 IonicContact OD1-CD2 3.17Å; D210-H237 PolarHBondContact OD1-CD2 3.08Å; D210-H237 IonicContact OD1-CE1 3.21Å; D210-H237 IonicContact OD1-CG 3.45Å; D210-H237 IonicContact OD1-NE2 2.83Å; D210-H237 PolarHBondContact OD1-NE2 2.9Å; D210-H237 VanDerWaalsContact OD1-NE2 3.17Å; D210-H237 IonicContact OD2-CD2 2.82Å; D210-H237 PolarHBondContact OD2-CD2 2.88Å; D210-H237 VanDerWaalsContact OD2-CD2 3.26Å; D210-H237 IonicContact OD2-CE1 3.08Å; D210-H237 PolarHBondContact OD2-CE1 3.3Å; D210-H237 IonicContact OD2-CG 2.69Å; D210-H237 VanDerWaalsContact OD2-CG 3.27Å; D210-H237 IonicContact OD2-ND1 2.83Å; D210-H237 PolarHBondContact OD2-ND1 3.43Å; D210-H237 IonicContact OD2-NE2 3.47Å; D210-H237 PolarHBondContact OD2-NE2 3.44Å; N235-H237 CarbonylContact O-C 3.55Å; N235-H237 PolarHBondContact O-N 2.97Å
238	N	35.2	Very low	51.8	Low	84 Å²	84	54.7 Å²	54.7	45%	0.449	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	0.6	179.1	-70.6	-20.9	0	0	0	114	N235 F240 V241 F242	N235-N238 HydrophobicContact CB-CB 3.95Å; N235-N238 CarbonylContact O-C 3.21Å; N235-N238 PolarHBondContact O-N 2.86Å; N238-F240 VanDerWaalsContact C-N 3.34Å; N238-V241 WeakPolarHBondContact O-CA 3.05Å; N238-V241 WeakPolarHBondContact O-CB 3.4Å; N238-V241 PolarHBondContact O-N 3.1Å; N238-F242 PolarHBondContact O-N 3.42Å; N238-F242 VanDerWaalsContact O-N 3.08Å
239	A	33.9	Very low	50.2	Low	8 Å²	8	56 Å²	56	7%	0.066	28%	0.279	C	S	.	.	H	α-helix	trans	-82	-28.6	-164.9	0	0	0	0	0	109.7	E234 N235 V241 C244	E234-A239 WeakPolarHBondContact O-CB 3.39Å; N235-A239 HydrophobicContact CB-CB 3.5Å; N235-A239 WeakPolarHBondContact O-CA 3.45Å; N235-A239 WeakPolarHBondContact O-CB 3.45Å; N235-A239 PolarHBondContact O-N 2.51Å; A239-V241 PolarHBondContact O-N 2.91Å; A239-C244 HydrophobicContact CB-CB 4.38Å; A239-C244 WeakPolarHBondContact O-CB 3.44Å; A239-C244 PolarHBondContact O-N 2.97Å; A239-C244 VanDerWaalsContact O-N 3.16Å
240	F	34	Very low	48.5	Very low	51 Å²	51	56.1 Å²	56.1	22%	0.224	28%	0.283	C	S	.	.	H	α-helix	trans	-66.4	-20.1	166.2	-101.9	-131.2	0	0	0	112.7	N238 K268	N238-F240 VanDerWaalsContact C-N 3.34Å; F240-K268 HydrophobicContact CD1-CB 4.42Å; F240-K268 HydrophobicContact CD1-CD 3.25Å; F240-K268 HydrophobicContact CD1-CG 3.86Å; F240-K268 HydrophobicContact CE1-CB 3.74Å; F240-K268 HydrophobicContact CE1-CD 3.05Å; F240-K268 HydrophobicContact CE1-CG 3.09Å; F240-K268 HydrophobicContact CE2-CD 4.35Å; F240-K268 VanDerWaalsContact CE2-CE 3.49Å; F240-K268 HydrophobicContact CG-CD 4.05Å; F240-K268 HydrophobicContact CZ-CD 3.64Å; F240-K268 HydrophobicContact CZ-CG 3.52Å; F240-K268 PolarHBondContact O-NZ 3.48Å
241	V	31.1	Very low	46.9	Very low	41 Å²	41	55.8 Å²	55.8	25%	0.248	28%	0.283	C	S	.	.	H	α-helix	trans	-97.7	-34	-179.3	-157.5	0	0	0	0	112.7	S121 Q122 N238 A239	S121-V241 WeakPolarHBondContact O-CG2 3.21Å; Q122-V241 HydrophobicContact CG-CG1 4.28Å; Q122-V241 HydrophobicContact CG-CG2 3.77Å; N238-V241 WeakPolarHBondContact O-CA 3.05Å; N238-V241 WeakPolarHBondContact O-CB 3.4Å; N238-V241 PolarHBondContact O-N 3.1Å; A239-V241 PolarHBondContact O-N 2.91Å
242	F	27.8	Very low	45.4	Very low	139 Å²	139	62.5 Å²	62.5	61%	0.61	31%	0.307	S	S	*	.	H	α-helix	trans	-145.6	5.6	-167.7	-82.6	-72.4	0	0	0	121.3	N238 M321	N238-F242 PolarHBondContact O-N 3.42Å; N238-F242 VanDerWaalsContact O-N 3.08Å; F242-M321 HydrophobicContact CE1-CE 3.65Å; F242-M321 HydrophobicContact CE1-SD 4.14Å; F242-M321 HydrophobicContact CE2-SD 4.26Å; F242-M321 HydrophobicContact CZ-CE 3.51Å; F242-M321 HydrophobicContact CZ-SD 3.42Å; F242-M321 WeakPolarHBondContact CZ-SD 3.03Å
243	K	29	Very low	44.2	Very low	147 Å²	147	61.8 Å²	61.8	64%	0.639	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-157.3	-11.5	170.6	-118.9	172	-176.6	-176.3	0	118.4	S245	K243-S245 PolarHBondContact O-N 2.9Å
244	C	32.4	Very low	43.5	Very low	20 Å²	20	65.2 Å²	65.2	14%	0.135	33%	0.326	C	S	.	.	S	Bend	trans	-87.4	73.2	156.4	-84.9	0	0	0	0	108	M150 A239 Q246	M150-C244 HydrophobicContact CE-CB 3.61Å; M150-C244 WeakPolarHBondContact CE-SG 3.41Å; A239-C244 HydrophobicContact CB-CB 4.38Å; A239-C244 WeakPolarHBondContact O-CB 3.44Å; A239-C244 PolarHBondContact O-N 2.97Å; A239-C244 VanDerWaalsContact O-N 3.16Å; C244-Q246 PolarHBondContact O-N 3.13Å
245	S	36.7	Very low	43	Very low	111 Å²	111	66 Å²	66	78%	0.776	34%	0.338	S	S	*	.			trans	-70.2	24.6	-169.8	40.9	0	0	0	0	115.2	K243	K243-S245 PolarHBondContact O-N 2.9Å
246	Q	45.3	Very low	43.4	Very low	94 Å²	94	67.7 Å²	67.7	44%	0.439	34%	0.344	S	S	.	.			trans	-126.6	98.8	179.2	-62.2	-171.8	3.2	0	0	109.9	C244 I248	C244-Q246 PolarHBondContact O-N 3.13Å; Q246-I248 PolarHBondContact O-N 3.21Å; Q246-I248 VanDerWaalsContact O-N 3.11Å
247	L	48.5	Very low	43.8	Very low	59 Å²	59	70.5 Å²	70.5	31%	0.309	38%	0.377	S	S	.	.			trans	-58.6	105.8	152.8	177.6	69.2	0	0	0	106.3	I249 I266 K268 V270 F313	L247-I249 HydrophobicContact CD2-CD1 3.74Å; L247-I249 HydrophobicContact CD2-CG1 3.9Å; L247-I249 HydrophobicContact CG-CD1 4.18Å; L247-I249 HydrophobicContact CG-CG1 3.77Å; L247-I249 PolarHBondContact O-N 3.07Å; L247-I266 HydrophobicContact CD1-CG2 3.6Å; L247-I266 HydrophobicContact CG-CG2 4.27Å; L247-K268 HydrophobicContact CD1-CB 3.73Å; L247-K268 HydrophobicContact CD1-CD 3.75Å; L247-K268 HydrophobicContact CD1-CG 3.62Å; L247-V270 HydrophobicContact CD1-CG1 3.87Å; L247-V270 HydrophobicContact CD2-CG1 4.09Å; L247-F313 HydrophobicContact CD2-CD2 3.85Å; L247-F313 HydrophobicContact CD2-CE2 3.37Å; L247-F313 HydrophobicContact CD2-CZ 4.16Å
248	I	47.9	Very low	44.3	Very low	29 Å²	29	75.2 Å²	75.2	15%	0.149	40%	0.399	C	S	.	.			trans	-78	113	174.9	-59.6	-176.7	0	0	0	106.9	K149 Q246 V250 L267	K149-I248 HydrophobicContact CB-CD1 4.11Å; Q246-I248 PolarHBondContact O-N 3.21Å; Q246-I248 VanDerWaalsContact O-N 3.11Å; I248-V250 HydrophobicContact CG2-CG2 3.98Å; I248-L267 HydrophobicContact CB-CB 4.43Å; I248-L267 HydrophobicContact CB-CD1 3.52Å; I248-L267 HydrophobicContact CB-CG 3.8Å; I248-L267 HydrophobicContact CD1-CD1 3.65Å; I248-L267 HydrophobicContact CG1-CD1 3.98Å; I248-L267 HydrophobicContact CG2-CD1 3.86Å; I248-L267 HydrophobicContact CG2-CG 4.08Å; I248-L267 PolarHBondContact O-N 3.17Å
249	I	51.4	Low	45.2	Very low	27 Å²	27	73.5 Å²	73.5	14%	0.138	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	107.9	171.7	-51.4	177.4	0	0	0	105.9	L247 V251 V264 E265 I266 F313 F326	L247-I249 HydrophobicContact CD2-CD1 3.74Å; L247-I249 HydrophobicContact CD2-CG1 3.9Å; L247-I249 HydrophobicContact CG-CD1 4.18Å; L247-I249 HydrophobicContact CG-CG1 3.77Å; L247-I249 PolarHBondContact O-N 3.07Å; I249-V251 HydrophobicContact CG2-CG2 3.72Å; I249-V264 HydrophobicContact CG2-CG1 3.34Å; I249-E265 CarbonylContact C-O 3.59Å; I249-E265 WeakPolarHBondContact CA-O 3.39Å; I249-I266 HydrophobicContact CG2-CG1 4.25Å; I249-F313 HydrophobicContact CD1-CE2 3.69Å; I249-F313 HydrophobicContact CD1-CZ 4.01Å; I249-F326 HydrophobicContact CD1-CD2 4.28Å; I249-F326 HydrophobicContact CD1-CE1 4.45Å; I249-F326 HydrophobicContact CD1-CE2 3.53Å; I249-F326 HydrophobicContact CD1-CZ 3.56Å
250	V	50.2	Low	46.1	Very low	39 Å²	39	74.7 Å²	74.7	24%	0.236	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	106.8	170.4	178.6	0	0	0	0	107.2	I248 R252 V264 E265	I248-V250 HydrophobicContact CG2-CG2 3.98Å; V250-R252 HydrophobicContact CG1-CG 4.09Å; V250-V264 CarbonylContact O-C 3.31Å; V250-V264 WeakPolarHBondContact O-CA 3.34Å; V250-E265 HydrophobicContact CB-CB 4.11Å; V250-E265 PolarHBondContact N-O 2.63Å; V250-E265 PolarHBondContact O-N 3.39Å
251	V	53.3	Low	47.3	Very low	35 Å²	35	77.4 Å²	77.4	21%	0.212	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	117.1	174.1	-177.7	0	0	0	0	108.3	I249 M253 V262 D263 V264 L342	I249-V251 HydrophobicContact CG2-CG2 3.72Å; V251-M253 HydrophobicContact CG1-CG 4.46Å; V251-V262 HydrophobicContact CG1-CG1 3.54Å; V251-D263 CarbonylContact C-O 3.53Å; V251-V264 HydrophobicContact CG1-CG2 4.33Å; V251-V264 HydrophobicContact CG2-CG1 4.23Å; V251-V264 HydrophobicContact CG2-CG2 4.23Å; V251-L342 HydrophobicContact CB-CD2 3.93Å; V251-L342 HydrophobicContact CG1-CD2 4.15Å
252	R	52.8	Low	48.5	Very low	142 Å²	142	76.3 Å²	76.3	54%	0.536	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.2	172.1	-53	-176	-166	-176.4	7.2	108.7	V250 V262 D263 E265	V250-R252 HydrophobicContact CG1-CG 4.09Å; R252-V262 CarbonylContact O-C 3.59Å; R252-V262 WeakPolarHBondContact O-CA 3.49Å; R252-D263 HydrophobicContact CB-CB 4.29Å; R252-D263 PolarHBondContact N-O 2.82Å; R252-D263 PolarHBondContact O-N 2.92Å; R252-E265 IonicContact CZ-OE2 3.77Å; R252-E265 IonicContact NE-OE2 3.11Å; R252-E265 IonicContact NH2-OE2 3.4Å; R252-E265 PolarHBondContact NH2-OE2 3.21Å
253	M	52.9	Low	50	Low	57 Å²	57	71 Å²	71	28%	0.281	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.5	175.8	-66.1	-175.2	60.4	0	0	109.4	V251 R261 V262 L331 L342	V251-M253 HydrophobicContact CG1-CG 4.46Å; M253-R261 CarbonylContact C-O 3.47Å; M253-R261 WeakPolarHBondContact CA-O 3.45Å; M253-V262 HydrophobicContact CE-CG2 4.35Å; M253-V262 HydrophobicContact CG-CG1 4.22Å; M253-V262 HydrophobicContact CG-CG2 4.1Å; M253-L331 HydrophobicContact SD-CD1 4.47Å; M253-L331 HydrophobicContact SD-CD2 3.67Å; M253-L342 HydrophobicContact SD-CD1 3.9Å
254	N	55.1	Low	51.3	Low	84 Å²	84	64.5 Å²	64.5	45%	0.449	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.8	174.1	-71.3	-31.3	0	0	0	108.9	M260 R261 D263	N254-M260 CarbonylContact O-C 3.59Å; N254-M260 WeakPolarHBondContact O-CA 3.48Å; N254-R261 HydrophobicContact CB-CB 4.27Å; N254-R261 PolarHBondContact N-O 3.22Å; N254-R261 PolarHBondContact O-N 2.8Å; N254-D263 PolarHBondContact ND2-OD2 3.12Å
255	C	48.5	Very low	52.4	Low	83 Å²	83	67 Å²	67	56%	0.561	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	109.3	175.5	-62.5	0	0	0	0	109.2
256	E	56.8	Low	53.3	Low	101 Å²	101	61.7 Å²	61.7	47%	0.472	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	160.3	169.8	-63.1	178.7	-130.6	0	0	110.2	Q258 H259	E256-Q258 PolarHBondContact O-N 2.77Å; E256-H259 CarbonylContact C-O 3.54Å; E256-H259 WeakPolarHBondContact CA-O 3.45Å; E256-H259 WeakPolarHBondContact CB-O 3.15Å; E256-H259 VanDerWaalsContact CD-CE1 3.42Å; E256-H259 PolarHBondContact N-O 3.41Å; E256-H259 CarbonylContact O-C 3.58Å; E256-H259 PolarHBondContact O-N 2.79Å; E256-H259 VanDerWaalsContact O-N 3.13Å; E256-H259 VanDerWaalsContact O-O 3.09Å; E256-H259 IonicContact OE1-CD2 3.87Å; E256-H259 IonicContact OE1-CE1 2.74Å; E256-H259 IonicContact OE1-NE2 3.18Å; E256-H259 PolarHBondContact OE1-NE2 2.82Å; E256-H259 IonicContact OE2-CE1 3.97Å; E256-H259 PolarHBondContact OE2-CE1 2.85Å; E256-H259 IonicContact OE2-NE2 2.63Å; E256-H259 PolarHBondContact OE2-NE2 2.85Å
257	A	53.6	Low	53.6	Low	107 Å²	107	59.1 Å²	59.1	88%	0.884	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.3	-171.7	0	0	0	0	0	114.8
258	Q	54.9	Low	53.8	Low	121 Å²	121	57.4 Å²	57.4	57%	0.565	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-4.2	179.1	-62.4	-167.8	7.7	0	0	113.6	E256 R299	E256-Q258 PolarHBondContact O-N 2.77Å; Q258-R299 VanDerWaalsContact O-CA 3.25Å; Q258-R299 WeakPolarHBondContact O-CA 3.41Å
259	H	53.9	Low	54.3	Low	48 Å²	48	57 Å²	57	22%	0.222	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	139.3	-179	56.8	-82.4	0	0	0	113.4	E256 A297 F298	E256-H259 CarbonylContact C-O 3.54Å; E256-H259 WeakPolarHBondContact CA-O 3.45Å; E256-H259 WeakPolarHBondContact CB-O 3.15Å; E256-H259 VanDerWaalsContact CD-CE1 3.42Å; E256-H259 PolarHBondContact N-O 3.41Å; E256-H259 CarbonylContact O-C 3.58Å; E256-H259 PolarHBondContact O-N 2.79Å; E256-H259 VanDerWaalsContact O-N 3.13Å; E256-H259 VanDerWaalsContact O-O 3.09Å; E256-H259 IonicContact OE1-CD2 3.87Å; E256-H259 IonicContact OE1-CE1 2.74Å; E256-H259 IonicContact OE1-NE2 3.18Å; E256-H259 PolarHBondContact OE1-NE2 2.82Å; E256-H259 IonicContact OE2-CE1 3.97Å; E256-H259 PolarHBondContact OE2-CE1 2.85Å; E256-H259 IonicContact OE2-NE2 2.63Å; E256-H259 PolarHBondContact OE2-NE2 2.85Å; H259-A297 HydrophobicContact CB-CB 3.51Å; H259-F298 VanDerWaalsContact CA-O 3.29Å; H259-F298 WeakPolarHBondContact CA-O 3.47Å
260	M	51.7	Low	54.6	Low	33 Å²	33	56.3 Å²	56.3	16%	0.163	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	147.7	159.3	-63.1	178.3	-76.3	0	0	108.4	N254 M296 A297 F298 T300	N254-M260 CarbonylContact O-C 3.59Å; N254-M260 WeakPolarHBondContact O-CA 3.48Å; M260-M296 CarbonylContact O-C 3.58Å; M260-A297 WeakPolarHBondContact O-CA 3.38Å; M260-F298 HydrophobicContact CB-CB 4.25Å; M260-F298 HydrophobicContact CB-CD2 4.05Å; M260-F298 HydrophobicContact CE-CB 3.8Å; M260-F298 HydrophobicContact CE-CD2 4.32Å; M260-F298 HydrophobicContact CE-CG 4.05Å; M260-F298 PolarHBondContact O-N 3.01Å; M260-T300 HydrophobicContact CE-CG2 4.26Å
261	R	59.6	Low	54.7	Low	109 Å²	109	56.5 Å²	56.5	41%	0.411	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	127.1	173.5	172.7	177.6	176.4	150.5	3.6	107.6	M253 N254 D263	M253-R261 CarbonylContact C-O 3.47Å; M253-R261 WeakPolarHBondContact CA-O 3.45Å; N254-R261 HydrophobicContact CB-CB 4.27Å; N254-R261 PolarHBondContact N-O 3.22Å; N254-R261 PolarHBondContact O-N 2.8Å; R261-D263 IonicContact CZ-OD1 2.86Å; R261-D263 IonicContact NE-OD1 2.94Å; R261-D263 PolarHBondContact NE-OD1 3.18Å; R261-D263 IonicContact NE-OD2 3.83Å; R261-D263 PolarHBondContact NE-OD2 3.5Å; R261-D263 IonicContact NH2-OD1 2.89Å; R261-D263 PolarHBondContact NH2-OD1 2.02Å; R261-D263 VanDerWaalsContact NH2-OD1 3.11Å
262	V	57	Low	55.1	Low	18 Å²	18	55.2 Å²	55.2	11%	0.109	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.4	175.2	-172.2	0	0	0	0	108	V251 R252 M253 V264 F309	V251-V262 HydrophobicContact CG1-CG1 3.54Å; R252-V262 CarbonylContact O-C 3.59Å; R252-V262 WeakPolarHBondContact O-CA 3.49Å; M253-V262 HydrophobicContact CE-CG2 4.35Å; M253-V262 HydrophobicContact CG-CG1 4.22Å; M253-V262 HydrophobicContact CG-CG2 4.1Å; V262-V264 HydrophobicContact CG1-CG2 4.06Å; V262-F309 HydrophobicContact CG2-CZ 4.41Å
263	D	58.7	Low	55.5	Low	26 Å²	26	51.6 Å²	51.6	14%	0.139	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	111.2	175	-57.1	-61.6	0	0	0	108.1	V251 R252 N254 R261 T294	V251-D263 CarbonylContact C-O 3.53Å; R252-D263 HydrophobicContact CB-CB 4.29Å; R252-D263 PolarHBondContact N-O 2.82Å; R252-D263 PolarHBondContact O-N 2.92Å; N254-D263 PolarHBondContact ND2-OD2 3.12Å; R261-D263 IonicContact CZ-OD1 2.86Å; R261-D263 IonicContact NE-OD1 2.94Å; R261-D263 PolarHBondContact NE-OD1 3.18Å; R261-D263 IonicContact NE-OD2 3.83Å; R261-D263 PolarHBondContact NE-OD2 3.5Å; R261-D263 IonicContact NH2-OD1 2.89Å; R261-D263 PolarHBondContact NH2-OD1 2.02Å; R261-D263 VanDerWaalsContact NH2-OD1 3.11Å; D263-T294 HydrophobicContact CB-CG2 4.35Å; D263-T294 WeakPolarHBondContact OD1-CG2 3.26Å
264	V	56.3	Low	55.7	Low	12 Å²	12	49.5 Å²	49.5	7%	0.073	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	112.6	177.7	-176.1	0	0	0	0	108.1	I249 V250 V251 V262 I266 T292 A293	I249-V264 HydrophobicContact CG2-CG1 3.34Å; V250-V264 CarbonylContact O-C 3.31Å; V250-V264 WeakPolarHBondContact O-CA 3.34Å; V251-V264 HydrophobicContact CG1-CG2 4.33Å; V251-V264 HydrophobicContact CG2-CG1 4.23Å; V251-V264 HydrophobicContact CG2-CG2 4.23Å; V262-V264 HydrophobicContact CG1-CG2 4.06Å; V264-I266 HydrophobicContact CG1-CD1 3.91Å; V264-I266 HydrophobicContact CG1-CG1 3.78Å; V264-T292 CarbonylContact O-C 3.57Å; V264-T292 WeakPolarHBondContact O-CA 3.37Å; V264-A293 HydrophobicContact CB-CB 4.12Å; V264-A293 HydrophobicContact CG2-CB 4.5Å; V264-A293 PolarHBondContact N-O 2.95Å; V264-A293 PolarHBondContact O-N 3.34Å
265	E	55.3	Low	55.9	Low	71 Å²	71	46 Å²	46	33%	0.332	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124.9	175.6	170.4	-177.7	-162.5	0	0	109.1	I249 V250 R252	I249-E265 CarbonylContact C-O 3.59Å; I249-E265 WeakPolarHBondContact CA-O 3.39Å; V250-E265 HydrophobicContact CB-CB 4.11Å; V250-E265 PolarHBondContact N-O 2.63Å; V250-E265 PolarHBondContact O-N 3.39Å; R252-E265 IonicContact CZ-OE2 3.77Å; R252-E265 IonicContact NE-OE2 3.11Å; R252-E265 IonicContact NH2-OE2 3.4Å; R252-E265 PolarHBondContact NH2-OE2 3.21Å
266	I	56.3	Low	56.3	Low	1 Å²	1	42.8 Å²	42.8	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	126.5	-172.2	-50.3	-177	0	0	0	108.1	L247 I249 V264 K268 V270 M287 W291 F313	L247-I266 HydrophobicContact CD1-CG2 3.6Å; L247-I266 HydrophobicContact CG-CG2 4.27Å; I249-I266 HydrophobicContact CG2-CG1 4.25Å; V264-I266 HydrophobicContact CG1-CD1 3.91Å; V264-I266 HydrophobicContact CG1-CG1 3.78Å; I266-K268 WeakPolarHBondContact CG2-O 3.32Å; I266-K268 PolarHBondContact O-N 3.15Å; I266-V270 HydrophobicContact CD1-CG2 3.33Å; I266-V270 HydrophobicContact CG1-CG2 4.49Å; I266-V270 HydrophobicContact CG2-CG1 3.86Å; I266-V270 HydrophobicContact CG2-CG2 4.23Å; I266-M287 HydrophobicContact CD1-CE 3.45Å; I266-M287 VanDerWaalsContact CD1-CE 3.45Å; I266-M287 HydrophobicContact CD1-SD 4.14Å; I266-M287 HydrophobicContact CG1-CE 4.49Å; I266-W291 PolarHBondContact N-O 3.3Å; I266-W291 VanDerWaalsContact O-CE3 3.24Å; I266-F313 HydrophobicContact CD1-CE1 4.34Å; I266-F313 HydrophobicContact CD1-CZ 4.03Å
267	L	51.3	Low	56.3	Low	39 Å²	39	40.3 Å²	40.3	20%	0.204	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	0.9	-178.4	-59	-169.7	0	0	0	114.4	P144 I248 W291	P144-L267 HydrophobicContact CB-CD1 4.33Å; P144-L267 HydrophobicContact CB-CD2 4.34Å; P144-L267 HydrophobicContact CG-CD1 3.44Å; P144-L267 VanDerWaalsContact CG-CD1 3.44Å; P144-L267 HydrophobicContact CG-CD2 3.61Å; P144-L267 HydrophobicContact CG-CG 4.14Å; I248-L267 HydrophobicContact CB-CB 4.43Å; I248-L267 HydrophobicContact CB-CD1 3.52Å; I248-L267 HydrophobicContact CB-CG 3.8Å; I248-L267 HydrophobicContact CD1-CD1 3.65Å; I248-L267 HydrophobicContact CG1-CD1 3.98Å; I248-L267 HydrophobicContact CG2-CD1 3.86Å; I248-L267 HydrophobicContact CG2-CG 4.08Å; I248-L267 PolarHBondContact O-N 3.17Å; L267-W291 WeakPolarHBondContact O-CZ3 3.33Å
268	K	53.5	Low	56.3	Low	23 Å²	23	41.4 Å²	41.4	10%	0.1	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	145.2	-179.7	-44.3	-163.5	170.3	-164.1	0	108.2	F240 L247 I266 V270	F240-K268 HydrophobicContact CD1-CB 4.42Å; F240-K268 HydrophobicContact CD1-CD 3.25Å; F240-K268 HydrophobicContact CD1-CG 3.86Å; F240-K268 HydrophobicContact CE1-CB 3.74Å; F240-K268 HydrophobicContact CE1-CD 3.05Å; F240-K268 HydrophobicContact CE1-CG 3.09Å; F240-K268 HydrophobicContact CE2-CD 4.35Å; F240-K268 VanDerWaalsContact CE2-CE 3.49Å; F240-K268 HydrophobicContact CG-CD 4.05Å; F240-K268 HydrophobicContact CZ-CD 3.64Å; F240-K268 HydrophobicContact CZ-CG 3.52Å; F240-K268 PolarHBondContact O-NZ 3.48Å; L247-K268 HydrophobicContact CD1-CB 3.73Å; L247-K268 HydrophobicContact CD1-CD 3.75Å; L247-K268 HydrophobicContact CD1-CG 3.62Å; I266-K268 WeakPolarHBondContact CG2-O 3.32Å; I266-K268 PolarHBondContact O-N 3.15Å; K268-V270 PolarHBondContact O-N 3.32Å; K268-V270 VanDerWaalsContact O-N 3.07Å
269	L	57.1	Low	56.7	Low	21 Å²	21	38.5 Å²	38.5	11%	0.11	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	114.3	168.3	-71.1	162.4	0	0	0	108.5	F74 A115 V120 N289 W291	F74-L269 HydrophobicContact CD1-CD1 3.81Å; F74-L269 HydrophobicContact CE1-CD1 3.73Å; A115-L269 HydrophobicContact CB-CD1 3.38Å; V120-L269 HydrophobicContact CG1-CD1 4.23Å; L269-N289 HydrophobicContact CD2-CB 3.91Å; L269-N289 WeakPolarHBondContact CD2-O 3.46Å; L269-W291 HydrophobicContact CD1-CZ2 4.14Å; L269-W291 HydrophobicContact CD2-CD2 4.3Å; L269-W291 HydrophobicContact CD2-CG 4.33Å; L269-W291 HydrophobicContact CD2-CZ2 4.24Å; L269-W291 HydrophobicContact CG-CZ2 3.84Å
270	V	57.6	Low	57.2	Low	13 Å²	13	39 Å²	39	8%	0.079	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	140.7	174.4	-69.1	0	0	0	0	109.9	L247 I266 K268 M287 N289 F313	L247-V270 HydrophobicContact CD1-CG1 3.87Å; L247-V270 HydrophobicContact CD2-CG1 4.09Å; I266-V270 HydrophobicContact CD1-CG2 3.33Å; I266-V270 HydrophobicContact CG1-CG2 4.49Å; I266-V270 HydrophobicContact CG2-CG1 3.86Å; I266-V270 HydrophobicContact CG2-CG2 4.23Å; K268-V270 PolarHBondContact O-N 3.32Å; K268-V270 VanDerWaalsContact O-N 3.07Å; V270-M287 HydrophobicContact CG2-CE 3.82Å; V270-M287 HydrophobicContact CG2-SD 4.2Å; V270-N289 PolarHBondContact O-N 2.98Å; V270-F313 HydrophobicContact CB-CD1 3.76Å; V270-F313 HydrophobicContact CB-CE1 3.63Å; V270-F313 HydrophobicContact CB-CZ 4.27Å; V270-F313 HydrophobicContact CG1-CD1 4.17Å; V270-F313 HydrophobicContact CG1-CE1 3.97Å; V270-F313 HydrophobicContact CG1-CE2 4.42Å; V270-F313 HydrophobicContact CG1-CZ 4.12Å; V270-F313 HydrophobicContact CG2-CD1 4.13Å; V270-F313 HydrophobicContact CG2-CE1 3.52Å; V270-F313 HydrophobicContact CG2-CZ 4.13Å
271	N	53.4	Low	57.9	Low	42 Å²	42	43.4 Å²	43.4	23%	0.225	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.7	163.8	-69.3	-43.8	0	0	0	107.2	M287 I288 N289 A314	N271-M287 WeakPolarHBondContact CA-O 3.34Å; N271-I288 WeakPolarHBondContact OD1-CA 3.36Å; N271-N289 PolarHBondContact ND2-OD1 3.34Å; N271-N289 VanDerWaalsContact ND2-OD1 3.13Å; N271-N289 PolarHBondContact OD1-N 3.04Å; N271-N289 PolarHBondContact OD1-OD1 2.97Å; N271-A314 CarbonylContact O-C 3.35Å; N271-A314 PolarHBondContact O-N 3.03Å
272	G	61.8	Low	58	Low	9 Å²	9	47.8 Å²	47.8	9%	0.093	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173	-169.7	-177.2	0	0	0	0	0	113.1	M287 I312	G272-M287 PolarHBondContact N-O 2.8Å; G272-M287 WeakPolarHBondContact O-CA 3.38Å; G272-M287 PolarHBondContact O-N 3.07Å; G272-I312 CarbonylContact C-O 3.56Å; G272-I312 WeakPolarHBondContact CA-O 3.33Å
273	E	59.5	Low	57.8	Low	66 Å²	66	47.6 Å²	47.6	31%	0.308	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	131.9	178.4	-60.9	-170	164	0	0	109.5	T275 I285 R286 I312	E273-T275 HydrophobicContact CB-CG2 4.38Å; E273-I285 CarbonylContact C-O 3.53Å; E273-I285 VanDerWaalsContact CA-O 3.3Å; E273-I285 WeakPolarHBondContact CA-O 2.99Å; E273-R286 HydrophobicContact CG-CG 4.4Å; E273-I312 PolarHBondContact N-O 3.19Å; E273-I312 PolarHBondContact O-N 3.37Å; E273-I312 VanDerWaalsContact O-O 3.12Å
274	V	58.2	Low	57.8	Low	13 Å²	13	52.4 Å²	52.4	8%	0.079	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	121	168.1	178.1	0	0	0	0	107.3	R284 I285 M287 A293	V274-R284 CarbonylContact O-C 3.51Å; V274-R284 WeakPolarHBondContact O-CA 3.45Å; V274-I285 HydrophobicContact CB-CB 4.21Å; V274-I285 HydrophobicContact CB-CD1 4.26Å; V274-I285 HydrophobicContact CG1-CD1 4.31Å; V274-I285 PolarHBondContact N-O 3.47Å; V274-I285 PolarHBondContact O-N 3.18Å; V274-M287 HydrophobicContact CG2-CG 4.19Å; V274-M287 HydrophobicContact CG2-SD 3.59Å; V274-M287 VanDerWaalsContact CG2-SD 3.59Å; V274-A293 HydrophobicContact CG2-CB 4.48Å
275	T	59.5	Low	58.1	Low	9 Å²	9	53.2 Å²	53.2	6%	0.055	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	151.7	-177.8	58.5	0	0	0	0	112	E273 C283 R284 I310	E273-T275 HydrophobicContact CB-CG2 4.38Å; T275-C283 CarbonylContact C-O 3.47Å; T275-C283 WeakPolarHBondContact CA-O 3.45Å; T275-R284 HydrophobicContact CG2-CG 4.12Å; T275-I310 CarbonylContact C-O 3.5Å; T275-I310 WeakPolarHBondContact CA-O 3.41Å; T275-I310 PolarHBondContact N-O 2.84Å; T275-I310 CarbonylContact O-C 3.58Å; T275-I310 PolarHBondContact O-N 2.89Å; T275-I310 PolarHBondContact OG1-O 3.37Å
276	S	56.8	Low	58.3	Low	16 Å²	16	58.6 Å²	58.6	11%	0.112	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	139.4	164.4	165.7	0	0	0	0	110.1	K278 D279 P280 C283	S276-K278 VanDerWaalsContact C-N 3.3Å; S276-K278 PolarHBondContact O-N 3.26Å; S276-K278 PolarHBondContact OG-N 3.05Å; S276-D279 WeakPolarHBondContact CB-O 3.5Å; S276-D279 CarbonylContact O-C 3.51Å; S276-D279 PolarHBondContact OG-N 2.75Å; S276-P280 WeakPolarHBondContact O-CA 2.93Å; S276-C283 PolarHBondContact N-O 3.05Å; S276-C283 VanDerWaalsContact N-O 3.13Å
277	V	55.9	Low	58.2	Low	49 Å²	49	58.8 Å²	58.8	30%	0.297	28%	0.276	S	S	.	.	S	Bend	trans	-62.9	-42.2	174.4	178.9	0	0	0	0	110.9	K308 I310	V277-K308 HydrophobicContact CB-CB 3.85Å; V277-K308 HydrophobicContact CG2-CB 3.78Å; V277-K308 WeakPolarHBondContact CG2-O 3.35Å; V277-K308 PolarHBondContact N-O 3Å; V277-I310 HydrophobicContact CB-CD1 3.85Å; V277-I310 HydrophobicContact CB-CG1 4.31Å; V277-I310 HydrophobicContact CG1-CD1 3.7Å; V277-I310 HydrophobicContact CG2-CB 3.81Å; V277-I310 HydrophobicContact CG2-CD1 3.29Å; V277-I310 HydrophobicContact CG2-CG1 3.25Å
278	K	54.6	Low	58.5	Low	131 Å²	131	61.1 Å²	61.1	57%	0.57	29%	0.288	S	S	*	.	S	Bend	trans	-81.4	-27.4	-172.6	-68.8	-178.3	178.2	171.9	0	111.9	S276 S306	S276-K278 VanDerWaalsContact C-N 3.3Å; S276-K278 PolarHBondContact O-N 3.26Å; S276-K278 PolarHBondContact OG-N 3.05Å; K278-S306 PolarHBondContact NZ-O 2.88Å; K278-S306 PolarHBondContact NZ-OG 2.77Å
279	D	62.9	Low	58.5	Low	59 Å²	59	60.7 Å²	60.7	32%	0.316	29%	0.287	S	S	.	.			trans	-151	81.6	-176.5	-167.4	-19	0	0	0	111.2	S276 N281 R282 C283	S276-D279 WeakPolarHBondContact CB-O 3.5Å; S276-D279 CarbonylContact O-C 3.51Å; S276-D279 PolarHBondContact OG-N 2.75Å; D279-N281 PolarHBondContact O-N 3.46Å; D279-N281 VanDerWaalsContact O-N 3.09Å; D279-N281 PolarHBondContact OD1-N 2.79Å; D279-R282 HydrophobicContact CB-CB 4Å; D279-R282 PolarHBondContact O-N 3.35Å; D279-R282 WeakPolarHBondContact OD1-CB 3.18Å; D279-R282 PolarHBondContact OD1-N 3.44Å; D279-R282 VanDerWaalsContact OD1-N 3.09Å; D279-R282 WeakPolarHBondContact OD2-CB 3.44Å; D279-R282 VanDerWaalsContact OD2-CD 3.23Å; D279-R282 WeakPolarHBondContact OD2-CD 3.45Å; D279-C283 PolarHBondContact O-N 2.86Å
280	P	63.4	Low	58.3	Low	59 Å²	59	61.2 Å²	61.2	38%	0.383	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.3	-175.5	-23.2	32.9	0	0	0	114.4	S276	S276-P280 WeakPolarHBondContact O-CA 2.93Å
281	N	68.2	Low	57.9	Low	125 Å²	125	63.1 Å²	63.1	67%	0.668	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-32.9	-176.9	-68.6	-24.5	0	0	0	112.1	D279 C283 R284	D279-N281 PolarHBondContact O-N 3.46Å; D279-N281 VanDerWaalsContact O-N 3.09Å; D279-N281 PolarHBondContact OD1-N 2.79Å; N281-C283 VanDerWaalsContact C-N 3.34Å; N281-R284 PolarHBondContact OD1-NH2 2.96Å
282	R	60	Low	57.9	Low	202 Å²	202	64.4 Å²	64.4	76%	0.762	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-27.2	179.8	-170.2	173.5	-173.9	-178	3.3	113.4	D279	D279-R282 HydrophobicContact CB-CB 4Å; D279-R282 PolarHBondContact O-N 3.35Å; D279-R282 WeakPolarHBondContact OD1-CB 3.18Å; D279-R282 PolarHBondContact OD1-N 3.44Å; D279-R282 VanDerWaalsContact OD1-N 3.09Å; D279-R282 WeakPolarHBondContact OD2-CB 3.44Å; D279-R282 VanDerWaalsContact OD2-CD 3.23Å; D279-R282 WeakPolarHBondContact OD2-CD 3.45Å
283	C	52.7	Low	57.2	Low	14 Å²	14	64.3 Å²	64.3	10%	0.095	31%	0.306	C	S	.	.	S	Bend	trans	-132.1	73.9	-177.4	-66.7	0	0	0	0	110.1	T275 S276 D279 N281 M296	T275-C283 CarbonylContact C-O 3.47Å; T275-C283 WeakPolarHBondContact CA-O 3.45Å; S276-C283 PolarHBondContact N-O 3.05Å; S276-C283 VanDerWaalsContact N-O 3.13Å; D279-C283 PolarHBondContact O-N 2.86Å; N281-C283 VanDerWaalsContact C-N 3.34Å; C283-M296 VanDerWaalsContact C-CE 3.4Å; C283-M296 VanDerWaalsContact CA-SD 3.56Å; C283-M296 HydrophobicContact CB-CE 3.76Å; C283-M296 HydrophobicContact CB-SD 3.33Å; C283-M296 WeakPolarHBondContact CB-SD 3.15Å; C283-M296 PolarHBondContact SG-SD 3.45Å
284	R	59.5	Low	56.3	Low	127 Å²	127	64.9 Å²	64.9	48%	0.479	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126.4	174.5	-169.2	-178.1	-57.8	-171	5.5	111	V274 T275 N281	V274-R284 CarbonylContact O-C 3.51Å; V274-R284 WeakPolarHBondContact O-CA 3.45Å; T275-R284 HydrophobicContact CG2-CG 4.12Å; N281-R284 PolarHBondContact OD1-NH2 2.96Å
285	I	62.5	Low	55.7	Low	29 Å²	29	66.4 Å²	66.4	15%	0.149	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	116.6	174.6	-47.4	163.9	0	0	0	107.2	E273 V274 S295 M296	E273-I285 CarbonylContact C-O 3.53Å; E273-I285 VanDerWaalsContact CA-O 3.3Å; E273-I285 WeakPolarHBondContact CA-O 2.99Å; V274-I285 HydrophobicContact CB-CB 4.21Å; V274-I285 HydrophobicContact CB-CD1 4.26Å; V274-I285 HydrophobicContact CG1-CD1 4.31Å; V274-I285 PolarHBondContact N-O 3.47Å; V274-I285 PolarHBondContact O-N 3.18Å; I285-S295 WeakPolarHBondContact CD1-O 3.38Å; I285-S295 WeakPolarHBondContact CD1-OG 3.34Å; I285-S295 WeakPolarHBondContact CG1-OG 3.44Å; I285-M296 HydrophobicContact CD1-CE 3.91Å; I285-M296 HydrophobicContact CG1-CE 3.43Å; I285-M296 VanDerWaalsContact CG1-CE 3.43Å
286	R	59	Low	54.6	Low	183 Å²	183	67.9 Å²	67.9	69%	0.691	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	123.2	173.9	-164.9	175.3	179.4	-173	-0.3	108.9	E273 I288	E273-R286 HydrophobicContact CG-CG 4.4Å; R286-I288 HydrophobicContact CG-CD1 4.39Å; R286-I288 HydrophobicContact CG-CG1 4.07Å
287	M	55.7	Low	53.3	Low	5 Å²	5	70.8 Å²	70.8	3%	0.025	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	116.4	172.9	-57.3	-169.7	72	0	0	108.2	I266 V270 N271 G272 V274 A293 F313	I266-M287 HydrophobicContact CD1-CE 3.45Å; I266-M287 VanDerWaalsContact CD1-CE 3.45Å; I266-M287 HydrophobicContact CD1-SD 4.14Å; I266-M287 HydrophobicContact CG1-CE 4.49Å; V270-M287 HydrophobicContact CG2-CE 3.82Å; V270-M287 HydrophobicContact CG2-SD 4.2Å; N271-M287 WeakPolarHBondContact CA-O 3.34Å; G272-M287 PolarHBondContact N-O 2.8Å; G272-M287 WeakPolarHBondContact O-CA 3.38Å; G272-M287 PolarHBondContact O-N 3.07Å; V274-M287 HydrophobicContact CG2-CG 4.19Å; V274-M287 HydrophobicContact CG2-SD 3.59Å; V274-M287 VanDerWaalsContact CG2-SD 3.59Å; M287-A293 HydrophobicContact CE-CB 3.4Å; M287-A293 VanDerWaalsContact CE-CB 3.4Å; M287-A293 HydrophobicContact CG-CB 4.11Å; M287-A293 HydrophobicContact SD-CB 3.66Å; M287-F313 HydrophobicContact SD-CE1 4.22Å
288	I	56.5	Low	52.3	Low	89 Å²	89	70.3 Å²	70.3	46%	0.456	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	111.3	173.7	-55.7	176.6	0	0	0	106.2	L73 N271 R286 S290	L73-I288 HydrophobicContact CD2-CG2 4.41Å; N271-I288 WeakPolarHBondContact OD1-CA 3.36Å; R286-I288 HydrophobicContact CG-CD1 4.39Å; R286-I288 HydrophobicContact CG-CG1 4.07Å; I288-S290 PolarHBondContact O-N 3.34Å
289	N	53.4	Low	51	Low	13 Å²	13	74 Å²	74	7%	0.07	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	44	44.5	179.8	-58.1	-46.9	0	0	0	112	L73 F74 L269 V270 N271	L73-N289 WeakPolarHBondContact CB-ND2 3.36Å; L73-N289 WeakPolarHBondContact O-CB 3.26Å; L73-N289 PolarHBondContact O-ND2 3.35Å; F74-N289 HydrophobicContact CD1-CB 4.08Å; F74-N289 HydrophobicContact CE1-CB 4.06Å; F74-N289 VanDerWaalsContact CE1-CG 3.48Å; F74-N289 VanDerWaalsContact CE1-OD1 3.27Å; F74-N289 WeakPolarHBondContact CE1-OD1 3.47Å; L269-N289 HydrophobicContact CD2-CB 3.91Å; L269-N289 WeakPolarHBondContact CD2-O 3.46Å; V270-N289 PolarHBondContact O-N 2.98Å; N271-N289 PolarHBondContact ND2-OD1 3.34Å; N271-N289 VanDerWaalsContact ND2-OD1 3.13Å; N271-N289 PolarHBondContact OD1-N 3.04Å; N271-N289 PolarHBondContact OD1-OD1 2.97Å
290	S	52.8	Low	49.5	Very low	32 Å²	32	74.4 Å²	74.4	22%	0.224	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.6	-174.6	-161.2	0	0	0	0	110.7	I288 T292	I288-S290 PolarHBondContact O-N 3.34Å; S290-T292 VanDerWaalsContact C-N 3.27Å; S290-T292 PolarHBondContact OG-N 2.85Å; S290-T292 PolarHBondContact OG-O 2.95Å
291	W	50.4	Low	47.7	Very low	54 Å²	54	82.2 Å²	82.2	21%	0.205	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	-24.9	167.4	-67.4	97.6	0	0	0	112.1	K99 S114 T119 I266 L267 L269	K99-W291 HydrophobicContact CD-CZ2 4.47Å; K99-W291 HydrophobicContact CG-CZ2 3.94Å; S114-W291 WeakPolarHBondContact O-CZ2 3.47Å; S114-W291 PolarHBondContact O-NE1 3.29Å; T119-W291 VanDerWaalsContact CB-CZ2 3.44Å; T119-W291 HydrophobicContact CG2-CH2 3.3Å; T119-W291 HydrophobicContact CG2-CZ2 3.54Å; I266-W291 PolarHBondContact N-O 3.3Å; I266-W291 VanDerWaalsContact O-CE3 3.24Å; L267-W291 WeakPolarHBondContact O-CZ3 3.33Å; L269-W291 HydrophobicContact CD1-CZ2 4.14Å; L269-W291 HydrophobicContact CD2-CD2 4.3Å; L269-W291 HydrophobicContact CD2-CG 4.33Å; L269-W291 HydrophobicContact CD2-CZ2 4.24Å; L269-W291 HydrophobicContact CG-CZ2 3.84Å
292	T	51.6	Low	45.7	Very low	69 Å²	69	85.7 Å²	85.7	42%	0.423	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	125.1	-176.1	52.7	0	0	0	0	111.1	V264 S290	V264-T292 CarbonylContact O-C 3.57Å; V264-T292 WeakPolarHBondContact O-CA 3.37Å; S290-T292 VanDerWaalsContact C-N 3.27Å; S290-T292 PolarHBondContact OG-N 2.85Å; S290-T292 PolarHBondContact OG-O 2.95Å
293	A	47.5	Very low	44.1	Very low	7 Å²	7	85.9 Å²	85.9	6%	0.058	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	103.9	158.8	0	0	0	0	0	108.1	V264 V274 M287	V264-A293 HydrophobicContact CB-CB 4.12Å; V264-A293 HydrophobicContact CG2-CB 4.5Å; V264-A293 PolarHBondContact N-O 2.95Å; V264-A293 PolarHBondContact O-N 3.34Å; V274-A293 HydrophobicContact CG2-CB 4.48Å; M287-A293 HydrophobicContact CE-CB 3.4Å; M287-A293 VanDerWaalsContact CE-CB 3.4Å; M287-A293 HydrophobicContact CG-CB 4.11Å; M287-A293 HydrophobicContact SD-CB 3.66Å
294	T	41.8	Very low	42.9	Very low	77 Å²	77	91.5 Å²	91.5	47%	0.472	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	104.1	165.7	46.5	0	0	0	0	107.8	D263	D263-T294 HydrophobicContact CB-CG2 4.35Å; D263-T294 WeakPolarHBondContact OD1-CG2 3.26Å
295	S	45.4	Very low	41.6	Very low	46 Å²	46	88.4 Å²	88.4	32%	0.322	43%	0.434	S	S	.	.			trans	-171.6	117	167.9	137.8	0	0	0	0	112.9	I285	I285-S295 WeakPolarHBondContact CD1-O 3.38Å; I285-S295 WeakPolarHBondContact CD1-OG 3.34Å; I285-S295 WeakPolarHBondContact CG1-OG 3.44Å
296	M	35.5	Very low	40.4	Very low	40 Å²	40	90.4 Å²	90.4	20%	0.197	45%	0.451	C	S	.	.				163.2	115.6	121.6	-95.3	167.5	-157.8	0	0	107.9	M260 C283 I285 F298	M260-M296 CarbonylContact O-C 3.58Å; C283-M296 VanDerWaalsContact C-CE 3.4Å; C283-M296 VanDerWaalsContact CA-SD 3.56Å; C283-M296 HydrophobicContact CB-CE 3.76Å; C283-M296 HydrophobicContact CB-SD 3.33Å; C283-M296 WeakPolarHBondContact CB-SD 3.15Å; C283-M296 PolarHBondContact SG-SD 3.45Å; I285-M296 HydrophobicContact CD1-CE 3.91Å; I285-M296 HydrophobicContact CG1-CE 3.43Å; I285-M296 VanDerWaalsContact CG1-CE 3.43Å; M296-F298 HydrophobicContact CB-CD2 4.14Å; M296-F298 HydrophobicContact CB-CE2 3.61Å; M296-F298 HydrophobicContact CB-CZ 3.99Å; M296-F298 WeakPolarHBondContact O-CD2 3.45Å; M296-F298 PolarHBondContact O-N 3.25Å; M296-F298 HydrophobicContact SD-CZ 4.14Å
297	A	29.5	Very low	39.3	Very low	77 Å²	77	83 Å²	83	64%	0.636	43%	0.427	S	S	*	.			trans	-75.6	105	169	0	0	0	0	0	109.6	H259 M260 R299	H259-A297 HydrophobicContact CB-CB 3.51Å; M260-A297 WeakPolarHBondContact O-CA 3.38Å; A297-R299 PolarHBondContact O-N 3.49Å
298	F	35	Very low	38.3	Very low	39 Å²	39	86.2 Å²	86.2	17%	0.171	44%	0.441	C	S	.	.			trans	-83.1	94.3	176.7	-72.4	-86.2	0	0	0	111.8	H259 M260 M296 T300 F309	H259-F298 VanDerWaalsContact CA-O 3.29Å; H259-F298 WeakPolarHBondContact CA-O 3.47Å; M260-F298 HydrophobicContact CB-CB 4.25Å; M260-F298 HydrophobicContact CB-CD2 4.05Å; M260-F298 HydrophobicContact CE-CB 3.8Å; M260-F298 HydrophobicContact CE-CD2 4.32Å; M260-F298 HydrophobicContact CE-CG 4.05Å; M260-F298 PolarHBondContact O-N 3.01Å; M296-F298 HydrophobicContact CB-CD2 4.14Å; M296-F298 HydrophobicContact CB-CE2 3.61Å; M296-F298 HydrophobicContact CB-CZ 3.99Å; M296-F298 WeakPolarHBondContact O-CD2 3.45Å; M296-F298 PolarHBondContact O-N 3.25Å; M296-F298 HydrophobicContact SD-CZ 4.14Å; F298-T300 PolarHBondContact O-N 2.81Å; F298-F309 HydrophobicContact CE2-CE1 4.09Å; F298-F309 AromaticContact CE2-CZ 3.66Å; F298-F309 HydrophobicContact CE2-CZ 3.66Å; F298-F309 AromaticContact CZ-CE1 3.7Å; F298-F309 HydrophobicContact CZ-CE1 3.7Å; F298-F309 AromaticContact CZ-CZ 3.54Å; F298-F309 HydrophobicContact CZ-CZ 3.54Å
299	R	28.1	Very low	37.5	Very low	207 Å²	207	83 Å²	83	78%	0.781	42%	0.424	S	S	*	.			trans	-60.7	99.8	168.1	-105	-176	179	-178.3	1.1	111	Q258 A297	Q258-R299 VanDerWaalsContact O-CA 3.25Å; Q258-R299 WeakPolarHBondContact O-CA 3.41Å; A297-R299 PolarHBondContact O-N 3.49Å
300	T	30.2	Very low	36.6	Very low	68 Å²	68	84.5 Å²	84.5	42%	0.417	43%	0.431	S	S	.	.			trans	-85.4	113.5	171.7	53.9	0	0	0	0	108.6	M260 F298 Y302	M260-T300 HydrophobicContact CE-CG2 4.26Å; F298-T300 PolarHBondContact O-N 2.81Å; T300-Y302 VanDerWaalsContact C-N 3.35Å
301	R	26.8	Very low	35.8	Very low	224 Å²	224	83.6 Å²	83.6	85%	0.845	43%	0.425	S	S	*	.			trans	-92.1	4.2	161	-87.5	-164.5	-167	-179.1	5.3	112.8
302	Y	25.6	Very low	35	Very low	198 Å²	198	84 Å²	84	78%	0.776	43%	0.43	S	S	*	.	S	Bend	trans	-143.4	140.4	-174.7	-66.7	-81.9	0	0	0	111.7	T300 V304	T300-Y302 VanDerWaalsContact C-N 3.35Å; Y302-V304 PolarHBondContact O-N 2.82Å
303	K	26.5	Very low	34.2	Very low	206 Å²	206	82 Å²	82	90%	0.896	42%	0.416	S	S	*	.	S	Bend	trans	-46.9	123	171	-77.1	175.8	173.4	177.9	0	110.1
304	V	27.9	Very low	33.5	Very low	132 Å²	132	84.2 Å²	84.2	80%	0.8	43%	0.434	S	S	*	.			trans	56.5	77.6	164.5	-161.9	0	0	0	0	115	Y302	Y302-V304 PolarHBondContact O-N 2.82Å
305	A	31.2	Very low	33.1	Very low	61 Å²	61	85.1 Å²	85.1	50%	0.504	44%	0.443	S	S	.	.			trans	-86.6	110.5	162.9	0	0	0	0	0	109.6	C307	A305-C307 PolarHBondContact O-N 3.46Å; A305-C307 VanDerWaalsContact O-N 3.09Å
306	S	37	Very low	32.3	Very low	72 Å²	72	88 Å²	88	50%	0.503	46%	0.463	S	S	.	.			trans	-67.2	101	169.6	48.4	0	0	0	0	110.3	K278	K278-S306 PolarHBondContact NZ-O 2.88Å; K278-S306 PolarHBondContact NZ-OG 2.77Å
307	C	36	Very low	32.3	Very low	28 Å²	28	91.5 Å²	91.5	19%	0.189	48%	0.483	C	S	.	.			trans	-86.2	113.1	174.6	-71.9	0	0	0	0	110.3	A305 F309	A305-C307 PolarHBondContact O-N 3.46Å; A305-C307 VanDerWaalsContact O-N 3.09Å; C307-F309 HydrophobicContact CB-CD2 4.14Å; C307-F309 HydrophobicContact CB-CE2 3.37Å; C307-F309 HydrophobicContact CB-CZ 3.81Å
308	K	35.8	Very low	32.3	Very low	71 Å²	71	92.8 Å²	92.8	31%	0.309	49%	0.487	S	S	.	.			trans	-96.7	128.2	167.8	-67.7	-166.8	173.9	-139.3	0	108.3	V277 T329 D330	V277-K308 HydrophobicContact CB-CB 3.85Å; V277-K308 HydrophobicContact CG2-CB 3.78Å; V277-K308 WeakPolarHBondContact CG2-O 3.35Å; V277-K308 PolarHBondContact N-O 3Å; K308-T329 PolarHBondContact NZ-O 3.1Å; K308-T329 VanDerWaalsContact NZ-O 3.17Å; K308-D330 VanDerWaalsContact CE-OD1 3.27Å; K308-D330 WeakPolarHBondContact CE-OD1 3.3Å; K308-D330 IonicContact NZ-OD1 2.74Å; K308-D330 PolarHBondContact NZ-OD1 3.14Å
309	F	38.4	Very low	32	Very low	23 Å²	23	98 Å²	98	10%	0.101	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.8	179	-64.4	-93	0	0	0	111.6	V262 F298 C307 L331	V262-F309 HydrophobicContact CG2-CZ 4.41Å; F298-F309 HydrophobicContact CE2-CE1 4.09Å; F298-F309 AromaticContact CE2-CZ 3.66Å; F298-F309 HydrophobicContact CE2-CZ 3.66Å; F298-F309 AromaticContact CZ-CE1 3.7Å; F298-F309 HydrophobicContact CZ-CE1 3.7Å; F298-F309 AromaticContact CZ-CZ 3.54Å; F298-F309 HydrophobicContact CZ-CZ 3.54Å; C307-F309 HydrophobicContact CB-CD2 4.14Å; C307-F309 HydrophobicContact CB-CE2 3.37Å; C307-F309 HydrophobicContact CB-CZ 3.81Å; F309-L331 HydrophobicContact CB-CD1 4.39Å; F309-L331 HydrophobicContact CD2-CD1 3.44Å; F309-L331 VanDerWaalsContact CD2-CD1 3.44Å; F309-L331 HydrophobicContact CE2-CD1 4.13Å; F309-L331 HydrophobicContact CG-CD1 4.35Å
310	I	35	Very low	32	Very low	43 Å²	43	95.5 Å²	95.5	22%	0.221	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	119.3	168.9	-85.8	155.9	0	0	0	106.5	T275 V277 I312 R327	T275-I310 CarbonylContact C-O 3.5Å; T275-I310 WeakPolarHBondContact CA-O 3.41Å; T275-I310 PolarHBondContact N-O 2.84Å; T275-I310 CarbonylContact O-C 3.58Å; T275-I310 PolarHBondContact O-N 2.89Å; T275-I310 PolarHBondContact OG1-O 3.37Å; V277-I310 HydrophobicContact CB-CD1 3.85Å; V277-I310 HydrophobicContact CB-CG1 4.31Å; V277-I310 HydrophobicContact CG1-CD1 3.7Å; V277-I310 HydrophobicContact CG2-CB 3.81Å; V277-I310 HydrophobicContact CG2-CD1 3.29Å; V277-I310 HydrophobicContact CG2-CG1 3.25Å; I310-I312 HydrophobicContact CG2-CD1 4.05Å; I310-I312 HydrophobicContact CG2-CG1 3.51Å; I310-R327 HydrophobicContact CG1-CG 4.22Å
311	C	35.7	Very low	31.9	Very low	14 Å²	14	98.5 Å²	98.5	10%	0.095	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.4	169.7	-64.9	0	0	0	0	108.2	F326	C311-F326 HydrophobicContact CB-CD1 4.38Å; C311-F326 HydrophobicContact CB-CD2 4.4Å; C311-F326 HydrophobicContact CB-CE1 3.34Å; C311-F326 HydrophobicContact CB-CE2 3.48Å; C311-F326 VanDerWaalsContact CB-CE2 3.48Å; C311-F326 HydrophobicContact CB-CZ 2.91Å; C311-F326 WeakPolarHBondContact O-CD1 3.29Å; C311-F326 WeakPolarHBondContact O-CE1 3.41Å; C311-F326 VanDerWaalsContact O-O 3.07Å
312	I	35.1	Very low	32	Very low	63 Å²	63	92.1 Å²	92.1	32%	0.323	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	108.9	179.9	-52.2	-178	0	0	0	107.2	G272 E273 I310	G272-I312 CarbonylContact C-O 3.56Å; G272-I312 WeakPolarHBondContact CA-O 3.33Å; E273-I312 PolarHBondContact N-O 3.19Å; E273-I312 PolarHBondContact O-N 3.37Å; E273-I312 VanDerWaalsContact O-O 3.12Å; I310-I312 HydrophobicContact CG2-CD1 4.05Å; I310-I312 HydrophobicContact CG2-CG1 3.51Å
313	F	33.1	Very low	32.5	Very low	26 Å²	26	86.2 Å²	86.2	11%	0.114	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	131.3	168.2	-63.7	-52.2	0	0	0	110	L247 I249 I266 V270 M287 F326	L247-F313 HydrophobicContact CD2-CD2 3.85Å; L247-F313 HydrophobicContact CD2-CE2 3.37Å; L247-F313 HydrophobicContact CD2-CZ 4.16Å; I249-F313 HydrophobicContact CD1-CE2 3.69Å; I249-F313 HydrophobicContact CD1-CZ 4.01Å; I266-F313 HydrophobicContact CD1-CE1 4.34Å; I266-F313 HydrophobicContact CD1-CZ 4.03Å; V270-F313 HydrophobicContact CB-CD1 3.76Å; V270-F313 HydrophobicContact CB-CE1 3.63Å; V270-F313 HydrophobicContact CB-CZ 4.27Å; V270-F313 HydrophobicContact CG1-CD1 4.17Å; V270-F313 HydrophobicContact CG1-CE1 3.97Å; V270-F313 HydrophobicContact CG1-CE2 4.42Å; V270-F313 HydrophobicContact CG1-CZ 4.12Å; V270-F313 HydrophobicContact CG2-CD1 4.13Å; V270-F313 HydrophobicContact CG2-CE1 3.52Å; V270-F313 HydrophobicContact CG2-CZ 4.13Å; M287-F313 HydrophobicContact SD-CE1 4.22Å; F313-F326 HydrophobicContact CD1-CE1 4.48Å; F313-F326 AromaticContact CD2-CD1 3.59Å; F313-F326 HydrophobicContact CD2-CD1 3.59Å; F313-F326 AromaticContact CD2-CE1 3.01Å; F313-F326 HydrophobicContact CD2-CE1 3.01Å; F313-F326 AromaticContact CD2-CZ 3.79Å; F313-F326 HydrophobicContact CD2-CZ 3.79Å; F313-F326 HydrophobicContact CE1-CE1 4.35Å; F313-F326 HydrophobicContact CE1-CZ 4.47Å; F313-F326 AromaticContact CE2-CD1 3.72Å; F313-F326 HydrophobicContact CE2-CD1 3.72Å; F313-F326 AromaticContact CE2-CE1 2.84Å; F313-F326 HydrophobicContact CE2-CE1 2.84Å; F313-F326 HydrophobicContact CE2-CE2 4.23Å; F313-F326 AromaticContact CE2-CZ 3.07Å; F313-F326 HydrophobicContact CE2-CZ 3.07Å; F313-F326 AromaticContact CG-CE1 3.87Å; F313-F326 HydrophobicContact CG-CE1 3.87Å; F313-F326 AromaticContact CZ-CE1 3.58Å; F313-F326 HydrophobicContact CZ-CE1 3.58Å; F313-F326 AromaticContact CZ-CZ 3.47Å; F313-F326 HydrophobicContact CZ-CZ 3.47Å; F313-F326 VanDerWaalsContact CZ-CZ 3.47Å
314	A	33.5	Very low	33.1	Very low	53 Å²	53	84.7 Å²	84.7	44%	0.438	51%	0.506	S	S	.	.			trans	-131	107.2	171.7	0	0	0	0	0	107.3	N271 S316	N271-A314 CarbonylContact O-C 3.35Å; N271-A314 PolarHBondContact O-N 3.03Å; A314-S316 PolarHBondContact O-N 3.2Å
315	S	33.2	Very low	33.5	Very low	96 Å²	96	85.2 Å²	85.2	67%	0.671	50%	0.497	S	S	*	.			trans	-80.2	101.9	169.6	55.9	0	0	0	0	108.8	L317	S315-L317 VanDerWaalsContact C-N 3.35Å; S315-L317 PolarHBondContact O-N 3.44Å
316	S	29.9	Very low	33.9	Very low	106 Å²	106	84.8 Å²	84.8	74%	0.741	48%	0.484	S	S	*	.			trans	-84.5	78.6	169.2	61.5	0	0	0	0	109.9	A314	A314-S316 PolarHBondContact O-N 3.2Å
317	L	33.7	Very low	33.8	Very low	115 Å²	115	87.5 Å²	87.5	60%	0.602	48%	0.483	S	S	*	.	S	Bend	trans	-151	110.8	156.9	-96.1	127.3	0	0	0	106.4	S315	S315-L317 VanDerWaalsContact C-N 3.35Å; S315-L317 PolarHBondContact O-N 3.44Å
318	S	30.5	Very low	34.2	Very low	103 Å²	103	86.7 Å²	86.7	72%	0.72	48%	0.478	S	S	*	.			trans	-47	146	176.3	54.1	0	0	0	0	112.6
319	L	28.4	Very low	34.3	Very low	149 Å²	149	85.1 Å²	85.1	78%	0.78	47%	0.474	S	S	*	.	S	Bend	cis	-131.3	148	24.3	-81.6	82.3	0	0	0	111.3
320	D	27.3	Very low	34.1	Very low	154 Å²	154	87.8 Å²	87.8	82%	0.824	49%	0.489	S	S	*	.	S	Bend	trans	56.8	56	156.9	-66.3	-19.3	0	0	0	120.1
321	M	29.7	Very low	34.1	Very low	132 Å²	132	87.1 Å²	87.1	65%	0.65	49%	0.486	S	S	*	.			trans	-148.8	127.4	153.8	-64.3	-164.2	95.6	0	0	111.7	F242	F242-M321 HydrophobicContact CE1-CE 3.65Å; F242-M321 HydrophobicContact CE1-SD 4.14Å; F242-M321 HydrophobicContact CE2-SD 4.26Å; F242-M321 HydrophobicContact CZ-CE 3.51Å; F242-M321 HydrophobicContact CZ-SD 3.42Å; F242-M321 WeakPolarHBondContact CZ-SD 3.03Å
322	A	28.3	Very low	34	Very low	89 Å²	89	91.5 Å²	91.5	74%	0.736	51%	0.512	S	S	*	.			trans	-57.1	146.2	178.5	0	0	0	0	0	112.4	Q324	A322-Q324 PolarHBondContact O-N 3.34Å
323	P	35.2	Very low	33.9	Very low	75 Å²	75	92 Å²	92	49%	0.487	53%	0.525	S	S	.	.			trans	-59.7	125.9	177	23.7	-32.3	0	0	0	110.5	K325	P323-K325 PolarHBondContact O-N 3.21Å
324	Q	39.6	Very low	33.8	Very low	173 Å²	173	95.1 Å²	95.1	81%	0.808	55%	0.547	S	S	*	.			trans	-70.8	95.4	169.5	-73.9	-170.4	-6.1	0	0	109	A322 F326	A322-Q324 PolarHBondContact O-N 3.34Å; Q324-F326 PolarHBondContact O-N 2.99Å
325	K	36.5	Very low	33.7	Very low	144 Å²	144	97.7 Å²	97.7	63%	0.626	55%	0.553	S	S	*	*	B	Isolated β-bridge	trans	-73.3	114.1	166.2	-73.1	-177.7	-179.7	177.2	0	108.5	P323 N347	P323-K325 PolarHBondContact O-N 3.21Å; K325-N347 PolarHBondContact O-ND2 2.82Å
326	F	38.8	Very low	33.7	Very low	51 Å²	51	101.1 Å²	101.1	22%	0.224	56%	0.563	C	S	.	*			trans	-101	140.4	165.3	70	-68.9	0	0	0	108.6	I249 C311 F313 Q324 V328	I249-F326 HydrophobicContact CD1-CD2 4.28Å; I249-F326 HydrophobicContact CD1-CE1 4.45Å; I249-F326 HydrophobicContact CD1-CE2 3.53Å; I249-F326 HydrophobicContact CD1-CZ 3.56Å; C311-F326 HydrophobicContact CB-CD1 4.38Å; C311-F326 HydrophobicContact CB-CD2 4.4Å; C311-F326 HydrophobicContact CB-CE1 3.34Å; C311-F326 HydrophobicContact CB-CE2 3.48Å; C311-F326 VanDerWaalsContact CB-CE2 3.48Å; C311-F326 HydrophobicContact CB-CZ 2.91Å; C311-F326 WeakPolarHBondContact O-CD1 3.29Å; C311-F326 WeakPolarHBondContact O-CE1 3.41Å; C311-F326 VanDerWaalsContact O-O 3.07Å; F313-F326 HydrophobicContact CD1-CE1 4.48Å; F313-F326 AromaticContact CD2-CD1 3.59Å; F313-F326 HydrophobicContact CD2-CD1 3.59Å; F313-F326 AromaticContact CD2-CE1 3.01Å; F313-F326 HydrophobicContact CD2-CE1 3.01Å; F313-F326 AromaticContact CD2-CZ 3.79Å; F313-F326 HydrophobicContact CD2-CZ 3.79Å; F313-F326 HydrophobicContact CE1-CE1 4.35Å; F313-F326 HydrophobicContact CE1-CZ 4.47Å; F313-F326 AromaticContact CE2-CD1 3.72Å; F313-F326 HydrophobicContact CE2-CD1 3.72Å; F313-F326 AromaticContact CE2-CE1 2.84Å; F313-F326 HydrophobicContact CE2-CE1 2.84Å; F313-F326 HydrophobicContact CE2-CE2 4.23Å; F313-F326 AromaticContact CE2-CZ 3.07Å; F313-F326 HydrophobicContact CE2-CZ 3.07Å; F313-F326 AromaticContact CG-CE1 3.87Å; F313-F326 HydrophobicContact CG-CE1 3.87Å; F313-F326 AromaticContact CZ-CE1 3.58Å; F313-F326 HydrophobicContact CZ-CE1 3.58Å; F313-F326 AromaticContact CZ-CZ 3.47Å; F313-F326 HydrophobicContact CZ-CZ 3.47Å; F313-F326 VanDerWaalsContact CZ-CZ 3.47Å; Q324-F326 PolarHBondContact O-N 2.99Å; F326-V328 HydrophobicContact CD2-CG2 4.37Å; F326-V328 HydrophobicContact CE2-CG2 4.39Å
327	R	36.7	Very low	33.8	Very low	129 Å²	129	105.6 Å²	105.6	49%	0.487	56%	0.563	S	S	.	*			trans	-117.7	113.4	-175.7	-171.1	-178.6	178.2	-168.2	-2.5	108	I310 T329	I310-R327 HydrophobicContact CG1-CG 4.22Å; R327-T329 HydrophobicContact CB-CG2 4.24Å; R327-T329 VanDerWaalsContact CD-CG2 3.44Å; R327-T329 HydrophobicContact CG-CG2 3.58Å; R327-T329 PolarHBondContact O-N 2.65Å; R327-T329 VanDerWaalsContact O-N 3.17Å
328	V	44.1	Very low	33.9	Very low	12 Å²	12	106.1 Å²	106.1	7%	0.073	58%	0.577	C	S	.	*			trans	-81.6	93.3	166.4	-175.4	0	0	0	0	106.5	F326 L331 L344	F326-V328 HydrophobicContact CD2-CG2 4.37Å; F326-V328 HydrophobicContact CE2-CG2 4.39Å; V328-L331 HydrophobicContact CG1-CD1 4.01Å; V328-L331 HydrophobicContact CG1-CG 3.95Å; V328-L344 HydrophobicContact CG1-CD2 4.35Å; V328-L344 HydrophobicContact CG2-CD2 3.97Å
329	T	36.6	Very low	34	Very low	38 Å²	38	104.7 Å²	104.7	23%	0.233	58%	0.578	C	S	.	*			trans	-72.5	-32.3	-168.5	40.8	0	0	0	0	113.8	K308 R327	K308-T329 PolarHBondContact NZ-O 3.1Å; K308-T329 VanDerWaalsContact NZ-O 3.17Å; R327-T329 HydrophobicContact CB-CG2 4.24Å; R327-T329 VanDerWaalsContact CD-CG2 3.44Å; R327-T329 HydrophobicContact CG-CG2 3.58Å; R327-T329 PolarHBondContact O-N 2.65Å; R327-T329 VanDerWaalsContact O-N 3.17Å
330	D	34.4	Very low	34.3	Very low	78 Å²	78	101.4 Å²	101.4	42%	0.417	56%	0.562	S	S	.	*			trans	-147.9	121.9	-177.1	-72.7	-57.2	0	0	0	111.8	K308 V332	K308-D330 VanDerWaalsContact CE-OD1 3.27Å; K308-D330 WeakPolarHBondContact CE-OD1 3.3Å; K308-D330 IonicContact NZ-OD1 2.74Å; K308-D330 PolarHBondContact NZ-OD1 3.14Å; D330-V332 HydrophobicContact CB-CG2 4.39Å
331	L	36.2	Very low	34.6	Very low	29 Å²	29	101.3 Å²	101.3	15%	0.152	56%	0.561	C	S	.	*			trans	-112.5	100.2	165.9	-84	160.1	0	0	0	106.2	M253 F309 V328 L342	M253-L331 HydrophobicContact SD-CD1 4.47Å; M253-L331 HydrophobicContact SD-CD2 3.67Å; F309-L331 HydrophobicContact CB-CD1 4.39Å; F309-L331 HydrophobicContact CD2-CD1 3.44Å; F309-L331 VanDerWaalsContact CD2-CD1 3.44Å; F309-L331 HydrophobicContact CE2-CD1 4.13Å; F309-L331 HydrophobicContact CG-CD1 4.35Å; V328-L331 HydrophobicContact CG1-CD1 4.01Å; V328-L331 HydrophobicContact CG1-CG 3.95Å; L331-L342 HydrophobicContact CD2-CD1 3.07Å; L331-L342 HydrophobicContact CD2-CD2 3.7Å; L331-L342 HydrophobicContact CD2-CG 3.52Å
332	V	32.6	Very low	34.8	Very low	107 Å²	107	97.8 Å²	97.8	65%	0.648	55%	0.545	S	S	*	.			trans	-109.8	99.4	176.2	-169.9	0	0	0	0	107	D330 T334	D330-V332 HydrophobicContact CB-CG2 4.39Å; V332-T334 HydrophobicContact CG1-CG2 3.72Å; V332-T334 PolarHBondContact O-N 3.25Å
333	A	33.7	Very low	35	Very low	72 Å²	72	99 Å²	99	60%	0.595	54%	0.538	S	S	*	.			trans	-75.8	98.9	164.9	0	0	0	0	0	107.4
334	T	30.9	Very low	34.9	Very low	92 Å²	92	99.1 Å²	99.1	56%	0.564	53%	0.534	S	S	*	.			trans	-86	108.8	171.4	48.6	0	0	0	0	108.6	V332 N340	V332-T334 HydrophobicContact CG1-CG2 3.72Å; V332-T334 PolarHBondContact O-N 3.25Å; T334-N340 PolarHBondContact O-ND2 3.43Å; T334-N340 PolarHBondContact O-OD1 3.02Å
335	D	31.5	Very low	34.5	Very low	108 Å²	108	96.4 Å²	96.4	58%	0.578	52%	0.517	S	S	*	.			trans	88.6	132	179.3	-152.3	-8.2	0	0	0	115.4	R337 N340	D335-R337 PolarHBondContact O-N 3.2Å; D335-R337 PolarHBondContact OD1-N 2.83Å; D335-N340 PolarHBondContact O-ND2 3.14Å
336	L	32.6	Very low	34.5	Very low	167 Å²	167	92.6 Å²	92.6	87%	0.874	50%	0.504	S	S	*	.	S	Bend	trans	-84	12	-178.2	-75.6	160.5	0	0	0	111.9
337	R	32.6	Very low	34.3	Very low	200 Å²	200	95.5 Å²	95.5	76%	0.755	52%	0.522	S	S	*	.	S	Bend	trans	-104.3	129.8	174.7	-58.7	-178.7	-163.5	-155.1	3.1	107.7	D335	D335-R337 PolarHBondContact O-N 3.2Å; D335-R337 PolarHBondContact OD1-N 2.83Å
338	S	34.8	Very low	34.4	Very low	126 Å²	126	96.2 Å²	96.2	88%	0.881	54%	0.535	S	S	*	.	S	Bend	trans	-30.6	133.4	-177.7	53.1	0	0	0	0	115.9
339	G	32.9	Very low	33.8	Very low	73 Å²	73	98 Å²	98	75%	0.753	56%	0.556	S	S	*	*			trans	109.4	46.8	156.3	0	0	0	0	0	117.5
340	N	35.4	Very low	33.5	Very low	81 Å²	81	104.2 Å²	104.2	43%	0.433	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-98.6	122	172.4	-68.9	-47.8	0	0	0	112	T334 D335	T334-N340 PolarHBondContact O-ND2 3.43Å; T334-N340 PolarHBondContact O-OD1 3.02Å; D335-N340 PolarHBondContact O-ND2 3.14Å
341	D	33.3	Very low	33.7	Very low	151 Å²	151	104.4 Å²	104.4	81%	0.807	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-76.8	144.9	173	-73.5	-37.9	0	0	0	112.1
342	L	34.6	Very low	33.5	Very low	59 Å²	59	105.2 Å²	105.2	31%	0.309	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-87.1	133.1	-178.4	-133.7	82.4	0	0	0	112.2	V251 M253 L331 L344	V251-L342 HydrophobicContact CB-CD2 3.93Å; V251-L342 HydrophobicContact CG1-CD2 4.15Å; M253-L342 HydrophobicContact SD-CD1 3.9Å; L331-L342 HydrophobicContact CD2-CD1 3.07Å; L331-L342 HydrophobicContact CD2-CD2 3.7Å; L331-L342 HydrophobicContact CD2-CG 3.52Å; L342-L344 HydrophobicContact CD2-CD2 4.08Å
343	L	32.4	Very low	33.1	Very low	115 Å²	115	109 Å²	109	60%	0.602	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-95.4	125.3	164.7	-69.7	165.6	0	0	0	109.7	Y345	L343-Y345 HydrophobicContact CB-CE2 4.12Å
344	L	32.8	Very low	32.8	Very low	77 Å²	77	111.6 Å²	111.6	40%	0.403	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-103.7	127.9	174.4	-69.1	169.4	0	0	0	110	V328 L342	V328-L344 HydrophobicContact CG1-CD2 4.35Å; V328-L344 HydrophobicContact CG2-CD2 3.97Å; L342-L344 HydrophobicContact CD2-CD2 4.08Å
345	Y	31.6	Very low	32.6	Very low	115 Å²	115	115.2 Å²	115.2	45%	0.451	64%	0.635	S	S	.	*			trans	-108.4	143.2	172.5	-64	-89.8	0	0	0	109.8	L343	L343-Y345 HydrophobicContact CB-CE2 4.12Å
346	D	35.8	Very low	32.2	Very low	65 Å²	65	120.9 Å²	120.9	35%	0.348	65%	0.648	S	S	.	*			trans	-95.8	175.3	164.9	73.8	-6.4	0	0	0	110.7	N348 G349	D346-N348 PolarHBondContact O-N 2.8Å; D346-N348 WeakPolarHBondContact OD1-CA 3.42Å; D346-N348 PolarHBondContact OD1-N 2.76Å; D346-G349 PolarHBondContact O-N 3.01Å; D346-G349 PolarHBondContact OD1-N 3.45Å
347	N	34.2	Very low	31.8	Very low	111 Å²	111	122 Å²	122	59%	0.594	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-6.8	178.4	-65.3	-32.3	0	0	0	113.4	K325	K325-N347 PolarHBondContact O-ND2 2.82Å
348	N	39.2	Very low	31.3	Very low	145 Å²	145	120.4 Å²	120.4	78%	0.775	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	3.9	-179.3	-63.1	-30.5	0	0	0	112.9	D346 F350	D346-N348 PolarHBondContact O-N 2.8Å; D346-N348 WeakPolarHBondContact OD1-CA 3.42Å; D346-N348 PolarHBondContact OD1-N 2.76Å; N348-F350 PolarHBondContact O-N 3.09Å
349	G	32.5	Very low	30.8	Very low	49 Å²	49	118.6 Å²	118.6	51%	0.505	64%	0.638	S	S	.	*	S	Bend	trans	67	33.4	164	0	0	0	0	0	115.6	D346	D346-G349 PolarHBondContact O-N 3.01Å; D346-G349 PolarHBondContact OD1-N 3.45Å
350	F	30.4	Very low	30.2	Very low	169 Å²	169	123.3 Å²	123.3	74%	0.741	64%	0.638	S	S	*	*			trans	-172	114.3	157.5	-144.8	-108	0	0	0	112	N348	N348-F350 PolarHBondContact O-N 3.09Å
351	V	38.2	Very low	29.7	Very low	82 Å²	82	128.8 Å²	128.8	50%	0.497	66%	0.658	S	S	.	*			trans	-123.5	119	155.6	-175.5	0	0	0	0	106.6
352	G	30.6	Very low	29.3	Very low	46 Å²	46	132.5 Å²	132.5	47%	0.474	68%	0.677	S	S	.	*			trans	-59	160.7	-159.5	0	0	0	0	0	116.9	C354	G352-C354 PolarHBondContact O-N 3.46Å
353	Q	25.8	Very low	29.1	Very low	187 Å²	187	136.2 Å²	136.2	87%	0.874	70%	0.696	S	S	*	*			trans	-28.5	110.6	172.5	-77.2	171.9	-19.7	0	0	113.4
354	C	27.3	Very low	28.9	Very low	126 Å²	126	137.3 Å²	137.3	85%	0.851	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-80.8	125.3	151.3	-81.6	0	0	0	0	108	G352	G352-C354 PolarHBondContact O-N 3.46Å
355	M	25.8	Very low	28.7	Very low	168 Å²	168	140.7 Å²	140.7	83%	0.828	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-65	142	-172.7	-70.2	-175.6	-119	0	0	112.7
356	R	22.7	Very low	28.5	Very low	226 Å²	226	142.2 Å²	142.2	85%	0.853	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-49.4	135.4	164.5	-72.4	173.2	168.9	176	-4.9	111.8
357	F	25.2	Very low	28	Very low	190 Å²	190	147 Å²	147	83%	0.833	76%	0.757	S	S	*	*			trans	-136	139.9	147.1	-92.2	-83.7	0	0	0	110.8
358	F	22.2	Very low	27.6	Very low	167 Å²	167	149.4 Å²	149.4	73%	0.732	77%	0.768	S	S	*	*			trans	-71.7	150.5	-164.1	-80.8	-100.2	0	0	0	114.9	F360	F358-F360 AromaticContact CD1-CD2 3.75Å; F358-F360 HydrophobicContact CD1-CD2 3.75Å; F358-F360 HydrophobicContact CD1-CE2 4.04Å; F358-F360 HydrophobicContact CE1-CD2 4.01Å; F358-F360 AromaticContact CE1-CE2 3.81Å; F358-F360 HydrophobicContact CE1-CE2 3.81Å
359	A	24.2	Very low	26.8	Very low	89 Å²	89	149.7 Å²	149.7	74%	0.736	77%	0.767	S	S	*	*			trans	-136.1	103.7	139	0	0	0	0	0	108.8
360	F	20.7	Very low	26.4	Very low	171 Å²	171	157.5 Å²	157.5	75%	0.75	79%	0.787	S	S	*	*			trans	-75.3	121	158.2	-102.1	-86.6	0	0	0	107	F358	F358-F360 AromaticContact CD1-CD2 3.75Å; F358-F360 HydrophobicContact CD1-CD2 3.75Å; F358-F360 HydrophobicContact CD1-CE2 4.04Å; F358-F360 HydrophobicContact CE1-CD2 4.01Å; F358-F360 AromaticContact CE1-CE2 3.81Å; F358-F360 HydrophobicContact CE1-CE2 3.81Å
361	F	23.8	Very low	26	Very low	196 Å²	196	156.5 Å²	156.5	86%	0.86	79%	0.791	S	S	*	*			trans	-118.9	111.1	155.2	-91	-83.8	0	0	0	107.1
362	L	25.8	Very low	24.9	Very low	230 Å²	230	163.3 Å²	163.3	100%	1.204	82%	0.818	S	S	*	*			trans	-87.4	0	143.3	-96.1	164.9	0	0	0	107.4

Retrieved 362 of 362 residues in 222.9 ms (Link to these results)

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