X5D9I7_HUMAN Loading...

Neuronal PAS domain-containing protein 3

May play a broad role in neurogenesis. May control regulatory pathways relevant to schizophrenia and to psychotic illness.

AlphaFold DB , UniProt , Accession X5D9I7, Species HUMAN (Homo sapiens, Human), Gene NPAS3, Length 795 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	41.8	Very low	51.4	Low	251 Å²	251	144.4 Å²	144.4	100%	1.236	78%	0.783	S	S	*	*				0	133.1	0	-70.7	166.1	168.9	0	0	108.1
2	A	43	Very low	52.3	Low	90 Å²	90	139.6 Å²	139.6	74%	0.744	77%	0.765	S	S	*	*			trans	-109.8	140.1	171.4	0	0	0	0	0	108.9	T4	A2-T4 PolarHBondContact O-N 3.38Å
3	P	55.5	Low	53.6	Low	127 Å²	127	133.9 Å²	133.9	83%	0.825	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-69.6	118.1	178.9	27.8	-33	0	0	0	110.1	K5	P3-K5 PolarHBondContact O-N 2.65Å
4	T	52.6	Low	55.1	Low	134 Å²	134	136.6 Å²	136.6	82%	0.822	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-62.4	120.3	173.5	45.7	0	0	0	0	109.9	A2	A2-T4 PolarHBondContact O-N 3.38Å
5	K	53.8	Low	56.4	Low	197 Å²	197	136.5 Å²	136.5	86%	0.857	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-57.2	130	170.1	-70.7	-179.5	178.5	176.3	0	108.9	P3 S7	P3-K5 PolarHBondContact O-N 2.65Å; K5-S7 PolarHBondContact O-N 3.42Å
6	P	49.7	Very low	57.7	Low	111 Å²	111	135.6 Å²	135.6	72%	0.721	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-62.9	125.2	173.5	26.3	-33.1	0	0	0	109	F8	P6-F8 PolarHBondContact O-N 3.36Å
7	S	50.2	Low	59.1	Low	104 Å²	104	138.8 Å²	138.8	73%	0.727	71%	0.711	S	S	*	*			trans	-67.2	115.9	174.5	45.4	0	0	0	0	109.1	K5 Q9	K5-S7 PolarHBondContact O-N 3.42Å; S7-Q9 PolarHBondContact O-N 3.45Å
8	F	51.4	Low	60.5	Low	187 Å²	187	135.6 Å²	135.6	82%	0.82	70%	0.695	S	S	*	*			trans	-67.7	81.9	170	-94	-89.4	0	0	0	109.6	P6 Q10	P6-F8 PolarHBondContact O-N 3.36Å; F8-Q10 PolarHBondContact O-N 3.08Å
9	Q	51.4	Low	61.8	Low	176 Å²	176	132.9 Å²	132.9	82%	0.822	68%	0.679	S	S	*	*			trans	-57	109.8	157	-75.6	-177.7	-23.7	0	0	106.9	S7 D11	S7-Q9 PolarHBondContact O-N 3.45Å; Q9-D11 VanDerWaalsContact C-N 3.32Å; Q9-D11 PolarHBondContact O-N 3.4Å
10	Q	56.9	Low	63	Low	133 Å²	133	128.9 Å²	128.9	62%	0.621	67%	0.667	S	S	*	*			trans	-71.3	94.7	173.6	-73.9	-172.1	2.8	0	0	108.3	F8 P12	F8-Q10 PolarHBondContact O-N 3.08Å; Q10-P12 WeakPolarHBondContact O-CD 3.03Å; Q10-P12 VanDerWaalsContact O-N 3.1Å
11	D	59.3	Low	64.2	Low	78 Å²	78	126.7 Å²	126.7	42%	0.417	66%	0.656	S	S	.	*			trans	-32.8	112.6	169.6	173.9	-0.3	0	0	0	111.2	Q9 S13 R14 R15	Q9-D11 VanDerWaalsContact C-N 3.32Å; Q9-D11 PolarHBondContact O-N 3.4Å; D11-S13 VanDerWaalsContact CG-OG 3.23Å; D11-S13 PolarHBondContact O-N 3.32Å; D11-S13 VanDerWaalsContact OD1-CB 3.32Å; D11-S13 WeakPolarHBondContact OD1-CB 3.45Å; D11-S13 PolarHBondContact OD1-N 3.35Å; D11-S13 PolarHBondContact OD1-OG 2.84Å; D11-S13 PolarHBondContact OD2-OG 3.17Å; D11-S13 VanDerWaalsContact OD2-OG 3.11Å; D11-R14 HydrophobicContact CB-CB 4.05Å; D11-R14 WeakPolarHBondContact O-CB 3.15Å; D11-R14 PolarHBondContact O-N 2.94Å; D11-R14 VanDerWaalsContact O-N 3.11Å; D11-R15 PolarHBondContact O-N 3.1Å; D11-R15 VanDerWaalsContact O-N 3.15Å
12	P	61.7	Low	66.4	Low	87 Å²	87	122.9 Å²	122.9	57%	0.565	63%	0.628	S	S	*	*	H	α-helix	trans	-55.3	-39.4	-179.1	-27.4	35.6	0	0	0	112.2	Q10 R14 R15 E16	Q10-P12 WeakPolarHBondContact O-CD 3.03Å; Q10-P12 VanDerWaalsContact O-N 3.1Å; P12-R14 VanDerWaalsContact C-N 3.3Å; P12-R14 PolarHBondContact O-N 3.14Å; P12-R15 WeakPolarHBondContact O-CB 3.39Å; P12-R15 PolarHBondContact O-N 2.98Å; P12-R15 VanDerWaalsContact O-N 3.07Å; P12-E16 WeakPolarHBondContact O-CB 3.19Å; P12-E16 WeakPolarHBondContact O-CG 3.42Å; P12-E16 PolarHBondContact O-N 3.1Å
13	S	70.1	Confident	68.8	Low	66 Å²	66	125.7 Å²	125.7	46%	0.462	62%	0.623	S	S	.	*	H	α-helix	trans	-63.5	-36.7	-179.5	79.7	0	0	0	0	111.7	D11 E16 R17	D11-S13 VanDerWaalsContact CG-OG 3.23Å; D11-S13 PolarHBondContact O-N 3.32Å; D11-S13 VanDerWaalsContact OD1-CB 3.32Å; D11-S13 WeakPolarHBondContact OD1-CB 3.45Å; D11-S13 PolarHBondContact OD1-N 3.35Å; D11-S13 PolarHBondContact OD1-OG 2.84Å; D11-S13 PolarHBondContact OD2-OG 3.17Å; D11-S13 VanDerWaalsContact OD2-OG 3.11Å; S13-E16 PolarHBondContact O-N 3.48Å; S13-R17 WeakPolarHBondContact O-CB 3.44Å; S13-R17 PolarHBondContact O-N 2.84Å
14	R	74.1	Confident	70.5	Confident	171 Å²	171	123.4 Å²	123.4	65%	0.645	60%	0.602	S	S	*	*	H	α-helix	trans	-68.3	-38.8	174.2	-173.2	177.8	178.3	-173.9	0.4	111.6	D11 P12 L18	D11-R14 HydrophobicContact CB-CB 4.05Å; D11-R14 WeakPolarHBondContact O-CB 3.15Å; D11-R14 PolarHBondContact O-N 2.94Å; D11-R14 VanDerWaalsContact O-N 3.11Å; P12-R14 VanDerWaalsContact C-N 3.3Å; P12-R14 PolarHBondContact O-N 3.14Å; R14-L18 HydrophobicContact CG-CD1 4.37Å; R14-L18 WeakPolarHBondContact O-CB 3.48Å; R14-L18 VanDerWaalsContact O-CG 3.26Å; R14-L18 WeakPolarHBondContact O-CG 3.37Å; R14-L18 PolarHBondContact O-N 3.05Å; R14-L18 VanDerWaalsContact O-N 3.08Å
15	R	74.3	Confident	72.5	Confident	135 Å²	135	124.7 Å²	124.7	51%	0.509	60%	0.596	S	S	.	*	H	α-helix	trans	-65.1	-44.9	175.4	-175.7	-176.6	-74.2	-179.8	-3.1	110.8	D11 P12 L18 Q19	D11-R15 PolarHBondContact O-N 3.1Å; D11-R15 VanDerWaalsContact O-N 3.15Å; P12-R15 WeakPolarHBondContact O-CB 3.39Å; P12-R15 PolarHBondContact O-N 2.98Å; P12-R15 VanDerWaalsContact O-N 3.07Å; R15-L18 PolarHBondContact O-N 3.25Å; R15-Q19 WeakPolarHBondContact O-CG 3.42Å; R15-Q19 PolarHBondContact O-N 3.2Å
16	E	78.1	Confident	74.4	Confident	122 Å²	122	119.1 Å²	119.1	57%	0.57	58%	0.582	S	S	*	*	H	α-helix	trans	-65.1	-45.4	177.3	-73	167.7	-176.8	0	0	112.1	P12 S13 L18 Q19 A20	P12-E16 WeakPolarHBondContact O-CB 3.19Å; P12-E16 WeakPolarHBondContact O-CG 3.42Å; P12-E16 PolarHBondContact O-N 3.1Å; S13-E16 PolarHBondContact O-N 3.48Å; E16-L18 VanDerWaalsContact C-N 3.28Å; E16-L18 PolarHBondContact O-N 3.41Å; E16-Q19 CarbonylContact O-C 3.53Å; E16-Q19 WeakPolarHBondContact O-CA 3.38Å; E16-Q19 WeakPolarHBondContact O-CB 3.49Å; E16-Q19 PolarHBondContact O-N 3.04Å; E16-A20 PolarHBondContact O-N 2.71Å
17	R	81.6	Confident	76.6	Confident	191 Å²	191	119.6 Å²	119.6	72%	0.721	57%	0.569	S	S	*	*	H	α-helix	trans	-59.9	-37.8	175.2	-165.1	174.7	-169.9	-179.5	4.1	112	S13 A20 L21	S13-R17 WeakPolarHBondContact O-CB 3.44Å; S13-R17 PolarHBondContact O-N 2.84Å; R17-A20 PolarHBondContact O-N 2.79Å; R17-L21 VanDerWaalsContact O-CG 3.32Å; R17-L21 WeakPolarHBondContact O-CG 3.46Å; R17-L21 PolarHBondContact O-N 3.28Å
18	L	84.3	Confident	78.8	Confident	81 Å²	81	117.4 Å²	117.4	42%	0.424	55%	0.549	S	S	.	.	H	α-helix	trans	-70	-33.4	172.5	-72.8	169.8	0	0	0	113	R14 R15 E16 R22	R14-L18 HydrophobicContact CG-CD1 4.37Å; R14-L18 WeakPolarHBondContact O-CB 3.48Å; R14-L18 VanDerWaalsContact O-CG 3.26Å; R14-L18 WeakPolarHBondContact O-CG 3.37Å; R14-L18 PolarHBondContact O-N 3.05Å; R14-L18 VanDerWaalsContact O-N 3.08Å; R15-L18 PolarHBondContact O-N 3.25Å; E16-L18 VanDerWaalsContact C-N 3.28Å; E16-L18 PolarHBondContact O-N 3.41Å; L18-R22 WeakPolarHBondContact O-CD 3.44Å; L18-R22 VanDerWaalsContact O-CG 3.25Å; L18-R22 WeakPolarHBondContact O-CG 3.37Å; L18-R22 PolarHBondContact O-N 3.36Å
19	Q	84.2	Confident	80.9	Confident	84 Å²	84	111.2 Å²	111.2	39%	0.393	53%	0.533	S	S	.	.	H	α-helix	trans	-68.9	-40.8	171.1	-71.3	-178.3	18.5	0	0	112	R15 E16 R22 K23	R15-Q19 WeakPolarHBondContact O-CG 3.42Å; R15-Q19 PolarHBondContact O-N 3.2Å; E16-Q19 CarbonylContact O-C 3.53Å; E16-Q19 WeakPolarHBondContact O-CA 3.38Å; E16-Q19 WeakPolarHBondContact O-CB 3.49Å; E16-Q19 PolarHBondContact O-N 3.04Å; Q19-R22 PolarHBondContact O-N 2.95Å; Q19-K23 WeakPolarHBondContact O-CG 3.29Å; Q19-K23 PolarHBondContact O-N 3.12Å
20	A	85.6	Confident	83.1	Confident	53 Å²	53	103.7 Å²	103.7	44%	0.438	50%	0.5	S	S	.	.	H	α-helix	trans	-59.2	-50	175.1	0	0	0	0	0	110.8	E16 R17 R22 K23 E24	E16-A20 PolarHBondContact O-N 2.71Å; R17-A20 PolarHBondContact O-N 2.79Å; A20-R22 VanDerWaalsContact C-N 3.27Å; A20-R22 PolarHBondContact O-N 2.96Å; A20-K23 PolarHBondContact O-N 3.42Å; A20-K23 VanDerWaalsContact O-N 3.12Å; A20-E24 VanDerWaalsContact O-CB 3.27Å; A20-E24 WeakPolarHBondContact O-CB 3.49Å; A20-E24 PolarHBondContact O-N 2.7Å
21	L	88.9	Confident	85	Confident	83 Å²	83	105 Å²	105	44%	0.435	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-30.4	176.1	-71.7	168	0	0	0	113.6	R17 K25	R17-L21 VanDerWaalsContact O-CG 3.32Å; R17-L21 WeakPolarHBondContact O-CG 3.46Å; R17-L21 PolarHBondContact O-N 3.28Å; L21-K25 WeakPolarHBondContact O-CB 3.48Å; L21-K25 WeakPolarHBondContact O-CG 3.17Å; L21-K25 PolarHBondContact O-N 2.86Å; L21-K25 VanDerWaalsContact O-N 3.1Å
22	R	88.6	Confident	86.8	Confident	171 Å²	171	104.4 Å²	104.4	65%	0.645	50%	0.502	S	S	*	.	H	α-helix	trans	-72	-45.6	172.2	-72.7	166.1	-176.7	160.9	0.1	111.7	L18 Q19 A20 E24 S26	L18-R22 WeakPolarHBondContact O-CD 3.44Å; L18-R22 VanDerWaalsContact O-CG 3.25Å; L18-R22 WeakPolarHBondContact O-CG 3.37Å; L18-R22 PolarHBondContact O-N 3.36Å; Q19-R22 PolarHBondContact O-N 2.95Å; A20-R22 VanDerWaalsContact C-N 3.27Å; A20-R22 PolarHBondContact O-N 2.96Å; R22-E24 VanDerWaalsContact C-N 3.31Å; R22-E24 PolarHBondContact O-N 2.72Å; R22-S26 WeakPolarHBondContact O-CB 3.38Å; R22-S26 PolarHBondContact O-N 3.22Å
23	K	92	Very high	88.5	Confident	148 Å²	148	107.7 Å²	107.7	64%	0.643	50%	0.503	S	S	*	.	H	α-helix	trans	-61.2	-40.5	175.8	-72.4	174.5	179.2	178.3	0	111.2	Q19 A20 S26 R27	Q19-K23 WeakPolarHBondContact O-CG 3.29Å; Q19-K23 PolarHBondContact O-N 3.12Å; A20-K23 PolarHBondContact O-N 3.42Å; A20-K23 VanDerWaalsContact O-N 3.12Å; K23-S26 PolarHBondContact O-N 3.08Å; K23-R27 VanDerWaalsContact O-CB 3.31Å; K23-R27 WeakPolarHBondContact O-CB 3.35Å; K23-R27 PolarHBondContact O-N 3.28Å
24	E	91.8	Very high	89.8	Confident	80 Å²	80	112 Å²	112	37%	0.374	51%	0.509	S	S	.	.	H	α-helix	trans	-62.5	-54.7	175.8	179.6	140.4	-98.4	0	0	112.3	A20 R22 S26 R27 D28	A20-E24 VanDerWaalsContact O-CB 3.27Å; A20-E24 WeakPolarHBondContact O-CB 3.49Å; A20-E24 PolarHBondContact O-N 2.7Å; R22-E24 VanDerWaalsContact C-N 3.31Å; R22-E24 PolarHBondContact O-N 2.72Å; E24-S26 PolarHBondContact O-N 3.35Å; E24-R27 WeakPolarHBondContact O-CB 3.43Å; E24-R27 PolarHBondContact O-N 2.8Å; E24-R27 VanDerWaalsContact O-N 3.09Å; E24-R27 IonicContact OE1-CZ 3.45Å; E24-R27 IonicContact OE1-NH1 3.39Å; E24-R27 PolarHBondContact OE1-NH1 3.07Å; E24-R27 IonicContact OE1-NH2 2.7Å; E24-R27 PolarHBondContact OE1-NH2 3.17Å; E24-D28 PolarHBondContact O-N 3.34Å
25	K	93.9	Very high	90.9	Very high	161 Å²	161	105.8 Å²	105.8	70%	0.7	50%	0.499	S	S	*	.	H	α-helix	trans	-56.2	-38.8	174.2	-74.3	179.3	178	-171.7	0	112.4	L21 A29	L21-K25 WeakPolarHBondContact O-CB 3.48Å; L21-K25 WeakPolarHBondContact O-CG 3.17Å; L21-K25 PolarHBondContact O-N 2.86Å; L21-K25 VanDerWaalsContact O-N 3.1Å; K25-A29 WeakPolarHBondContact O-CB 3.3Å; K25-A29 PolarHBondContact O-N 2.79Å
26	S	95.1	Very high	92.1	Very high	80 Å²	80	106 Å²	106	56%	0.559	50%	0.503	S	S	*	.	H	α-helix	trans	-67.3	-43.4	175.5	-171.5	0	0	0	0	112.6	R22 K23 E24 A30	R22-S26 WeakPolarHBondContact O-CB 3.38Å; R22-S26 PolarHBondContact O-N 3.22Å; K23-S26 PolarHBondContact O-N 3.08Å; E24-S26 PolarHBondContact O-N 3.35Å; S26-A30 WeakPolarHBondContact O-CB 3.26Å; S26-A30 PolarHBondContact O-N 3.48Å
27	R	95.3	Very high	93	Very high	121 Å²	121	103.9 Å²	103.9	46%	0.457	49%	0.493	S	S	.	.	H	α-helix	trans	-59.9	-46.3	175.9	-179.8	-167.8	69.8	-151.2	-6.4	111.3	K23 E24 A30 R31	K23-R27 VanDerWaalsContact O-CB 3.31Å; K23-R27 WeakPolarHBondContact O-CB 3.35Å; K23-R27 PolarHBondContact O-N 3.28Å; E24-R27 WeakPolarHBondContact O-CB 3.43Å; E24-R27 PolarHBondContact O-N 2.8Å; E24-R27 VanDerWaalsContact O-N 3.09Å; E24-R27 IonicContact OE1-CZ 3.45Å; E24-R27 IonicContact OE1-NH1 3.39Å; E24-R27 PolarHBondContact OE1-NH1 3.07Å; E24-R27 IonicContact OE1-NH2 2.7Å; E24-R27 PolarHBondContact OE1-NH2 3.17Å; R27-A30 PolarHBondContact O-N 2.99Å; R27-R31 WeakPolarHBondContact O-CB 3.5Å; R27-R31 PolarHBondContact O-N 3.26Å
28	D	95.9	Very high	93.7	Very high	57 Å²	57	98.7 Å²	98.7	31%	0.305	48%	0.48	S	S	.	.	H	α-helix	trans	-79.7	-32.5	-173.7	-60.4	-28.1	0	0	0	111.5	E24 R31 S32	E24-D28 PolarHBondContact O-N 3.34Å; D28-R31 PolarHBondContact O-N 2.8Å; D28-R31 IonicContact OD1-CZ 3.98Å; D28-R31 IonicContact OD1-NH1 2.95Å; D28-R31 PolarHBondContact OD1-NH1 3.49Å; D28-S32 WeakPolarHBondContact O-CB 3.31Å; D28-S32 PolarHBondContact O-N 3.27Å
29	A	96.6	Very high	94.3	Very high	58 Å²	58	100.2 Å²	100.2	48%	0.479	48%	0.483	S	S	.	.	H	α-helix	trans	-63.9	-39.5	165.7	0	0	0	0	0	112.5	K25 R33	K25-A29 WeakPolarHBondContact O-CB 3.3Å; K25-A29 PolarHBondContact O-N 2.79Å; A29-R33 WeakPolarHBondContact O-CB 3.23Å; A29-R33 PolarHBondContact O-N 3.05Å
30	A	96.8	Very high	95	Very high	17 Å²	17	102 Å²	102	14%	0.14	49%	0.492	C	S	.	.	H	α-helix	trans	-68.3	-38.6	174.6	0	0	0	0	0	112.4	S26 R27 R33 R34	S26-A30 WeakPolarHBondContact O-CB 3.26Å; S26-A30 PolarHBondContact O-N 3.48Å; R27-A30 PolarHBondContact O-N 2.99Å; A30-R33 PolarHBondContact O-N 3.42Å; A30-R34 WeakPolarHBondContact O-CB 3.19Å; A30-R34 WeakPolarHBondContact O-CG 3.47Å; A30-R34 PolarHBondContact O-N 2.95Å
31	R	96.7	Very high	95.6	Very high	160 Å²	160	101.5 Å²	101.5	60%	0.604	48%	0.48	S	S	*	.	H	α-helix	trans	-63.4	-46.1	172.8	-175.7	-173.4	-80	145.3	-17.2	111	R27 D28 R34 G35	R27-R31 WeakPolarHBondContact O-CB 3.5Å; R27-R31 PolarHBondContact O-N 3.26Å; D28-R31 PolarHBondContact O-N 2.8Å; D28-R31 IonicContact OD1-CZ 3.98Å; D28-R31 IonicContact OD1-NH1 2.95Å; D28-R31 PolarHBondContact OD1-NH1 3.49Å; R31-R34 PolarHBondContact O-N 2.83Å; R31-G35 PolarHBondContact O-N 2.83Å
32	S	97.6	Very high	95.9	Very high	67 Å²	67	103.4 Å²	103.4	47%	0.469	48%	0.482	S	S	.	.	H	α-helix	trans	-61.4	-43.4	176	-175.2	0	0	0	0	112	D28 G35 K36	D28-S32 WeakPolarHBondContact O-CB 3.31Å; D28-S32 PolarHBondContact O-N 3.27Å; S32-G35 PolarHBondContact O-N 3Å; S32-K36 PolarHBondContact O-N 3.48Å
33	R	97.8	Very high	96.4	Very high	155 Å²	155	98.1 Å²	98.1	59%	0.585	46%	0.464	S	S	*	.	H	α-helix	trans	-59.5	-50.7	174.5	-174.1	176.2	68.4	-109.8	6.4	111.7	A29 A30 G35 K36 E37	A29-R33 WeakPolarHBondContact O-CB 3.23Å; A29-R33 PolarHBondContact O-N 3.05Å; A30-R33 PolarHBondContact O-N 3.42Å; R33-G35 VanDerWaalsContact C-N 3.29Å; R33-G35 PolarHBondContact O-N 2.79Å; R33-K36 PolarHBondContact O-N 3.39Å; R33-E37 VanDerWaalsContact O-CB 3.23Å; R33-E37 WeakPolarHBondContact O-CB 3.18Å; R33-E37 PolarHBondContact O-N 3.34Å
34	R	97.5	Very high	96.6	Very high	156 Å²	156	93.6 Å²	93.6	59%	0.589	45%	0.447	S	S	*	.	H	α-helix	trans	-60.4	-36.2	176.5	-72.8	172.8	-176.6	166.1	0.4	112.6	A30 R31 N38	A30-R34 WeakPolarHBondContact O-CB 3.19Å; A30-R34 WeakPolarHBondContact O-CG 3.47Å; A30-R34 PolarHBondContact O-N 2.95Å; R31-R34 PolarHBondContact O-N 2.83Å; R34-N38 VanDerWaalsContact O-CB 3.3Å; R34-N38 WeakPolarHBondContact O-CB 3.06Å; R34-N38 PolarHBondContact O-N 2.73Å; R34-N38 PolarHBondContact O-OD1 2.8Å
35	G	97.4	Very high	96.9	Very high	42 Å²	42	89.9 Å²	89.9	43%	0.433	43%	0.43	S	S	.	.	H	α-helix	trans	-63.6	-47	176.1	0	0	0	0	0	112.4	R31 S32 R33 F39	R31-G35 PolarHBondContact O-N 2.83Å; S32-G35 PolarHBondContact O-N 3Å; R33-G35 VanDerWaalsContact C-N 3.29Å; R33-G35 PolarHBondContact O-N 2.79Å; G35-F39 PolarHBondContact O-N 2.75Å; G35-F39 VanDerWaalsContact O-N 3.13Å
36	K	97.9	Very high	97.1	Very high	140 Å²	140	87.1 Å²	87.1	61%	0.609	42%	0.418	S	S	*	.	H	α-helix	trans	-64.3	-48.3	173.9	-67.7	-174.2	178.1	-168	0	111.7	S32 R33 N38 F39 E40	S32-K36 PolarHBondContact O-N 3.48Å; R33-K36 PolarHBondContact O-N 3.39Å; K36-N38 VanDerWaalsContact C-N 3.34Å; K36-N38 PolarHBondContact O-N 3.41Å; K36-F39 WeakPolarHBondContact O-CA 3.5Å; K36-F39 WeakPolarHBondContact O-CB 3.31Å; K36-F39 PolarHBondContact O-N 2.97Å; K36-E40 WeakPolarHBondContact O-CG 3.4Å; K36-E40 PolarHBondContact O-N 3.04Å
37	E	97.1	Very high	97.2	Very high	76 Å²	76	90 Å²	90	36%	0.355	43%	0.427	S	S	.	.	H	α-helix	trans	-52	-49.7	175.8	-175.2	-156.7	130.5	0	0	111.6	R33 F39 E40 F41 K60	R33-E37 VanDerWaalsContact O-CB 3.23Å; R33-E37 WeakPolarHBondContact O-CB 3.18Å; R33-E37 PolarHBondContact O-N 3.34Å; E37-F39 VanDerWaalsContact C-N 3.3Å; E37-F39 PolarHBondContact O-N 2.83Å; E37-E40 PolarHBondContact O-N 3.36Å; E37-F41 HydrophobicContact CG-CD2 4.03Å; E37-F41 HydrophobicContact CG-CE2 3.88Å; E37-F41 WeakPolarHBondContact O-CD2 3.33Å; E37-F41 PolarHBondContact O-N 2.97Å; E37-K60 IonicContact OE1-NZ 2.83Å; E37-K60 PolarHBondContact OE1-NZ 2.91Å
38	N	97.1	Very high	97.3	Very high	83 Å²	83	84.9 Å²	84.9	44%	0.444	41%	0.408	S	S	.	.	H	α-helix	trans	-60.7	-36.4	175.9	-73.1	4.1	0	0	0	113	R34 K36 Y42 K60	R34-N38 VanDerWaalsContact O-CB 3.3Å; R34-N38 WeakPolarHBondContact O-CB 3.06Å; R34-N38 PolarHBondContact O-N 2.73Å; R34-N38 PolarHBondContact O-OD1 2.8Å; K36-N38 VanDerWaalsContact C-N 3.34Å; K36-N38 PolarHBondContact O-N 3.41Å; N38-Y42 WeakPolarHBondContact O-CB 3.46Å; N38-Y42 PolarHBondContact O-N 3.07Å; N38-K60 VanDerWaalsContact OD1-CE 3.29Å; N38-K60 WeakPolarHBondContact OD1-CE 3.41Å; N38-K60 PolarHBondContact OD1-NZ 2.93Å
39	F	97.6	Very high	97.3	Very high	113 Å²	113	86.3 Å²	86.3	50%	0.496	42%	0.42	S	S	.	.	H	α-helix	trans	-67.1	-47.7	175.9	175.8	-96.2	0	0	0	111.6	G35 K36 E37 F41 Y42 E43	G35-F39 PolarHBondContact O-N 2.75Å; G35-F39 VanDerWaalsContact O-N 3.13Å; K36-F39 WeakPolarHBondContact O-CA 3.5Å; K36-F39 WeakPolarHBondContact O-CB 3.31Å; K36-F39 PolarHBondContact O-N 2.97Å; E37-F39 VanDerWaalsContact C-N 3.3Å; E37-F39 PolarHBondContact O-N 2.83Å; F39-F41 VanDerWaalsContact C-N 3.28Å; F39-F41 PolarHBondContact O-N 3.21Å; F39-Y42 PolarHBondContact O-N 2.74Å; F39-E43 HydrophobicContact CD1-CG 4.34Å; F39-E43 HydrophobicContact CD2-CG 4.47Å; F39-E43 HydrophobicContact CE1-CG 3.82Å; F39-E43 HydrophobicContact CE2-CG 3.96Å; F39-E43 HydrophobicContact CZ-CG 3.61Å; F39-E43 PolarHBondContact O-N 2.95Å
40	E	98.1	Very high	97.2	Very high	122 Å²	122	85 Å²	85	57%	0.57	41%	0.405	S	S	*	.	H	α-helix	trans	-60.1	-38.7	175.3	-55.7	-53.4	143	0	0	111.7	K36 E37 Y42 L44	K36-E40 WeakPolarHBondContact O-CG 3.4Å; K36-E40 PolarHBondContact O-N 3.04Å; E37-E40 PolarHBondContact O-N 3.36Å; E40-Y42 PolarHBondContact O-N 3.35Å; E40-L44 WeakPolarHBondContact O-CB 3.49Å; E40-L44 PolarHBondContact O-N 3.18Å
41	F	97.9	Very high	97.1	Very high	41 Å²	41	87.6 Å²	87.6	18%	0.18	42%	0.421	C	S	.	.	H	α-helix	trans	-60.7	-41.8	172.8	-91.1	-70.3	0	0	0	112.7	E37 F39 A45 K60 I63 I64	E37-F41 HydrophobicContact CG-CD2 4.03Å; E37-F41 HydrophobicContact CG-CE2 3.88Å; E37-F41 WeakPolarHBondContact O-CD2 3.33Å; E37-F41 PolarHBondContact O-N 2.97Å; F39-F41 VanDerWaalsContact C-N 3.28Å; F39-F41 PolarHBondContact O-N 3.21Å; F41-A45 WeakPolarHBondContact O-CB 3.49Å; F41-A45 PolarHBondContact O-N 2.87Å; F41-K60 HydrophobicContact CD1-CB 4.09Å; F41-K60 HydrophobicContact CD1-CD 4.46Å; F41-K60 HydrophobicContact CD1-CG 3.85Å; F41-K60 HydrophobicContact CD2-CD 3.76Å; F41-K60 VanDerWaalsContact CD2-CE 3.43Å; F41-K60 HydrophobicContact CD2-CG 4Å; F41-K60 HydrophobicContact CE1-CB 3.68Å; F41-K60 HydrophobicContact CE1-CD 4.29Å; F41-K60 HydrophobicContact CE1-CG 3.87Å; F41-K60 WeakPolarHBondContact CE1-O 3.49Å; F41-K60 HydrophobicContact CE2-CB 4.45Å; F41-K60 HydrophobicContact CE2-CD 3.6Å; F41-K60 HydrophobicContact CE2-CG 4.05Å; F41-K60 HydrophobicContact CG-CD 4.22Å; F41-K60 HydrophobicContact CG-CG 3.93Å; F41-K60 HydrophobicContact CZ-CB 3.9Å; F41-K60 HydrophobicContact CZ-CD 3.89Å; F41-K60 HydrophobicContact CZ-CG 3.98Å; F41-I63 HydrophobicContact CD1-CB 4.32Å; F41-I63 HydrophobicContact CD1-CD1 4.23Å; F41-I63 HydrophobicContact CD1-CG2 4.17Å; F41-I64 HydrophobicContact CE1-CD1 3.75Å; F41-I64 HydrophobicContact CE1-CG1 3.79Å; F41-I64 HydrophobicContact CZ-CD1 4.32Å; F41-I64 HydrophobicContact CZ-CG1 4.33Å
42	Y	96.1	Very high	96.9	Very high	124 Å²	124	83.6 Å²	83.6	49%	0.486	42%	0.422	S	S	.	.	H	α-helix	trans	-71.1	-42.2	-179.2	-179.2	-115.7	0	0	0	112.3	N38 F39 E40 A45 K46	N38-Y42 WeakPolarHBondContact O-CB 3.46Å; N38-Y42 PolarHBondContact O-N 3.07Å; F39-Y42 PolarHBondContact O-N 2.74Å; E40-Y42 PolarHBondContact O-N 3.35Å; Y42-A45 PolarHBondContact O-N 3.27Å; Y42-K46 WeakPolarHBondContact O-CG 3.48Å; Y42-K46 PolarHBondContact O-N 2.77Å
43	E	97.6	Very high	96.8	Very high	59 Å²	59	83.6 Å²	83.6	28%	0.276	43%	0.426	S	S	.	.	H	α-helix	trans	-66.4	-38.7	172.8	-62	-49.9	121.1	0	0	111.6	F39 A45 K46 L47	F39-E43 HydrophobicContact CD1-CG 4.34Å; F39-E43 HydrophobicContact CD2-CG 4.47Å; F39-E43 HydrophobicContact CE1-CG 3.82Å; F39-E43 HydrophobicContact CE2-CG 3.96Å; F39-E43 HydrophobicContact CZ-CG 3.61Å; F39-E43 PolarHBondContact O-N 2.95Å; E43-A45 VanDerWaalsContact C-N 3.33Å; E43-A45 PolarHBondContact O-N 2.94Å; E43-K46 VanDerWaalsContact CD-NZ 3.26Å; E43-K46 WeakPolarHBondContact O-CB 3.37Å; E43-K46 PolarHBondContact O-N 3.11Å; E43-K46 IonicContact OE1-NZ 3.08Å; E43-K46 PolarHBondContact OE1-NZ 3.16Å; E43-K46 IonicContact OE2-NZ 3.41Å; E43-K46 PolarHBondContact OE2-NZ 3.31Å; E43-K46 VanDerWaalsContact OE2-NZ 3.08Å; E43-L47 WeakPolarHBondContact O-CG 3.49Å; E43-L47 PolarHBondContact O-N 3.29Å
44	L	97.9	Very high	96.7	Very high	53 Å²	53	79.3 Å²	79.3	28%	0.277	41%	0.414	S	S	.	.	H	α-helix	trans	-62.7	-38.9	174.1	-177.8	59.1	0	0	0	112.2	E40 L47 I63 I64 T67	E40-L44 WeakPolarHBondContact O-CB 3.49Å; E40-L44 PolarHBondContact O-N 3.18Å; L44-L47 PolarHBondContact O-N 3.47Å; L44-I63 HydrophobicContact CB-CG2 4.25Å; L44-I63 HydrophobicContact CD2-CG2 3.87Å; L44-I63 HydrophobicContact CG-CG2 3.87Å; L44-I64 HydrophobicContact CD2-CD1 4.1Å; L44-T67 HydrophobicContact CD1-CG2 4Å
45	A	97.8	Very high	96.5	Very high	3 Å²	3	72.4 Å²	72.4	3%	0.025	39%	0.389	C	S	.	.	H	α-helix	trans	-62.5	-40.6	175.7	0	0	0	0	0	112.3	F41 Y42 E43 L47 L48 T55 I63	F41-A45 WeakPolarHBondContact O-CB 3.49Å; F41-A45 PolarHBondContact O-N 2.87Å; Y42-A45 PolarHBondContact O-N 3.27Å; E43-A45 VanDerWaalsContact C-N 3.33Å; E43-A45 PolarHBondContact O-N 2.94Å; A45-L47 PolarHBondContact O-N 3.12Å; A45-L48 WeakPolarHBondContact O-CB 3.47Å; A45-L48 PolarHBondContact O-N 3.4Å; A45-T55 VanDerWaalsContact O-CB 3.29Å; A45-T55 WeakPolarHBondContact O-CB 3.46Å; A45-T55 VanDerWaalsContact O-CG2 3.3Å; A45-T55 WeakPolarHBondContact O-CG2 3.31Å; A45-I63 HydrophobicContact CB-CD1 3.87Å; A45-I63 HydrophobicContact CB-CG1 4Å
46	K	97	Very high	96.3	Very high	103 Å²	103	73.9 Å²	73.9	45%	0.448	39%	0.393	S	S	.	.	H	α-helix	trans	-62.3	-26.2	174.7	-68.7	172.2	-177.8	169.5	0	113.8	Y42 E43	Y42-K46 WeakPolarHBondContact O-CG 3.48Å; Y42-K46 PolarHBondContact O-N 2.77Å; E43-K46 VanDerWaalsContact CD-NZ 3.26Å; E43-K46 WeakPolarHBondContact O-CB 3.37Å; E43-K46 PolarHBondContact O-N 3.11Å; E43-K46 IonicContact OE1-NZ 3.08Å; E43-K46 PolarHBondContact OE1-NZ 3.16Å; E43-K46 IonicContact OE2-NZ 3.41Å; E43-K46 PolarHBondContact OE2-NZ 3.31Å; E43-K46 VanDerWaalsContact OE2-NZ 3.08Å
47	L	97.2	Very high	96.1	Very high	140 Å²	140	75 Å²	75	73%	0.733	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-3.4	-179.1	-65.8	172.6	0	0	0	113.4	E43 L44 A45	E43-L47 WeakPolarHBondContact O-CG 3.49Å; E43-L47 PolarHBondContact O-N 3.29Å; L44-L47 PolarHBondContact O-N 3.47Å; A45-L47 PolarHBondContact O-N 3.12Å
48	L	97.2	Very high	96.1	Very high	13 Å²	13	72.7 Å²	72.7	7%	0.068	39%	0.39	C	S	.	.	S	Bend	trans	-71.3	145.5	171.3	-66	173.5	0	0	0	110.6	A45 L50 T55 L58 L66	A45-L48 WeakPolarHBondContact O-CB 3.47Å; A45-L48 PolarHBondContact O-N 3.4Å; L48-L50 PolarHBondContact O-N 2.98Å; L48-T55 HydrophobicContact CB-CG2 4.18Å; L48-L58 HydrophobicContact CD1-CD1 3.6Å; L48-L66 HydrophobicContact CD1-CB 3.99Å; L48-L66 HydrophobicContact CD1-CD1 3.94Å; L48-L66 HydrophobicContact CD2-CB 3.92Å
49	P	95.6	Very high	96.1	Very high	87 Å²	87	72.7 Å²	72.7	57%	0.565	39%	0.39	S	S	*	.	S	Bend	trans	-78.7	57.4	179.8	36.1	-39.2	0	0	0	111.5	Y70	P49-Y70 HydrophobicContact CB-CE2 4.45Å; P49-Y70 HydrophobicContact CG-CD2 3.71Å; P49-Y70 HydrophobicContact CG-CE2 3.84Å; P49-Y70 HydrophobicContact CG-CG 4.43Å
50	L	95	Very high	96.1	Very high	30 Å²	30	71 Å²	71	16%	0.157	38%	0.383	C	S	.	.	S	Bend	trans	-137.5	151.1	-176.3	-69.5	175.1	0	0	0	110.3	L48 T55 L66 V174	L48-L50 PolarHBondContact O-N 2.98Å; L50-T55 HydrophobicContact CB-CG2 3.59Å; L50-L66 HydrophobicContact CD1-CD1 3.93Å; L50-V174 HydrophobicContact CD1-CG2 4.07Å
51	P	95.1	Very high	96.1	Very high	72 Å²	72	68.5 Å²	68.5	47%	0.468	38%	0.383	S	S	.	.			trans	-54.7	140.2	175.4	-27	34.7	0	0	0	113.5	A53 I54 T55	P51-A53 PolarHBondContact O-N 3.13Å; P51-A53 VanDerWaalsContact O-N 3.1Å; P51-I54 HydrophobicContact CG-CD1 4.4Å; P51-I54 WeakPolarHBondContact O-CA 3.31Å; P51-I54 WeakPolarHBondContact O-CB 3.43Å; P51-I54 PolarHBondContact O-N 3.03Å; P51-T55 PolarHBondContact O-N 3.16Å; P51-T55 VanDerWaalsContact O-N 3.1Å
52	A	93.5	Very high	96	Very high	76 Å²	76	67 Å²	67	63%	0.628	38%	0.378	S	S	*	.	H	α-helix	trans	-58	-28.4	-178	0	0	0	0	0	114	I54 T55 S56	A52-I54 PolarHBondContact O-N 3.3Å; A52-T55 WeakPolarHBondContact CA-OG1 3.36Å; A52-S56 WeakPolarHBondContact O-CB 3.39Å; A52-S56 PolarHBondContact O-N 2.8Å; A52-S56 VanDerWaalsContact O-N 3.17Å; A52-S56 PolarHBondContact O-OG 3.18Å
53	A	94.7	Very high	96.1	Very high	67 Å²	67	61.5 Å²	61.5	55%	0.554	36%	0.356	S	S	*	.	H	α-helix	trans	-64.1	-26.2	174	0	0	0	0	0	113.4	P51 Q57	P51-A53 PolarHBondContact O-N 3.13Å; P51-A53 VanDerWaalsContact O-N 3.1Å; A53-Q57 PolarHBondContact O-NE2 3.02Å
54	I	94.4	Very high	96.2	Very high	66 Å²	66	62.1 Å²	62.1	34%	0.338	36%	0.361	S	S	.	.	H	α-helix	trans	-90	-50.4	175.8	-57.5	-178.4	0	0	0	109.7	P51 A52 S56 Q57 L58 V174	P51-I54 HydrophobicContact CG-CD1 4.4Å; P51-I54 WeakPolarHBondContact O-CA 3.31Å; P51-I54 WeakPolarHBondContact O-CB 3.43Å; P51-I54 PolarHBondContact O-N 3.03Å; A52-I54 PolarHBondContact O-N 3.3Å; I54-S56 PolarHBondContact O-N 2.96Å; I54-Q57 PolarHBondContact O-N 3.4Å; I54-L58 HydrophobicContact CG2-CD2 4.39Å; I54-V174 HydrophobicContact CG2-CG2 3.94Å
55	T	94.4	Very high	96.2	Very high	11 Å²	11	62.3 Å²	62.3	7%	0.067	36%	0.358	C	S	.	.	H	α-helix	trans	-63.8	-29.2	-173.2	59.4	0	0	0	0	113.7	A45 L48 L50 P51 A52 Q57 L58	A45-T55 VanDerWaalsContact O-CB 3.29Å; A45-T55 WeakPolarHBondContact O-CB 3.46Å; A45-T55 VanDerWaalsContact O-CG2 3.3Å; A45-T55 WeakPolarHBondContact O-CG2 3.31Å; L48-T55 HydrophobicContact CB-CG2 4.18Å; L50-T55 HydrophobicContact CB-CG2 3.59Å; P51-T55 PolarHBondContact O-N 3.16Å; P51-T55 VanDerWaalsContact O-N 3.1Å; A52-T55 WeakPolarHBondContact CA-OG1 3.36Å; T55-Q57 PolarHBondContact O-N 3.45Å; T55-L58 HydrophobicContact CG2-CD1 4.36Å
56	S	92.9	Very high	96.2	Very high	73 Å²	73	62.8 Å²	62.8	51%	0.51	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.1	174.3	52.4	0	0	0	0	115	A52 I54	A52-S56 WeakPolarHBondContact O-CB 3.39Å; A52-S56 PolarHBondContact O-N 2.8Å; A52-S56 VanDerWaalsContact O-N 3.17Å; A52-S56 PolarHBondContact O-OG 3.18Å; I54-S56 PolarHBondContact O-N 2.96Å
57	Q	94.4	Very high	96.3	Very high	163 Å²	163	59 Å²	59	76%	0.762	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	1.6	-176.9	-59.5	-175.9	57.6	0	0	113.5	A53 I54 T55	A53-Q57 PolarHBondContact O-NE2 3.02Å; I54-Q57 PolarHBondContact O-N 3.4Å; T55-Q57 PolarHBondContact O-N 3.45Å
58	L	96.4	Very high	96.3	Very high	28 Å²	28	56.7 Å²	56.7	15%	0.147	33%	0.333	C	S	.	.			trans	-71.7	140.2	-177.2	-65	174.4	0	0	0	112.6	L48 I54 T55 I63 L66 V174	L48-L58 HydrophobicContact CD1-CD1 3.6Å; I54-L58 HydrophobicContact CG2-CD2 4.39Å; T55-L58 HydrophobicContact CG2-CD1 4.36Å; L58-I63 HydrophobicContact CB-CD1 4.19Å; L58-I63 HydrophobicContact CB-CG1 3.69Å; L58-I63 HydrophobicContact CD1-CG1 4.14Å; L58-L66 HydrophobicContact CD1-CD1 3.84Å; L58-L66 HydrophobicContact CD2-CD1 4.17Å; L58-V174 HydrophobicContact CD2-CG1 3.53Å; L58-V174 HydrophobicContact CD2-CG2 4.43Å
59	D	96.9	Very high	96.4	Very high	83 Å²	83	56.4 Å²	56.4	44%	0.444	33%	0.332	S	S	.	.			trans	-74.4	159.3	167	79	-86.9	0	0	0	111.8	A61 S62 I63	D59-A61 VanDerWaalsContact C-N 3.33Å; D59-A61 PolarHBondContact O-N 3.25Å; D59-A61 WeakPolarHBondContact OD2-CA 3.18Å; D59-A61 VanDerWaalsContact OD2-CB 3.29Å; D59-A61 WeakPolarHBondContact OD2-CB 3.23Å; D59-A61 PolarHBondContact OD2-N 3.48Å; D59-S62 PolarHBondContact O-N 3.25Å; D59-S62 WeakPolarHBondContact OD1-CB 3.36Å; D59-S62 PolarHBondContact OD1-OG 3.12Å; D59-S62 PolarHBondContact OD2-N 2.87Å; D59-I63 WeakPolarHBondContact O-CG1 3.32Å; D59-I63 PolarHBondContact O-N 3.02Å
60	K	97.2	Very high	96.5	Very high	78 Å²	78	57.3 Å²	57.3	34%	0.339	33%	0.325	S	S	.	.	H	α-helix	trans	-58.6	-37.3	-178.1	-73.9	-174.2	169.2	-176.5	0	114.4	E37 N38 F41 I64	E37-K60 IonicContact OE1-NZ 2.83Å; E37-K60 PolarHBondContact OE1-NZ 2.91Å; N38-K60 VanDerWaalsContact OD1-CE 3.29Å; N38-K60 WeakPolarHBondContact OD1-CE 3.41Å; N38-K60 PolarHBondContact OD1-NZ 2.93Å; F41-K60 HydrophobicContact CD1-CB 4.09Å; F41-K60 HydrophobicContact CD1-CD 4.46Å; F41-K60 HydrophobicContact CD1-CG 3.85Å; F41-K60 HydrophobicContact CD2-CD 3.76Å; F41-K60 VanDerWaalsContact CD2-CE 3.43Å; F41-K60 HydrophobicContact CD2-CG 4Å; F41-K60 HydrophobicContact CE1-CB 3.68Å; F41-K60 HydrophobicContact CE1-CD 4.29Å; F41-K60 HydrophobicContact CE1-CG 3.87Å; F41-K60 WeakPolarHBondContact CE1-O 3.49Å; F41-K60 HydrophobicContact CE2-CB 4.45Å; F41-K60 HydrophobicContact CE2-CD 3.6Å; F41-K60 HydrophobicContact CE2-CG 4.05Å; F41-K60 HydrophobicContact CG-CD 4.22Å; F41-K60 HydrophobicContact CG-CG 3.93Å; F41-K60 HydrophobicContact CZ-CB 3.9Å; F41-K60 HydrophobicContact CZ-CD 3.89Å; F41-K60 HydrophobicContact CZ-CG 3.98Å; K60-I64 PolarHBondContact O-N 3.43Å
61	A	97.8	Very high	96.6	Very high	68 Å²	68	59.3 Å²	59.3	56%	0.562	34%	0.336	S	S	*	.	H	α-helix	trans	-72.6	-41	-179.4	0	0	0	0	0	110.5	D59 I64 R65	D59-A61 VanDerWaalsContact C-N 3.33Å; D59-A61 PolarHBondContact O-N 3.25Å; D59-A61 WeakPolarHBondContact OD2-CA 3.18Å; D59-A61 VanDerWaalsContact OD2-CB 3.29Å; D59-A61 WeakPolarHBondContact OD2-CB 3.23Å; D59-A61 PolarHBondContact OD2-N 3.48Å; A61-I64 PolarHBondContact O-N 2.84Å; A61-R65 WeakPolarHBondContact O-CB 3.15Å; A61-R65 PolarHBondContact O-N 3.4Å
62	S	97.6	Very high	96.7	Very high	11 Å²	11	59.8 Å²	59.8	8%	0.077	33%	0.33	C	S	.	.	H	α-helix	trans	-62.7	-39.1	172.3	-64.9	0	0	0	0	112.8	D59 I64 R65 L66	D59-S62 PolarHBondContact O-N 3.25Å; D59-S62 WeakPolarHBondContact OD1-CB 3.36Å; D59-S62 PolarHBondContact OD1-OG 3.12Å; D59-S62 PolarHBondContact OD2-N 2.87Å; S62-I64 PolarHBondContact O-N 3.38Å; S62-R65 PolarHBondContact O-N 2.68Å; S62-R65 PolarHBondContact OG-NH2 3.28Å; S62-L66 VanDerWaalsContact O-CB 3.31Å; S62-L66 WeakPolarHBondContact O-CB 3.46Å; S62-L66 WeakPolarHBondContact O-CG 3.48Å; S62-L66 PolarHBondContact O-N 2.79Å
63	I	98.4	Very high	96.8	Very high	8 Å²	8	57.6 Å²	57.6	4%	0.041	31%	0.307	C	S	.	.	H	α-helix	trans	-56.1	-53.5	174.7	-66.9	161.4	0	0	0	110.5	F41 L44 A45 L58 D59 R65 L66 T67	F41-I63 HydrophobicContact CD1-CB 4.32Å; F41-I63 HydrophobicContact CD1-CD1 4.23Å; F41-I63 HydrophobicContact CD1-CG2 4.17Å; L44-I63 HydrophobicContact CB-CG2 4.25Å; L44-I63 HydrophobicContact CD2-CG2 3.87Å; L44-I63 HydrophobicContact CG-CG2 3.87Å; A45-I63 HydrophobicContact CB-CD1 3.87Å; A45-I63 HydrophobicContact CB-CG1 4Å; L58-I63 HydrophobicContact CB-CD1 4.19Å; L58-I63 HydrophobicContact CB-CG1 3.69Å; L58-I63 HydrophobicContact CD1-CG1 4.14Å; D59-I63 WeakPolarHBondContact O-CG1 3.32Å; D59-I63 PolarHBondContact O-N 3.02Å; I63-R65 PolarHBondContact O-N 3.06Å; I63-L66 PolarHBondContact O-N 3.48Å; I63-T67 PolarHBondContact O-N 2.93Å; I63-T67 PolarHBondContact O-OG1 2.74Å
64	I	98.4	Very high	96.7	Very high	72 Å²	72	60 Å²	60	37%	0.369	30%	0.302	S	S	.	.	H	α-helix	trans	-62.3	-44	178.7	-59.6	-55.2	0	0	0	111.8	F41 L44 K60 A61 S62 L66 T67 I68	F41-I64 HydrophobicContact CE1-CD1 3.75Å; F41-I64 HydrophobicContact CE1-CG1 3.79Å; F41-I64 HydrophobicContact CZ-CD1 4.32Å; F41-I64 HydrophobicContact CZ-CG1 4.33Å; L44-I64 HydrophobicContact CD2-CD1 4.1Å; K60-I64 PolarHBondContact O-N 3.43Å; A61-I64 PolarHBondContact O-N 2.84Å; S62-I64 PolarHBondContact O-N 3.38Å; I64-L66 PolarHBondContact O-N 2.85Å; I64-T67 PolarHBondContact O-N 2.62Å; I64-I68 HydrophobicContact CG2-CD1 3.61Å; I64-I68 HydrophobicContact CG2-CG1 4.21Å; I64-I68 WeakPolarHBondContact O-CB 3.36Å; I64-I68 WeakPolarHBondContact O-CG1 3.25Å; I64-I68 PolarHBondContact O-N 2.83Å
65	R	98.2	Very high	96.6	Very high	57 Å²	57	60.3 Å²	60.3	22%	0.215	30%	0.304	C	S	.	.	H	α-helix	trans	-61.1	-42.8	-179.1	-176.6	169.7	58.4	91.8	8	111.6	A61 S62 I63 S69 V174 E175 T177 S179	A61-R65 WeakPolarHBondContact O-CB 3.15Å; A61-R65 PolarHBondContact O-N 3.4Å; S62-R65 PolarHBondContact O-N 2.68Å; S62-R65 PolarHBondContact OG-NH2 3.28Å; I63-R65 PolarHBondContact O-N 3.06Å; R65-S69 VanDerWaalsContact O-CB 3.32Å; R65-S69 WeakPolarHBondContact O-CB 3.19Å; R65-S69 PolarHBondContact O-N 3.47Å; R65-S69 PolarHBondContact O-OG 3.18Å; R65-V174 PolarHBondContact NH1-O 3.08Å; R65-V174 PolarHBondContact NH2-O 2.97Å; R65-E175 PolarHBondContact NH1-O 2.98Å; R65-T177 PolarHBondContact NH1-O 3.17Å; R65-S179 PolarHBondContact NH1-OG 3.02Å
66	L	98.4	Very high	96.5	Very high	12 Å²	12	60.2 Å²	60.2	6%	0.063	30%	0.303	C	S	.	.	H	α-helix	trans	-68.3	-44	174.2	-67.9	172	0	0	0	111.9	L48 L50 L58 S62 I63 I64 I68 S69 Y70 V174 T177	L48-L66 HydrophobicContact CD1-CB 3.99Å; L48-L66 HydrophobicContact CD1-CD1 3.94Å; L48-L66 HydrophobicContact CD2-CB 3.92Å; L50-L66 HydrophobicContact CD1-CD1 3.93Å; L58-L66 HydrophobicContact CD1-CD1 3.84Å; L58-L66 HydrophobicContact CD2-CD1 4.17Å; S62-L66 VanDerWaalsContact O-CB 3.31Å; S62-L66 WeakPolarHBondContact O-CB 3.46Å; S62-L66 WeakPolarHBondContact O-CG 3.48Å; S62-L66 PolarHBondContact O-N 2.79Å; I63-L66 PolarHBondContact O-N 3.48Å; I64-L66 PolarHBondContact O-N 2.85Å; L66-I68 PolarHBondContact O-N 3.1Å; L66-S69 PolarHBondContact O-N 3.39Å; L66-Y70 WeakPolarHBondContact O-CB 3.33Å; L66-Y70 PolarHBondContact O-N 3.45Å; L66-V174 HydrophobicContact CD1-CG1 4.31Å; L66-T177 HydrophobicContact CD2-CG2 3.8Å
67	T	98.4	Very high	96.4	Very high	25 Å²	25	57.4 Å²	57.4	15%	0.153	28%	0.284	C	S	.	.	H	α-helix	trans	-59.4	-48	176.3	-58.6	0	0	0	0	112	L44 I63 I64 S69 Y70 L71	L44-T67 HydrophobicContact CD1-CG2 4Å; I63-T67 PolarHBondContact O-N 2.93Å; I63-T67 PolarHBondContact O-OG1 2.74Å; I64-T67 PolarHBondContact O-N 2.62Å; T67-S69 VanDerWaalsContact C-N 3.33Å; T67-S69 PolarHBondContact O-N 3.33Å; T67-Y70 PolarHBondContact O-N 2.85Å; T67-L71 HydrophobicContact CG2-CD1 4.07Å; T67-L71 VanDerWaalsContact O-CG 3.31Å; T67-L71 WeakPolarHBondContact O-CG 3.4Å; T67-L71 PolarHBondContact O-N 2.89Å
68	I	98.3	Very high	96.1	Very high	90 Å²	90	53 Å²	53	46%	0.462	27%	0.266	S	S	.	.	H	α-helix	trans	-61.6	-43.6	178.1	-70	172.6	0	0	0	110.6	I64 L66 L71 K72	I64-I68 HydrophobicContact CG2-CD1 3.61Å; I64-I68 HydrophobicContact CG2-CG1 4.21Å; I64-I68 WeakPolarHBondContact O-CB 3.36Å; I64-I68 WeakPolarHBondContact O-CG1 3.25Å; I64-I68 PolarHBondContact O-N 2.83Å; L66-I68 PolarHBondContact O-N 3.1Å; I68-L71 PolarHBondContact O-N 3.09Å; I68-K72 WeakPolarHBondContact O-CB 3.48Å; I68-K72 PolarHBondContact O-N 3.19Å
69	S	98.3	Very high	95.6	Very high	7 Å²	7	55.6 Å²	55.6	5%	0.049	28%	0.277	C	S	.	.	H	α-helix	trans	-66.7	-43.3	-179.2	-54.9	0	0	0	0	111.7	R65 L66 T67 L71 K72 M73 G178	R65-S69 VanDerWaalsContact O-CB 3.32Å; R65-S69 WeakPolarHBondContact O-CB 3.19Å; R65-S69 PolarHBondContact O-N 3.47Å; R65-S69 PolarHBondContact O-OG 3.18Å; L66-S69 PolarHBondContact O-N 3.39Å; T67-S69 VanDerWaalsContact C-N 3.33Å; T67-S69 PolarHBondContact O-N 3.33Å; S69-L71 PolarHBondContact O-N 3.49Å; S69-K72 PolarHBondContact O-N 3.04Å; S69-M73 WeakPolarHBondContact O-CB 3.39Å; S69-M73 PolarHBondContact O-N 2.97Å; S69-G178 WeakPolarHBondContact OG-CA 3.27Å; S69-G178 PolarHBondContact OG-N 3.38Å
70	Y	97.9	Very high	94.6	Very high	106 Å²	106	51.8 Å²	51.8	42%	0.416	26%	0.258	S	S	.	.	H	α-helix	trans	-60.4	-43.3	174.6	174.7	-105	0	0	0	112.5	P49 L66 T67 M73 R74	P49-Y70 HydrophobicContact CB-CE2 4.45Å; P49-Y70 HydrophobicContact CG-CD2 3.71Å; P49-Y70 HydrophobicContact CG-CE2 3.84Å; P49-Y70 HydrophobicContact CG-CG 4.43Å; L66-Y70 WeakPolarHBondContact O-CB 3.33Å; L66-Y70 PolarHBondContact O-N 3.45Å; T67-Y70 PolarHBondContact O-N 2.85Å; Y70-M73 PolarHBondContact O-N 3.4Å; Y70-R74 WeakPolarHBondContact O-CB 3.5Å; Y70-R74 PolarHBondContact O-N 2.91Å
71	L	97.6	Very high	93.6	Very high	73 Å²	73	54.4 Å²	54.4	38%	0.382	28%	0.276	S	S	.	.	H	α-helix	trans	-65.2	-49.3	176.3	-69	172.3	0	0	0	111.4	T67 I68 S69 M73 R74 D75	T67-L71 HydrophobicContact CG2-CD1 4.07Å; T67-L71 VanDerWaalsContact O-CG 3.31Å; T67-L71 WeakPolarHBondContact O-CG 3.4Å; T67-L71 PolarHBondContact O-N 2.89Å; I68-L71 PolarHBondContact O-N 3.09Å; S69-L71 PolarHBondContact O-N 3.49Å; L71-M73 VanDerWaalsContact C-N 3.27Å; L71-M73 PolarHBondContact O-N 3.25Å; L71-R74 PolarHBondContact O-N 3.42Å; L71-D75 VanDerWaalsContact O-CG 3.29Å; L71-D75 PolarHBondContact O-N 3.46Å
72	K	96.2	Very high	92.7	Very high	82 Å²	82	55.6 Å²	55.6	36%	0.357	28%	0.278	S	S	.	.	H	α-helix	trans	-58.1	-38.4	173.4	-80.1	-167.2	170.3	-168.9	0	112	I68 S69 D75 F76 E155 L159	I68-K72 WeakPolarHBondContact O-CB 3.48Å; I68-K72 PolarHBondContact O-N 3.19Å; S69-K72 PolarHBondContact O-N 3.04Å; K72-D75 PolarHBondContact O-N 3.25Å; K72-F76 VanDerWaalsContact O-CB 3.28Å; K72-F76 WeakPolarHBondContact O-CB 3.39Å; K72-F76 PolarHBondContact O-N 3.4Å; K72-E155 IonicContact NZ-OE2 3.81Å; K72-E155 PolarHBondContact NZ-OE2 3.3Å; K72-L159 HydrophobicContact CB-CD2 3.57Å; K72-L159 HydrophobicContact CD-CD2 4.08Å; K72-L159 HydrophobicContact CG-CD2 4.48Å
73	M	95.6	Very high	92	Very high	29 Å²	29	58 Å²	58	14%	0.143	29%	0.292	C	S	.	.	H	α-helix	trans	-67	-43.7	179.6	-176.6	57.9	-176.5	0	0	111.9	S69 Y70 L71 D75 F76 A77 W84 A151 L159 Y160	S69-M73 WeakPolarHBondContact O-CB 3.39Å; S69-M73 PolarHBondContact O-N 2.97Å; Y70-M73 PolarHBondContact O-N 3.4Å; L71-M73 VanDerWaalsContact C-N 3.27Å; L71-M73 PolarHBondContact O-N 3.25Å; M73-D75 VanDerWaalsContact C-N 3.33Å; M73-F76 PolarHBondContact O-N 3.04Å; M73-F76 HydrophobicContact SD-CD1 4.4Å; M73-A77 VanDerWaalsContact O-CB 3.24Å; M73-A77 WeakPolarHBondContact O-CB 3.44Å; M73-A77 PolarHBondContact O-N 3.24Å; M73-W84 HydrophobicContact CE-CE3 4.29Å; M73-W84 HydrophobicContact CE-CZ3 3.58Å; M73-A151 HydrophobicContact CE-CB 4.06Å; M73-A151 HydrophobicContact SD-CB 4.08Å; M73-L159 HydrophobicContact CB-CB 3.99Å; M73-L159 HydrophobicContact CG-CB 4.29Å; M73-L159 HydrophobicContact SD-CB 3.52Å; M73-L159 VanDerWaalsContact SD-CB 3.52Å; M73-L159 HydrophobicContact SD-CD1 4.39Å; M73-Y160 VanDerWaalsContact CE-CB 3.43Å; M73-Y160 HydrophobicContact CE-CG 4.04Å
74	R	93.7	Very high	91.4	Very high	117 Å²	117	62.8 Å²	62.8	44%	0.442	31%	0.31	S	S	.	.	H	α-helix	trans	-63.1	-41.7	174.3	-172.4	-173	66.5	-166.8	-2.8	111.2	Y70 L71 A77 N78	Y70-R74 WeakPolarHBondContact O-CB 3.5Å; Y70-R74 PolarHBondContact O-N 2.91Å; L71-R74 PolarHBondContact O-N 3.42Å; R74-A77 PolarHBondContact O-N 2.95Å; R74-N78 WeakPolarHBondContact O-CB 3.24Å; R74-N78 VanDerWaalsContact O-CG 3.24Å; R74-N78 PolarHBondContact O-N 3.3Å; R74-N78 VanDerWaalsContact O-N 3.12Å; R74-N78 PolarHBondContact O-ND2 2.94Å; R74-N78 VanDerWaalsContact O-ND2 3.12Å
75	D	91.7	Very high	90.1	Very high	73 Å²	73	64.4 Å²	64.4	39%	0.39	32%	0.32	S	S	.	.	H	α-helix	trans	-69.5	-35.8	178.8	-65.9	-5.2	0	0	0	111.2	L71 K72 M73 Q79	L71-D75 VanDerWaalsContact O-CG 3.29Å; L71-D75 PolarHBondContact O-N 3.46Å; K72-D75 PolarHBondContact O-N 3.25Å; M73-D75 VanDerWaalsContact C-N 3.33Å; D75-Q79 WeakPolarHBondContact O-CB 3.39Å; D75-Q79 VanDerWaalsContact O-CG 3.27Å; D75-Q79 WeakPolarHBondContact O-CG 3.46Å; D75-Q79 PolarHBondContact O-N 3.21Å; D75-Q79 PolarHBondContact O-NE2 3.49Å
76	F	92.4	Very high	87.9	Confident	9 Å²	9	70 Å²	70	4%	0.039	35%	0.353	C	S	.	.	H	α-helix	trans	-64.3	-50.2	170.8	176.7	-87.3	0	0	0	111.6	K72 M73 N78 Q79 W84 A151 L159 R280 M296 V299	K72-F76 VanDerWaalsContact O-CB 3.28Å; K72-F76 WeakPolarHBondContact O-CB 3.39Å; K72-F76 PolarHBondContact O-N 3.4Å; M73-F76 PolarHBondContact O-N 3.04Å; M73-F76 HydrophobicContact SD-CD1 4.4Å; F76-N78 PolarHBondContact O-N 2.81Å; F76-Q79 PolarHBondContact O-N 3.01Å; F76-W84 HydrophobicContact CD1-CH2 4.49Å; F76-W84 AromaticContact CE1-CH2 3.91Å; F76-W84 HydrophobicContact CE1-CH2 3.91Å; F76-W84 HydrophobicContact CE1-CZ2 4.32Å; F76-W84 HydrophobicContact CE1-CZ3 4.45Å; F76-A151 HydrophobicContact CE1-CB 4.28Å; F76-L159 HydrophobicContact CB-CD1 3.57Å; F76-L159 HydrophobicContact CD1-CD1 4.31Å; F76-L159 HydrophobicContact CD2-CD1 3.77Å; F76-L159 HydrophobicContact CG-CD1 3.65Å; F76-R280 HydrophobicContact CE2-CB 4.48Å; F76-R280 HydrophobicContact CZ-CB 4.06Å; F76-R280 PolarHBondContact O-NH1 3.28Å; F76-M296 HydrophobicContact CB-CE 4.41Å; F76-M296 HydrophobicContact CD2-CB 3.94Å; F76-M296 HydrophobicContact CD2-CE 3.75Å; F76-M296 HydrophobicContact CE2-CB 3.71Å; F76-M296 HydrophobicContact CE2-CE 4.27Å; F76-M296 HydrophobicContact CG-CE 4.1Å; F76-M296 WeakPolarHBondContact O-CE 3.28Å; F76-V299 HydrophobicContact CE1-CG2 3.74Å; F76-V299 HydrophobicContact CZ-CG2 3.63Å
77	A	91.3	Very high	85.5	Confident	14 Å²	14	80.5 Å²	80.5	12%	0.116	39%	0.392	C	S	.	.	H	α-helix	trans	-51.9	-42.4	178.1	0	0	0	0	0	112.1	M73 R74 P83 W84 R280	M73-A77 VanDerWaalsContact O-CB 3.24Å; M73-A77 WeakPolarHBondContact O-CB 3.44Å; M73-A77 PolarHBondContact O-N 3.24Å; R74-A77 PolarHBondContact O-N 2.95Å; A77-P83 WeakPolarHBondContact O-CA 3.42Å; A77-W84 HydrophobicContact CB-CB 4.17Å; A77-W84 HydrophobicContact CB-CD2 4.34Å; A77-W84 HydrophobicContact CB-CE3 3.97Å; A77-W84 HydrophobicContact CB-CG 4.46Å; A77-W84 PolarHBondContact O-N 2.92Å; A77-R280 PolarHBondContact O-NH2 3.25Å
78	N	88.4	Confident	82.7	Confident	71 Å²	71	85.6 Å²	85.6	38%	0.38	42%	0.415	S	S	.	.	H	α-helix	trans	-79	-20.2	-177.9	-72.3	-27.1	0	0	0	116	R74 F76	R74-N78 WeakPolarHBondContact O-CB 3.24Å; R74-N78 VanDerWaalsContact O-CG 3.24Å; R74-N78 PolarHBondContact O-N 3.3Å; R74-N78 VanDerWaalsContact O-N 3.12Å; R74-N78 PolarHBondContact O-ND2 2.94Å; R74-N78 VanDerWaalsContact O-ND2 3.12Å; F76-N78 PolarHBondContact O-N 2.81Å
79	Q	84.8	Confident	79.9	Confident	82 Å²	82	89.5 Å²	89.5	38%	0.383	43%	0.432	S	S	.	.	H	α-helix	trans	-102.1	-19.3	-167.7	-82.6	177.5	97.5	0	0	116	D75 F76 M296	D75-Q79 WeakPolarHBondContact O-CB 3.39Å; D75-Q79 VanDerWaalsContact O-CG 3.27Å; D75-Q79 WeakPolarHBondContact O-CG 3.46Å; D75-Q79 PolarHBondContact O-N 3.21Å; D75-Q79 PolarHBondContact O-NE2 3.49Å; F76-Q79 PolarHBondContact O-N 3.01Å; Q79-M296 HydrophobicContact CB-CE 3.63Å; Q79-M296 HydrophobicContact CB-SD 4.37Å
80	G	76.4	Confident	77.2	Confident	3 Å²	3	91.9 Å²	91.9	3%	0.031	46%	0.458	C	S	.	.	S	Bend	trans	-95.1	166.5	173.6	0	0	0	0	0	111.6	P82 P83 R280	G80-P82 CarbonylContact O-C 3.15Å; G80-P83 WeakPolarHBondContact O-CA 3.32Å; G80-P83 VanDerWaalsContact O-N 3.11Å; G80-R280 PolarHBondContact O-NH2 3.31Å
81	D	75.2	Confident	74.2	Confident	134 Å²	134	92.7 Å²	92.7	72%	0.717	48%	0.476	S	S	*	.	S	Bend	trans	-97.9	138.3	-176	-160.1	24.6	0	0	0	111.9
82	P	79.4	Confident	71.2	Confident	93 Å²	93	93.5 Å²	93.5	60%	0.604	49%	0.485	S	S	*	.	S	Bend	cis	-62.3	152.3	-25.5	30.5	-34.9	0	0	0	111.2	G80 R280	G80-P82 CarbonylContact O-C 3.15Å; P82-R280 PolarHBondContact O-NH2 3.34Å
83	P	83.8	Confident	68.5	Low	60 Å²	60	95.6 Å²	95.6	39%	0.39	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-63.4	134.2	169.7	-25.1	36.3	0	0	0	111	A77 G80 N85	A77-P83 WeakPolarHBondContact O-CA 3.42Å; G80-P83 WeakPolarHBondContact O-CA 3.32Å; G80-P83 VanDerWaalsContact O-N 3.11Å; P83-N85 PolarHBondContact O-N 3.01Å
84	W	85.9	Confident	65.5	Low	110 Å²	110	101 Å²	101	42%	0.417	54%	0.537	S	S	.	.			trans	-79.2	52.9	-172.5	-56	-13.1	0	0	0	113.4	M73 F76 A77 V299	M73-W84 HydrophobicContact CE-CE3 4.29Å; M73-W84 HydrophobicContact CE-CZ3 3.58Å; F76-W84 HydrophobicContact CD1-CH2 4.49Å; F76-W84 AromaticContact CE1-CH2 3.91Å; F76-W84 HydrophobicContact CE1-CH2 3.91Å; F76-W84 HydrophobicContact CE1-CZ2 4.32Å; F76-W84 HydrophobicContact CE1-CZ3 4.45Å; A77-W84 HydrophobicContact CB-CB 4.17Å; A77-W84 HydrophobicContact CB-CD2 4.34Å; A77-W84 HydrophobicContact CB-CE3 3.97Å; A77-W84 HydrophobicContact CB-CG 4.46Å; A77-W84 PolarHBondContact O-N 2.92Å; W84-V299 HydrophobicContact CH2-CG1 3.88Å; W84-V299 HydrophobicContact CH2-CG2 3.88Å; W84-V299 HydrophobicContact CZ2-CG1 4.15Å; W84-V299 HydrophobicContact CZ2-CG2 3.98Å
85	N	70.8	Confident	62.7	Low	106 Å²	106	101.6 Å²	101.6	57%	0.567	55%	0.554	S	S	*	*			trans	-83	114.5	176.6	-74.3	-71.3	0	0	0	110.5	P83 R87	P83-N85 PolarHBondContact O-N 3.01Å; N85-R87 PolarHBondContact O-N 2.7Å
86	L	52	Low	59.8	Low	175 Å²	175	103.4 Å²	103.4	92%	0.916	57%	0.572	S	S	*	*			trans	-68.2	27.3	169.9	-82.8	161.1	0	0	0	113.9	M88	L86-M88 PolarHBondContact O-N 2.69Å
87	R	46.8	Very low	57	Low	231 Å²	231	108.5 Å²	108.5	87%	0.872	60%	0.603	S	S	*	*			trans	-90.8	101.3	169.3	-85.1	-164.5	168.2	-152.7	-4.3	109.4	N85	N85-R87 PolarHBondContact O-N 2.7Å
88	M	40	Very low	54.2	Low	132 Å²	132	117.7 Å²	117.7	65%	0.65	64%	0.641	S	S	*	*			trans	-23.1	137	152.8	-85.9	-77.5	179.9	0	0	113.2	L86 G90 E134	L86-M88 PolarHBondContact O-N 2.69Å; M88-G90 PolarHBondContact O-N 2.82Å; M88-E134 WeakPolarHBondContact CE-OE1 3.34Å; M88-E134 WeakPolarHBondContact CE-OE2 3.3Å
89	E	38.8	Very low	51.3	Low	172 Å²	172	118 Å²	118	80%	0.804	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-52.2	128.4	179.9	-67.1	179	104.1	0	0	112.3
90	G	42.2	Very low	48.8	Very low	58 Å²	58	121.7 Å²	121.7	60%	0.598	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-68	146.2	144.1	0	0	0	0	0	108.2	M88	M88-G90 PolarHBondContact O-N 2.82Å
91	P	35.5	Very low	46.5	Very low	122 Å²	122	128.3 Å²	128.3	79%	0.792	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-55.4	143.2	-171.9	22.5	-34	0	0	0	112.4
92	P	34.8	Very low	44.4	Very low	90 Å²	90	129 Å²	129	58%	0.584	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-62.1	142.7	-167.1	22.6	-34.2	0	0	0	112.9	N94	P92-N94 VanDerWaalsContact C-N 3.27Å; P92-N94 PolarHBondContact O-N 2.81Å
93	P	38.4	Very low	41.8	Very low	127 Å²	127	137.6 Å²	137.6	83%	0.825	73%	0.733	S	S	*	*			trans	-81.4	55.9	-166.2	34.5	-38.6	0	0	0	114.4	T95	P93-T95 PolarHBondContact O-N 3.24Å
94	N	34.4	Very low	39.2	Very low	143 Å²	143	144.3 Å²	144.3	77%	0.765	76%	0.756	S	S	*	*			trans	-86.1	89.7	176.3	-78.6	0.4	0	0	0	112.6	P92	P92-N94 VanDerWaalsContact C-N 3.27Å; P92-N94 PolarHBondContact O-N 2.81Å
95	T	34.9	Very low	36.6	Very low	129 Å²	129	144.1 Å²	144.1	79%	0.791	77%	0.772	S	S	*	*			trans	40.1	92.5	137.3	59.1	0	0	0	0	118.9	P93	P93-T95 PolarHBondContact O-N 3.24Å
96	S	29.5	Very low	35.1	Very low	110 Å²	110	147.4 Å²	147.4	77%	0.769	78%	0.784	S	S	*	*				-174.5	110.6	124.3	-167.1	0	0	0	0	113.9
97	V	34.5	Very low	34.2	Very low	116 Å²	116	147.1 Å²	147.1	70%	0.703	78%	0.782	S	S	*	*			trans	51.6	127.1	138.5	-177.3	0	0	0	0	121.1
98	K	31.7	Very low	33.3	Very low	208 Å²	208	142 Å²	142	90%	0.904	78%	0.78	S	S	*	*			trans	69.6	111.3	167	-69.1	160.7	-173.1	172.8	0	117
99	G	27.6	Very low	33	Very low	78 Å²	78	144.2 Å²	144.2	80%	0.804	79%	0.791	S	S	*	*			trans	169.1	57.2	170	0	0	0	0	0	115.9	Q101	G99-Q101 PolarHBondContact O-N 2.99Å
100	I	32.8	Very low	32.6	Very low	159 Å²	159	147.2 Å²	147.2	82%	0.815	80%	0.795	S	S	*	*			trans	-71.9	123.2	167.5	-47.1	172.8	0	0	0	107.9
101	Q	28.3	Very low	32.2	Very low	142 Å²	142	153.9 Å²	153.9	66%	0.664	81%	0.808	S	S	*	*				-179.6	142.9	120.8	-144.4	71.1	9.7	0	0	112.7	G99	G99-Q101 PolarHBondContact O-N 2.99Å
102	M	30.5	Very low	31.9	Very low	149 Å²	149	154.2 Å²	154.2	73%	0.734	81%	0.808	S	S	*	*			trans	16.9	131.2	147.8	-68.8	153.2	39.3	0	0	120
103	W	25.5	Very low	32.1	Very low	272 Å²	272	156.1 Å²	156.1	100%	1.03	82%	0.82	S	S	*	*				-132.6	123.9	122.8	-112.8	25.3	0	0	0	110.5
104	K	29.5	Very low	31.8	Very low	201 Å²	201	155.5 Å²	155.5	87%	0.874	82%	0.817	S	S	*	*			trans	-157.3	150.8	172.9	-164.3	169.8	-171.9	171.4	0	108.6
105	S	29.7	Very low	31.8	Very low	107 Å²	107	157.2 Å²	157.2	75%	0.748	82%	0.821	S	S	*	*			trans	87.9	122.9	-171.9	-156.6	0	0	0	0	113.8
106	E	39.6	Very low	31.7	Very low	175 Å²	175	157.3 Å²	157.3	82%	0.818	82%	0.821	S	S	*	*			trans	-58.1	154.1	150.2	-50.2	107.1	111.7	0	0	110.2
107	L	33.9	Very low	32	Very low	169 Å²	169	159.7 Å²	159.7	89%	0.885	82%	0.823	S	S	*	*			trans	153.2	87.9	136.1	-174.7	72.1	0	0	0	111
108	C	28.6	Very low	32.3	Very low	122 Å²	122	157.8 Å²	157.8	82%	0.824	83%	0.827	S	S	*	*			trans	-150.4	86	153.4	-161.5	0	0	0	0	111.4
109	M	32.8	Very low	32.4	Very low	179 Å²	179	151.6 Å²	151.6	88%	0.882	82%	0.815	S	S	*	*			trans	-97.6	99	164.3	-131.2	-70.8	-92.5	0	0	107.5
110	R	31	Very low	32.9	Very low	235 Å²	235	157.1 Å²	157.1	89%	0.887	82%	0.82	S	S	*	*			trans	-155.5	136	170.3	-112.5	165.1	-166	-164.3	0.2	112
111	K	33.8	Very low	33.5	Very low	198 Å²	198	160.8 Å²	160.8	86%	0.861	82%	0.824	S	S	*	*			trans	-79.8	135.4	-178.1	-61.3	177.3	175.9	-176.4	0	111.6
112	T	29.1	Very low	34.2	Very low	129 Å²	129	165.4 Å²	165.4	79%	0.791	84%	0.835	S	S	*	*			trans	-156.7	126.1	137.9	35.5	0	0	0	0	108
113	P	38.7	Very low	35.3	Very low	131 Å²	131	166 Å²	166	85%	0.851	83%	0.829	S	S	*	*			trans	-71.6	135.6	161.3	31.8	-31.1	0	0	0	108.4
114	C	31.2	Very low	36.7	Very low	113 Å²	113	155.4 Å²	155.4	76%	0.764	80%	0.797	S	S	*	*			trans	-125.2	126.2	170.6	-171.8	0	0	0	0	107.6	V116	C114-V116 PolarHBondContact O-N 3.49Å
115	E	34.1	Very low	38	Very low	179 Å²	179	151.2 Å²	151.2	84%	0.836	79%	0.79	S	S	*	*			trans	-68.3	125.7	-179.4	-64.2	166.1	113.6	0	0	109.9
116	V	33	Very low	39.1	Very low	131 Å²	131	149.7 Å²	149.7	79%	0.794	78%	0.779	S	S	*	*			trans	-109.1	82.3	175.2	-176	0	0	0	0	108.9	C114	C114-V116 PolarHBondContact O-N 3.49Å
117	I	37.3	Very low	40.2	Very low	160 Å²	160	142.8 Å²	142.8	82%	0.821	75%	0.752	S	S	*	*			trans	-74.1	137.1	166.1	-62.7	176.2	0	0	0	108.5
118	G	39.8	Very low	41.5	Very low	76 Å²	76	138.7 Å²	138.7	78%	0.784	73%	0.731	S	S	*	*	S	Bend	trans	89.7	37.4	154	0	0	0	0	0	118.4
119	A	34.3	Very low	42.9	Very low	79 Å²	79	134.6 Å²	134.6	65%	0.653	71%	0.705	S	S	*	*			trans	-139.2	63.3	166	0	0	0	0	0	112.6	R121	A119-R121 PolarHBondContact O-N 3.47Å
120	Q	38.2	Very low	44.4	Very low	194 Å²	194	130.5 Å²	130.5	91%	0.907	69%	0.686	S	S	*	*			trans	-74.8	66.1	175.8	-160.3	162.5	-3	0	0	110.9	R122	Q120-R122 PolarHBondContact O-N 3.36Å
121	R	44.6	Very low	46.1	Very low	236 Å²	236	123.8 Å²	123.8	89%	0.891	67%	0.665	S	S	*	*			trans	-52.9	105.8	170.8	176.8	-171	-98.9	-147.3	-2.1	106.9	A119 R123	A119-R121 PolarHBondContact O-N 3.47Å; R121-R123 PolarHBondContact O-N 2.87Å
122	R	43.9	Very low	47.8	Very low	239 Å²	239	118.5 Å²	118.5	90%	0.902	65%	0.649	S	S	*	*			trans	-55.5	106.4	175.5	-75.4	-172.4	177.3	-119.9	3.1	108	Q120 S124	Q120-R122 PolarHBondContact O-N 3.36Å; R122-S124 PolarHBondContact O-N 2.98Å; R122-S124 VanDerWaalsContact O-N 3.11Å
123	R	52.3	Low	49.7	Very low	160 Å²	160	118.3 Å²	118.3	60%	0.604	64%	0.637	S	S	*	*			trans	-54.2	118.5	161.6	-81.9	-176.6	159.9	126.3	-10.5	105.8	R121 L128 E131	R121-R123 PolarHBondContact O-N 2.87Å; R123-L128 HydrophobicContact CB-CD1 4.28Å; R123-L128 HydrophobicContact CB-CG 4.28Å; R123-E131 IonicContact CZ-OE1 3.3Å; R123-E131 IonicContact CZ-OE2 3.62Å; R123-E131 IonicContact NE-OE1 2.66Å; R123-E131 PolarHBondContact NE-OE1 3.14Å; R123-E131 IonicContact NE-OE2 3.11Å; R123-E131 IonicContact NH2-OE1 2.65Å; R123-E131 PolarHBondContact NH2-OE1 3.04Å; R123-E131 VanDerWaalsContact NH2-OE1 3.11Å; R123-E131 IonicContact NH2-OE2 3.63Å
124	S	55.3	Low	51.5	Low	51 Å²	51	116.5 Å²	116.5	36%	0.357	62%	0.618	S	S	.	*			trans	-63.4	151.6	174.4	54.3	0	0	0	0	108.7	R122 S126 A127 L128	R122-S124 PolarHBondContact O-N 2.98Å; R122-S124 VanDerWaalsContact O-N 3.11Å; S124-S126 WeakPolarHBondContact CB-OG 3.37Å; S124-S126 PolarHBondContact O-N 2.92Å; S124-S126 VanDerWaalsContact O-N 3.11Å; S124-S126 PolarHBondContact OG-OG 3.2Å; S124-A127 PolarHBondContact O-N 3.25Å; S124-A127 PolarHBondContact OG-N 3.19Å; S124-A127 VanDerWaalsContact OG-N 3.15Å; S124-L128 PolarHBondContact O-N 3.12Å
125	P	57	Low	53.7	Low	113 Å²	113	114.7 Å²	114.7	73%	0.734	61%	0.611	S	S	*	*	H	α-helix	trans	-54	-29.4	170.2	-27.5	36.2	0	0	0	112.4	A129	P125-A129 VanDerWaalsContact O-CB 3.26Å; P125-A129 WeakPolarHBondContact O-CB 3.39Å; P125-A129 PolarHBondContact O-N 3.45Å
126	S	53.7	Low	56	Low	74 Å²	74	111.1 Å²	111.1	52%	0.517	59%	0.594	S	S	.	*	H	α-helix	trans	-65.9	-37.9	171.8	53.5	0	0	0	0	114	S124 A129 I130	S124-S126 WeakPolarHBondContact CB-OG 3.37Å; S124-S126 PolarHBondContact O-N 2.92Å; S124-S126 VanDerWaalsContact O-N 3.11Å; S124-S126 PolarHBondContact OG-OG 3.2Å; S126-A129 PolarHBondContact O-N 3.09Å; S126-I130 WeakPolarHBondContact O-CB 3.28Å; S126-I130 WeakPolarHBondContact O-CD1 3.4Å; S126-I130 WeakPolarHBondContact O-CG1 3.43Å; S126-I130 PolarHBondContact O-N 3.18Å
127	A	61	Low	58.6	Low	30 Å²	30	108.9 Å²	108.9	25%	0.248	58%	0.577	C	S	.	*	H	α-helix	trans	-67.6	-41.7	177.9	0	0	0	0	0	111.6	S124 I130 E131	S124-A127 PolarHBondContact O-N 3.25Å; S124-A127 PolarHBondContact OG-N 3.19Å; S124-A127 VanDerWaalsContact OG-N 3.15Å; A127-I130 PolarHBondContact O-N 3.13Å; A127-E131 WeakPolarHBondContact O-CG 3.39Å; A127-E131 PolarHBondContact O-N 2.88Å
128	L	61.4	Low	60.9	Low	84 Å²	84	103.5 Å²	103.5	44%	0.44	56%	0.561	S	S	.	*	H	α-helix	trans	-68.7	-36.7	174.3	-76.1	163.1	0	0	0	112.2	R123 S124 E131 V132	R123-L128 HydrophobicContact CB-CD1 4.28Å; R123-L128 HydrophobicContact CB-CG 4.28Å; S124-L128 PolarHBondContact O-N 3.12Å; L128-E131 PolarHBondContact O-N 2.87Å; L128-V132 WeakPolarHBondContact O-CB 3.49Å; L128-V132 VanDerWaalsContact O-CG2 3.32Å; L128-V132 WeakPolarHBondContact O-CG2 3.19Å; L128-V132 PolarHBondContact O-N 2.91Å
129	A	59.6	Low	63.3	Low	35 Å²	35	102.9 Å²	102.9	29%	0.289	55%	0.545	S	S	.	.	H	α-helix	trans	-62.9	-42.6	172.9	0	0	0	0	0	111.6	P125 S126 V132 F133	P125-A129 VanDerWaalsContact O-CB 3.26Å; P125-A129 WeakPolarHBondContact O-CB 3.39Å; P125-A129 PolarHBondContact O-N 3.45Å; S126-A129 PolarHBondContact O-N 3.09Å; A129-V132 PolarHBondContact O-N 3.18Å; A129-F133 HydrophobicContact CB-CD2 4.17Å; A129-F133 HydrophobicContact CB-CE2 4.14Å; A129-F133 WeakPolarHBondContact O-CB 3.42Å; A129-F133 WeakPolarHBondContact O-CD2 3.42Å; A129-F133 WeakPolarHBondContact O-CG 3.48Å; A129-F133 PolarHBondContact O-N 2.94Å
130	I	62.8	Low	65.9	Low	94 Å²	94	102.9 Å²	102.9	48%	0.482	53%	0.531	S	S	.	.	H	α-helix	trans	-60.8	-53.3	173.6	-69.1	161.5	0	0	0	110	S126 A127 V132 F133 E134	S126-I130 WeakPolarHBondContact O-CB 3.28Å; S126-I130 WeakPolarHBondContact O-CD1 3.4Å; S126-I130 WeakPolarHBondContact O-CG1 3.43Å; S126-I130 PolarHBondContact O-N 3.18Å; A127-I130 PolarHBondContact O-N 3.13Å; I130-V132 PolarHBondContact O-N 3.27Å; I130-V132 VanDerWaalsContact O-N 3.13Å; I130-F133 PolarHBondContact O-N 2.84Å; I130-E134 WeakPolarHBondContact O-CB 3.39Å; I130-E134 PolarHBondContact O-N 3.1Å
131	E	67.1	Low	68.5	Low	93 Å²	93	97.9 Å²	97.9	44%	0.435	51%	0.509	S	S	.	.	H	α-helix	trans	-53.1	-36.6	178.1	-74.3	174.6	175.1	0	0	112.4	R123 A127 L128	R123-E131 IonicContact CZ-OE1 3.3Å; R123-E131 IonicContact CZ-OE2 3.62Å; R123-E131 IonicContact NE-OE1 2.66Å; R123-E131 PolarHBondContact NE-OE1 3.14Å; R123-E131 IonicContact NE-OE2 3.11Å; R123-E131 IonicContact NH2-OE1 2.65Å; R123-E131 PolarHBondContact NH2-OE1 3.04Å; R123-E131 VanDerWaalsContact NH2-OE1 3.11Å; R123-E131 IonicContact NH2-OE2 3.63Å; A127-E131 WeakPolarHBondContact O-CG 3.39Å; A127-E131 PolarHBondContact O-N 2.88Å; L128-E131 PolarHBondContact O-N 2.87Å
132	V	69.4	Low	70.9	Confident	87 Å²	87	88.2 Å²	88.2	53%	0.527	48%	0.475	S	S	.	.	H	α-helix	trans	-80.5	-45	179.8	170.3	0	0	0	0	113.7	L128 A129 I130 H136	L128-V132 WeakPolarHBondContact O-CB 3.49Å; L128-V132 VanDerWaalsContact O-CG2 3.32Å; L128-V132 WeakPolarHBondContact O-CG2 3.19Å; L128-V132 PolarHBondContact O-N 2.91Å; A129-V132 PolarHBondContact O-N 3.18Å; I130-V132 PolarHBondContact O-N 3.27Å; I130-V132 VanDerWaalsContact O-N 3.13Å; V132-H136 PolarHBondContact O-ND1 3.44Å; V132-H136 VanDerWaalsContact O-ND1 3.15Å
133	F	69.6	Low	73.2	Confident	125 Å²	125	84.1 Å²	84.1	55%	0.548	47%	0.466	S	S	.	.	H	α-helix	trans	-76.8	-32.5	-178.2	-69.9	-56.1	0	0	0	112.6	A129 I130 H136 L137	A129-F133 HydrophobicContact CB-CD2 4.17Å; A129-F133 HydrophobicContact CB-CE2 4.14Å; A129-F133 WeakPolarHBondContact O-CB 3.42Å; A129-F133 WeakPolarHBondContact O-CD2 3.42Å; A129-F133 WeakPolarHBondContact O-CG 3.48Å; A129-F133 PolarHBondContact O-N 2.94Å; I130-F133 PolarHBondContact O-N 2.84Å; F133-H136 PolarHBondContact O-N 2.88Å; F133-L137 WeakPolarHBondContact O-CA 3.45Å; F133-L137 PolarHBondContact O-N 3.25Å
134	E	77.1	Confident	75.1	Confident	94 Å²	94	81.3 Å²	81.3	44%	0.439	47%	0.471	S	S	.	.	H	α-helix	trans	-65.8	-41.9	177.3	-172.1	172.5	-176.5	0	0	111.3	M88 I130 H136 L137	M88-E134 WeakPolarHBondContact CE-OE1 3.34Å; M88-E134 WeakPolarHBondContact CE-OE2 3.3Å; I130-E134 WeakPolarHBondContact O-CB 3.39Å; I130-E134 PolarHBondContact O-N 3.1Å; E134-H136 PolarHBondContact O-N 2.8Å; E134-H136 VanDerWaalsContact O-N 3.12Å; E134-L137 WeakPolarHBondContact O-CB 3.5Å; E134-L137 PolarHBondContact O-N 3.24Å
135	A	76.2	Confident	76.8	Confident	75 Å²	75	81.5 Å²	81.5	62%	0.62	47%	0.468	S	S	*	.	H	α-helix	trans	-59	-25.5	178.6	0	0	0	0	0	114.2
136	H	83.3	Confident	78.4	Confident	104 Å²	104	81.6 Å²	81.6	48%	0.481	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	11.4	-178.1	-56.3	93.7	0	0	0	113	V132 F133 E134 G138 S139 H140	V132-H136 PolarHBondContact O-ND1 3.44Å; V132-H136 VanDerWaalsContact O-ND1 3.15Å; F133-H136 PolarHBondContact O-N 2.88Å; E134-H136 PolarHBondContact O-N 2.8Å; E134-H136 VanDerWaalsContact O-N 3.12Å; H136-G138 VanDerWaalsContact C-N 3.33Å; H136-G138 PolarHBondContact O-N 2.86Å; H136-S139 WeakPolarHBondContact O-CB 3.39Å; H136-S139 PolarHBondContact O-N 2.86Å; H136-H140 PolarHBondContact O-N 2.8Å
137	L	85.9	Confident	80.3	Confident	84 Å²	84	78.1 Å²	78.1	44%	0.44	44%	0.438	S	S	.	.	H	α-helix	trans	-55.8	-43.7	-169.3	-179.9	59.7	0	0	0	113	F133 E134 S139 H140 I141	F133-L137 WeakPolarHBondContact O-CA 3.45Å; F133-L137 PolarHBondContact O-N 3.25Å; E134-L137 WeakPolarHBondContact O-CB 3.5Å; E134-L137 PolarHBondContact O-N 3.24Å; L137-S139 PolarHBondContact O-N 3Å; L137-H140 PolarHBondContact O-N 2.81Å; L137-I141 HydrophobicContact CD1-CD1 3.98Å; L137-I141 HydrophobicContact CD1-CG1 4.2Å; L137-I141 HydrophobicContact CG-CD1 3.87Å; L137-I141 VanDerWaalsContact O-CG1 3.26Å; L137-I141 WeakPolarHBondContact O-CG1 3.43Å; L137-I141 PolarHBondContact O-N 3.35Å
138	G	87.3	Confident	82.1	Confident	47 Å²	47	76.7 Å²	76.7	49%	0.485	43%	0.426	S	S	.	.	H	α-helix	trans	-60.8	-43.5	177.4	0	0	0	0	0	112.9	H136 I141 L142	H136-G138 VanDerWaalsContact C-N 3.33Å; H136-G138 PolarHBondContact O-N 2.86Å; G138-I141 PolarHBondContact O-N 3.47Å; G138-L142 WeakPolarHBondContact O-CG 3.17Å; G138-L142 PolarHBondContact O-N 2.81Å; G138-L142 VanDerWaalsContact O-N 3.08Å
139	S	88.4	Confident	83.9	Confident	63 Å²	63	74.1 Å²	74.1	44%	0.441	41%	0.414	S	S	.	.	H	α-helix	trans	-65.9	-42.9	176.1	-53.8	0	0	0	0	111.6	H136 L137 L142 Q143	H136-S139 WeakPolarHBondContact O-CB 3.39Å; H136-S139 PolarHBondContact O-N 2.86Å; L137-S139 PolarHBondContact O-N 3Å; S139-L142 PolarHBondContact O-N 3.06Å; S139-Q143 VanDerWaalsContact O-CB 3.26Å; S139-Q143 WeakPolarHBondContact O-CB 3.18Å; S139-Q143 WeakPolarHBondContact O-CG 3.41Å; S139-Q143 PolarHBondContact O-N 2.88Å
140	H	90.4	Very high	85.7	Confident	79 Å²	79	72.5 Å²	72.5	37%	0.366	40%	0.401	S	S	.	.	H	α-helix	trans	-64.3	-40.4	177.4	-72.6	-41.7	0	0	0	112.7	H136 L137 S144	H136-H140 PolarHBondContact O-N 2.8Å; L137-H140 PolarHBondContact O-N 2.81Å; H140-S144 WeakPolarHBondContact O-CB 3.49Å; H140-S144 PolarHBondContact O-N 2.99Å; H140-S144 VanDerWaalsContact O-N 3.08Å; H140-S144 PolarHBondContact O-OG 3.22Å
141	I	92.8	Very high	87.4	Confident	88 Å²	88	68.1 Å²	68.1	45%	0.451	38%	0.378	S	S	.	.	H	α-helix	trans	-59	-53.9	173.4	-71	164.4	0	0	0	109.9	L137 G138 Q143 S144 L145	L137-I141 HydrophobicContact CD1-CD1 3.98Å; L137-I141 HydrophobicContact CD1-CG1 4.2Å; L137-I141 HydrophobicContact CG-CD1 3.87Å; L137-I141 VanDerWaalsContact O-CG1 3.26Å; L137-I141 WeakPolarHBondContact O-CG1 3.43Å; L137-I141 PolarHBondContact O-N 3.35Å; G138-I141 PolarHBondContact O-N 3.47Å; I141-Q143 VanDerWaalsContact C-N 3.35Å; I141-Q143 PolarHBondContact O-N 2.97Å; I141-S144 PolarHBondContact O-N 2.89Å; I141-L145 HydrophobicContact CG2-CD1 4.13Å; I141-L145 WeakPolarHBondContact O-CG 3.41Å; I141-L145 PolarHBondContact O-N 2.66Å
142	L	94.1	Very high	88.9	Confident	34 Å²	34	63.7 Å²	63.7	18%	0.178	36%	0.357	C	S	.	.	H	α-helix	trans	-67.7	-31.6	-176.2	-66.9	-179.2	0	0	0	113.5	G138 S139 V149 T164	G138-L142 WeakPolarHBondContact O-CG 3.17Å; G138-L142 PolarHBondContact O-N 2.81Å; G138-L142 VanDerWaalsContact O-N 3.08Å; S139-L142 PolarHBondContact O-N 3.06Å; L142-V149 HydrophobicContact CD2-CG2 4.18Å; L142-T164 HydrophobicContact CB-CG2 4.18Å
143	Q	91.7	Very high	90.1	Very high	152 Å²	152	59.7 Å²	59.7	71%	0.71	33%	0.333	S	S	*	.	H	α-helix	trans	-80	-16.5	177	-70.9	173.4	-7.7	0	0	113.8	S139 I141	S139-Q143 VanDerWaalsContact O-CB 3.26Å; S139-Q143 WeakPolarHBondContact O-CB 3.18Å; S139-Q143 WeakPolarHBondContact O-CG 3.41Å; S139-Q143 PolarHBondContact O-N 2.88Å; I141-Q143 VanDerWaalsContact C-N 3.35Å; I141-Q143 PolarHBondContact O-N 2.97Å
144	S	92.5	Very high	91.3	Very high	102 Å²	102	57.8 Å²	57.8	71%	0.713	33%	0.326	S	S	*	.	H	α-helix	trans	-96.3	-10.9	179.6	-58	0	0	0	0	113.3	H140 I141	H140-S144 WeakPolarHBondContact O-CB 3.49Å; H140-S144 PolarHBondContact O-N 2.99Å; H140-S144 VanDerWaalsContact O-N 3.08Å; H140-S144 PolarHBondContact O-OG 3.22Å; I141-S144 PolarHBondContact O-N 2.89Å
145	L	92.4	Very high	92.1	Very high	55 Å²	55	57.2 Å²	57.2	29%	0.288	32%	0.323	S	S	.	.	S	Bend	trans	-89.5	123.9	173.9	-71	170	0	0	0	109.9	I141 G147 V149 V301	I141-L145 HydrophobicContact CG2-CD1 4.13Å; I141-L145 WeakPolarHBondContact O-CG 3.41Å; I141-L145 PolarHBondContact O-N 2.66Å; L145-G147 PolarHBondContact O-N 3.18Å; L145-V149 HydrophobicContact CD1-CG2 3.5Å; L145-V149 VanDerWaalsContact CD1-CG2 3.5Å; L145-V301 HydrophobicContact CD2-CG1 4.26Å
146	D	90	Very high	93.1	Very high	115 Å²	115	53.7 Å²	53.7	62%	0.615	29%	0.294	S	S	*	.	S	Bend	trans	-78.7	69.6	169.8	-167	19.5	0	0	0	110.4	Y168 H303	D146-Y168 WeakPolarHBondContact CA-OH 3.32Å; D146-Y168 VanDerWaalsContact OD1-CE1 3.29Å; D146-Y168 WeakPolarHBondContact OD1-CE1 3.38Å; D146-Y168 PolarHBondContact OD1-OH 2.74Å; D146-H303 PolarHBondContact O-ND1 3.13Å
147	G	94.3	Very high	93.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.288	C	S	.	.	S	Bend	trans	165.9	-155.9	-176.8	0	0	0	0	0	114.2	L145 T164 Y168 A302	L145-G147 PolarHBondContact O-N 3.18Å; G147-T164 PolarHBondContact O-OG1 2.87Å; G147-Y168 VanDerWaalsContact CA-CE2 3.45Å; G147-Y168 VanDerWaalsContact N-CZ 3.27Å; G147-Y168 PolarHBondContact N-OH 3.2Å; G147-Y168 VanDerWaalsContact N-OH 3.14Å; G147-Y168 WeakPolarHBondContact O-CE2 3.36Å; G147-A302 CarbonylContact C-O 3.59Å; G147-A302 VanDerWaalsContact CA-O 3.27Å; G147-A302 WeakPolarHBondContact CA-O 3.48Å
148	F	97.8	Very high	94.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	147.6	178.4	58.1	-84.2	0	0	0	111.7	F150 I161 S162 T164 V165 Y168 L169 M254 I273 A302	F148-F150 AromaticContact CD2-CD1 3.91Å; F148-F150 HydrophobicContact CD2-CD1 3.91Å; F148-F150 HydrophobicContact CD2-CE1 4.46Å; F148-F150 AromaticContact CE2-CD1 3.76Å; F148-F150 HydrophobicContact CE2-CD1 3.76Å; F148-F150 AromaticContact CE2-CE1 3.9Å; F148-F150 HydrophobicContact CE2-CE1 3.9Å; F148-I161 HydrophobicContact CD2-CD1 3.75Å; F148-I161 HydrophobicContact CD2-CG1 4.14Å; F148-I161 HydrophobicContact CE2-CD1 3.97Å; F148-S162 WeakPolarHBondContact CA-OG 3.3Å; F148-S162 WeakPolarHBondContact CB-OG 3.23Å; F148-T164 WeakPolarHBondContact CA-OG1 3.43Å; F148-T164 WeakPolarHBondContact CB-OG1 3.31Å; F148-V165 HydrophobicContact CB-CB 4.01Å; F148-V165 HydrophobicContact CD1-CB 4.45Å; F148-V165 HydrophobicContact CD1-CG2 4.24Å; F148-V165 HydrophobicContact CD2-CB 4.02Å; F148-V165 HydrophobicContact CD2-CG2 3.8Å; F148-V165 HydrophobicContact CE1-CG2 4.34Å; F148-V165 HydrophobicContact CE2-CG2 3.91Å; F148-V165 HydrophobicContact CG-CB 3.92Å; F148-V165 HydrophobicContact CG-CG2 3.97Å; F148-V165 HydrophobicContact CZ-CG2 4.18Å; F148-Y168 HydrophobicContact CD1-CD2 4.18Å; F148-Y168 HydrophobicContact CD1-CG 4.34Å; F148-L169 HydrophobicContact CE1-CD1 4.26Å; F148-L169 HydrophobicContact CE1-CG 4.39Å; F148-L169 HydrophobicContact CZ-CD1 3.87Å; F148-L169 HydrophobicContact CZ-CG 4.49Å; F148-M254 HydrophobicContact CE2-SD 4.45Å; F148-M254 HydrophobicContact CZ-SD 4.11Å; F148-I273 HydrophobicContact CE1-CD1 4.06Å; F148-I273 HydrophobicContact CZ-CD1 4.27Å; F148-I273 HydrophobicContact CZ-CG1 4.36Å; F148-I273 HydrophobicContact CZ-CG2 4.13Å; F148-A302 HydrophobicContact CD1-CB 4.44Å; F148-A302 HydrophobicContact CD2-CB 4.03Å; F148-A302 HydrophobicContact CE1-CB 4.14Å; F148-A302 HydrophobicContact CE2-CB 3.71Å; F148-A302 HydrophobicContact CG-CB 4.39Å; F148-A302 HydrophobicContact CZ-CB 3.77Å; F148-A302 PolarHBondContact N-O 2.9Å; F148-A302 PolarHBondContact O-N 2.92Å
149	V	98.3	Very high	94.9	Very high	31 Å²	31	46.8 Å²	46.8	19%	0.188	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	136.1	-177.3	-178.2	0	0	0	0	108.6	L142 L145 Y160 I161 S162 V300 V301	L142-V149 HydrophobicContact CD2-CG2 4.18Å; L145-V149 HydrophobicContact CD1-CG2 3.5Å; L145-V149 VanDerWaalsContact CD1-CG2 3.5Å; V149-Y160 HydrophobicContact CB-CE1 4.48Å; V149-Y160 HydrophobicContact CG1-CE1 4.45Å; V149-I161 CarbonylContact O-C 3.47Å; V149-I161 VanDerWaalsContact O-CA 3.31Å; V149-I161 WeakPolarHBondContact O-CA 3.29Å; V149-S162 PolarHBondContact N-OG 2.95Å; V149-S162 PolarHBondContact O-N 2.77Å; V149-V300 WeakPolarHBondContact CA-O 3.49Å; V149-V300 WeakPolarHBondContact CG1-O 3.13Å; V149-V301 HydrophobicContact CG2-CG2 4.4Å
150	F	98.4	Very high	95.4	Very high	1 Å²	1	47.3 Å²	47.3	0%	0.004	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	157.8	172.9	65.7	-103.6	0	0	0	114	F148 L152 F158 Y160 I161 I275 V300 A302	F148-F150 AromaticContact CD2-CD1 3.91Å; F148-F150 HydrophobicContact CD2-CD1 3.91Å; F148-F150 HydrophobicContact CD2-CE1 4.46Å; F148-F150 AromaticContact CE2-CD1 3.76Å; F148-F150 HydrophobicContact CE2-CD1 3.76Å; F148-F150 AromaticContact CE2-CE1 3.9Å; F148-F150 HydrophobicContact CE2-CE1 3.9Å; F150-L152 HydrophobicContact CD2-CD1 4.43Å; F150-L152 HydrophobicContact CD2-CD2 3.99Å; F150-L152 HydrophobicContact CD2-CG 3.81Å; F150-L152 HydrophobicContact CE2-CD1 3.85Å; F150-L152 HydrophobicContact CE2-CD2 4.15Å; F150-L152 HydrophobicContact CE2-CG 3.73Å; F150-F158 HydrophobicContact CB-CD1 4.14Å; F150-F158 HydrophobicContact CB-CE1 4.24Å; F150-F158 HydrophobicContact CD1-CE1 4.39Å; F150-F158 HydrophobicContact CD2-CD1 4.3Å; F150-F158 HydrophobicContact CD2-CE1 4.03Å; F150-F158 HydrophobicContact CE2-CE1 4.43Å; F150-F158 HydrophobicContact CG-CD1 4.32Å; F150-F158 HydrophobicContact CG-CE1 4Å; F150-Y160 CarbonylContact C-O 3.57Å; F150-Y160 VanDerWaalsContact CA-O 3.28Å; F150-Y160 WeakPolarHBondContact CA-O 3.29Å; F150-Y160 VanDerWaalsContact CB-O 3.31Å; F150-Y160 WeakPolarHBondContact CB-O 3.35Å; F150-I161 HydrophobicContact CB-CB 3.94Å; F150-I161 HydrophobicContact CB-CD1 3.92Å; F150-I161 HydrophobicContact CB-CG1 3.89Å; F150-I161 HydrophobicContact CD1-CD1 4.2Å; F150-I161 HydrophobicContact CG-CD1 4.39Å; F150-I275 HydrophobicContact CZ-CD1 3.87Å; F150-I275 HydrophobicContact CZ-CG1 4.27Å; F150-V300 HydrophobicContact CD1-CB 4.25Å; F150-V300 HydrophobicContact CD1-CG1 4.14Å; F150-V300 HydrophobicContact CD2-CB 3.92Å; F150-V300 HydrophobicContact CD2-CG2 4.14Å; F150-V300 HydrophobicContact CE1-CB 4.06Å; F150-V300 HydrophobicContact CE1-CG1 3.63Å; F150-V300 HydrophobicContact CE2-CB 3.69Å; F150-V300 HydrophobicContact CE2-CG1 4.07Å; F150-V300 HydrophobicContact CE2-CG2 3.57Å; F150-V300 HydrophobicContact CG-CB 4.21Å; F150-V300 HydrophobicContact CZ-CB 3.78Å; F150-V300 HydrophobicContact CZ-CG1 3.59Å; F150-V300 HydrophobicContact CZ-CG2 3.87Å; F150-V300 PolarHBondContact N-O 2.93Å; F150-V300 PolarHBondContact O-N 2.84Å; F150-A302 HydrophobicContact CD1-CB 4.14Å; F150-A302 HydrophobicContact CE1-CB 3.66Å
151	A	98.3	Very high	95.7	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	120.8	171.7	0	0	0	0	0	109.2	M73 F76 L159 Y160 L298	M73-A151 HydrophobicContact CE-CB 4.06Å; M73-A151 HydrophobicContact SD-CB 4.08Å; F76-A151 HydrophobicContact CE1-CB 4.28Å; A151-L159 PolarHBondContact O-N 3.17Å; A151-Y160 PolarHBondContact N-O 3.05Å; A151-Y160 PolarHBondContact O-N 3.16Å; A151-L298 CarbonylContact C-O 3.49Å; A151-L298 WeakPolarHBondContact CA-O 3.49Å
152	L	98.3	Very high	96	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	150.5	169.8	-56.3	-179.7	0	0	0	109.5	F150 K157 F158 V181 M193 L197 G297 L298	F150-L152 HydrophobicContact CD2-CD1 4.43Å; F150-L152 HydrophobicContact CD2-CD2 3.99Å; F150-L152 HydrophobicContact CD2-CG 3.81Å; F150-L152 HydrophobicContact CE2-CD1 3.85Å; F150-L152 HydrophobicContact CE2-CD2 4.15Å; F150-L152 HydrophobicContact CE2-CG 3.73Å; L152-K157 WeakPolarHBondContact CA-O 3.4Å; L152-F158 HydrophobicContact CD2-CB 4.45Å; L152-F158 HydrophobicContact CD2-CD1 3.44Å; L152-F158 VanDerWaalsContact CD2-CD1 3.44Å; L152-F158 HydrophobicContact CD2-CD2 4.49Å; L152-F158 HydrophobicContact CD2-CE1 3.7Å; L152-F158 HydrophobicContact CD2-CG 3.88Å; L152-F158 HydrophobicContact CD2-CZ 4.35Å; L152-V181 HydrophobicContact CD1-CB 4.07Å; L152-V181 HydrophobicContact CD1-CG1 4.09Å; L152-V181 HydrophobicContact CD1-CG2 4.11Å; L152-V181 HydrophobicContact CD2-CB 4.12Å; L152-V181 HydrophobicContact CD2-CG2 4.47Å; L152-M193 HydrophobicContact CD1-CE 3.45Å; L152-M193 VanDerWaalsContact CD1-CE 3.45Å; L152-L197 HydrophobicContact CB-CD2 4.45Å; L152-L197 HydrophobicContact CD1-CD1 4.37Å; L152-L197 HydrophobicContact CD1-CD2 4.09Å; L152-G297 CarbonylContact O-C 3.54Å; L152-G297 VanDerWaalsContact O-CA 3.29Å; L152-G297 WeakPolarHBondContact O-CA 3.38Å; L152-L298 HydrophobicContact CB-CB 4.38Å; L152-L298 PolarHBondContact N-O 3.25Å; L152-L298 PolarHBondContact O-N 3.45Å
153	N	95.8	Very high	96.1	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-179.7	164.2	77.3	-16.2	0	0	0	112.2	E155 G156 K157 L159 M296	N153-E155 PolarHBondContact ND2-OE2 2.91Å; N153-E155 PolarHBondContact O-N 3.15Å; N153-E155 VanDerWaalsContact O-N 3.09Å; N153-E155 WeakPolarHBondContact OD1-CA 3.35Å; N153-E155 WeakPolarHBondContact OD1-CB 3.44Å; N153-E155 PolarHBondContact OD1-N 2.87Å; N153-G156 PolarHBondContact O-N 3.02Å; N153-G156 PolarHBondContact OD1-N 2.9Å; N153-K157 PolarHBondContact N-O 2.82Å; N153-K157 WeakPolarHBondContact OD1-CB 3.39Å; N153-K157 PolarHBondContact OD1-N 2.84Å; N153-L159 HydrophobicContact CB-CD1 3.87Å; N153-L159 HydrophobicContact CB-CD2 3.98Å; N153-L159 HydrophobicContact CB-CG 3.88Å; N153-M296 CarbonylContact C-O 3.58Å; N153-M296 VanDerWaalsContact CA-O 3.3Å; N153-M296 WeakPolarHBondContact CA-O 3.47Å
154	Q	92.9	Very high	96.4	Very high	85 Å²	85	36.3 Å²	36.3	40%	0.397	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-13.2	176	71.7	-78.6	-6.4	0	0	115.1	M199 M296	Q154-M199 VanDerWaalsContact O-CE 3.22Å; Q154-M199 WeakPolarHBondContact O-CE 3.43Å; Q154-M296 PolarHBondContact N-O 3.18Å; Q154-M296 PolarHBondContact OE1-O 2.64Å
155	E	94.8	Very high	96.6	Very high	82 Å²	82	31.4 Å²	31.4	38%	0.383	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	5.6	172.9	-61.6	119.5	-139.5	0	0	112.4	K72 N153 K157	K72-E155 IonicContact NZ-OE2 3.81Å; K72-E155 PolarHBondContact NZ-OE2 3.3Å; N153-E155 PolarHBondContact ND2-OE2 2.91Å; N153-E155 PolarHBondContact O-N 3.15Å; N153-E155 VanDerWaalsContact O-N 3.09Å; N153-E155 WeakPolarHBondContact OD1-CA 3.35Å; N153-E155 WeakPolarHBondContact OD1-CB 3.44Å; N153-E155 PolarHBondContact OD1-N 2.87Å; E155-K157 HydrophobicContact CB-CG 4.48Å; E155-K157 PolarHBondContact O-N 3.09Å
156	G	96.4	Very high	96.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	70.8	15.1	-177.1	0	0	0	0	0	114	N153 V181 M199	N153-G156 PolarHBondContact O-N 3.02Å; N153-G156 PolarHBondContact OD1-N 2.9Å; G156-V181 VanDerWaalsContact O-CB 3.29Å; G156-V181 WeakPolarHBondContact O-CB 3.46Å; G156-V181 VanDerWaalsContact O-CG1 3.25Å; G156-V181 WeakPolarHBondContact O-CG1 3.22Å; G156-V181 PolarHBondContact O-N 3.19Å; G156-M199 VanDerWaalsContact N-CE 3.33Å
157	K	98.3	Very high	96.8	Very high	81 Å²	81	31.5 Å²	31.5	35%	0.352	16%	0.156	S	C	.	.	B	Isolated β-bridge	trans	-88.4	137.5	178.2	-70	176.3	170.3	-74.2	0	111.4	L152 N153 E155 L159 G178 S179	L152-K157 WeakPolarHBondContact CA-O 3.4Å; N153-K157 PolarHBondContact N-O 2.82Å; N153-K157 WeakPolarHBondContact OD1-CB 3.39Å; N153-K157 PolarHBondContact OD1-N 2.84Å; E155-K157 HydrophobicContact CB-CG 4.48Å; E155-K157 PolarHBondContact O-N 3.09Å; K157-L159 PolarHBondContact O-N 2.76Å; K157-L159 VanDerWaalsContact O-N 3.09Å; K157-G178 PolarHBondContact NZ-O 2.83Å; K157-S179 VanDerWaalsContact CA-O 3.31Å; K157-S179 WeakPolarHBondContact CA-O 3.45Å
158	F	98.6	Very high	96.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	108.1	174.5	-66.3	-77.3	0	0	0	110.8	F150 L152 I161 L176 G178 S179 V181 Y184 M254	F150-F158 HydrophobicContact CB-CD1 4.14Å; F150-F158 HydrophobicContact CB-CE1 4.24Å; F150-F158 HydrophobicContact CD1-CE1 4.39Å; F150-F158 HydrophobicContact CD2-CD1 4.3Å; F150-F158 HydrophobicContact CD2-CE1 4.03Å; F150-F158 HydrophobicContact CE2-CE1 4.43Å; F150-F158 HydrophobicContact CG-CD1 4.32Å; F150-F158 HydrophobicContact CG-CE1 4Å; L152-F158 HydrophobicContact CD2-CB 4.45Å; L152-F158 HydrophobicContact CD2-CD1 3.44Å; L152-F158 VanDerWaalsContact CD2-CD1 3.44Å; L152-F158 HydrophobicContact CD2-CD2 4.49Å; L152-F158 HydrophobicContact CD2-CE1 3.7Å; L152-F158 HydrophobicContact CD2-CG 3.88Å; L152-F158 HydrophobicContact CD2-CZ 4.35Å; F158-I161 HydrophobicContact CD1-CB 4.36Å; F158-I161 HydrophobicContact CD1-CD1 4.14Å; F158-I161 HydrophobicContact CE1-CD1 3.82Å; F158-I161 HydrophobicContact CZ-CD1 4.48Å; F158-L176 HydrophobicContact CD2-CB 4.37Å; F158-L176 HydrophobicContact CD2-CD2 4.37Å; F158-L176 WeakPolarHBondContact CD2-O 3.36Å; F158-L176 HydrophobicContact CE2-CD2 3.8Å; F158-L176 HydrophobicContact CZ-CD2 4.21Å; F158-G178 WeakPolarHBondContact O-CA 3.35Å; F158-G178 PolarHBondContact O-N 2.9Å; F158-S179 PolarHBondContact N-O 3.02Å; F158-S179 VanDerWaalsContact N-O 3.16Å; F158-V181 HydrophobicContact CE2-CB 4.24Å; F158-V181 HydrophobicContact CE2-CG2 4.39Å; F158-V181 HydrophobicContact CZ-CB 4.21Å; F158-V181 HydrophobicContact CZ-CG2 3.92Å; F158-Y184 HydrophobicContact CE2-CD2 4.24Å; F158-M254 HydrophobicContact CZ-CE 4.21Å
159	L	98.2	Very high	96.5	Very high	10 Å²	10	33.2 Å²	33.2	5%	0.052	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-35.2	167.9	-61.7	-171.5	0	0	0	111.1	K72 M73 F76 A151 N153 K157	K72-L159 HydrophobicContact CB-CD2 3.57Å; K72-L159 HydrophobicContact CD-CD2 4.08Å; K72-L159 HydrophobicContact CG-CD2 4.48Å; M73-L159 HydrophobicContact CB-CB 3.99Å; M73-L159 HydrophobicContact CG-CB 4.29Å; M73-L159 HydrophobicContact SD-CB 3.52Å; M73-L159 VanDerWaalsContact SD-CB 3.52Å; M73-L159 HydrophobicContact SD-CD1 4.39Å; F76-L159 HydrophobicContact CB-CD1 3.57Å; F76-L159 HydrophobicContact CD1-CD1 4.31Å; F76-L159 HydrophobicContact CD2-CD1 3.77Å; F76-L159 HydrophobicContact CG-CD1 3.65Å; A151-L159 PolarHBondContact O-N 3.17Å; N153-L159 HydrophobicContact CB-CD1 3.87Å; N153-L159 HydrophobicContact CB-CD2 3.98Å; N153-L159 HydrophobicContact CB-CG 3.88Å; K157-L159 PolarHBondContact O-N 2.76Å; K157-L159 VanDerWaalsContact O-N 3.09Å
160	Y	98.3	Very high	96.4	Very high	74 Å²	74	33.1 Å²	33.1	29%	0.29	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	147.4	175	170.1	-95.5	0	0	0	109.8	M73 V149 F150 A151	M73-Y160 VanDerWaalsContact CE-CB 3.43Å; M73-Y160 HydrophobicContact CE-CG 4.04Å; V149-Y160 HydrophobicContact CB-CE1 4.48Å; V149-Y160 HydrophobicContact CG1-CE1 4.45Å; F150-Y160 CarbonylContact C-O 3.57Å; F150-Y160 VanDerWaalsContact CA-O 3.28Å; F150-Y160 WeakPolarHBondContact CA-O 3.29Å; F150-Y160 VanDerWaalsContact CB-O 3.31Å; F150-Y160 WeakPolarHBondContact CB-O 3.35Å; A151-Y160 PolarHBondContact N-O 3.05Å; A151-Y160 PolarHBondContact O-N 3.16Å
161	I	98.5	Very high	96.2	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	147.1	162.1	-173.9	149.8	0	0	0	108.7	F148 V149 F150 F158 V165 Q173 L176	F148-I161 HydrophobicContact CD2-CD1 3.75Å; F148-I161 HydrophobicContact CD2-CG1 4.14Å; F148-I161 HydrophobicContact CE2-CD1 3.97Å; V149-I161 CarbonylContact O-C 3.47Å; V149-I161 VanDerWaalsContact O-CA 3.31Å; V149-I161 WeakPolarHBondContact O-CA 3.29Å; F150-I161 HydrophobicContact CB-CB 3.94Å; F150-I161 HydrophobicContact CB-CD1 3.92Å; F150-I161 HydrophobicContact CB-CG1 3.89Å; F150-I161 HydrophobicContact CD1-CD1 4.2Å; F150-I161 HydrophobicContact CG-CD1 4.39Å; F158-I161 HydrophobicContact CD1-CB 4.36Å; F158-I161 HydrophobicContact CD1-CD1 4.14Å; F158-I161 HydrophobicContact CE1-CD1 3.82Å; F158-I161 HydrophobicContact CZ-CD1 4.48Å; I161-V165 HydrophobicContact CD1-CB 4.11Å; I161-V165 HydrophobicContact CD1-CG1 4.37Å; I161-V165 HydrophobicContact CD1-CG2 3.92Å; I161-V165 HydrophobicContact CG1-CB 4.08Å; I161-V165 HydrophobicContact CG1-CG1 4.16Å; I161-V165 HydrophobicContact CG1-CG2 4.44Å; I161-Q173 HydrophobicContact CG2-CB 4.45Å; I161-Q173 HydrophobicContact CG2-CG 4Å; I161-Q173 WeakPolarHBondContact O-CG 3.45Å; I161-Q173 PolarHBondContact O-NE2 2.9Å; I161-L176 HydrophobicContact CD1-CD1 4.15Å; I161-L176 HydrophobicContact CG2-CB 3.93Å
162	S	98.1	Very high	96.2	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.			trans	-74.9	148	178.5	61.1	0	0	0	0	112.1	F148 V149 T164 V165	F148-S162 WeakPolarHBondContact CA-OG 3.3Å; F148-S162 WeakPolarHBondContact CB-OG 3.23Å; V149-S162 PolarHBondContact N-OG 2.95Å; V149-S162 PolarHBondContact O-N 2.77Å; S162-T164 PolarHBondContact O-N 2.93Å; S162-T164 VanDerWaalsContact O-N 3.09Å; S162-T164 PolarHBondContact OG-OG1 2.99Å; S162-V165 VanDerWaalsContact O-CG1 3.31Å; S162-V165 WeakPolarHBondContact O-CG1 3.26Å; S162-V165 PolarHBondContact O-N 2.88Å; S162-V165 VanDerWaalsContact O-N 3.12Å
163	E	96.6	Very high	96.1	Very high	103 Å²	103	37.5 Å²	37.5	48%	0.481	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.3	177.6	-61.5	176.2	144.8	0	0	112.6	V165 S166	E163-V165 PolarHBondContact O-N 3.14Å; E163-V165 VanDerWaalsContact O-N 3.11Å; E163-S166 WeakPolarHBondContact O-CB 3.32Å; E163-S166 PolarHBondContact O-N 3.06Å; E163-S166 VanDerWaalsContact O-N 3.16Å; E163-S166 PolarHBondContact O-OG 2.91Å
164	T	96.8	Very high	96.2	Very high	17 Å²	17	38.3 Å²	38.3	10%	0.104	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.8	177	60.1	0	0	0	0	114	L142 G147 F148 S162 S166 I167 Y168	L142-T164 HydrophobicContact CB-CG2 4.18Å; G147-T164 PolarHBondContact O-OG1 2.87Å; F148-T164 WeakPolarHBondContact CA-OG1 3.43Å; F148-T164 WeakPolarHBondContact CB-OG1 3.31Å; S162-T164 PolarHBondContact O-N 2.93Å; S162-T164 VanDerWaalsContact O-N 3.09Å; S162-T164 PolarHBondContact OG-OG1 2.99Å; T164-S166 PolarHBondContact O-N 3.09Å; T164-S166 VanDerWaalsContact O-N 3.07Å; T164-I167 HydrophobicContact CG2-CD1 4.25Å; T164-I167 VanDerWaalsContact O-CB 3.3Å; T164-I167 WeakPolarHBondContact O-CB 3.43Å; T164-I167 PolarHBondContact O-N 2.92Å; T164-Y168 VanDerWaalsContact O-CD2 3.28Å; T164-Y168 WeakPolarHBondContact O-CD2 3.43Å
165	V	97.1	Very high	96.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-54.4	-29.5	173.2	70.9	0	0	0	0	112.6	F148 I161 S162 E163 I167 Y168 L169 L176	F148-V165 HydrophobicContact CB-CB 4.01Å; F148-V165 HydrophobicContact CD1-CB 4.45Å; F148-V165 HydrophobicContact CD1-CG2 4.24Å; F148-V165 HydrophobicContact CD2-CB 4.02Å; F148-V165 HydrophobicContact CD2-CG2 3.8Å; F148-V165 HydrophobicContact CE1-CG2 4.34Å; F148-V165 HydrophobicContact CE2-CG2 3.91Å; F148-V165 HydrophobicContact CG-CB 3.92Å; F148-V165 HydrophobicContact CG-CG2 3.97Å; F148-V165 HydrophobicContact CZ-CG2 4.18Å; I161-V165 HydrophobicContact CD1-CB 4.11Å; I161-V165 HydrophobicContact CD1-CG1 4.37Å; I161-V165 HydrophobicContact CD1-CG2 3.92Å; I161-V165 HydrophobicContact CG1-CB 4.08Å; I161-V165 HydrophobicContact CG1-CG1 4.16Å; I161-V165 HydrophobicContact CG1-CG2 4.44Å; S162-V165 VanDerWaalsContact O-CG1 3.31Å; S162-V165 WeakPolarHBondContact O-CG1 3.26Å; S162-V165 PolarHBondContact O-N 2.88Å; S162-V165 VanDerWaalsContact O-N 3.12Å; E163-V165 PolarHBondContact O-N 3.14Å; E163-V165 VanDerWaalsContact O-N 3.11Å; V165-I167 VanDerWaalsContact C-N 3.29Å; V165-I167 PolarHBondContact O-N 2.87Å; V165-Y168 PolarHBondContact O-N 2.87Å; V165-L169 HydrophobicContact CG2-CB 4.37Å; V165-L169 HydrophobicContact CG2-CD1 3.98Å; V165-L169 HydrophobicContact CG2-CG 4.43Å; V165-L169 PolarHBondContact O-N 3.34Å; V165-L176 HydrophobicContact CB-CD1 4.47Å; V165-L176 HydrophobicContact CG1-CD1 3.78Å; V165-L176 HydrophobicContact CG2-CD1 3.89Å
166	S	95.2	Very high	96.6	Very high	58 Å²	58	34.2 Å²	34.2	41%	0.406	18%	0.181	S	C	.	.	H	α-helix	trans	-63.5	-30.6	174.9	62.1	0	0	0	0	113.5	E163 T164 G170 L171	E163-S166 WeakPolarHBondContact O-CB 3.32Å; E163-S166 PolarHBondContact O-N 3.06Å; E163-S166 VanDerWaalsContact O-N 3.16Å; E163-S166 PolarHBondContact O-OG 2.91Å; T164-S166 PolarHBondContact O-N 3.09Å; T164-S166 VanDerWaalsContact O-N 3.07Å; S166-G170 WeakPolarHBondContact O-CA 3.07Å; S166-G170 PolarHBondContact O-N 2.9Å; S166-L171 VanDerWaalsContact CA-O 3.28Å; S166-L171 WeakPolarHBondContact CA-O 3.5Å; S166-L171 WeakPolarHBondContact CB-O 3.46Å; S166-L171 PolarHBondContact N-O 2.86Å
167	I	92.7	Very high	96.7	Very high	113 Å²	113	34.9 Å²	34.9	58%	0.579	19%	0.185	S	C	*	.	H	α-helix	trans	-71.6	-38.7	177.1	-52.6	172.8	0	0	0	110.3	T164 V165 L258	T164-I167 HydrophobicContact CG2-CD1 4.25Å; T164-I167 VanDerWaalsContact O-CB 3.3Å; T164-I167 WeakPolarHBondContact O-CB 3.43Å; T164-I167 PolarHBondContact O-N 2.92Å; V165-I167 VanDerWaalsContact C-N 3.29Å; V165-I167 PolarHBondContact O-N 2.87Å; I167-L258 WeakPolarHBondContact O-CD1 3.43Å
168	Y	92.3	Very high	96.7	Very high	36 Å²	36	31.5 Å²	31.5	14%	0.141	17%	0.173	C	C	.	.	H	α-helix	trans	-93.7	-32.7	-171.1	-65.5	-75.9	0	0	0	114.3	D146 G147 F148 T164 V165 L258 K271 A304	D146-Y168 WeakPolarHBondContact CA-OH 3.32Å; D146-Y168 VanDerWaalsContact OD1-CE1 3.29Å; D146-Y168 WeakPolarHBondContact OD1-CE1 3.38Å; D146-Y168 PolarHBondContact OD1-OH 2.74Å; G147-Y168 VanDerWaalsContact CA-CE2 3.45Å; G147-Y168 VanDerWaalsContact N-CZ 3.27Å; G147-Y168 PolarHBondContact N-OH 3.2Å; G147-Y168 VanDerWaalsContact N-OH 3.14Å; G147-Y168 WeakPolarHBondContact O-CE2 3.36Å; F148-Y168 HydrophobicContact CD1-CD2 4.18Å; F148-Y168 HydrophobicContact CD1-CG 4.34Å; T164-Y168 VanDerWaalsContact O-CD2 3.28Å; T164-Y168 WeakPolarHBondContact O-CD2 3.43Å; V165-Y168 PolarHBondContact O-N 2.87Å; Y168-L258 WeakPolarHBondContact O-CD1 3.34Å; Y168-K271 WeakPolarHBondContact O-CD 3.33Å; Y168-K271 WeakPolarHBondContact O-CE 3.41Å; Y168-K271 PolarHBondContact O-NZ 3.34Å; Y168-A304 HydrophobicContact CD1-CB 3.86Å; Y168-A304 HydrophobicContact CG-CB 4.24Å
169	L	93.6	Very high	96.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-121.4	-15.2	-178.8	-66.3	180	0	0	0	114	F148 V165 L171 M254 K255 S256 T257 K271 I273	F148-L169 HydrophobicContact CE1-CD1 4.26Å; F148-L169 HydrophobicContact CE1-CG 4.39Å; F148-L169 HydrophobicContact CZ-CD1 3.87Å; F148-L169 HydrophobicContact CZ-CG 4.49Å; V165-L169 HydrophobicContact CG2-CB 4.37Å; V165-L169 HydrophobicContact CG2-CD1 3.98Å; V165-L169 HydrophobicContact CG2-CG 4.43Å; V165-L169 PolarHBondContact O-N 3.34Å; L169-L171 HydrophobicContact CB-CB 4.48Å; L169-L171 HydrophobicContact CB-CD1 4.28Å; L169-L171 HydrophobicContact CB-CG 4.16Å; L169-L171 HydrophobicContact CD1-CD1 4.32Å; L169-L171 PolarHBondContact O-N 3.02Å; L169-M254 HydrophobicContact CD1-CB 3.88Å; L169-M254 HydrophobicContact CD1-CE 4.27Å; L169-M254 HydrophobicContact CD1-SD 4.29Å; L169-M254 HydrophobicContact CD2-CB 4.31Å; L169-K255 WeakPolarHBondContact CD2-O 3.46Å; L169-S256 CarbonylContact O-C 3.52Å; L169-S256 VanDerWaalsContact O-CA 3.28Å; L169-S256 WeakPolarHBondContact O-CA 3.42Å; L169-T257 PolarHBondContact O-N 2.93Å; L169-T257 PolarHBondContact O-OG1 2.88Å; L169-K271 HydrophobicContact CD2-CB 4.16Å; L169-K271 HydrophobicContact CD2-CD 4.32Å; L169-I273 HydrophobicContact CD2-CD1 4.02Å; L169-I273 HydrophobicContact CD2-CG1 4.5Å
170	G	94.4	Very high	96.7	Very high	29 Å²	29	32.8 Å²	32.8	30%	0.299	18%	0.183	S	C	.	.			trans	72.3	9.9	-174.9	0	0	0	0	0	114.5	S166 T257	S166-G170 WeakPolarHBondContact O-CA 3.07Å; S166-G170 PolarHBondContact O-N 2.9Å; G170-T257 VanDerWaalsContact CA-OG1 3.26Å; G170-T257 WeakPolarHBondContact CA-OG1 3.35Å; G170-T257 PolarHBondContact O-OG1 2.71Å
171	L	95.6	Very high	96.7	Very high	8 Å²	8	29.3 Å²	29.3	4%	0.042	17%	0.169	C	C	.	.			trans	-90.7	151.9	175.7	-62.8	177.3	0	0	0	110.8	S166 L169 L176 Y184 K255 T257	S166-L171 VanDerWaalsContact CA-O 3.28Å; S166-L171 WeakPolarHBondContact CA-O 3.5Å; S166-L171 WeakPolarHBondContact CB-O 3.46Å; S166-L171 PolarHBondContact N-O 2.86Å; L169-L171 HydrophobicContact CB-CB 4.48Å; L169-L171 HydrophobicContact CB-CD1 4.28Å; L169-L171 HydrophobicContact CB-CG 4.16Å; L169-L171 HydrophobicContact CD1-CD1 4.32Å; L169-L171 PolarHBondContact O-N 3.02Å; L171-L176 HydrophobicContact CB-CD1 3.75Å; L171-L176 HydrophobicContact CB-CG 4.36Å; L171-L176 HydrophobicContact CD1-CD1 4.35Å; L171-L176 HydrophobicContact CD1-CD2 4.24Å; L171-Y184 HydrophobicContact CD1-CD1 3.63Å; L171-Y184 HydrophobicContact CD1-CE1 4.08Å; L171-Y184 HydrophobicContact CD2-CE1 4.45Å; L171-K255 HydrophobicContact CD1-CB 4.45Å; L171-K255 WeakPolarHBondContact CD1-O 3.47Å; L171-T257 HydrophobicContact CD2-CG2 3.86Å
172	S	97	Very high	96.7	Very high	56 Å²	56	31.2 Å²	31.2	39%	0.392	18%	0.178	S	C	.	.			trans	-90.8	139.6	-179.1	178.5	0	0	0	0	112.4	V174 E175 L176	S172-V174 PolarHBondContact O-N 3.33Å; S172-V174 PolarHBondContact OG-N 3.09Å; S172-E175 WeakPolarHBondContact O-CB 3.21Å; S172-E175 PolarHBondContact O-N 3.01Å; S172-L176 PolarHBondContact O-N 2.92Å
173	Q	97.8	Very high	96.7	Very high	30 Å²	30	35.3 Å²	35.3	14%	0.14	20%	0.199	C	C	.	.	H	α-helix	trans	-53.9	-39.9	170.2	-179.7	-166.4	60.1	0	0	111.8	I161 E175 L176 T177	I161-Q173 HydrophobicContact CG2-CB 4.45Å; I161-Q173 HydrophobicContact CG2-CG 4Å; I161-Q173 WeakPolarHBondContact O-CG 3.45Å; I161-Q173 PolarHBondContact O-NE2 2.9Å; Q173-E175 VanDerWaalsContact C-N 3.27Å; Q173-E175 PolarHBondContact O-N 2.98Å; Q173-L176 PolarHBondContact O-N 3.15Å; Q173-T177 VanDerWaalsContact O-CB 3.3Å; Q173-T177 WeakPolarHBondContact O-CB 3.36Å; Q173-T177 PolarHBondContact O-N 3.26Å; Q173-T177 PolarHBondContact O-OG1 3.02Å
174	V	97.7	Very high	96.8	Very high	22 Å²	22	31.5 Å²	31.5	13%	0.133	18%	0.181	C	C	.	.	H	α-helix	trans	-66.3	-30.2	178.2	166.2	0	0	0	0	111.9	L50 I54 L58 R65 L66 S172	L50-V174 HydrophobicContact CD1-CG2 4.07Å; I54-V174 HydrophobicContact CG2-CG2 3.94Å; L58-V174 HydrophobicContact CD2-CG1 3.53Å; L58-V174 HydrophobicContact CD2-CG2 4.43Å; R65-V174 PolarHBondContact NH1-O 3.08Å; R65-V174 PolarHBondContact NH2-O 2.97Å; L66-V174 HydrophobicContact CD1-CG1 4.31Å; S172-V174 PolarHBondContact O-N 3.33Å; S172-V174 PolarHBondContact OG-N 3.09Å
175	E	97.2	Very high	96.8	Very high	80 Å²	80	30.8 Å²	30.8	37%	0.374	18%	0.176	S	C	.	.	H	α-helix	trans	-78.5	-41.7	177.4	-164.1	-151.1	137	0	0	111.2	R65 S172 Q173 S179 Y184	R65-E175 PolarHBondContact NH1-O 2.98Å; S172-E175 WeakPolarHBondContact O-CB 3.21Å; S172-E175 PolarHBondContact O-N 3.01Å; Q173-E175 VanDerWaalsContact C-N 3.27Å; Q173-E175 PolarHBondContact O-N 2.98Å; E175-S179 PolarHBondContact O-OG 2.83Å; E175-Y184 WeakPolarHBondContact OE1-CE1 3.42Å; E175-Y184 PolarHBondContact OE1-OH 2.8Å
176	L	98.3	Very high	96.8	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-76.1	-39.5	-177.1	-73.7	159.2	0	0	0	113.7	F158 I161 V165 L171 S172 Q173 G178 S179 Y184	F158-L176 HydrophobicContact CD2-CB 4.37Å; F158-L176 HydrophobicContact CD2-CD2 4.37Å; F158-L176 WeakPolarHBondContact CD2-O 3.36Å; F158-L176 HydrophobicContact CE2-CD2 3.8Å; F158-L176 HydrophobicContact CZ-CD2 4.21Å; I161-L176 HydrophobicContact CD1-CD1 4.15Å; I161-L176 HydrophobicContact CG2-CB 3.93Å; V165-L176 HydrophobicContact CB-CD1 4.47Å; V165-L176 HydrophobicContact CG1-CD1 3.78Å; V165-L176 HydrophobicContact CG2-CD1 3.89Å; L171-L176 HydrophobicContact CB-CD1 3.75Å; L171-L176 HydrophobicContact CB-CG 4.36Å; L171-L176 HydrophobicContact CD1-CD1 4.35Å; L171-L176 HydrophobicContact CD1-CD2 4.24Å; S172-L176 PolarHBondContact O-N 2.92Å; Q173-L176 PolarHBondContact O-N 3.15Å; L176-G178 PolarHBondContact O-N 2.94Å; L176-S179 VanDerWaalsContact O-CB 3.29Å; L176-S179 WeakPolarHBondContact O-CB 3.43Å; L176-S179 PolarHBondContact O-N 2.88Å; L176-S179 PolarHBondContact O-OG 2.81Å; L176-Y184 HydrophobicContact CD2-CD1 3.66Å; L176-Y184 HydrophobicContact CD2-CD2 3.6Å; L176-Y184 HydrophobicContact CD2-CE1 3.75Å; L176-Y184 HydrophobicContact CD2-CE2 3.71Å; L176-Y184 HydrophobicContact CD2-CG 3.58Å; L176-Y184 HydrophobicContact CG-CE1 4.49Å
177	T	98.6	Very high	96.8	Very high	14 Å²	14	34.7 Å²	34.7	9%	0.086	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	121.4	-172	-58.5	0	0	0	0	112	R65 L66 Q173 S179	R65-T177 PolarHBondContact NH1-O 3.17Å; L66-T177 HydrophobicContact CD2-CG2 3.8Å; Q173-T177 VanDerWaalsContact O-CB 3.3Å; Q173-T177 WeakPolarHBondContact O-CB 3.36Å; Q173-T177 PolarHBondContact O-N 3.26Å; Q173-T177 PolarHBondContact O-OG1 3.02Å; T177-S179 VanDerWaalsContact C-N 3.32Å
178	G	98.1	Very high	96.9	Very high	10 Å²	10	32.1 Å²	32.1	10%	0.103	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	-11.1	-176.2	0	0	0	0	0	115.9	S69 K157 F158 L176	S69-G178 WeakPolarHBondContact OG-CA 3.27Å; S69-G178 PolarHBondContact OG-N 3.38Å; K157-G178 PolarHBondContact NZ-O 2.83Å; F158-G178 WeakPolarHBondContact O-CA 3.35Å; F158-G178 PolarHBondContact O-N 2.9Å; L176-G178 PolarHBondContact O-N 2.94Å
179	S	98.5	Very high	97.2	Very high	17 Å²	17	30.5 Å²	30.5	12%	0.119	19%	0.191	C	C	.	.	S	Bend	trans	-79.3	165.9	174.2	-50.9	0	0	0	0	110.8	R65 K157 F158 E175 L176 T177	R65-S179 PolarHBondContact NH1-OG 3.02Å; K157-S179 VanDerWaalsContact CA-O 3.31Å; K157-S179 WeakPolarHBondContact CA-O 3.45Å; F158-S179 PolarHBondContact N-O 3.02Å; F158-S179 VanDerWaalsContact N-O 3.16Å; E175-S179 PolarHBondContact O-OG 2.83Å; L176-S179 VanDerWaalsContact O-CB 3.29Å; L176-S179 WeakPolarHBondContact O-CB 3.43Å; L176-S179 PolarHBondContact O-N 2.88Å; L176-S179 PolarHBondContact O-OG 2.81Å; T177-S179 VanDerWaalsContact C-N 3.32Å
180	S	98.3	Very high	97.3	Very high	20 Å²	20	33.1 Å²	33.1	14%	0.14	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-80.8	140.8	178.3	-162.6	0	0	0	0	110.5	F182 D183 Y184	S180-F182 PolarHBondContact O-N 3.22Å; S180-D183 WeakPolarHBondContact CA-OD2 3.38Å; S180-D183 VanDerWaalsContact CB-CG 3.5Å; S180-D183 WeakPolarHBondContact CB-OD2 3.48Å; S180-D183 PolarHBondContact N-OD2 2.93Å; S180-D183 WeakPolarHBondContact O-CB 3.11Å; S180-D183 PolarHBondContact O-N 3.05Å; S180-D183 VanDerWaalsContact O-N 3.11Å; S180-Y184 WeakPolarHBondContact O-CD2 3.5Å
181	V	98.5	Very high	97.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-58.4	-37.7	172.5	69.7	0	0	0	0	111.2	L152 G156 F158 D183 Y184 V185 M193 L197	L152-V181 HydrophobicContact CD1-CB 4.07Å; L152-V181 HydrophobicContact CD1-CG1 4.09Å; L152-V181 HydrophobicContact CD1-CG2 4.11Å; L152-V181 HydrophobicContact CD2-CB 4.12Å; L152-V181 HydrophobicContact CD2-CG2 4.47Å; G156-V181 VanDerWaalsContact O-CB 3.29Å; G156-V181 WeakPolarHBondContact O-CB 3.46Å; G156-V181 VanDerWaalsContact O-CG1 3.25Å; G156-V181 WeakPolarHBondContact O-CG1 3.22Å; G156-V181 PolarHBondContact O-N 3.19Å; F158-V181 HydrophobicContact CE2-CB 4.24Å; F158-V181 HydrophobicContact CE2-CG2 4.39Å; F158-V181 HydrophobicContact CZ-CB 4.21Å; F158-V181 HydrophobicContact CZ-CG2 3.92Å; V181-D183 PolarHBondContact O-N 2.98Å; V181-Y184 PolarHBondContact O-N 3.31Å; V181-V185 HydrophobicContact CG2-CG2 3.81Å; V181-V185 WeakPolarHBondContact O-CG2 3.45Å; V181-V185 PolarHBondContact O-N 3.44Å; V181-M193 HydrophobicContact CG1-CE 4.16Å; V181-M193 HydrophobicContact CG1-CG 4.21Å; V181-M193 HydrophobicContact CG2-CE 4.09Å; V181-L197 HydrophobicContact CG1-CD1 4.41Å
182	F	98.3	Very high	97.4	Very high	42 Å²	42	38.1 Å²	38.1	18%	0.184	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-63.2	-21.9	178.4	-57.2	-76.5	0	0	0	113.7	S180 Y184 H190 M193 A194 L197 M199	S180-F182 PolarHBondContact O-N 3.22Å; F182-Y184 PolarHBondContact O-N 2.78Å; F182-H190 HydrophobicContact CD1-CB 4.1Å; F182-H190 AromaticContact CD1-CG 3.86Å; F182-H190 HydrophobicContact CE1-CB 4.46Å; F182-H190 WeakPolarHBondContact CE1-O 3.31Å; F182-H190 PolarHBondContact O-CE1 3.18Å; F182-H190 PolarHBondContact O-NE2 3.28Å; F182-H190 VanDerWaalsContact O-NE2 3.08Å; F182-M193 HydrophobicContact CE1-CB 3.94Å; F182-M193 HydrophobicContact CE1-CG 3.93Å; F182-M193 HydrophobicContact CZ-CG 4.29Å; F182-A194 HydrophobicContact CE1-CB 4.25Å; F182-A194 HydrophobicContact CZ-CB 4.11Å; F182-L197 HydrophobicContact CE2-CD1 4.42Å; F182-L197 HydrophobicContact CZ-CD1 4.11Å; F182-M199 HydrophobicContact CE2-CE 4.11Å; F182-M199 HydrophobicContact CE2-SD 3.88Å; F182-M199 HydrophobicContact CZ-CE 4.48Å; F182-M199 HydrophobicContact CZ-SD 3.77Å
183	D	98.1	Very high	97.4	Very high	85 Å²	85	35.4 Å²	35.4	46%	0.455	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-67.4	-20.7	173.4	-55	-33.6	0	0	0	111.5	S180 V181 K255	S180-D183 WeakPolarHBondContact CA-OD2 3.38Å; S180-D183 VanDerWaalsContact CB-CG 3.5Å; S180-D183 WeakPolarHBondContact CB-OD2 3.48Å; S180-D183 PolarHBondContact N-OD2 2.93Å; S180-D183 WeakPolarHBondContact O-CB 3.11Å; S180-D183 PolarHBondContact O-N 3.05Å; S180-D183 VanDerWaalsContact O-N 3.11Å; V181-D183 PolarHBondContact O-N 2.98Å; D183-K255 WeakPolarHBondContact O-CE 3.22Å; D183-K255 PolarHBondContact O-NZ 3.14Å
184	Y	98.1	Very high	97.3	Very high	23 Å²	23	34 Å²	34	9%	0.09	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-13.9	-173.3	-64.6	-84.2	0	0	0	114.6	F158 L171 E175 L176 S180 V181 F182 M254 K255	F158-Y184 HydrophobicContact CE2-CD2 4.24Å; L171-Y184 HydrophobicContact CD1-CD1 3.63Å; L171-Y184 HydrophobicContact CD1-CE1 4.08Å; L171-Y184 HydrophobicContact CD2-CE1 4.45Å; E175-Y184 WeakPolarHBondContact OE1-CE1 3.42Å; E175-Y184 PolarHBondContact OE1-OH 2.8Å; L176-Y184 HydrophobicContact CD2-CD1 3.66Å; L176-Y184 HydrophobicContact CD2-CD2 3.6Å; L176-Y184 HydrophobicContact CD2-CE1 3.75Å; L176-Y184 HydrophobicContact CD2-CE2 3.71Å; L176-Y184 HydrophobicContact CD2-CG 3.58Å; L176-Y184 HydrophobicContact CG-CE1 4.49Å; S180-Y184 WeakPolarHBondContact O-CD2 3.5Å; V181-Y184 PolarHBondContact O-N 3.31Å; F182-Y184 PolarHBondContact O-N 2.78Å; Y184-M254 CarbonylContact O-C 3.53Å; Y184-M254 WeakPolarHBondContact O-CA 3.45Å; Y184-K255 WeakPolarHBondContact O-CG 3.18Å; Y184-K255 PolarHBondContact O-N 3.44Å
185	V	98.2	Very high	97.1	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.012	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-88.1	145.9	174.6	179.2	0	0	0	0	110.2	V181 D189 H190 I252 M254	V181-V185 HydrophobicContact CG2-CG2 3.81Å; V181-V185 WeakPolarHBondContact O-CG2 3.45Å; V181-V185 PolarHBondContact O-N 3.44Å; V185-D189 HydrophobicContact CG1-CB 3.86Å; V185-H190 PolarHBondContact O-NE2 3.49Å; V185-I252 HydrophobicContact CG1-CB 4.25Å; V185-I252 HydrophobicContact CG1-CD1 4.2Å; V185-I252 HydrophobicContact CG2-CD1 3.6Å; V185-M254 HydrophobicContact CG2-CG 4.38Å
186	H	96.6	Very high	96.9	Very high	56 Å²	56	38 Å²	38	26%	0.259	22%	0.216	S	C	.	.			trans	-60.4	133.2	175	-178.5	-101.8	0	0	0	111.1	G188 D189 H190 R253 Y270	H186-G188 PolarHBondContact ND1-N 3.02Å; H186-G188 PolarHBondContact O-N 3.23Å; H186-G188 VanDerWaalsContact O-N 3.09Å; H186-D189 IonicContact ND1-OD1 3.99Å; H186-D189 PolarHBondContact O-N 2.72Å; H186-H190 PolarHBondContact O-CD2 2.82Å; H186-R253 HydrophobicContact CB-CB 3.65Å; H186-R253 WeakPolarHBondContact CB-O 3.29Å; H186-R253 PolarHBondContact N-O 2.98Å; H186-Y270 HydrophobicContact CB-CD1 3.85Å; H186-Y270 HydrophobicContact CB-CE1 3.73Å; H186-Y270 HydrophobicContact CB-CG 4.49Å; H186-Y270 AromaticContact CD2-CE2 3.84Å; H186-Y270 AromaticContact CD2-CZ 3.91Å
187	P	96	Very high	96.6	Very high	84 Å²	84	38.2 Å²	38.2	55%	0.545	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-54.2	-34.4	-175	-30.3	36.8	0	0	0	115.2	D189 H190	P187-D189 PolarHBondContact O-N 3.03Å; P187-H190 WeakPolarHBondContact O-CB 3.49Å; P187-H190 PolarHBondContact O-N 3.21Å
188	G	94.9	Very high	96.2	Very high	59 Å²	59	39.5 Å²	39.5	61%	0.608	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-64.6	-15.3	176.1	0	0	0	0	0	115	H186	H186-G188 PolarHBondContact ND1-N 3.02Å; H186-G188 PolarHBondContact O-N 3.23Å; H186-G188 VanDerWaalsContact O-N 3.09Å
189	D	96.9	Very high	95.7	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.016	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-107.6	2.9	-177.5	-49.3	-10.8	0	0	0	111.2	V185 H186 P187 M193 I252 R253	V185-D189 HydrophobicContact CG1-CB 3.86Å; H186-D189 IonicContact ND1-OD1 3.99Å; H186-D189 PolarHBondContact O-N 2.72Å; P187-D189 PolarHBondContact O-N 3.03Å; D189-M193 WeakPolarHBondContact O-CB 3.18Å; D189-M193 PolarHBondContact O-N 3.04Å; D189-I252 HydrophobicContact CB-CB 4.36Å; D189-I252 HydrophobicContact CB-CG2 4.26Å; D189-R253 IonicContact OD1-CZ 3.02Å; D189-R253 VanDerWaalsContact OD1-CZ 3.29Å; D189-R253 IonicContact OD1-NE 2.71Å; D189-R253 PolarHBondContact OD1-NE 2.71Å; D189-R253 VanDerWaalsContact OD1-NE 3.15Å; D189-R253 IonicContact OD1-NH2 3.75Å; D189-R253 PolarHBondContact OD1-NH2 2.86Å; D189-R253 VanDerWaalsContact OD2-CB 3.23Å; D189-R253 WeakPolarHBondContact OD2-CB 3.42Å; D189-R253 WeakPolarHBondContact OD2-CG 3.49Å; D189-R253 IonicContact OD2-CZ 3.58Å; D189-R253 PolarHBondContact OD2-N 3.08Å; D189-R253 IonicContact OD2-NE 3.53Å; D189-R253 PolarHBondContact OD2-NE 3.37Å; D189-R253 IonicContact OD2-NH2 3.59Å
190	H	97.1	Very high	94.3	Very high	54 Å²	54	50.5 Å²	50.5	25%	0.25	28%	0.277	C	S	.	.	H	α-helix	trans	-67	-36.7	-176.5	-76.7	-165	0	0	0	112.9	F182 V185 H186 P187 A194	F182-H190 HydrophobicContact CD1-CB 4.1Å; F182-H190 AromaticContact CD1-CG 3.86Å; F182-H190 HydrophobicContact CE1-CB 4.46Å; F182-H190 WeakPolarHBondContact CE1-O 3.31Å; F182-H190 PolarHBondContact O-CE1 3.18Å; F182-H190 PolarHBondContact O-NE2 3.28Å; F182-H190 VanDerWaalsContact O-NE2 3.08Å; V185-H190 PolarHBondContact O-NE2 3.49Å; H186-H190 PolarHBondContact O-CD2 2.82Å; P187-H190 WeakPolarHBondContact O-CB 3.49Å; P187-H190 PolarHBondContact O-N 3.21Å; H190-A194 WeakPolarHBondContact O-CB 3.27Å; H190-A194 PolarHBondContact O-N 3.11Å
191	V	96.3	Very high	92.3	Very high	94 Å²	94	54 Å²	54	57%	0.57	29%	0.294	S	S	*	.	H	α-helix	trans	-66.1	-48.6	179.1	177.6	0	0	0	0	110.4	M193 A194 E195 L201	V191-M193 PolarHBondContact O-N 3.19Å; V191-A194 PolarHBondContact O-N 3.29Å; V191-E195 PolarHBondContact O-N 2.94Å; V191-L201 HydrophobicContact CB-CD1 4.38Å; V191-L201 HydrophobicContact CG1-CD1 3.95Å; V191-L201 HydrophobicContact CG2-CD1 4.33Å
192	E	95.6	Very high	89.8	Confident	48 Å²	48	59.2 Å²	59.2	22%	0.224	33%	0.328	C	S	.	.	H	α-helix	trans	-58.6	-48.2	175.4	-176.5	-177.2	151.3	0	0	111.4	A194 E195 Q196 K375	E192-A194 VanDerWaalsContact C-N 3.28Å; E192-A194 PolarHBondContact O-N 3.31Å; E192-E195 PolarHBondContact O-N 2.91Å; E192-Q196 HydrophobicContact CG-CG 4.36Å; E192-Q196 WeakPolarHBondContact O-CB 3.25Å; E192-Q196 WeakPolarHBondContact O-CG 3.29Å; E192-Q196 PolarHBondContact O-N 2.85Å; E192-K375 IonicContact OE1-NZ 2.7Å; E192-K375 PolarHBondContact OE1-NZ 2.78Å; E192-K375 WeakPolarHBondContact OE2-CE 3.42Å; E192-K375 IonicContact OE2-NZ 3.93Å; E192-K375 PolarHBondContact OE2-NZ 3.02Å
193	M	96.3	Very high	87	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-59.7	-37.6	177.7	-173.6	70.6	-151.9	0	0	112.5	L152 V181 F182 D189 V191 L197 F250 I252 I275 L298	L152-M193 HydrophobicContact CD1-CE 3.45Å; L152-M193 VanDerWaalsContact CD1-CE 3.45Å; V181-M193 HydrophobicContact CG1-CE 4.16Å; V181-M193 HydrophobicContact CG1-CG 4.21Å; V181-M193 HydrophobicContact CG2-CE 4.09Å; F182-M193 HydrophobicContact CE1-CB 3.94Å; F182-M193 HydrophobicContact CE1-CG 3.93Å; F182-M193 HydrophobicContact CZ-CG 4.29Å; D189-M193 WeakPolarHBondContact O-CB 3.18Å; D189-M193 PolarHBondContact O-N 3.04Å; V191-M193 PolarHBondContact O-N 3.19Å; M193-L197 HydrophobicContact CE-CD1 3.78Å; M193-L197 HydrophobicContact CE-CD2 4.47Å; M193-L197 HydrophobicContact CE-CG 4.02Å; M193-L197 HydrophobicContact CG-CD1 4.31Å; M193-L197 WeakPolarHBondContact O-CB 3.28Å; M193-L197 WeakPolarHBondContact O-CD1 3.31Å; M193-L197 WeakPolarHBondContact O-CG 3.33Å; M193-L197 PolarHBondContact O-N 2.88Å; M193-F250 HydrophobicContact CE-CZ 4.27Å; M193-F250 HydrophobicContact SD-CE2 3.68Å; M193-F250 HydrophobicContact SD-CZ 3.75Å; M193-I252 HydrophobicContact SD-CD1 3.76Å; M193-I275 HydrophobicContact SD-CD1 4.34Å; M193-L298 HydrophobicContact CE-CD2 4.31Å
194	A	95.1	Very high	84.4	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.008	38%	0.377	C	S	.	.	H	α-helix	trans	-69.9	-42.5	177	0	0	0	0	0	112.3	F182 H190 V191 E192 L197 G198 M199 L201	F182-A194 HydrophobicContact CE1-CB 4.25Å; F182-A194 HydrophobicContact CZ-CB 4.11Å; H190-A194 WeakPolarHBondContact O-CB 3.27Å; H190-A194 PolarHBondContact O-N 3.11Å; V191-A194 PolarHBondContact O-N 3.29Å; E192-A194 VanDerWaalsContact C-N 3.28Å; E192-A194 PolarHBondContact O-N 3.31Å; A194-L197 PolarHBondContact O-N 2.72Å; A194-G198 PolarHBondContact O-N 2.79Å; A194-M199 HydrophobicContact CB-CB 4.14Å; A194-M199 HydrophobicContact CB-SD 4.26Å; A194-M199 WeakPolarHBondContact O-CB 3.47Å; A194-M199 PolarHBondContact O-N 2.85Å; A194-L201 HydrophobicContact CB-CD1 4.12Å; A194-L201 HydrophobicContact CB-CD2 3.85Å; A194-L201 HydrophobicContact CB-CG 4Å
195	E	93.3	Very high	81.7	Confident	139 Å²	139	74 Å²	74	65%	0.65	42%	0.418	S	S	*	.	H	α-helix	trans	-61.1	-47.4	175.1	-174.6	-177.7	170.8	0	0	111.6	V191 E192 L197 G198	V191-E195 PolarHBondContact O-N 2.94Å; E192-E195 PolarHBondContact O-N 2.91Å; E195-L197 PolarHBondContact O-N 2.8Å; E195-G198 WeakPolarHBondContact O-CA 3.46Å; E195-G198 PolarHBondContact O-N 2.9Å
196	Q	94.3	Very high	78.7	Confident	47 Å²	47	77.4 Å²	77.4	22%	0.22	45%	0.452	C	S	.	.	H	α-helix	trans	-62	-29.6	177.7	-63.2	-76.3	-15.8	0	0	112	E192 G198 R248 F250	E192-Q196 HydrophobicContact CG-CG 4.36Å; E192-Q196 WeakPolarHBondContact O-CB 3.25Å; E192-Q196 WeakPolarHBondContact O-CG 3.29Å; E192-Q196 PolarHBondContact O-N 2.85Å; Q196-G198 VanDerWaalsContact C-N 3.33Å; Q196-R248 WeakPolarHBondContact O-CD 3.38Å; Q196-R248 PolarHBondContact O-NE 3.44Å; Q196-F250 HydrophobicContact CB-CD1 4.07Å; Q196-F250 HydrophobicContact CB-CE1 3.62Å; Q196-F250 HydrophobicContact CB-CE2 4.15Å; Q196-F250 HydrophobicContact CB-CZ 3.67Å; Q196-F250 HydrophobicContact CG-CB 4.43Å; Q196-F250 HydrophobicContact CG-CD1 3.7Å; Q196-F250 HydrophobicContact CG-CD2 3.88Å; Q196-F250 HydrophobicContact CG-CE1 3.78Å; Q196-F250 HydrophobicContact CG-CE2 3.96Å; Q196-F250 HydrophobicContact CG-CG 3.76Å; Q196-F250 HydrophobicContact CG-CZ 3.91Å
197	L	92.7	Very high	76	Confident	4 Å²	4	82.7 Å²	82.7	2%	0.021	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.8	171.9	-77.7	166.4	0	0	0	114.4	L152 V181 F182 M193 A194 E195 M199 L298	L152-L197 HydrophobicContact CB-CD2 4.45Å; L152-L197 HydrophobicContact CD1-CD1 4.37Å; L152-L197 HydrophobicContact CD1-CD2 4.09Å; V181-L197 HydrophobicContact CG1-CD1 4.41Å; F182-L197 HydrophobicContact CE2-CD1 4.42Å; F182-L197 HydrophobicContact CZ-CD1 4.11Å; M193-L197 HydrophobicContact CE-CD1 3.78Å; M193-L197 HydrophobicContact CE-CD2 4.47Å; M193-L197 HydrophobicContact CE-CG 4.02Å; M193-L197 HydrophobicContact CG-CD1 4.31Å; M193-L197 WeakPolarHBondContact O-CB 3.28Å; M193-L197 WeakPolarHBondContact O-CD1 3.31Å; M193-L197 WeakPolarHBondContact O-CG 3.33Å; M193-L197 PolarHBondContact O-N 2.88Å; A194-L197 PolarHBondContact O-N 2.72Å; E195-L197 PolarHBondContact O-N 2.8Å; L197-M199 VanDerWaalsContact C-N 3.33Å; L197-M199 HydrophobicContact CB-CE 4.34Å; L197-M199 HydrophobicContact CB-CG 3.93Å; L197-M199 HydrophobicContact CB-SD 4.19Å; L197-M199 HydrophobicContact CD1-CE 3.8Å; L197-M199 HydrophobicContact CD1-SD 4.03Å; L197-L298 HydrophobicContact CD2-CB 3.73Å; L197-L298 HydrophobicContact CD2-CD2 4.24Å
198	G	89	Confident	73.1	Confident	41 Å²	41	87.1 Å²	87.1	42%	0.423	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	22.1	-173.5	0	0	0	0	0	113.8	A194 E195 Q196	A194-G198 PolarHBondContact O-N 2.79Å; E195-G198 WeakPolarHBondContact O-CA 3.46Å; E195-G198 PolarHBondContact O-N 2.9Å; Q196-G198 VanDerWaalsContact C-N 3.33Å
199	M	87.6	Confident	70.1	Confident	49 Å²	49	89.1 Å²	89.1	24%	0.241	51%	0.505	C	S	.	.			trans	-77.5	121.5	178.1	-66.4	175.5	165.8	0	0	110.5	Q154 G156 F182 A194 L197 L201	Q154-M199 VanDerWaalsContact O-CE 3.22Å; Q154-M199 WeakPolarHBondContact O-CE 3.43Å; G156-M199 VanDerWaalsContact N-CE 3.33Å; F182-M199 HydrophobicContact CE2-CE 4.11Å; F182-M199 HydrophobicContact CE2-SD 3.88Å; F182-M199 HydrophobicContact CZ-CE 4.48Å; F182-M199 HydrophobicContact CZ-SD 3.77Å; A194-M199 HydrophobicContact CB-CB 4.14Å; A194-M199 HydrophobicContact CB-SD 4.26Å; A194-M199 WeakPolarHBondContact O-CB 3.47Å; A194-M199 PolarHBondContact O-N 2.85Å; L197-M199 VanDerWaalsContact C-N 3.33Å; L197-M199 HydrophobicContact CB-CE 4.34Å; L197-M199 HydrophobicContact CB-CG 3.93Å; L197-M199 HydrophobicContact CB-SD 4.19Å; L197-M199 HydrophobicContact CD1-CE 3.8Å; L197-M199 HydrophobicContact CD1-SD 4.03Å; M199-L201 PolarHBondContact O-N 2.98Å
200	K	69.2	Low	67	Low	209 Å²	209	97.8 Å²	97.8	91%	0.909	55%	0.545	S	S	*	.			trans	-70.3	95.4	165.9	-68.2	-169.6	177.8	-172.4	0	109.2
201	L	57.3	Low	63.8	Low	93 Å²	93	99 Å²	99	49%	0.487	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-59	137.5	165.4	-67.9	173.6	0	0	0	109.1	V191 A194 M199	V191-L201 HydrophobicContact CB-CD1 4.38Å; V191-L201 HydrophobicContact CG1-CD1 3.95Å; V191-L201 HydrophobicContact CG2-CD1 4.33Å; A194-L201 HydrophobicContact CB-CD1 4.12Å; A194-L201 HydrophobicContact CB-CD2 3.85Å; A194-L201 HydrophobicContact CB-CG 4Å; M199-L201 PolarHBondContact O-N 2.98Å
202	P	45	Very low	60.6	Low	110 Å²	110	101 Å²	101	71%	0.714	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-59.8	129.4	171.8	-22.7	33.6	0	0	0	110.2	G204	P202-G204 PolarHBondContact O-N 2.85Å
203	P	39.7	Very low	57.6	Low	137 Å²	137	102.9 Å²	102.9	89%	0.89	61%	0.609	S	S	*	*	S	Bend	trans	-64.8	123.8	173.7	27.1	-32.9	0	0	0	109.1
204	G	43.3	Very low	54.6	Low	76 Å²	76	111.9 Å²	111.9	78%	0.784	65%	0.65	S	S	*	*			trans	113.1	44.8	175.3	0	0	0	0	0	117.1	P202	P202-G204 PolarHBondContact O-N 2.85Å
205	R	42.2	Very low	51.6	Low	249 Å²	249	119.2 Å²	119.2	94%	0.94	69%	0.69	S	S	*	*			trans	-137.5	59	154.5	-128.9	175.6	-160.6	-100.6	-1.5	113.1
206	G	34.6	Very low	48.7	Very low	72 Å²	72	116.1 Å²	116.1	74%	0.742	70%	0.695	S	S	*	*			trans	-62.8	150.5	170.9	0	0	0	0	0	112.7	L208	G206-L208 PolarHBondContact O-N 3.2Å
207	L	39.3	Very low	46	Very low	167 Å²	167	118.3 Å²	118.3	87%	0.874	72%	0.721	S	S	*	*			trans	-44.8	122.8	174.7	-178.2	73.6	0	0	0	114
208	L	35.1	Very low	43.2	Very low	177 Å²	177	124.4 Å²	124.4	93%	0.927	76%	0.764	S	S	*	*			trans	-137.4	140.1	152	-81.1	-177.8	0	0	0	109.6	G206	G206-L208 PolarHBondContact O-N 3.2Å
209	S	32.1	Very low	40.8	Very low	102 Å²	102	128 Å²	128	71%	0.713	78%	0.782	S	S	*	*			trans	-117.3	121.6	-178.1	-177.1	0	0	0	0	111
210	Q	32.9	Very low	38.3	Very low	185 Å²	185	130 Å²	130	86%	0.864	81%	0.807	S	S	*	*			trans	49.6	90.3	148.3	-163	164.5	4.7	0	0	118.2
211	G	28.3	Very low	36.6	Very low	79 Å²	79	126.1 Å²	126.1	81%	0.814	81%	0.806	S	S	*	*			trans	-120.1	159.1	155.2	0	0	0	0	0	110.3
212	T	29.1	Very low	35.5	Very low	137 Å²	137	127.1 Å²	127.1	84%	0.84	82%	0.821	S	S	*	*			trans	-110.1	164.9	-168.3	46.8	0	0	0	0	114.9
213	A	32.5	Very low	34.8	Very low	87 Å²	87	128 Å²	128	72%	0.719	83%	0.83	S	S	*	*			trans	87.2	115.2	168.4	0	0	0	0	0	118.2
214	E	34.6	Very low	34.7	Very low	188 Å²	188	126.2 Å²	126.2	88%	0.879	82%	0.821	S	S	*	*				34.6	139.1	108.9	-68	171.3	-164.6	0	0	118.9
215	D	32.1	Very low	34.2	Very low	156 Å²	156	131.1 Å²	131.1	83%	0.834	82%	0.823	S	S	*	*			cis	-156	169.2	-1.4	-162.7	-1.3	0	0	0	109.6
216	G	32.1	Very low	33.8	Very low	73 Å²	73	124.4 Å²	124.4	75%	0.753	81%	0.814	S	S	*	*			trans	166.9	80.3	175.6	0	0	0	0	0	116.9
217	A	36.8	Very low	33.5	Very low	94 Å²	94	130.1 Å²	130.1	78%	0.777	82%	0.822	S	S	*	*			trans	-86	133.1	177.9	0	0	0	0	0	114.1
218	S	35.5	Very low	33.2	Very low	131 Å²	131	128.2 Å²	128.2	92%	0.916	82%	0.817	S	S	*	*			trans	-157.9	157.2	153.1	-86.3	0	0	0	0	110.6
219	S	38.3	Very low	33	Very low	116 Å²	116	125.8 Å²	125.8	81%	0.811	81%	0.812	S	S	*	*			trans	-131.2	151.9	-151.8	56.4	0	0	0	0	115.9
220	A	34.3	Very low	32.9	Very low	92 Å²	92	129 Å²	129	76%	0.76	82%	0.816	S	S	*	*			trans	48.3	118.8	153.9	0	0	0	0	0	119.9
221	S	32.8	Very low	33	Very low	127 Å²	127	125.8 Å²	125.8	89%	0.888	81%	0.811	S	S	*	*				175.3	177.2	94.3	50.5	0	0	0	0	112.1
222	S	35.8	Very low	33.2	Very low	115 Å²	115	129 Å²	129	80%	0.804	82%	0.815	S	S	*	*			trans	-97.9	143.9	-170.4	55.6	0	0	0	0	114.1
223	S	30.1	Very low	33.4	Very low	128 Å²	128	130.6 Å²	130.6	90%	0.895	81%	0.812	S	S	*	*			trans	-154.1	170.4	141.6	65.8	0	0	0	0	110.9
224	S	36.2	Very low	33.7	Very low	100 Å²	100	131.8 Å²	131.8	70%	0.699	82%	0.815	S	S	*	*			trans	-135.9	119.2	-170.8	56.2	0	0	0	0	112.7
225	Q	33.2	Very low	33.5	Very low	179 Å²	179	129.7 Å²	129.7	84%	0.836	82%	0.815	S	S	*	*			trans	-165.3	125.2	156.8	-98.2	137.5	101	0	0	103.9
226	S	33.4	Very low	33.5	Very low	107 Å²	107	127 Å²	127	75%	0.748	81%	0.809	S	S	*	*				75.6	59.1	55.4	82.9	0	0	0	0	114
227	E	29.3	Very low	33.9	Very low	193 Å²	193	128 Å²	128	90%	0.902	80%	0.802	S	S	*	*			trans	-116.2	142.7	156.8	-67	-166.6	123	0	0	109.6
228	T	33.6	Very low	34	Very low	127 Å²	127	128 Å²	128	78%	0.779	80%	0.797	S	S	*	*			trans	-107	124.9	-172.1	43.7	0	0	0	0	111.3
229	P	30.1	Very low	34.4	Very low	126 Å²	126	129.9 Å²	129.9	82%	0.818	80%	0.795	S	S	*	*			trans	-73.5	123.8	153.5	30.6	-29.2	0	0	0	108.4
230	E	30.4	Very low	34.8	Very low	170 Å²	170	129 Å²	129	79%	0.794	78%	0.781	S	S	*	*			trans	-68.3	144.2	174	-66.4	-161.9	131.9	0	0	111.2	V232	E230-V232 PolarHBondContact O-N 3.05Å; E230-V232 VanDerWaalsContact O-N 3.08Å
231	P	34.5	Very low	35.1	Very low	117 Å²	117	129.9 Å²	129.9	76%	0.76	78%	0.777	S	S	*	*			trans	-76.4	96.9	174	31.5	-32.5	0	0	0	109.8	E233	P231-E233 PolarHBondContact O-N 3.09Å; P231-E233 VanDerWaalsContact O-N 3.1Å
232	V	33.5	Very low	36.1	Very low	147 Å²	147	129.6 Å²	129.6	89%	0.891	77%	0.77	S	S	*	*			trans	-55.9	116.7	167.1	-111.2	0	0	0	0	109.1	E230	E230-V232 PolarHBondContact O-N 3.05Å; E230-V232 VanDerWaalsContact O-N 3.08Å
233	E	33.3	Very low	36.7	Very low	170 Å²	170	129.6 Å²	129.6	79%	0.794	76%	0.761	S	S	*	*			trans	-72	143.3	-172.3	-69.9	-162.4	127.2	0	0	112.8	P231	P231-E233 PolarHBondContact O-N 3.09Å; P231-E233 VanDerWaalsContact O-N 3.1Å
234	S	38.3	Very low	37.8	Very low	112 Å²	112	130.2 Å²	130.2	78%	0.783	75%	0.754	S	S	*	*			trans	48.7	84.3	141.2	-57.8	0	0	0	0	118
235	T	29.3	Very low	39.3	Very low	143 Å²	143	127.6 Å²	127.6	88%	0.877	73%	0.734	S	S	*	*			trans	-115.2	107.9	143.9	-41.7	0	0	0	0	109.4
236	S	32.3	Very low	41.8	Very low	100 Å²	100	120.5 Å²	120.5	70%	0.699	70%	0.702	S	S	*	*			trans	4.6	118	171.9	-54.2	0	0	0	0	118.4	S238	S236-S238 PolarHBondContact O-N 3.36Å
237	P	41.5	Very low	44.7	Very low	93 Å²	93	120 Å²	120	60%	0.604	69%	0.688	S	S	*	*			trans	-59.9	121.6	149.7	28.3	-31.6	0	0	0	107.5	L239 P292	P237-L239 PolarHBondContact O-N 2.82Å; P237-P292 HydrophobicContact CG-CB 3.6Å; P237-P292 HydrophobicContact CG-CG 3.93Å
238	S	38.3	Very low	47.8	Very low	96 Å²	96	112.8 Å²	112.8	67%	0.671	65%	0.652	S	S	*	*			trans	-56.9	138.5	178.5	38.1	0	0	0	0	110.3	S236 L240	S236-S238 PolarHBondContact O-N 3.36Å; S238-L240 VanDerWaalsContact C-N 3.32Å; S238-L240 PolarHBondContact O-N 2.83Å
239	L	43.4	Very low	50.7	Low	169 Å²	169	110.6 Å²	110.6	89%	0.885	64%	0.642	S	S	*	*			trans	-68.4	89.7	179.9	-69.8	170.4	0	0	0	109.4	P237 T241	P237-L239 PolarHBondContact O-N 2.82Å; L239-T241 PolarHBondContact O-N 2.89Å; L239-T241 VanDerWaalsContact O-N 3.12Å
240	L	47	Very low	53.8	Low	99 Å²	99	104.9 Å²	104.9	52%	0.518	61%	0.605	S	S	.	*			trans	-61.1	113.2	171.6	-64.1	-179	0	0	0	108.5	S238 T242	S238-L240 VanDerWaalsContact C-N 3.32Å; S238-L240 PolarHBondContact O-N 2.83Å; L240-T242 PolarHBondContact O-N 2.92Å
241	T	41.4	Very low	57	Low	110 Å²	110	97.3 Å²	97.3	68%	0.675	57%	0.569	S	S	*	*			trans	-64.4	124.8	-179.8	37.1	0	0	0	0	110.3	L239 D243 T245	L239-T241 PolarHBondContact O-N 2.89Å; L239-T241 VanDerWaalsContact O-N 3.12Å; T241-D243 PolarHBondContact O-N 2.81Å; T241-T245 PolarHBondContact O-OG1 3.41Å
242	T	52.7	Low	60	Low	120 Å²	120	91.7 Å²	91.7	74%	0.736	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	99	-167.9	-36.6	0	0	0	0	111.8	L240	L240-T242 PolarHBondContact O-N 2.92Å
243	D	49.6	Very low	63	Low	116 Å²	116	87.5 Å²	87.5	62%	0.62	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn		173.8	-60.5	125	-86.9	-19.1	0	0	0	109	T241 T245 L246	T241-D243 PolarHBondContact O-N 2.81Å; D243-T245 VanDerWaalsContact C-N 3.28Å; D243-T245 PolarHBondContact O-N 3.15Å; D243-L246 PolarHBondContact O-N 2.96Å
244	N	51.9	Low	66	Low	140 Å²	140	79.5 Å²	79.5	75%	0.749	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-64.9	-25.8	-175.3	-67	-13.7	0	0	0	113.9	L246 E247	N244-L246 PolarHBondContact O-N 2.8Å; N244-E247 PolarHBondContact O-N 2.9Å
245	T	67.7	Low	68.7	Low	46 Å²	46	78 Å²	78	28%	0.282	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-71.4	-8.5	-176.5	61.6	0	0	0	0	114.3	T241 D243 R248	T241-T245 PolarHBondContact O-OG1 3.41Å; D243-T245 VanDerWaalsContact C-N 3.28Å; D243-T245 PolarHBondContact O-N 3.15Å; T245-R248 PolarHBondContact O-NH1 2.83Å; T245-R248 PolarHBondContact O-NH2 2.81Å
246	L	87.2	Confident	71.7	Confident	29 Å²	29	72 Å²	72	15%	0.152	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-104.6	-12.6	-177.8	-57	178.5	0	0	0	113.5	D243 N244 R278 L279 L281	D243-L246 PolarHBondContact O-N 2.96Å; N244-L246 PolarHBondContact O-N 2.8Å; L246-R278 CarbonylContact O-C 3.44Å; L246-R278 WeakPolarHBondContact O-CA 3.35Å; L246-L279 PolarHBondContact O-N 2.8Å; L246-L281 HydrophobicContact CD1-CD1 3.54Å; L246-L281 HydrophobicContact CD1-CG 4.13Å; L246-L281 HydrophobicContact CD2-CD1 3.87Å; L246-L281 HydrophobicContact CD2-CD2 4.4Å; L246-L281 HydrophobicContact CD2-CG 4.16Å; L246-L281 HydrophobicContact CG-CD1 4.37Å
247	E	92.6	Very high	74.5	Confident	96 Å²	96	71.5 Å²	71.5	45%	0.449	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	145.6	174.9	-52.7	-146.7	142	0	0	111.1	N244 R278	N244-E247 PolarHBondContact O-N 2.9Å; E247-R278 HydrophobicContact CG-CG 4.34Å; E247-R278 IonicContact OE1-CZ 2.72Å; E247-R278 IonicContact OE1-NE 2.73Å; E247-R278 PolarHBondContact OE1-NE 3.3Å; E247-R278 IonicContact OE1-NH2 3.57Å; E247-R278 PolarHBondContact OE1-NH2 3.46Å
248	R	94.3	Very high	76.6	Confident	43 Å²	43	70.2 Å²	70.2	16%	0.162	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	120.9	-176	-64.4	-69.9	178.4	-89	6.6	108.9	Q196 T245 F250 T276 G277 L298	Q196-R248 WeakPolarHBondContact O-CD 3.38Å; Q196-R248 PolarHBondContact O-NE 3.44Å; T245-R248 PolarHBondContact O-NH1 2.83Å; T245-R248 PolarHBondContact O-NH2 2.81Å; R248-F250 HydrophobicContact CB-CD1 4.31Å; R248-F250 HydrophobicContact CB-CE1 4.13Å; R248-T276 CarbonylContact O-C 3.51Å; R248-T276 WeakPolarHBondContact O-CA 3.43Å; R248-G277 PolarHBondContact N-O 3.03Å; R248-G277 PolarHBondContact O-N 3.12Å; R248-L298 HydrophobicContact CB-CD1 4.06Å; R248-L298 HydrophobicContact CG-CD1 3.69Å
249	S	95.3	Very high	78.1	Confident	81 Å²	81	71 Å²	71	57%	0.566	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.5	111.9	175.2	-172.2	0	0	0	0	108.3	H274 I275	S249-H274 PolarHBondContact OG-NE2 3.36Å; S249-I275 VanDerWaalsContact CA-O 3.28Å; S249-I275 WeakPolarHBondContact CA-O 3.24Å
250	F	96.2	Very high	79	Confident	6 Å²	6	66.3 Å²	66.3	3%	0.026	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	166.7	-174	63.9	-80.9	0	0	0	111.4	M193 Q196 R248 I252 I275	M193-F250 HydrophobicContact CE-CZ 4.27Å; M193-F250 HydrophobicContact SD-CE2 3.68Å; M193-F250 HydrophobicContact SD-CZ 3.75Å; Q196-F250 HydrophobicContact CB-CD1 4.07Å; Q196-F250 HydrophobicContact CB-CE1 3.62Å; Q196-F250 HydrophobicContact CB-CE2 4.15Å; Q196-F250 HydrophobicContact CB-CZ 3.67Å; Q196-F250 HydrophobicContact CG-CB 4.43Å; Q196-F250 HydrophobicContact CG-CD1 3.7Å; Q196-F250 HydrophobicContact CG-CD2 3.88Å; Q196-F250 HydrophobicContact CG-CE1 3.78Å; Q196-F250 HydrophobicContact CG-CE2 3.96Å; Q196-F250 HydrophobicContact CG-CG 3.76Å; Q196-F250 HydrophobicContact CG-CZ 3.91Å; R248-F250 HydrophobicContact CB-CD1 4.31Å; R248-F250 HydrophobicContact CB-CE1 4.13Å; F250-I252 HydrophobicContact CD2-CG2 3.69Å; F250-I252 HydrophobicContact CE2-CG2 3.6Å; F250-I275 HydrophobicContact CD1-CB 4.28Å; F250-I275 HydrophobicContact CD1-CG2 3.93Å; F250-I275 HydrophobicContact CE1-CB 4.05Å; F250-I275 HydrophobicContact CE1-CD1 4.5Å; F250-I275 HydrophobicContact CE1-CG2 3.39Å; F250-I275 HydrophobicContact CE2-CB 4.46Å; F250-I275 HydrophobicContact CE2-CD1 3.9Å; F250-I275 HydrophobicContact CZ-CB 4.14Å; F250-I275 HydrophobicContact CZ-CD1 3.76Å; F250-I275 HydrophobicContact CZ-CG2 3.74Å; F250-I275 PolarHBondContact N-O 3.12Å; F250-I275 VanDerWaalsContact N-O 3.14Å; F250-I275 PolarHBondContact O-N 3.01Å
251	F	97	Very high	79.3	Confident	10 Å²	10	72.8 Å²	72.8	4%	0.044	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.5	-176.6	-59.8	-86	0	0	0	111	V272 I273 H274 L305 D371 K375 C378 V379	F251-V272 HydrophobicContact CB-CG1 4.19Å; F251-V272 HydrophobicContact CD1-CG1 4.22Å; F251-I273 WeakPolarHBondContact CA-O 3.33Å; F251-H274 HydrophobicContact CD1-CB 3.79Å; F251-H274 AromaticContact CD1-CD2 3.88Å; F251-H274 HydrophobicContact CE1-CB 3.54Å; F251-H274 AromaticContact CE1-CD2 3.39Å; F251-H274 WeakPolarHBondContact CE1-CD2 3.39Å; F251-H274 AromaticContact CE1-CG 3.45Å; F251-H274 VanDerWaalsContact CE1-CG 3.45Å; F251-H274 AromaticContact CZ-CD2 3.55Å; F251-H274 AromaticContact CZ-CG 3.97Å; F251-H274 AromaticContact CZ-NE2 3.92Å; F251-L305 HydrophobicContact CD1-CD1 4.12Å; F251-L305 HydrophobicContact CE1-CD1 4.07Å; F251-D371 HydrophobicContact CD2-CB 4.32Å; F251-D371 WeakPolarHBondContact CD2-OD2 3.29Å; F251-K375 HydrophobicContact CB-CD 3.83Å; F251-K375 VanDerWaalsContact O-CD 3.32Å; F251-K375 WeakPolarHBondContact O-CD 3.48Å; F251-K375 WeakPolarHBondContact O-CE 3.23Å; F251-K375 PolarHBondContact O-NZ 2.93Å; F251-C378 HydrophobicContact CE2-CB 4.46Å; F251-C378 HydrophobicContact CZ-CB 4.46Å; F251-V379 HydrophobicContact CE1-CB 4.21Å; F251-V379 HydrophobicContact CE1-CG2 4.41Å; F251-V379 HydrophobicContact CZ-CB 4.03Å; F251-V379 VanDerWaalsContact CZ-O 3.3Å; F251-V379 WeakPolarHBondContact CZ-O 3.46Å
252	I	96.9	Very high	79.5	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	155.5	173.4	63.2	175.2	0	0	0	111.6	V185 D189 M193 F250 M254 I273 I275	V185-I252 HydrophobicContact CG1-CB 4.25Å; V185-I252 HydrophobicContact CG1-CD1 4.2Å; V185-I252 HydrophobicContact CG2-CD1 3.6Å; D189-I252 HydrophobicContact CB-CB 4.36Å; D189-I252 HydrophobicContact CB-CG2 4.26Å; M193-I252 HydrophobicContact SD-CD1 3.76Å; F250-I252 HydrophobicContact CD2-CG2 3.69Å; F250-I252 HydrophobicContact CE2-CG2 3.6Å; I252-M254 HydrophobicContact CD1-CG 4.01Å; I252-M254 HydrophobicContact CD1-SD 4.32Å; I252-M254 HydrophobicContact CG1-CG 4.05Å; I252-I273 PolarHBondContact N-O 2.89Å; I252-I273 PolarHBondContact O-N 2.84Å; I252-I275 HydrophobicContact CD1-CD1 3.41Å; I252-I275 VanDerWaalsContact CD1-CD1 3.41Å; I252-I275 HydrophobicContact CG1-CD1 3.83Å
253	R	96.2	Very high	78.9	Confident	59 Å²	59	68.2 Å²	68.2	22%	0.223	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	113.9	174.9	-63.7	169.2	-77.8	-157.2	-3.3	109.2	H186 D189 Y270 K271 V272 N374	H186-R253 HydrophobicContact CB-CB 3.65Å; H186-R253 WeakPolarHBondContact CB-O 3.29Å; H186-R253 PolarHBondContact N-O 2.98Å; D189-R253 IonicContact OD1-CZ 3.02Å; D189-R253 VanDerWaalsContact OD1-CZ 3.29Å; D189-R253 IonicContact OD1-NE 2.71Å; D189-R253 PolarHBondContact OD1-NE 2.71Å; D189-R253 VanDerWaalsContact OD1-NE 3.15Å; D189-R253 IonicContact OD1-NH2 3.75Å; D189-R253 PolarHBondContact OD1-NH2 2.86Å; D189-R253 VanDerWaalsContact OD2-CB 3.23Å; D189-R253 WeakPolarHBondContact OD2-CB 3.42Å; D189-R253 WeakPolarHBondContact OD2-CG 3.49Å; D189-R253 IonicContact OD2-CZ 3.58Å; D189-R253 PolarHBondContact OD2-N 3.08Å; D189-R253 IonicContact OD2-NE 3.53Å; D189-R253 PolarHBondContact OD2-NE 3.37Å; D189-R253 IonicContact OD2-NH2 3.59Å; R253-Y270 HydrophobicContact CB-CD1 4.35Å; R253-K271 CarbonylContact C-O 3.54Å; R253-K271 VanDerWaalsContact CA-O 3.29Å; R253-K271 WeakPolarHBondContact CA-O 2.99Å; R253-V272 HydrophobicContact CG-CG2 4.33Å; R253-N374 PolarHBondContact NH1-O 3.04Å
254	M	96.6	Very high	78.2	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	146.1	177.2	-63.8	-166.9	70.6	0	0	111.8	F148 F158 L169 Y184 V185 I252 Y270 K271 I273	F148-M254 HydrophobicContact CE2-SD 4.45Å; F148-M254 HydrophobicContact CZ-SD 4.11Å; F158-M254 HydrophobicContact CZ-CE 4.21Å; L169-M254 HydrophobicContact CD1-CB 3.88Å; L169-M254 HydrophobicContact CD1-CE 4.27Å; L169-M254 HydrophobicContact CD1-SD 4.29Å; L169-M254 HydrophobicContact CD2-CB 4.31Å; Y184-M254 CarbonylContact O-C 3.53Å; Y184-M254 WeakPolarHBondContact O-CA 3.45Å; V185-M254 HydrophobicContact CG2-CG 4.38Å; I252-M254 HydrophobicContact CD1-CG 4.01Å; I252-M254 HydrophobicContact CD1-SD 4.32Å; I252-M254 HydrophobicContact CG1-CG 4.05Å; M254-Y270 CarbonylContact O-C 3.59Å; M254-Y270 WeakPolarHBondContact O-CA 3.08Å; M254-K271 PolarHBondContact N-O 3.13Å; M254-K271 PolarHBondContact O-N 3.25Å; M254-I273 HydrophobicContact CB-CG1 3.81Å; M254-I273 HydrophobicContact CG-CB 4.25Å; M254-I273 HydrophobicContact CG-CG1 3.74Å; M254-I273 HydrophobicContact SD-CB 4.32Å; M254-I273 HydrophobicContact SD-CG1 3.92Å; M254-I273 HydrophobicContact SD-CG2 4.36Å
255	K	95.3	Very high	77.9	Confident	82 Å²	82	70.5 Å²	70.5	36%	0.357	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	136.1	178.3	-73.9	180	-174.2	168.2	0	111.3	L169 L171 D183 Y184 G269 Y270	L169-K255 WeakPolarHBondContact CD2-O 3.46Å; L171-K255 HydrophobicContact CD1-CB 4.45Å; L171-K255 WeakPolarHBondContact CD1-O 3.47Å; D183-K255 WeakPolarHBondContact O-CE 3.22Å; D183-K255 PolarHBondContact O-NZ 3.14Å; Y184-K255 WeakPolarHBondContact O-CG 3.18Å; Y184-K255 PolarHBondContact O-N 3.44Å; K255-G269 CarbonylContact C-O 3.52Å; K255-G269 VanDerWaalsContact CA-O 3.26Å; K255-G269 WeakPolarHBondContact CA-O 3.49Å; K255-Y270 HydrophobicContact CB-CE1 4.42Å; K255-Y270 WeakPolarHBondContact CE-OH 3.26Å; K255-Y270 HydrophobicContact CG-CD1 4.03Å; K255-Y270 HydrophobicContact CG-CE1 3.43Å; K255-Y270 VanDerWaalsContact CG-CE1 3.43Å
256	S	92.7	Very high	76.8	Confident	15 Å²	15	78.2 Å²	78.2	11%	0.105	40%	0.399	C	S	.	.			trans	-135.5	119.5	-178.5	170.4	0	0	0	0	110	L169 L258 G269	L169-S256 CarbonylContact O-C 3.52Å; L169-S256 VanDerWaalsContact O-CA 3.28Å; L169-S256 WeakPolarHBondContact O-CA 3.42Å; S256-L258 VanDerWaalsContact C-N 3.34Å; S256-L258 PolarHBondContact OG-N 2.79Å; S256-G269 PolarHBondContact N-O 3.49Å
257	T	91.2	Very high	75.2	Confident	90 Å²	90	80 Å²	80	55%	0.552	42%	0.415	S	S	*	.			trans	-83.8	-12.4	173.8	56.8	0	0	0	0	112.5	L169 G170 L171 T259	L169-T257 PolarHBondContact O-N 2.93Å; L169-T257 PolarHBondContact O-OG1 2.88Å; G170-T257 VanDerWaalsContact CA-OG1 3.26Å; G170-T257 WeakPolarHBondContact CA-OG1 3.35Å; G170-T257 PolarHBondContact O-OG1 2.71Å; L171-T257 HydrophobicContact CD2-CG2 3.86Å; T257-T259 PolarHBondContact O-N 3.26Å
258	L	85.8	Confident	73.9	Confident	67 Å²	67	79.9 Å²	79.9	35%	0.351	42%	0.424	S	S	.	.			trans	-65.3	115.5	177.5	-59.6	174.5	0	0	0	111.2	I167 Y168 S256	I167-L258 WeakPolarHBondContact O-CD1 3.43Å; Y168-L258 WeakPolarHBondContact O-CD1 3.34Å; S256-L258 VanDerWaalsContact C-N 3.34Å; S256-L258 PolarHBondContact OG-N 2.79Å
259	T	68.8	Low	73.5	Confident	111 Å²	111	79.2 Å²	79.2	68%	0.681	43%	0.431	S	S	*	.			trans	-77.4	132.5	172.7	51.6	0	0	0	0	110.6	T257 R261	T257-T259 PolarHBondContact O-N 3.26Å; T259-R261 VanDerWaalsContact C-N 3.32Å; T259-R261 PolarHBondContact O-N 2.86Å
260	K	63.2	Low	73.3	Confident	72 Å²	72	78 Å²	78	31%	0.313	41%	0.414	S	S	.	.			trans	-74.1	85.4	174.8	-169.7	172.3	-174.9	177.5	0	109.8	G262 V263 T309	K260-G262 PolarHBondContact O-N 2.83Å; K260-V263 HydrophobicContact CD-CB 4.14Å; K260-V263 HydrophobicContact CD-CG2 4.06Å; K260-V263 HydrophobicContact CG-CB 4.36Å; K260-V263 HydrophobicContact CG-CG2 4.39Å; K260-V263 PolarHBondContact O-N 2.9Å; K260-T309 PolarHBondContact NZ-OG1 2.89Å
261	R	52.3	Low	73.1	Confident	235 Å²	235	80.9 Å²	80.9	89%	0.887	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	129.8	172	-64.5	-175.9	-177	179.8	0.9	109.4	T259	T259-R261 VanDerWaalsContact C-N 3.32Å; T259-R261 PolarHBondContact O-N 2.86Å
262	G	45.5	Very low	72.9	Confident	82 Å²	82	80.8 Å²	80.8	85%	0.845	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	1	173.5	0	0	0	0	0	117.2	K260	K260-G262 PolarHBondContact O-N 2.83Å
263	V	40.2	Very low	72.9	Confident	51 Å²	51	80.8 Å²	80.8	31%	0.309	43%	0.427	S	S	.	.			trans	-134	122.2	172.6	-173	0	0	0	0	110.8	K260 I265	K260-V263 HydrophobicContact CD-CB 4.14Å; K260-V263 HydrophobicContact CD-CG2 4.06Å; K260-V263 HydrophobicContact CG-CB 4.36Å; K260-V263 HydrophobicContact CG-CG2 4.39Å; K260-V263 PolarHBondContact O-N 2.9Å; V263-I265 HydrophobicContact CG1-CB 4.28Å; V263-I265 HydrophobicContact CG1-CD1 3.8Å; V263-I265 HydrophobicContact CG1-CG1 3.86Å; V263-I265 PolarHBondContact O-N 2.75Å
264	H	35.8	Very low	72.9	Confident	206 Å²	206	79.1 Å²	79.1	95%	0.954	42%	0.422	S	S	*	.			trans	-74.2	35.3	-179.3	-76	-90.6	0	0	0	114.5
265	I	45.8	Very low	72.9	Confident	98 Å²	98	79 Å²	79	50%	0.503	42%	0.421	S	S	.	.			trans	-90.6	124.5	169.2	-68.5	169	0	0	0	107.6	V263 S267	V263-I265 HydrophobicContact CG1-CB 4.28Å; V263-I265 HydrophobicContact CG1-CD1 3.8Å; V263-I265 HydrophobicContact CG1-CG1 3.86Å; V263-I265 PolarHBondContact O-N 2.75Å; I265-S267 VanDerWaalsContact C-N 3.28Å; I265-S267 PolarHBondContact O-N 3.46Å
266	K	43.1	Very low	73	Confident	208 Å²	208	77.2 Å²	77.2	90%	0.904	42%	0.417	S	S	*	.			trans	-65.7	89.9	165.8	-65.4	177.2	-177.6	175.6	0	107.9	S268	K266-S268 PolarHBondContact O-N 3.16Å
267	S	54.5	Low	73.2	Confident	68 Å²	68	77.4 Å²	77.4	48%	0.476	42%	0.421	S	S	.	.			trans	-57.8	136.9	171.9	50.5	0	0	0	0	108.7	I265 G269	I265-S267 VanDerWaalsContact C-N 3.28Å; I265-S267 PolarHBondContact O-N 3.46Å; S267-G269 PolarHBondContact O-N 3.05Å
268	S	64.6	Low	73.3	Confident	93 Å²	93	80.6 Å²	80.6	65%	0.65	42%	0.423	S	S	*	.			trans	-66.8	5.7	-174.3	53.4	0	0	0	0	114.7	K266 Y270	K266-S268 PolarHBondContact O-N 3.16Å; S268-Y270 VanDerWaalsContact C-N 3.33Å; S268-Y270 WeakPolarHBondContact O-CD2 3.29Å; S268-Y270 WeakPolarHBondContact O-CE2 3.47Å
269	G	86.8	Confident	73.6	Confident	29 Å²	29	77.7 Å²	77.7	30%	0.299	41%	0.408	S	S	.	.	S	Bend	trans	78.5	12.6	-167.8	0	0	0	0	0	113.7	K255 S256 S267	K255-G269 CarbonylContact C-O 3.52Å; K255-G269 VanDerWaalsContact CA-O 3.26Å; K255-G269 WeakPolarHBondContact CA-O 3.49Å; S256-G269 PolarHBondContact N-O 3.49Å; S267-G269 PolarHBondContact O-N 3.05Å
270	Y	90.8	Very high	74.6	Confident	56 Å²	56	73.5 Å²	73.5	22%	0.22	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	156.4	-179.8	-61.8	-93.7	0	0	0	113	H186 R253 M254 K255 S268	H186-Y270 HydrophobicContact CB-CD1 3.85Å; H186-Y270 HydrophobicContact CB-CE1 3.73Å; H186-Y270 HydrophobicContact CB-CG 4.49Å; H186-Y270 AromaticContact CD2-CE2 3.84Å; H186-Y270 AromaticContact CD2-CZ 3.91Å; R253-Y270 HydrophobicContact CB-CD1 4.35Å; M254-Y270 CarbonylContact O-C 3.59Å; M254-Y270 WeakPolarHBondContact O-CA 3.08Å; K255-Y270 HydrophobicContact CB-CE1 4.42Å; K255-Y270 WeakPolarHBondContact CE-OH 3.26Å; K255-Y270 HydrophobicContact CG-CD1 4.03Å; K255-Y270 HydrophobicContact CG-CE1 3.43Å; K255-Y270 VanDerWaalsContact CG-CE1 3.43Å; S268-Y270 VanDerWaalsContact C-N 3.33Å; S268-Y270 WeakPolarHBondContact O-CD2 3.29Å; S268-Y270 WeakPolarHBondContact O-CE2 3.47Å
271	K	91.8	Very high	75.6	Confident	66 Å²	66	71.9 Å²	71.9	29%	0.287	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	151.5	164.9	-75.6	-172	-178.2	-177.5	0	110.4	Y168 L169 R253 M254	Y168-K271 WeakPolarHBondContact O-CD 3.33Å; Y168-K271 WeakPolarHBondContact O-CE 3.41Å; Y168-K271 PolarHBondContact O-NZ 3.34Å; L169-K271 HydrophobicContact CD2-CB 4.16Å; L169-K271 HydrophobicContact CD2-CD 4.32Å; R253-K271 CarbonylContact C-O 3.54Å; R253-K271 VanDerWaalsContact CA-O 3.29Å; R253-K271 WeakPolarHBondContact CA-O 2.99Å; M254-K271 PolarHBondContact N-O 3.13Å; M254-K271 PolarHBondContact O-N 3.25Å
272	V	93.8	Very high	76.8	Confident	8 Å²	8	66.4 Å²	66.4	5%	0.048	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	125.1	169	-172.9	0	0	0	0	109.5	F251 R253 L305 K375 Q377	F251-V272 HydrophobicContact CB-CG1 4.19Å; F251-V272 HydrophobicContact CD1-CG1 4.22Å; R253-V272 HydrophobicContact CG-CG2 4.33Å; V272-L305 HydrophobicContact CB-CD1 4.39Å; V272-L305 HydrophobicContact CG1-CD1 3.94Å; V272-L305 PolarHBondContact O-N 3.3Å; V272-K375 HydrophobicContact CG2-CB 4.45Å; V272-K375 WeakPolarHBondContact CG2-O 3.32Å; V272-Q377 HydrophobicContact CB-CB 4.05Å; V272-Q377 HydrophobicContact CB-CG 4.4Å; V272-Q377 HydrophobicContact CG1-CB 4.28Å; V272-Q377 HydrophobicContact CG2-CB 3.97Å; V272-Q377 HydrophobicContact CG2-CG 4.06Å
273	I	96.4	Very high	77.8	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.3	175	-58	-54.4	0	0	0	108	F148 L169 F251 I252 M254 I275 A302 H303 A304	F148-I273 HydrophobicContact CE1-CD1 4.06Å; F148-I273 HydrophobicContact CZ-CD1 4.27Å; F148-I273 HydrophobicContact CZ-CG1 4.36Å; F148-I273 HydrophobicContact CZ-CG2 4.13Å; L169-I273 HydrophobicContact CD2-CD1 4.02Å; L169-I273 HydrophobicContact CD2-CG1 4.5Å; F251-I273 WeakPolarHBondContact CA-O 3.33Å; I252-I273 PolarHBondContact N-O 2.89Å; I252-I273 PolarHBondContact O-N 2.84Å; M254-I273 HydrophobicContact CB-CG1 3.81Å; M254-I273 HydrophobicContact CG-CB 4.25Å; M254-I273 HydrophobicContact CG-CG1 3.74Å; M254-I273 HydrophobicContact SD-CB 4.32Å; M254-I273 HydrophobicContact SD-CG1 3.92Å; M254-I273 HydrophobicContact SD-CG2 4.36Å; I273-I275 HydrophobicContact CG2-CG1 4.24Å; I273-A302 HydrophobicContact CG2-CB 3.63Å; I273-H303 WeakPolarHBondContact CA-O 3.49Å; I273-A304 HydrophobicContact CD1-CB 3.47Å; I273-A304 VanDerWaalsContact CD1-CB 3.47Å
274	H	96.8	Very high	78.7	Confident	23 Å²	23	66.5 Å²	66.5	11%	0.106	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	117.1	165.5	-176	-150.2	0	0	0	108.6	S249 F251 T276 A302 H303 L305	S249-H274 PolarHBondContact OG-NE2 3.36Å; F251-H274 HydrophobicContact CD1-CB 3.79Å; F251-H274 AromaticContact CD1-CD2 3.88Å; F251-H274 HydrophobicContact CE1-CB 3.54Å; F251-H274 AromaticContact CE1-CD2 3.39Å; F251-H274 WeakPolarHBondContact CE1-CD2 3.39Å; F251-H274 AromaticContact CE1-CG 3.45Å; F251-H274 VanDerWaalsContact CE1-CG 3.45Å; F251-H274 AromaticContact CZ-CD2 3.55Å; F251-H274 AromaticContact CZ-CG 3.97Å; F251-H274 AromaticContact CZ-NE2 3.92Å; H274-T276 WeakPolarHBondContact CE1-CG2 3.48Å; H274-A302 WeakPolarHBondContact O-CA 3.34Å; H274-H303 HydrophobicContact CB-CB 4.46Å; H274-H303 PolarHBondContact N-O 3.08Å; H274-H303 PolarHBondContact O-N 3.14Å; H274-L305 HydrophobicContact CB-CD2 4.16Å
275	I	97	Very high	79.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	127.1	173.8	-76.6	177.7	0	0	0	108.1	F150 M193 S249 F250 I252 I273 V300 A302	F150-I275 HydrophobicContact CZ-CD1 3.87Å; F150-I275 HydrophobicContact CZ-CG1 4.27Å; M193-I275 HydrophobicContact SD-CD1 4.34Å; S249-I275 VanDerWaalsContact CA-O 3.28Å; S249-I275 WeakPolarHBondContact CA-O 3.24Å; F250-I275 HydrophobicContact CD1-CB 4.28Å; F250-I275 HydrophobicContact CD1-CG2 3.93Å; F250-I275 HydrophobicContact CE1-CB 4.05Å; F250-I275 HydrophobicContact CE1-CD1 4.5Å; F250-I275 HydrophobicContact CE1-CG2 3.39Å; F250-I275 HydrophobicContact CE2-CB 4.46Å; F250-I275 HydrophobicContact CE2-CD1 3.9Å; F250-I275 HydrophobicContact CZ-CB 4.14Å; F250-I275 HydrophobicContact CZ-CD1 3.76Å; F250-I275 HydrophobicContact CZ-CG2 3.74Å; F250-I275 PolarHBondContact N-O 3.12Å; F250-I275 VanDerWaalsContact N-O 3.14Å; F250-I275 PolarHBondContact O-N 3.01Å; I252-I275 HydrophobicContact CD1-CD1 3.41Å; I252-I275 VanDerWaalsContact CD1-CD1 3.41Å; I252-I275 HydrophobicContact CG1-CD1 3.83Å; I273-I275 HydrophobicContact CG2-CG1 4.24Å; I275-V300 HydrophobicContact CB-CG1 4.22Å; I275-V300 HydrophobicContact CG1-CG1 4.08Å; I275-V300 HydrophobicContact CG2-CB 4.47Å; I275-V300 HydrophobicContact CG2-CG1 3.72Å; I275-V300 HydrophobicContact CG2-CG2 3.88Å; I275-A302 HydrophobicContact CG1-CB 4.49Å
276	T	96.8	Very high	80.1	Confident	44 Å²	44	61.5 Å²	61.5	27%	0.27	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.4	165.9	64.2	0	0	0	0	109.3	R248 H274 V300 V301	R248-T276 CarbonylContact O-C 3.51Å; R248-T276 WeakPolarHBondContact O-CA 3.43Å; H274-T276 WeakPolarHBondContact CE1-CG2 3.48Å; T276-V300 CarbonylContact O-C 3.46Å; T276-V300 WeakPolarHBondContact O-CA 3.31Å; T276-V301 PolarHBondContact N-O 3.2Å; T276-V301 PolarHBondContact O-N 2.65Å; T276-V301 VanDerWaalsContact O-O 3.05Å; T276-V301 PolarHBondContact OG1-O 2.79Å
277	G	95.8	Very high	80.5	Confident	19 Å²	19	61.2 Å²	61.2	20%	0.196	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.4	-173.8	-171.8	0	0	0	0	0	114.9	R248 V299	R248-G277 PolarHBondContact N-O 3.03Å; R248-G277 PolarHBondContact O-N 3.12Å; G277-V299 CarbonylContact C-O 3.55Å; G277-V299 WeakPolarHBondContact CA-O 3.29Å
278	R	94.3	Very high	80.6	Confident	157 Å²	157	62 Å²	62	59%	0.592	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.1	175.7	-62.2	-170.8	-179.2	88.3	4.7	111.5	L246 E247 R280 V299	L246-R278 CarbonylContact O-C 3.44Å; L246-R278 WeakPolarHBondContact O-CA 3.35Å; E247-R278 HydrophobicContact CG-CG 4.34Å; E247-R278 IonicContact OE1-CZ 2.72Å; E247-R278 IonicContact OE1-NE 2.73Å; E247-R278 PolarHBondContact OE1-NE 3.3Å; E247-R278 IonicContact OE1-NH2 3.57Å; E247-R278 PolarHBondContact OE1-NH2 3.46Å; R278-R280 PolarHBondContact O-N 2.9Å; R278-V299 PolarHBondContact N-O 3.35Å; R278-V299 PolarHBondContact O-N 3.06Å
279	L	92.4	Very high	80.4	Confident	5 Å²	5	67.6 Å²	67.6	3%	0.026	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	112.4	175	-163	70.2	0	0	0	108.7	L246 I295 L298	L246-L279 PolarHBondContact O-N 2.8Å; L279-I295 HydrophobicContact CD1-CG2 3.84Å; L279-I295 HydrophobicContact CD2-CD1 3.82Å; L279-I295 HydrophobicContact CD2-CG1 3.83Å; L279-I295 HydrophobicContact CD2-CG2 4.08Å; L279-I295 HydrophobicContact CG-CG1 4.37Å; L279-I295 HydrophobicContact CG-CG2 3.9Å; L279-L298 HydrophobicContact CB-CD1 4.3Å; L279-L298 HydrophobicContact CD1-CB 4.21Å; L279-L298 HydrophobicContact CD1-CD1 3.96Å
280	R	88.8	Confident	78.8	Confident	23 Å²	23	72.3 Å²	72.3	9%	0.087	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	130.8	-173.2	-158.9	170.7	-176.3	-142.4	-0.5	110.1	F76 A77 G80 P82 R278 M296 G297 V299	F76-R280 HydrophobicContact CE2-CB 4.48Å; F76-R280 HydrophobicContact CZ-CB 4.06Å; F76-R280 PolarHBondContact O-NH1 3.28Å; A77-R280 PolarHBondContact O-NH2 3.25Å; G80-R280 PolarHBondContact O-NH2 3.31Å; P82-R280 PolarHBondContact O-NH2 3.34Å; R278-R280 PolarHBondContact O-N 2.9Å; R280-M296 WeakPolarHBondContact O-CB 3.32Å; R280-M296 PolarHBondContact O-N 2.84Å; R280-G297 PolarHBondContact N-O 2.61Å; R280-V299 HydrophobicContact CB-CG2 4.41Å
281	L	84.5	Confident	77.1	Confident	39 Å²	39	72.5 Å²	72.5	20%	0.204	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	146.8	-177.6	-69	-179	0	0	0	111.8	L246 I295	L246-L281 HydrophobicContact CD1-CD1 3.54Å; L246-L281 HydrophobicContact CD1-CG 4.13Å; L246-L281 HydrophobicContact CD2-CD1 3.87Å; L246-L281 HydrophobicContact CD2-CD2 4.4Å; L246-L281 HydrophobicContact CD2-CG 4.16Å; L246-L281 HydrophobicContact CG-CD1 4.37Å; L281-I295 HydrophobicContact CD2-CG1 3.98Å
282	R	77.4	Confident	75.3	Confident	119 Å²	119	73.4 Å²	73.4	45%	0.449	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	109	167.3	-172.4	179.3	-175	172.5	5.9	109.3	Q294 M296	R282-Q294 PolarHBondContact N-O 3.02Å; R282-Q294 PolarHBondContact O-N 3.47Å; R282-M296 HydrophobicContact CB-CG 3.66Å; R282-M296 HydrophobicContact CB-SD 3.8Å; R282-M296 HydrophobicContact CG-SD 4.49Å
283	V	66.3	Low	74.1	Confident	80 Å²	80	75.8 Å²	75.8	49%	0.485	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	126.5	171.3	-175.2	0	0	0	0	109	L285	V283-L285 HydrophobicContact CG1-CD2 4.14Å; V283-L285 HydrophobicContact CG1-CG 4.19Å
284	S	60.3	Low	73.2	Confident	56 Å²	56	81.9 Å²	81.9	39%	0.392	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	104.3	175.9	-171.7	0	0	0	0	110.2	S286	S284-S286 PolarHBondContact O-N 3.36Å
285	L	58.6	Low	72.7	Confident	149 Å²	149	83 Å²	83	78%	0.78	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	101.2	178.9	-65.6	175.8	0	0	0	110.4	V283	V283-L285 HydrophobicContact CG1-CD2 4.14Å; V283-L285 HydrophobicContact CG1-CG 4.19Å
286	S	51.3	Low	72.4	Confident	49 Å²	49	83.7 Å²	83.7	34%	0.343	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	112.3	174.8	61	0	0	0	0	112	S284 G288 R289 V291	S284-S286 PolarHBondContact O-N 3.36Å; S286-G288 PolarHBondContact O-N 2.75Å; S286-G288 VanDerWaalsContact O-N 3.16Å; S286-R289 PolarHBondContact O-N 3.39Å; S286-V291 WeakPolarHBondContact OG-CG2 3.31Å
287	H	51.1	Low	72.2	Confident	203 Å²	203	81.6 Å²	81.6	94%	0.94	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	40	57.4	162.6	-61.1	97.7	0	0	0	116	R289	H287-R289 PolarHBondContact O-N 2.91Å
288	G	58	Low	72.2	Confident	85 Å²	85	80.7 Å²	80.7	88%	0.876	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	7.8	168.8	0	0	0	0	0	116.2	S286	S286-G288 PolarHBondContact O-N 2.75Å; S286-G288 VanDerWaalsContact O-N 3.16Å
289	R	58.7	Low	72.3	Confident	210 Å²	210	75 Å²	75	79%	0.792	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	134.4	167.6	-65.5	-173.4	178.9	-168.2	-1.6	110.5	S286 H287 V291	S286-R289 PolarHBondContact O-N 3.39Å; H287-R289 PolarHBondContact O-N 2.91Å; R289-V291 PolarHBondContact O-N 3.31Å
290	T	54.6	Low	72.6	Confident	128 Å²	128	74.9 Å²	74.9	79%	0.785	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	112.9	171.4	34.5	0	0	0	0	109.3
291	V	54	Low	73	Confident	59 Å²	59	75.8 Å²	75.8	36%	0.358	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	141.8	174	172	0	0	0	0	108.6	S286 R289 S293	S286-V291 WeakPolarHBondContact OG-CG2 3.31Å; R289-V291 PolarHBondContact O-N 3.31Å; V291-S293 PolarHBondContact O-N 3.02Å
292	P	55.1	Low	73.6	Confident	86 Å²	86	73.9 Å²	73.9	56%	0.558	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.8	130.9	179.8	18.8	-33.3	0	0	0	112.6	P237 Q294	P237-P292 HydrophobicContact CG-CB 3.6Å; P237-P292 HydrophobicContact CG-CG 3.93Å; P292-Q294 PolarHBondContact O-N 3.41Å
293	S	68	Low	74.4	Confident	58 Å²	58	71 Å²	71	41%	0.406	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	125.1	-177.1	-63.1	0	0	0	0	112.2	V291	V291-S293 PolarHBondContact O-N 3.02Å
294	Q	78.2	Confident	75.4	Confident	127 Å²	127	67.9 Å²	67.9	59%	0.593	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	136.6	175	-169.3	179.8	9.9	0	0	110.9	R282 P292 M296	R282-Q294 PolarHBondContact N-O 3.02Å; R282-Q294 PolarHBondContact O-N 3.47Å; P292-Q294 PolarHBondContact O-N 3.41Å; Q294-M296 PolarHBondContact O-N 2.93Å
295	I	86.3	Confident	76.4	Confident	47 Å²	47	65.9 Å²	65.9	24%	0.241	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	123.9	170.9	-65.1	161.7	0	0	0	109.6	L279 L281	L279-I295 HydrophobicContact CD1-CG2 3.84Å; L279-I295 HydrophobicContact CD2-CD1 3.82Å; L279-I295 HydrophobicContact CD2-CG1 3.83Å; L279-I295 HydrophobicContact CD2-CG2 4.08Å; L279-I295 HydrophobicContact CG-CG1 4.37Å; L279-I295 HydrophobicContact CG-CG2 3.9Å; L281-I295 HydrophobicContact CD2-CG1 3.98Å
296	M	89.3	Confident	76.9	Confident	14 Å²	14	62.1 Å²	62.1	7%	0.069	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-20.5	173.3	-62.5	174.5	58.5	0	0	112.7	F76 Q79 N153 Q154 R280 R282 Q294	F76-M296 HydrophobicContact CB-CE 4.41Å; F76-M296 HydrophobicContact CD2-CB 3.94Å; F76-M296 HydrophobicContact CD2-CE 3.75Å; F76-M296 HydrophobicContact CE2-CB 3.71Å; F76-M296 HydrophobicContact CE2-CE 4.27Å; F76-M296 HydrophobicContact CG-CE 4.1Å; F76-M296 WeakPolarHBondContact O-CE 3.28Å; Q79-M296 HydrophobicContact CB-CE 3.63Å; Q79-M296 HydrophobicContact CB-SD 4.37Å; N153-M296 CarbonylContact C-O 3.58Å; N153-M296 VanDerWaalsContact CA-O 3.3Å; N153-M296 WeakPolarHBondContact CA-O 3.47Å; Q154-M296 PolarHBondContact N-O 3.18Å; Q154-M296 PolarHBondContact OE1-O 2.64Å; R280-M296 WeakPolarHBondContact O-CB 3.32Å; R280-M296 PolarHBondContact O-N 2.84Å; R282-M296 HydrophobicContact CB-CG 3.66Å; R282-M296 HydrophobicContact CB-SD 3.8Å; R282-M296 HydrophobicContact CG-SD 4.49Å; Q294-M296 PolarHBondContact O-N 2.93Å
297	G	93.1	Very high	77.4	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	130.2	-168	-172.2	0	0	0	0	0	112.7	L152 R280	L152-G297 CarbonylContact O-C 3.54Å; L152-G297 VanDerWaalsContact O-CA 3.29Å; L152-G297 WeakPolarHBondContact O-CA 3.38Å; R280-G297 PolarHBondContact N-O 2.61Å
298	L	96.3	Very high	77.6	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	135.1	-165.4	-172.8	73.7	0	0	0	111	A151 L152 M193 L197 R248 L279 V300	A151-L298 CarbonylContact C-O 3.49Å; A151-L298 WeakPolarHBondContact CA-O 3.49Å; L152-L298 HydrophobicContact CB-CB 4.38Å; L152-L298 PolarHBondContact N-O 3.25Å; L152-L298 PolarHBondContact O-N 3.45Å; M193-L298 HydrophobicContact CE-CD2 4.31Å; L197-L298 HydrophobicContact CD2-CB 3.73Å; L197-L298 HydrophobicContact CD2-CD2 4.24Å; R248-L298 HydrophobicContact CB-CD1 4.06Å; R248-L298 HydrophobicContact CG-CD1 3.69Å; L279-L298 HydrophobicContact CB-CD1 4.3Å; L279-L298 HydrophobicContact CD1-CB 4.21Å; L279-L298 HydrophobicContact CD1-CD1 3.96Å; L298-V300 HydrophobicContact CD2-CG2 3.51Å; L298-V300 HydrophobicContact CG-CG2 3.59Å
299	V	97.1	Very high	77.6	Confident	38 Å²	38	53.2 Å²	53.2	23%	0.23	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126	174.9	-173.7	0	0	0	0	109	F76 W84 G277 R278 R280	F76-V299 HydrophobicContact CE1-CG2 3.74Å; F76-V299 HydrophobicContact CZ-CG2 3.63Å; W84-V299 HydrophobicContact CH2-CG1 3.88Å; W84-V299 HydrophobicContact CH2-CG2 3.88Å; W84-V299 HydrophobicContact CZ2-CG1 4.15Å; W84-V299 HydrophobicContact CZ2-CG2 3.98Å; G277-V299 CarbonylContact C-O 3.55Å; G277-V299 WeakPolarHBondContact CA-O 3.29Å; R278-V299 PolarHBondContact N-O 3.35Å; R278-V299 PolarHBondContact O-N 3.06Å; R280-V299 HydrophobicContact CB-CG2 4.41Å
300	V	97.5	Very high	77.4	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	140	-162.6	174.1	0	0	0	0	112.3	V149 F150 I275 T276 L298 A302	V149-V300 WeakPolarHBondContact CA-O 3.49Å; V149-V300 WeakPolarHBondContact CG1-O 3.13Å; F150-V300 HydrophobicContact CD1-CB 4.25Å; F150-V300 HydrophobicContact CD1-CG1 4.14Å; F150-V300 HydrophobicContact CD2-CB 3.92Å; F150-V300 HydrophobicContact CD2-CG2 4.14Å; F150-V300 HydrophobicContact CE1-CB 4.06Å; F150-V300 HydrophobicContact CE1-CG1 3.63Å; F150-V300 HydrophobicContact CE2-CB 3.69Å; F150-V300 HydrophobicContact CE2-CG1 4.07Å; F150-V300 HydrophobicContact CE2-CG2 3.57Å; F150-V300 HydrophobicContact CG-CB 4.21Å; F150-V300 HydrophobicContact CZ-CB 3.78Å; F150-V300 HydrophobicContact CZ-CG1 3.59Å; F150-V300 HydrophobicContact CZ-CG2 3.87Å; F150-V300 PolarHBondContact N-O 2.93Å; F150-V300 PolarHBondContact O-N 2.84Å; I275-V300 HydrophobicContact CB-CG1 4.22Å; I275-V300 HydrophobicContact CG1-CG1 4.08Å; I275-V300 HydrophobicContact CG2-CB 4.47Å; I275-V300 HydrophobicContact CG2-CG1 3.72Å; I275-V300 HydrophobicContact CG2-CG2 3.88Å; T276-V300 CarbonylContact O-C 3.46Å; T276-V300 WeakPolarHBondContact O-CA 3.31Å; L298-V300 HydrophobicContact CD2-CG2 3.51Å; L298-V300 HydrophobicContact CG-CG2 3.59Å; V300-A302 HydrophobicContact CG1-CB 3.89Å
301	V	97.7	Very high	77.3	Confident	42 Å²	42	47.9 Å²	47.9	26%	0.255	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	124.5	151	-170.8	0	0	0	0	107.7	L145 V149 T276	L145-V301 HydrophobicContact CD2-CG1 4.26Å; V149-V301 HydrophobicContact CG2-CG2 4.4Å; T276-V301 PolarHBondContact N-O 3.2Å; T276-V301 PolarHBondContact O-N 2.65Å; T276-V301 VanDerWaalsContact O-O 3.05Å; T276-V301 PolarHBondContact OG1-O 2.79Å
302	A	97.6	Very high	77.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121.7	-173.5	0	0	0	0	0	110.3	G147 F148 F150 I273 H274 I275 V300	G147-A302 CarbonylContact C-O 3.59Å; G147-A302 VanDerWaalsContact CA-O 3.27Å; G147-A302 WeakPolarHBondContact CA-O 3.48Å; F148-A302 HydrophobicContact CD1-CB 4.44Å; F148-A302 HydrophobicContact CD2-CB 4.03Å; F148-A302 HydrophobicContact CE1-CB 4.14Å; F148-A302 HydrophobicContact CE2-CB 3.71Å; F148-A302 HydrophobicContact CG-CB 4.39Å; F148-A302 HydrophobicContact CZ-CB 3.77Å; F148-A302 PolarHBondContact N-O 2.9Å; F148-A302 PolarHBondContact O-N 2.92Å; F150-A302 HydrophobicContact CD1-CB 4.14Å; F150-A302 HydrophobicContact CE1-CB 3.66Å; I273-A302 HydrophobicContact CG2-CB 3.63Å; H274-A302 WeakPolarHBondContact O-CA 3.34Å; I275-A302 HydrophobicContact CG1-CB 4.49Å; V300-A302 HydrophobicContact CG1-CB 3.89Å
303	H	92.7	Very high	77.4	Confident	57 Å²	57	48.7 Å²	48.7	26%	0.264	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.4	-178.3	-59.8	-74.8	0	0	0	109.4	D146 I273 H274	D146-H303 PolarHBondContact O-ND1 3.13Å; I273-H303 WeakPolarHBondContact CA-O 3.49Å; H274-H303 HydrophobicContact CB-CB 4.46Å; H274-H303 PolarHBondContact N-O 3.08Å; H274-H303 PolarHBondContact O-N 3.14Å
304	A	88.1	Confident	77	Confident	15 Å²	15	56.4 Å²	56.4	12%	0.124	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	120.9	171.6	0	0	0	0	0	108.9	Y168 I273	Y168-A304 HydrophobicContact CD1-CB 3.86Å; Y168-A304 HydrophobicContact CG-CB 4.24Å; I273-A304 HydrophobicContact CD1-CB 3.47Å; I273-A304 VanDerWaalsContact CD1-CB 3.47Å
305	L	82	Confident	76.4	Confident	15 Å²	15	52.6 Å²	52.6	8%	0.079	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-66.4	139.7	-176.4	-60.1	-176.9	0	0	0	110.3	F251 V272 H274 Q377 V379	F251-L305 HydrophobicContact CD1-CD1 4.12Å; F251-L305 HydrophobicContact CE1-CD1 4.07Å; V272-L305 HydrophobicContact CB-CD1 4.39Å; V272-L305 HydrophobicContact CG1-CD1 3.94Å; V272-L305 PolarHBondContact O-N 3.3Å; H274-L305 HydrophobicContact CB-CD2 4.16Å; L305-Q377 HydrophobicContact CB-CB 4.34Å; L305-Q377 HydrophobicContact CD1-CB 3.62Å; L305-V379 HydrophobicContact CD1-CG2 4.3Å; L305-V379 HydrophobicContact CD2-CG2 3.52Å
306	P	68.8	Low	75.4	Confident	70 Å²	70	55.7 Å²	55.7	46%	0.455	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-64.1	158.2	-172.1	24.2	-33.7	0	0	0	112.2	Q377	P306-Q377 PolarHBondContact O-NE2 2.98Å
307	P	61.7	Low	74	Confident	61 Å²	61	59.4 Å²	59.4	40%	0.396	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-60.2	152.5	-178.6	-24	35.1	0	0	0	113.2	T309	P307-T309 PolarHBondContact O-N 3.41Å
308	P	55	Low	73.7	Confident	52 Å²	52	64.2 Å²	64.2	34%	0.338	34%	0.34	S	S	.	.	S	Bend	trans	-62.4	20.3	-179.7	-24.5	31.4	0	0	0	118.3	T400 I414	P308-T400 HydrophobicContact CB-CG2 3.56Å; P308-T400 HydrophobicContact CG-CG2 3.56Å; P308-I414 WeakPolarHBondContact O-CD1 3.41Å
309	T	57.5	Low	73.3	Confident	37 Å²	37	65.1 Å²	65.1	23%	0.227	35%	0.345	C	S	.	.			trans	-108.2	103.2	-165.6	-5.4	0	0	0	0	110.6	K260 P307 N311 E312	K260-T309 PolarHBondContact NZ-OG1 2.89Å; P307-T309 PolarHBondContact O-N 3.41Å; T309-N311 PolarHBondContact O-N 3.26Å; T309-N311 VanDerWaalsContact O-N 3.08Å; T309-E312 WeakPolarHBondContact CB-OE1 3.33Å; T309-E312 WeakPolarHBondContact O-CB 3.41Å; T309-E312 PolarHBondContact O-N 2.69Å; T309-E312 PolarHBondContact OG1-OE1 3.46Å
310	I	54.9	Low	73.1	Confident	74 Å²	74	63.3 Å²	63.3	38%	0.379	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-51.7	-33.8	179	-169.3	170.1	0	0	0	113	E312 V313 V321 I414	I310-E312 PolarHBondContact O-N 3.35Å; I310-V313 PolarHBondContact O-N 3.29Å; I310-V313 VanDerWaalsContact O-N 3.13Å; I310-V321 HydrophobicContact CD1-CG1 4.19Å; I310-I414 HydrophobicContact CB-CD1 4.42Å
311	N	52.4	Low	72.9	Confident	152 Å²	152	63.4 Å²	63.4	81%	0.813	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-66	-14.7	177	-60.7	4.7	0	0	0	114.6	T309	T309-N311 PolarHBondContact O-N 3.26Å; T309-N311 VanDerWaalsContact O-N 3.08Å
312	E	53.6	Low	72.7	Confident	117 Å²	117	61.4 Å²	61.4	55%	0.547	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-96	-13.5	176.2	-68.8	169.4	-118.8	0	0	112.1	T309 I310 R314	T309-E312 WeakPolarHBondContact CB-OE1 3.33Å; T309-E312 WeakPolarHBondContact O-CB 3.41Å; T309-E312 PolarHBondContact O-N 2.69Å; T309-E312 PolarHBondContact OG1-OE1 3.46Å; I310-E312 PolarHBondContact O-N 3.35Å; E312-R314 PolarHBondContact O-N 2.77Å
313	V	57.8	Low	72.6	Confident	45 Å²	45	64.9 Å²	64.9	27%	0.273	34%	0.336	S	S	.	.			trans	-76.6	111.7	177.7	-174.8	0	0	0	0	109.5	I310 I315 M319	I310-V313 PolarHBondContact O-N 3.29Å; I310-V313 VanDerWaalsContact O-N 3.13Å; V313-I315 HydrophobicContact CG1-CG1 4.17Å; V313-I315 PolarHBondContact O-N 2.88Å; V313-M319 HydrophobicContact CG1-CE 4.41Å
314	R	59.3	Low	72.7	Confident	220 Å²	220	62.2 Å²	62.2	83%	0.83	32%	0.323	S	S	*	.			trans	-77.3	104.5	169.1	-64.6	-178.2	-178.1	177.6	1.3	108.5	E312 D316	E312-R314 PolarHBondContact O-N 2.77Å; R314-D316 PolarHBondContact O-N 2.87Å; R314-D316 VanDerWaalsContact O-N 3.13Å
315	I	66.5	Low	73.1	Confident	47 Å²	47	64.8 Å²	64.8	24%	0.241	34%	0.335	C	S	.	.			trans	-85.1	85	-175.2	-41	179.5	0	0	0	110.4	V313 M319 V321 E334 R336	V313-I315 HydrophobicContact CG1-CG1 4.17Å; V313-I315 PolarHBondContact O-N 2.88Å; I315-M319 HydrophobicContact CG2-CB 4.04Å; I315-V321 HydrophobicContact CD1-CG2 4.02Å; I315-E334 WeakPolarHBondContact CD1-OE1 3.37Å; I315-R336 PolarHBondContact O-NH1 3.48Å
316	D	63.6	Low	73.7	Confident	111 Å²	111	67.2 Å²	67.2	59%	0.594	35%	0.346	S	S	*	.			trans	-64.1	177.5	173.3	-73.1	-35.3	0	0	0	112.4	R314 R336	R314-D316 PolarHBondContact O-N 2.87Å; R314-D316 VanDerWaalsContact O-N 3.13Å; D316-R336 PolarHBondContact O-NH1 2.69Å
317	C	61.1	Low	75.1	Confident	93 Å²	93	66.7 Å²	66.7	63%	0.628	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	152.5	170	53.2	0	0	0	0	111.3	M319	C317-M319 VanDerWaalsContact C-N 3.32Å
318	H	85.7	Confident	76.8	Confident	100 Å²	100	63.8 Å²	63.8	46%	0.463	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	28.7	-172.1	-48.5	-82.2	0	0	0	114	Y340 L419	H318-Y340 PolarHBondContact N-OH 3.49Å; H318-L419 HydrophobicContact CB-CB 3.92Å; H318-L419 WeakPolarHBondContact O-CB 3.35Å; H318-L419 PolarHBondContact O-N 3.17Å
319	M	89.7	Confident	78.8	Confident	20 Å²	20	63.4 Å²	63.4	10%	0.099	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	146.5	170.4	-67.6	177.8	61.6	0	0	111.5	V313 I315 C317 R336 V416 N417 Y418	V313-M319 HydrophobicContact CG1-CE 4.41Å; I315-M319 HydrophobicContact CG2-CB 4.04Å; C317-M319 VanDerWaalsContact C-N 3.32Å; M319-R336 WeakPolarHBondContact O-CD 3.2Å; M319-V416 HydrophobicContact CE-CG1 3.5Å; M319-V416 VanDerWaalsContact CE-CG1 3.5Å; M319-N417 VanDerWaalsContact CA-O 3.26Å; M319-N417 WeakPolarHBondContact CA-O 3.47Å; M319-Y418 HydrophobicContact CE-CD1 3.83Å; M319-Y418 HydrophobicContact CE-CE1 3.32Å; M319-Y418 HydrophobicContact CG-CD1 3.82Å; M319-Y418 HydrophobicContact CG-CE1 4.28Å; M319-Y418 HydrophobicContact CG-CG 4.46Å; M319-Y418 HydrophobicContact SD-CD1 3.71Å; M319-Y418 HydrophobicContact SD-CE1 3.59Å; M319-Y418 VanDerWaalsContact SD-CE1 3.59Å
320	F	92.1	Very high	80.7	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	149.2	169.5	72.8	-83.5	0	0	0	111.6	T322 E334 I337 Y340 M341 I395 N417 L419	F320-T322 HydrophobicContact CD2-CG2 4.43Å; F320-T322 HydrophobicContact CE2-CG2 4.04Å; F320-E334 WeakPolarHBondContact CA-OE2 3.26Å; F320-I337 HydrophobicContact CD2-CB 4.17Å; F320-I337 HydrophobicContact CD2-CD1 4.48Å; F320-I337 HydrophobicContact CD2-CG1 4.37Å; F320-I337 HydrophobicContact CE2-CB 4.34Å; F320-I337 HydrophobicContact CE2-CD1 3.84Å; F320-I337 HydrophobicContact CE2-CG1 4.06Å; F320-I337 HydrophobicContact CG-CB 4.48Å; F320-I337 HydrophobicContact CZ-CD1 4.12Å; F320-I337 HydrophobicContact CZ-CG1 4.18Å; F320-Y340 HydrophobicContact CD1-CD2 4.23Å; F320-M341 HydrophobicContact CE1-CE 3.85Å; F320-M341 HydrophobicContact CZ-CE 3.57Å; F320-I395 HydrophobicContact CE1-CD1 4.36Å; F320-I395 HydrophobicContact CZ-CD1 4.45Å; F320-N417 HydrophobicContact CD1-CB 3.9Å; F320-N417 HydrophobicContact CD2-CB 4.47Å; F320-N417 HydrophobicContact CE1-CB 3.51Å; F320-N417 HydrophobicContact CE2-CB 4.14Å; F320-N417 VanDerWaalsContact CE2-ND2 3.29Å; F320-N417 WeakPolarHBondContact CE2-ND2 3.17Å; F320-N417 HydrophobicContact CG-CB 4.35Å; F320-N417 HydrophobicContact CZ-CB 3.64Å; F320-N417 PolarHBondContact N-O 2.78Å; F320-N417 VanDerWaalsContact N-O 3.15Å; F320-N417 WeakPolarHBondContact O-CB 3.32Å; F320-N417 PolarHBondContact O-N 2.96Å; F320-N417 PolarHBondContact O-ND2 3.46Å; F320-N417 VanDerWaalsContact O-ND2 3.09Å; F320-L419 HydrophobicContact CD1-CD1 4.24Å; F320-L419 HydrophobicContact CE1-CD1 3.96Å
321	V	92.6	Very high	82.7	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.018	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	134.7	-177.7	-173.8	0	0	0	0	111.7	I310 I315 E334 I414 V416	I310-V321 HydrophobicContact CD1-CG1 4.19Å; I315-V321 HydrophobicContact CD1-CG2 4.02Å; V321-E334 HydrophobicContact CB-CG 4.17Å; V321-E334 PolarHBondContact N-OE2 2.89Å; V321-E334 PolarHBondContact O-N 3.01Å; V321-E334 VanDerWaalsContact O-N 3.08Å; V321-I414 HydrophobicContact CG1-CG2 3.94Å; V321-V416 HydrophobicContact CG2-CG2 4.4Å
322	T	94.8	Very high	84.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	145.9	163.5	40.2	0	0	0	0	110.7	F320 I330 Y332 C333 W415 N417	F320-T322 HydrophobicContact CD2-CG2 4.43Å; F320-T322 HydrophobicContact CE2-CG2 4.04Å; T322-I330 HydrophobicContact CG2-CG2 4.37Å; T322-Y332 CarbonylContact C-O 3.09Å; T322-Y332 WeakPolarHBondContact CA-O 3.17Å; T322-C333 HydrophobicContact CG2-CB 3.77Å; T322-C333 VanDerWaalsContact CG2-SG 3.58Å; T322-W415 PolarHBondContact N-O 2.87Å; T322-W415 PolarHBondContact O-N 3.28Å; T322-W415 PolarHBondContact OG1-O 3.35Å; T322-N417 PolarHBondContact OG1-ND2 2.99Å
323	R	94.1	Very high	86.8	Confident	74 Å²	74	54 Å²	54	28%	0.279	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.9	168.5	-172.3	-165.6	-175.7	-139	-0.7	107.5	I331 Y332 E410 N412 I413	R323-I331 HydrophobicContact CG-CD1 4.39Å; R323-I331 WeakPolarHBondContact O-CB 3.39Å; R323-I331 PolarHBondContact O-N 3.42Å; R323-Y332 HydrophobicContact CB-CD1 4.31Å; R323-Y332 PolarHBondContact N-O 2.56Å; R323-Y332 PolarHBondContact O-N 2.86Å; R323-Y332 VanDerWaalsContact O-N 3.14Å; R323-E410 IonicContact CZ-OE1 3.9Å; R323-E410 IonicContact NH1-OE1 3.93Å; R323-E410 IonicContact NH2-OE1 2.79Å; R323-E410 PolarHBondContact NH2-OE1 3.28Å; R323-N412 HydrophobicContact CG-CB 4.33Å; R323-N412 PolarHBondContact NE-OD1 3.01Å; R323-N412 PolarHBondContact NH2-ND2 2.87Å; R323-N412 PolarHBondContact NH2-OD1 3.13Å; R323-I413 WeakPolarHBondContact CA-O 3.37Å
324	V	95.9	Very high	88.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	155.5	-173.8	-47.5	0	0	0	0	111.4	L328 N329 I330 I413	V324-L328 HydrophobicContact CG2-CD2 3.73Å; V324-N329 CarbonylContact C-O 3.53Å; V324-N329 WeakPolarHBondContact CA-O 3.35Å; V324-N329 WeakPolarHBondContact CB-O 3.2Å; V324-I330 HydrophobicContact CG1-CB 4.45Å; V324-I330 HydrophobicContact CG1-CG1 4Å; V324-I413 HydrophobicContact CG2-CB 3.62Å; V324-I413 HydrophobicContact CG2-CD1 4.46Å; V324-I413 HydrophobicContact CG2-CG2 3.72Å; V324-I413 PolarHBondContact N-O 2.7Å; V324-I413 PolarHBondContact O-N 3.36Å
325	N	96	Very high	90.1	Very high	69 Å²	69	48.9 Å²	48.9	37%	0.369	25%	0.247	S	C	.	.			trans	-72.4	172	171.9	-87.8	-25.9	0	0	0	111.1	D327 L328 N329 I331	N325-D327 WeakPolarHBondContact CB-OD1 3.21Å; N325-D327 PolarHBondContact O-N 3.01Å; N325-L328 WeakPolarHBondContact O-CA 3.19Å; N325-L328 PolarHBondContact O-N 2.92Å; N325-N329 HydrophobicContact CB-CB 4.18Å; N325-N329 PolarHBondContact N-O 2.79Å; N325-I331 HydrophobicContact CB-CD1 4.47Å; N325-I331 VanDerWaalsContact OD1-CD1 3.23Å; N325-I331 WeakPolarHBondContact OD1-CD1 3.47Å
326	M	95.2	Very high	91.3	Very high	66 Å²	66	50.3 Å²	50.3	33%	0.325	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-5	177.7	-60.2	-57.3	-60.8	0	0	114.7	H369 L373 I401 K411 I413	M326-H369 PolarHBondContact O-NE2 3.41Å; M326-L373 HydrophobicContact CE-CD2 3.41Å; M326-L373 VanDerWaalsContact CE-CD2 3.41Å; M326-I401 HydrophobicContact CE-CD1 3.8Å; M326-I401 HydrophobicContact CE-CG1 4.33Å; M326-I401 HydrophobicContact SD-CG2 4.43Å; M326-K411 HydrophobicContact CG-CB 4.37Å; M326-K411 HydrophobicContact SD-CB 3.84Å; M326-I413 HydrophobicContact SD-CD1 4.22Å; M326-I413 HydrophobicContact SD-CG1 4.17Å
327	D	96.5	Very high	92.8	Very high	60 Å²	60	45 Å²	45	32%	0.321	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	8.2	173.8	72.2	-32.2	0	0	0	112.9	N325 N329 R352	N325-D327 WeakPolarHBondContact CB-OD1 3.21Å; N325-D327 PolarHBondContact O-N 3.01Å; D327-N329 VanDerWaalsContact C-N 3.32Å; D327-N329 WeakPolarHBondContact OD1-CB 3.41Å; D327-N329 PolarHBondContact OD1-N 2.73Å; D327-R352 WeakPolarHBondContact OD2-CD 3.21Å
328	L	97.4	Very high	94.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.21	C	C	.	.			trans	62.2	24.7	-168.5	-49.8	-179.9	0	0	0	115.3	V324 N325 R352 C353 Y354 I365 H369 I413 W415	V324-L328 HydrophobicContact CG2-CD2 3.73Å; N325-L328 WeakPolarHBondContact O-CA 3.19Å; N325-L328 PolarHBondContact O-N 2.92Å; L328-R352 CarbonylContact O-C 3.58Å; L328-R352 WeakPolarHBondContact O-CA 3.42Å; L328-C353 HydrophobicContact CB-CB 4.05Å; L328-C353 PolarHBondContact O-N 3.49Å; L328-C353 PolarHBondContact O-SG 3.08Å; L328-Y354 HydrophobicContact CD1-CE2 4.26Å; L328-I365 HydrophobicContact CD1-CG2 4.42Å; L328-H369 HydrophobicContact CD1-CB 4.22Å; L328-I413 HydrophobicContact CD2-CD1 4.1Å; L328-W415 HydrophobicContact CD1-CH2 4.46Å; L328-W415 HydrophobicContact CD1-CZ3 4.39Å; L328-W415 HydrophobicContact CD2-CE3 4Å; L328-W415 HydrophobicContact CD2-CZ3 3.81Å
329	N	97.9	Very high	94.7	Very high	43 Å²	43	44.3 Å²	44.3	23%	0.23	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-70.2	125.5	166.4	-167.2	-8.8	0	0	0	111.2	V324 N325 D327 I331 G350 K351 R352	V324-N329 CarbonylContact C-O 3.53Å; V324-N329 WeakPolarHBondContact CA-O 3.35Å; V324-N329 WeakPolarHBondContact CB-O 3.2Å; N325-N329 HydrophobicContact CB-CB 4.18Å; N325-N329 PolarHBondContact N-O 2.79Å; D327-N329 VanDerWaalsContact C-N 3.32Å; D327-N329 WeakPolarHBondContact OD1-CB 3.41Å; D327-N329 PolarHBondContact OD1-N 2.73Å; N329-I331 PolarHBondContact O-N 3.3Å; N329-G350 WeakPolarHBondContact OD1-CA 3.45Å; N329-G350 PolarHBondContact OD1-O 3.12Å; N329-G350 VanDerWaalsContact OD1-O 3.12Å; N329-K351 PolarHBondContact OD1-N 2.88Å; N329-K351 PolarHBondContact OD1-O 2.98Å; N329-R352 HydrophobicContact CB-CG 3.87Å
330	I	97.9	Very high	94.8	Very high	1 Å²	1	45 Å²	45	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	110.5	-173.9	-58.3	171.1	0	0	0	110.1	T322 V324 I348 V349 G350 K351 F356 W385	T322-I330 HydrophobicContact CG2-CG2 4.37Å; V324-I330 HydrophobicContact CG1-CB 4.45Å; V324-I330 HydrophobicContact CG1-CG1 4Å; I330-I348 HydrophobicContact CD1-CB 4.25Å; I330-I348 HydrophobicContact CD1-CD1 4.25Å; I330-I348 HydrophobicContact CD1-CG1 4.5Å; I330-V349 HydrophobicContact CG2-CG2 4.09Å; I330-V349 WeakPolarHBondContact O-CA 3.28Å; I330-G350 PolarHBondContact O-N 3.11Å; I330-K351 WeakPolarHBondContact CB-O 3.22Å; I330-K351 WeakPolarHBondContact CG1-O 3.28Å; I330-K351 PolarHBondContact N-O 2.89Å; I330-F356 HydrophobicContact CD1-CD2 4.28Å; I330-F356 HydrophobicContact CD1-CE2 4.09Å; I330-W385 HydrophobicContact CD1-CH2 4.26Å; I330-W385 HydrophobicContact CD1-CZ2 4.38Å
331	I	96.2	Very high	95	Very high	63 Å²	63	45.5 Å²	45.5	32%	0.323	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-33.5	179.1	-41.9	165.1	0	0	0	110.9	R323 N325 N329	R323-I331 HydrophobicContact CG-CD1 4.39Å; R323-I331 WeakPolarHBondContact O-CB 3.39Å; R323-I331 PolarHBondContact O-N 3.42Å; N325-I331 HydrophobicContact CB-CD1 4.47Å; N325-I331 VanDerWaalsContact OD1-CD1 3.23Å; N325-I331 WeakPolarHBondContact OD1-CD1 3.47Å; N329-I331 PolarHBondContact O-N 3.3Å
332	Y	95.9	Very high	95	Very high	116 Å²	116	48.9 Å²	48.9	46%	0.455	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	146.4	-176.5	165.3	-91	0	0	0	110.8	T322 R323 E334	T322-Y332 CarbonylContact C-O 3.09Å; T322-Y332 WeakPolarHBondContact CA-O 3.17Å; R323-Y332 HydrophobicContact CB-CD1 4.31Å; R323-Y332 PolarHBondContact N-O 2.56Å; R323-Y332 PolarHBondContact O-N 2.86Å; R323-Y332 VanDerWaalsContact O-N 3.14Å; Y332-E334 HydrophobicContact CE1-CG 4.07Å
333	C	96.1	Very high	94.9	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.014	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144.8	168.6	-174.4	0	0	0	0	109.6	T322 P345 I348	T322-C333 HydrophobicContact CG2-CB 3.77Å; T322-C333 VanDerWaalsContact CG2-SG 3.58Å; C333-P345 HydrophobicContact CB-CB 4.09Å; C333-P345 HydrophobicContact CB-CG 4.35Å; C333-I348 HydrophobicContact CB-CD1 3.85Å; C333-I348 HydrophobicContact CB-CG1 4.41Å
334	E	93.1	Very high	95.1	Very high	31 Å²	31	48.5 Å²	48.5	15%	0.145	25%	0.247	C	C	.	.			trans	-65.4	141.9	167.8	-68.2	-177.7	139.4	0	0	111.8	I315 F320 V321 Y332 R336 I337	I315-E334 WeakPolarHBondContact CD1-OE1 3.37Å; F320-E334 WeakPolarHBondContact CA-OE2 3.26Å; V321-E334 HydrophobicContact CB-CG 4.17Å; V321-E334 PolarHBondContact N-OE2 2.89Å; V321-E334 PolarHBondContact O-N 3.01Å; V321-E334 VanDerWaalsContact O-N 3.08Å; Y332-E334 HydrophobicContact CE1-CG 4.07Å; E334-R336 PolarHBondContact O-N 3.43Å; E334-I337 WeakPolarHBondContact O-CG2 3.39Å; E334-I337 PolarHBondContact O-N 3.03Å
335	N	94.1	Very high	95.1	Very high	127 Å²	127	49.4 Å²	49.4	68%	0.679	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-59	-18.3	177.5	-64.6	2.1	0	0	0	114	I337 S338	N335-I337 PolarHBondContact O-N 2.86Å; N335-I337 VanDerWaalsContact O-N 3.17Å; N335-S338 PolarHBondContact O-N 3.26Å; N335-S338 PolarHBondContact O-OG 2.88Å
336	R	91.3	Very high	95.1	Very high	78 Å²	78	52.2 Å²	52.2	29%	0.294	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-64.4	-14.6	179.7	-154.2	-172	-66.5	-174.7	0	113.3	I315 D316 M319 E334 S338 D339 Y340	I315-R336 PolarHBondContact O-NH1 3.48Å; D316-R336 PolarHBondContact O-NH1 2.69Å; M319-R336 WeakPolarHBondContact O-CD 3.2Å; E334-R336 PolarHBondContact O-N 3.43Å; R336-S338 PolarHBondContact O-N 3.38Å; R336-D339 HydrophobicContact CG-CB 4.4Å; R336-D339 WeakPolarHBondContact CG-OD2 3.28Å; R336-D339 WeakPolarHBondContact O-CB 3.48Å; R336-D339 PolarHBondContact O-N 3.27Å; R336-Y340 WeakPolarHBondContact CD-OH 3.2Å; R336-Y340 HydrophobicContact CG-CE2 3.92Å; R336-Y340 WeakPolarHBondContact O-CD2 3.33Å
337	I	94.4	Very high	95.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-55.1	-35.3	172.1	-168	173.6	0	0	0	112.1	F320 E334 N335 D339 Y340 M341 P345 I348	F320-I337 HydrophobicContact CD2-CB 4.17Å; F320-I337 HydrophobicContact CD2-CD1 4.48Å; F320-I337 HydrophobicContact CD2-CG1 4.37Å; F320-I337 HydrophobicContact CE2-CB 4.34Å; F320-I337 HydrophobicContact CE2-CD1 3.84Å; F320-I337 HydrophobicContact CE2-CG1 4.06Å; F320-I337 HydrophobicContact CG-CB 4.48Å; F320-I337 HydrophobicContact CZ-CD1 4.12Å; F320-I337 HydrophobicContact CZ-CG1 4.18Å; E334-I337 WeakPolarHBondContact O-CG2 3.39Å; E334-I337 PolarHBondContact O-N 3.03Å; N335-I337 PolarHBondContact O-N 2.86Å; N335-I337 VanDerWaalsContact O-N 3.17Å; I337-D339 PolarHBondContact O-N 2.76Å; I337-Y340 CarbonylContact O-C 3.58Å; I337-Y340 PolarHBondContact O-N 3.49Å; I337-M341 HydrophobicContact CD1-CE 4.09Å; I337-M341 HydrophobicContact CD1-SD 3.73Å; I337-M341 HydrophobicContact CG1-CB 4.15Å; I337-M341 HydrophobicContact CG1-CE 4.11Å; I337-M341 HydrophobicContact CG1-CG 3.97Å; I337-M341 HydrophobicContact CG1-SD 3.75Å; I337-M341 PolarHBondContact O-N 3.28Å; I337-P345 HydrophobicContact CG2-CG 3.86Å; I337-I348 HydrophobicContact CD1-CD1 3.47Å; I337-I348 VanDerWaalsContact CD1-CD1 3.47Å
338	S	94.7	Very high	95.1	Very high	57 Å²	57	47.9 Å²	47.9	40%	0.399	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-68.6	-12.9	177.5	-49.6	0	0	0	0	114.4	N335 R336	N335-S338 PolarHBondContact O-N 3.26Å; N335-S338 PolarHBondContact O-OG 2.88Å; R336-S338 PolarHBondContact O-N 3.38Å
339	D	93.3	Very high	95.1	Very high	120 Å²	120	50.9 Å²	50.9	64%	0.642	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-79.1	-13.3	171.7	-61.6	-14	0	0	0	111.5	R336 I337	R336-D339 HydrophobicContact CG-CB 4.4Å; R336-D339 WeakPolarHBondContact CG-OD2 3.28Å; R336-D339 WeakPolarHBondContact O-CB 3.48Å; R336-D339 PolarHBondContact O-N 3.27Å; I337-D339 PolarHBondContact O-N 2.76Å
340	Y	92.1	Very high	95.1	Very high	36 Å²	36	51.3 Å²	51.3	14%	0.141	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-19	-164.8	-58.4	-33.6	0	0	0	114.4	H318 F320 R336 I337 L419	H318-Y340 PolarHBondContact N-OH 3.49Å; F320-Y340 HydrophobicContact CD1-CD2 4.23Å; R336-Y340 WeakPolarHBondContact CD-OH 3.2Å; R336-Y340 HydrophobicContact CG-CE2 3.92Å; R336-Y340 WeakPolarHBondContact O-CD2 3.33Å; I337-Y340 CarbonylContact O-C 3.58Å; I337-Y340 PolarHBondContact O-N 3.49Å; Y340-L419 HydrophobicContact CD1-CD2 4.08Å; Y340-L419 HydrophobicContact CD2-CD1 4.18Å; Y340-L419 HydrophobicContact CD2-CD2 4.5Å; Y340-L419 HydrophobicContact CG-CD1 4.23Å; Y340-L419 HydrophobicContact CG-CD2 3.84Å
341	M	94.6	Very high	95.1	Very high	10 Å²	10	56 Å²	56	5%	0.049	30%	0.303	C	S	.	.	S	Bend	trans	-137.9	159	-175.8	-64.8	-164.3	-164.4	0	0	112.5	F320 I337 L343 W385 I393 I395	F320-M341 HydrophobicContact CE1-CE 3.85Å; F320-M341 HydrophobicContact CZ-CE 3.57Å; I337-M341 HydrophobicContact CD1-CE 4.09Å; I337-M341 HydrophobicContact CD1-SD 3.73Å; I337-M341 HydrophobicContact CG1-CB 4.15Å; I337-M341 HydrophobicContact CG1-CE 4.11Å; I337-M341 HydrophobicContact CG1-CG 3.97Å; I337-M341 HydrophobicContact CG1-SD 3.75Å; I337-M341 PolarHBondContact O-N 3.28Å; M341-L343 HydrophobicContact CB-CB 4.23Å; M341-L343 PolarHBondContact O-N 3.47Å; M341-L343 VanDerWaalsContact O-N 3.1Å; M341-L343 HydrophobicContact SD-CD1 4.23Å; M341-W385 HydrophobicContact CE-CB 4.38Å; M341-W385 HydrophobicContact CE-CD2 3.86Å; M341-W385 HydrophobicContact CE-CG 3.74Å; M341-W385 HydrophobicContact SD-CG 4.36Å; M341-I393 HydrophobicContact CE-CD1 3.8Å; M341-I393 HydrophobicContact CE-CG1 4.4Å; M341-I393 HydrophobicContact CG-CD1 3.9Å; M341-I395 HydrophobicContact CE-CD1 3.72Å
342	D	92.9	Very high	95.1	Very high	74 Å²	74	58.9 Å²	58.9	40%	0.396	31%	0.31	S	S	.	.	S	Bend	trans	-74.8	11.9	169	-63.4	0.5	0	0	0	112.8	K388 N389	D342-K388 HydrophobicContact CB-CB 3.76Å; D342-K388 VanDerWaalsContact O-CB 3.3Å; D342-K388 WeakPolarHBondContact O-CB 3.47Å; D342-K388 VanDerWaalsContact O-CD 3.29Å; D342-K388 WeakPolarHBondContact O-CD 3.29Å; D342-N389 PolarHBondContact OD2-ND2 3.22Å
343	L	94.3	Very high	95.2	Very high	9 Å²	9	53.4 Å²	53.4	5%	0.047	29%	0.289	C	S	.	.			trans	-121.7	132.6	-174.5	-68.8	168	0	0	0	110.2	M341 D347 I348 F356 K388	M341-L343 HydrophobicContact CB-CB 4.23Å; M341-L343 PolarHBondContact O-N 3.47Å; M341-L343 VanDerWaalsContact O-N 3.1Å; M341-L343 HydrophobicContact SD-CD1 4.23Å; L343-D347 HydrophobicContact CB-CB 4.49Å; L343-D347 HydrophobicContact CD2-CB 3.74Å; L343-I348 HydrophobicContact CB-CG2 4.12Å; L343-I348 HydrophobicContact CD1-CG2 4.1Å; L343-I348 HydrophobicContact CD2-CG2 4.35Å; L343-I348 HydrophobicContact CG-CG2 4.43Å; L343-F356 HydrophobicContact CD1-CD1 4.18Å; L343-F356 HydrophobicContact CD1-CE1 4.24Å; L343-K388 HydrophobicContact CD2-CB 3.78Å; L343-K388 HydrophobicContact CD2-CD 4.26Å; L343-K388 HydrophobicContact CD2-CG 4.16Å; L343-K388 HydrophobicContact CG-CB 4.15Å
344	T	96.4	Very high	95.3	Very high	56 Å²	56	56.5 Å²	56.5	34%	0.344	30%	0.301	S	S	.	.			trans	-94.2	168.2	171.1	76.9	0	0	0	0	110.7	V346 D347	T344-V346 PolarHBondContact O-N 2.94Å; T344-V346 VanDerWaalsContact O-N 3.13Å; T344-V346 PolarHBondContact OG1-N 3.42Å; T344-D347 WeakPolarHBondContact CA-OD2 3.31Å; T344-D347 VanDerWaalsContact CB-OD2 3.31Å; T344-D347 WeakPolarHBondContact CB-OD2 3.3Å; T344-D347 PolarHBondContact N-OD2 2.72Å; T344-D347 PolarHBondContact O-N 3.46Å; T344-D347 PolarHBondContact OG1-OD2 2.95Å
345	P	97.1	Very high	95.5	Very high	19 Å²	19	59.8 Å²	59.8	12%	0.123	32%	0.316	C	S	.	.	H	α-helix	trans	-54.5	-30.5	171.7	-28	37.4	0	0	0	113.9	C333 I337 I348 V349	C333-P345 HydrophobicContact CB-CB 4.09Å; C333-P345 HydrophobicContact CB-CG 4.35Å; I337-P345 HydrophobicContact CG2-CG 3.86Å; P345-I348 PolarHBondContact O-N 3.16Å; P345-V349 WeakPolarHBondContact O-CB 3.4Å; P345-V349 VanDerWaalsContact O-CG2 3.24Å; P345-V349 WeakPolarHBondContact O-CG2 3.31Å; P345-V349 PolarHBondContact O-N 3.07Å
346	V	96.2	Very high	95.7	Very high	129 Å²	129	54.6 Å²	54.6	78%	0.782	29%	0.287	S	S	*	.	H	α-helix	trans	-71.1	-31	179.9	-174.7	0	0	0	0	111.6	T344 I348	T344-V346 PolarHBondContact O-N 2.94Å; T344-V346 VanDerWaalsContact O-N 3.13Å; T344-V346 PolarHBondContact OG1-N 3.42Å; V346-I348 VanDerWaalsContact C-N 3.26Å; V346-I348 PolarHBondContact O-N 2.84Å
347	D	95.4	Very high	96	Very high	34 Å²	34	51.1 Å²	51.1	18%	0.182	27%	0.274	C	S	.	.	H	α-helix	trans	-71.4	-21	177.7	-60.7	-90.1	0	0	0	112.9	L343 T344 K351 K388	L343-D347 HydrophobicContact CB-CB 4.49Å; L343-D347 HydrophobicContact CD2-CB 3.74Å; T344-D347 WeakPolarHBondContact CA-OD2 3.31Å; T344-D347 VanDerWaalsContact CB-OD2 3.31Å; T344-D347 WeakPolarHBondContact CB-OD2 3.3Å; T344-D347 PolarHBondContact N-OD2 2.72Å; T344-D347 PolarHBondContact O-N 3.46Å; T344-D347 PolarHBondContact OG1-OD2 2.95Å; D347-K351 WeakPolarHBondContact O-CD 3.3Å; D347-K351 WeakPolarHBondContact O-CE 3.33Å; D347-K351 PolarHBondContact O-NZ 2.83Å; D347-K388 IonicContact OD1-NZ 3.15Å; D347-K388 PolarHBondContact OD1-NZ 3.32Å
348	I	96.5	Very high	96.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-120.1	-25.5	-167.8	70.3	165.7	0	0	0	115.8	I330 C333 I337 L343 P345 V346 K351 F356	I330-I348 HydrophobicContact CD1-CB 4.25Å; I330-I348 HydrophobicContact CD1-CD1 4.25Å; I330-I348 HydrophobicContact CD1-CG1 4.5Å; C333-I348 HydrophobicContact CB-CD1 3.85Å; C333-I348 HydrophobicContact CB-CG1 4.41Å; I337-I348 HydrophobicContact CD1-CD1 3.47Å; I337-I348 VanDerWaalsContact CD1-CD1 3.47Å; L343-I348 HydrophobicContact CB-CG2 4.12Å; L343-I348 HydrophobicContact CD1-CG2 4.1Å; L343-I348 HydrophobicContact CD2-CG2 4.35Å; L343-I348 HydrophobicContact CG-CG2 4.43Å; P345-I348 PolarHBondContact O-N 3.16Å; V346-I348 VanDerWaalsContact C-N 3.26Å; V346-I348 PolarHBondContact O-N 2.84Å; I348-K351 PolarHBondContact O-N 2.7Å; I348-F356 HydrophobicContact CB-CE2 3.89Å; I348-F356 HydrophobicContact CB-CZ 3.77Å; I348-F356 HydrophobicContact CG2-CE1 3.86Å; I348-F356 HydrophobicContact CG2-CE2 3.99Å; I348-F356 HydrophobicContact CG2-CZ 3.51Å
349	V	97.9	Very high	96.3	Very high	64 Å²	64	54 Å²	54	39%	0.388	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	140	176.9	166.6	0	0	0	0	110.2	I330 P345 K351	I330-V349 HydrophobicContact CG2-CG2 4.09Å; I330-V349 WeakPolarHBondContact O-CA 3.28Å; P345-V349 WeakPolarHBondContact O-CB 3.4Å; P345-V349 VanDerWaalsContact O-CG2 3.24Å; P345-V349 WeakPolarHBondContact O-CG2 3.31Å; P345-V349 PolarHBondContact O-N 3.07Å; V349-K351 VanDerWaalsContact C-N 3.28Å; V349-K351 PolarHBondContact O-N 3.09Å
350	G	96.9	Very high	96.5	Very high	51 Å²	51	55 Å²	55	53%	0.526	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-8.2	-173.6	0	0	0	0	0	114.8	N329 I330	N329-G350 WeakPolarHBondContact OD1-CA 3.45Å; N329-G350 PolarHBondContact OD1-O 3.12Å; N329-G350 VanDerWaalsContact OD1-O 3.12Å; I330-G350 PolarHBondContact O-N 3.11Å
351	K	97.4	Very high	96.8	Very high	99 Å²	99	54.4 Å²	54.4	43%	0.43	30%	0.296	S	S	.	.	S	Bend	trans	-100.8	147.2	174.1	-65.8	167.4	-178.1	169.3	0	110.8	N329 I330 D347 I348 V349 F356	N329-K351 PolarHBondContact OD1-N 2.88Å; N329-K351 PolarHBondContact OD1-O 2.98Å; I330-K351 WeakPolarHBondContact CB-O 3.22Å; I330-K351 WeakPolarHBondContact CG1-O 3.28Å; I330-K351 PolarHBondContact N-O 2.89Å; D347-K351 WeakPolarHBondContact O-CD 3.3Å; D347-K351 WeakPolarHBondContact O-CE 3.33Å; D347-K351 PolarHBondContact O-NZ 2.83Å; I348-K351 PolarHBondContact O-N 2.7Å; V349-K351 VanDerWaalsContact C-N 3.28Å; V349-K351 PolarHBondContact O-N 3.09Å; K351-F356 HydrophobicContact CB-CE2 3.9Å; K351-F356 HydrophobicContact CB-CZ 4.16Å; K351-F356 HydrophobicContact CD-CE2 4.31Å; K351-F356 HydrophobicContact CD-CZ 3.69Å
352	R	97.5	Very high	97	Very high	124 Å²	124	56 Å²	56	47%	0.468	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-73.9	140.8	171.2	-67	179.7	-74.4	-152	-0.9	111.5	D327 L328 N329 Y354 H355	D327-R352 WeakPolarHBondContact OD2-CD 3.21Å; L328-R352 CarbonylContact O-C 3.58Å; L328-R352 WeakPolarHBondContact O-CA 3.42Å; N329-R352 HydrophobicContact CB-CG 3.87Å; R352-Y354 PolarHBondContact O-N 2.89Å; R352-H355 PolarHBondContact N-ND1 3.47Å; R352-H355 PolarHBondContact O-N 3.38Å; R352-H355 PolarHBondContact O-ND1 3.05Å
353	C	97.8	Very high	97.2	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.014	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-51.8	-31.3	180	-67	0	0	0	0	113.6	L328 H355 F356 I357	L328-C353 HydrophobicContact CB-CB 4.05Å; L328-C353 PolarHBondContact O-N 3.49Å; L328-C353 PolarHBondContact O-SG 3.08Å; C353-H355 PolarHBondContact O-N 3.08Å; C353-H355 VanDerWaalsContact O-N 3.17Å; C353-F356 PolarHBondContact O-N 3.24Å; C353-I357 HydrophobicContact CB-CD1 4.23Å; C353-I357 WeakPolarHBondContact O-CG1 3.48Å; C353-I357 PolarHBondContact O-N 3.31Å
354	Y	98.1	Very high	97.4	Very high	67 Å²	67	58 Å²	58	26%	0.263	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-58.4	-23.8	178.7	-64.2	-63.8	0	0	0	114.9	L328 R352 F356 I357 V362 I365 H369	L328-Y354 HydrophobicContact CD1-CE2 4.26Å; R352-Y354 PolarHBondContact O-N 2.89Å; Y354-F356 PolarHBondContact O-N 2.9Å; Y354-I357 HydrophobicContact CD1-CD1 4.1Å; Y354-V362 HydrophobicContact CD1-CG1 4.13Å; Y354-V362 HydrophobicContact CE1-CG1 4.46Å; Y354-I365 HydrophobicContact CE1-CG2 4.27Å; Y354-H369 PolarHBondContact OH-ND1 2.92Å; Y354-H369 VanDerWaalsContact OH-ND1 3.16Å
355	H	96.8	Very high	97.5	Very high	100 Å²	100	55.4 Å²	55.4	46%	0.463	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-71.8	-13.8	173.9	-51.9	96.9	0	0	0	113.3	R352 C353 M386	R352-H355 PolarHBondContact N-ND1 3.47Å; R352-H355 PolarHBondContact O-N 3.38Å; R352-H355 PolarHBondContact O-ND1 3.05Å; C353-H355 PolarHBondContact O-N 3.08Å; C353-H355 VanDerWaalsContact O-N 3.17Å; H355-M386 WeakPolarHBondContact O-CE 3.26Å
356	F	97.5	Very high	97.5	Very high	18 Å²	18	60.3 Å²	60.3	8%	0.079	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-7.4	-178	-56.5	-68.9	0	0	0	113.3	I330 L343 I348 K351 C353 Y354 W385 M386	I330-F356 HydrophobicContact CD1-CD2 4.28Å; I330-F356 HydrophobicContact CD1-CE2 4.09Å; L343-F356 HydrophobicContact CD1-CD1 4.18Å; L343-F356 HydrophobicContact CD1-CE1 4.24Å; I348-F356 HydrophobicContact CB-CE2 3.89Å; I348-F356 HydrophobicContact CB-CZ 3.77Å; I348-F356 HydrophobicContact CG2-CE1 3.86Å; I348-F356 HydrophobicContact CG2-CE2 3.99Å; I348-F356 HydrophobicContact CG2-CZ 3.51Å; K351-F356 HydrophobicContact CB-CE2 3.9Å; K351-F356 HydrophobicContact CB-CZ 4.16Å; K351-F356 HydrophobicContact CD-CE2 4.31Å; K351-F356 HydrophobicContact CD-CZ 3.69Å; C353-F356 PolarHBondContact O-N 3.24Å; Y354-F356 PolarHBondContact O-N 2.9Å; F356-W385 HydrophobicContact CB-CD2 4.18Å; F356-W385 HydrophobicContact CB-CG 4.33Å; F356-W385 HydrophobicContact CB-CZ2 4.08Å; F356-W385 HydrophobicContact CD2-CZ2 4.04Å; F356-W385 HydrophobicContact CG-CZ2 4.15Å; F356-W385 AromaticContact CG-NE1 3.8Å; F356-W385 CarbonylContact O-C 3.49Å; F356-W385 WeakPolarHBondContact O-CA 3.4Å; F356-M386 PolarHBondContact O-N 3.3Å
357	I	98.3	Very high	97.6	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.021	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-88.7	126.6	-179.5	-66.7	157.4	0	0	0	108.2	C353 Y354 A359 D361 V362 I365 Y383	C353-I357 HydrophobicContact CB-CD1 4.23Å; C353-I357 WeakPolarHBondContact O-CG1 3.48Å; C353-I357 PolarHBondContact O-N 3.31Å; Y354-I357 HydrophobicContact CD1-CD1 4.1Å; I357-A359 PolarHBondContact O-N 3.2Å; I357-D361 HydrophobicContact CG2-CB 3.92Å; I357-V362 HydrophobicContact CB-CG2 4.26Å; I357-V362 HydrophobicContact CG2-CG2 3.84Å; I357-I365 HydrophobicContact CD1-CB 3.99Å; I357-I365 HydrophobicContact CD1-CG1 3.94Å; I357-I365 HydrophobicContact CD1-CG2 3.66Å; I357-I365 HydrophobicContact CG1-CG1 4.43Å; I357-I365 HydrophobicContact CG2-CG1 4.05Å; I357-Y383 HydrophobicContact CG1-CD2 4.07Å; I357-Y383 HydrophobicContact CG1-CE2 3.95Å; I357-Y383 HydrophobicContact CG2-CD2 4.43Å
358	H	98.3	Very high	97.7	Very high	33 Å²	33	58.1 Å²	58.1	15%	0.153	30%	0.299	C	S	.	.			trans	-54.9	134.4	175.6	-178.7	-94.2	0	0	0	111	E360 D361 V362 R384 M386	H358-E360 VanDerWaalsContact C-N 3.27Å; H358-E360 IonicContact CE1-OE2 2.82Å; H358-E360 PolarHBondContact O-N 2.86Å; H358-D361 PolarHBondContact O-N 3.44Å; H358-V362 PolarHBondContact O-N 3.38Å; H358-R384 HydrophobicContact CB-CB 3.64Å; H358-R384 PolarHBondContact CE1-NH1 3.07Å; H358-R384 VanDerWaalsContact CE1-NH1 3.28Å; H358-R384 PolarHBondContact N-O 3.04Å; H358-R384 VanDerWaalsContact ND1-CZ 3.26Å; H358-R384 PolarHBondContact ND1-NH1 3.04Å; H358-M386 HydrophobicContact CB-CG 4.36Å
359	A	97.6	Very high	97.8	Very high	84 Å²	84	58.8 Å²	58.8	69%	0.694	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-50.9	-40.2	-166.5	0	0	0	0	0	114.8	I357 D361 V362	I357-A359 PolarHBondContact O-N 3.2Å; A359-D361 VanDerWaalsContact C-N 3.28Å; A359-D361 PolarHBondContact O-N 2.95Å; A359-V362 WeakPolarHBondContact O-CB 3.36Å; A359-V362 PolarHBondContact O-N 3.12Å
360	E	98.1	Very high	97.8	Very high	141 Å²	141	59.8 Å²	59.8	66%	0.659	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-63.7	-28.1	178	-174.1	-178.4	-160.1	0	0	113.6	H358 R384	H358-E360 VanDerWaalsContact C-N 3.27Å; H358-E360 IonicContact CE1-OE2 2.82Å; H358-E360 PolarHBondContact O-N 2.86Å; E360-R384 IonicContact OE2-CZ 2.7Å; E360-R384 IonicContact OE2-NH1 2.69Å; E360-R384 PolarHBondContact OE2-NH1 3.42Å; E360-R384 IonicContact OE2-NH2 2.68Å; E360-R384 PolarHBondContact OE2-NH2 2.93Å
361	D	98.4	Very high	97.7	Very high	24 Å²	24	58.2 Å²	58.2	13%	0.128	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-89.5	-12.9	-179.1	-61.1	-31.1	0	0	0	113.2	I357 H358 A359 E363 G364 I365 R384	I357-D361 HydrophobicContact CG2-CB 3.92Å; H358-D361 PolarHBondContact O-N 3.44Å; A359-D361 VanDerWaalsContact C-N 3.28Å; A359-D361 PolarHBondContact O-N 2.95Å; D361-E363 VanDerWaalsContact C-N 3.31Å; D361-E363 PolarHBondContact O-N 3.41Å; D361-G364 WeakPolarHBondContact O-CA 3.1Å; D361-G364 PolarHBondContact O-N 3.15Å; D361-I365 PolarHBondContact O-N 3.13Å; D361-R384 VanDerWaalsContact CG-NH2 3.31Å; D361-R384 IonicContact OD1-CZ 2.66Å; D361-R384 IonicContact OD1-NE 2.74Å; D361-R384 IonicContact OD1-NH2 3.1Å; D361-R384 PolarHBondContact OD1-NH2 3.31Å; D361-R384 WeakPolarHBondContact OD2-CB 3.49Å; D361-R384 IonicContact OD2-CZ 3.84Å; D361-R384 PolarHBondContact OD2-N 2.9Å; D361-R384 IonicContact OD2-NE 3.29Å; D361-R384 PolarHBondContact OD2-NE 2.91Å; D361-R384 IonicContact OD2-NH2 2.64Å; D361-R384 PolarHBondContact OD2-NH2 3.39Å
362	V	98	Very high	97.6	Very high	45 Å²	45	53.5 Å²	53.5	27%	0.273	26%	0.264	S	S	.	.	H	α-helix	trans	-56.9	-41.7	-172.4	172.2	0	0	0	0	112	Y354 I357 H358 A359 G364 I365 R366	Y354-V362 HydrophobicContact CD1-CG1 4.13Å; Y354-V362 HydrophobicContact CE1-CG1 4.46Å; I357-V362 HydrophobicContact CB-CG2 4.26Å; I357-V362 HydrophobicContact CG2-CG2 3.84Å; H358-V362 PolarHBondContact O-N 3.38Å; A359-V362 WeakPolarHBondContact O-CB 3.36Å; A359-V362 PolarHBondContact O-N 3.12Å; V362-G364 VanDerWaalsContact C-N 3.34Å; V362-G364 PolarHBondContact O-N 2.91Å; V362-I365 PolarHBondContact O-N 3.17Å; V362-R366 WeakPolarHBondContact O-CB 3.07Å; V362-R366 PolarHBondContact O-N 3.29Å
363	E	97.7	Very high	97.4	Very high	104 Å²	104	51.1 Å²	51.1	49%	0.486	26%	0.26	S	S	.	.	H	α-helix	trans	-66.2	-36.3	177.8	179.8	55.6	-158.3	0	0	112.2	D361 I365 R366 H367	D361-E363 VanDerWaalsContact C-N 3.31Å; D361-E363 PolarHBondContact O-N 3.41Å; E363-I365 VanDerWaalsContact C-N 3.35Å; E363-I365 PolarHBondContact O-N 2.92Å; E363-R366 PolarHBondContact O-N 3.28Å; E363-R366 IonicContact OE1-CZ 3.21Å; E363-R366 IonicContact OE1-NE 3.54Å; E363-R366 IonicContact OE1-NH2 3.83Å; E363-R366 PolarHBondContact OE1-NH2 3.42Å; E363-R366 IonicContact OE2-CZ 2.71Å; E363-R366 IonicContact OE2-NE 3.42Å; E363-R366 PolarHBondContact OE2-NE 3.11Å; E363-R366 IonicContact OE2-NH2 2.79Å; E363-R366 PolarHBondContact OE2-NH2 3.31Å; E363-H367 WeakPolarHBondContact O-CB 3.41Å; E363-H367 PolarHBondContact O-N 2.86Å
364	G	97.2	Very high	97.3	Very high	19 Å²	19	55.5 Å²	55.5	20%	0.196	28%	0.283	C	S	.	.	H	α-helix	trans	-64.5	-38	174.3	0	0	0	0	0	112.7	D361 V362 S368	D361-G364 WeakPolarHBondContact O-CA 3.1Å; D361-G364 PolarHBondContact O-N 3.15Å; V362-G364 VanDerWaalsContact C-N 3.34Å; V362-G364 PolarHBondContact O-N 2.91Å; G364-S368 PolarHBondContact O-N 3.3Å; G364-S368 VanDerWaalsContact O-N 3.12Å; G364-S368 PolarHBondContact O-OG 2.57Å
365	I	98.4	Very high	97	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-75.3	-37.6	174.1	-58.3	-59.5	0	0	0	111.7	L328 Y354 I357 D361 V362 E363 H367 S368 H369 T380 Y383 W415	L328-I365 HydrophobicContact CD1-CG2 4.42Å; Y354-I365 HydrophobicContact CE1-CG2 4.27Å; I357-I365 HydrophobicContact CD1-CB 3.99Å; I357-I365 HydrophobicContact CD1-CG1 3.94Å; I357-I365 HydrophobicContact CD1-CG2 3.66Å; I357-I365 HydrophobicContact CG1-CG1 4.43Å; I357-I365 HydrophobicContact CG2-CG1 4.05Å; D361-I365 PolarHBondContact O-N 3.13Å; V362-I365 PolarHBondContact O-N 3.17Å; E363-I365 VanDerWaalsContact C-N 3.35Å; E363-I365 PolarHBondContact O-N 2.92Å; I365-H367 VanDerWaalsContact C-N 3.31Å; I365-H367 PolarHBondContact O-N 3.22Å; I365-S368 WeakPolarHBondContact O-CB 3.48Å; I365-S368 PolarHBondContact O-N 3.11Å; I365-H369 VanDerWaalsContact O-CB 3.31Å; I365-H369 WeakPolarHBondContact O-CB 3.26Å; I365-H369 PolarHBondContact O-N 2.92Å; I365-T380 HydrophobicContact CD1-CG2 3.7Å; I365-Y383 HydrophobicContact CD1-CD1 3.67Å; I365-Y383 HydrophobicContact CD1-CD2 4.24Å; I365-Y383 HydrophobicContact CD1-CE1 4.09Å; I365-Y383 HydrophobicContact CD1-CG 3.73Å; I365-Y383 HydrophobicContact CG1-CD2 4.38Å; I365-Y383 HydrophobicContact CG1-CG 4.23Å; I365-W415 HydrophobicContact CG2-CH2 4.31Å
366	R	98.3	Very high	96.8	Very high	123 Å²	123	49.6 Å²	49.6	46%	0.464	26%	0.263	S	S	.	.	H	α-helix	trans	-59.1	-42.2	174.8	-166.2	-171.2	70.6	84.3	3.5	111.5	V362 E363 H369 L370	V362-R366 WeakPolarHBondContact O-CB 3.07Å; V362-R366 PolarHBondContact O-N 3.29Å; E363-R366 PolarHBondContact O-N 3.28Å; E363-R366 IonicContact OE1-CZ 3.21Å; E363-R366 IonicContact OE1-NE 3.54Å; E363-R366 IonicContact OE1-NH2 3.83Å; E363-R366 PolarHBondContact OE1-NH2 3.42Å; E363-R366 IonicContact OE2-CZ 2.71Å; E363-R366 IonicContact OE2-NE 3.42Å; E363-R366 PolarHBondContact OE2-NE 3.11Å; E363-R366 IonicContact OE2-NH2 2.79Å; E363-R366 PolarHBondContact OE2-NH2 3.31Å; R366-H369 PolarHBondContact O-N 3.26Å; R366-L370 PolarHBondContact O-N 2.96Å
367	H	97.6	Very high	96.6	Very high	108 Å²	108	49.8 Å²	49.8	50%	0.5	27%	0.265	S	S	.	.	H	α-helix	trans	-64.8	-46.9	173.2	-169.9	87.7	0	0	0	112	E363 I365 H369 L370 D371	E363-H367 WeakPolarHBondContact O-CB 3.41Å; E363-H367 PolarHBondContact O-N 2.86Å; I365-H367 VanDerWaalsContact C-N 3.31Å; I365-H367 PolarHBondContact O-N 3.22Å; H367-H369 VanDerWaalsContact C-N 3.25Å; H367-H369 PolarHBondContact O-N 2.89Å; H367-L370 WeakPolarHBondContact O-CB 3.41Å; H367-L370 PolarHBondContact O-N 3.28Å; H367-L370 VanDerWaalsContact O-N 3.13Å; H367-D371 PolarHBondContact O-N 2.78Å
368	S	97.9	Very high	96.4	Very high	8 Å²	8	49.6 Å²	49.6	6%	0.056	26%	0.264	C	S	.	.	H	α-helix	trans	-58.5	-37.6	176.3	-54.3	0	0	0	0	112.2	G364 I365 D371 L372 C378	G364-S368 PolarHBondContact O-N 3.3Å; G364-S368 VanDerWaalsContact O-N 3.12Å; G364-S368 PolarHBondContact O-OG 2.57Å; I365-S368 WeakPolarHBondContact O-CB 3.48Å; I365-S368 PolarHBondContact O-N 3.11Å; S368-D371 WeakPolarHBondContact O-CB 3.33Å; S368-D371 PolarHBondContact O-N 3Å; S368-L372 WeakPolarHBondContact O-CB 3.35Å; S368-L372 PolarHBondContact O-N 3.24Å; S368-C378 PolarHBondContact O-SG 3.3Å; S368-C378 VanDerWaalsContact O-SG 3.36Å
369	H	98.1	Very high	96.3	Very high	15 Å²	15	49.1 Å²	49.1	7%	0.069	26%	0.263	C	S	.	.	H	α-helix	trans	-69.9	-39.1	176.7	-175.7	-162.8	0	0	0	112	M326 L328 Y354 I365 R366 H367 D371 L372 L373	M326-H369 PolarHBondContact O-NE2 3.41Å; L328-H369 HydrophobicContact CD1-CB 4.22Å; Y354-H369 PolarHBondContact OH-ND1 2.92Å; Y354-H369 VanDerWaalsContact OH-ND1 3.16Å; I365-H369 VanDerWaalsContact O-CB 3.31Å; I365-H369 WeakPolarHBondContact O-CB 3.26Å; I365-H369 PolarHBondContact O-N 2.92Å; R366-H369 PolarHBondContact O-N 3.26Å; H367-H369 VanDerWaalsContact C-N 3.25Å; H367-H369 PolarHBondContact O-N 2.89Å; H369-D371 VanDerWaalsContact C-N 3.35Å; H369-D371 PolarHBondContact O-N 3.19Å; H369-L372 WeakPolarHBondContact O-CB 3.18Å; H369-L372 PolarHBondContact O-N 2.83Å; H369-L373 VanDerWaalsContact O-CG 3.32Å; H369-L373 WeakPolarHBondContact O-CG 3.19Å; H369-L373 PolarHBondContact O-N 3.15Å
370	L	97.2	Very high	96.2	Very high	84 Å²	84	45.3 Å²	45.3	44%	0.44	23%	0.231	S	C	.	.	H	α-helix	trans	-62	-41.8	173	-177.8	60	0	0	0	111.8	R366 H367 L373 N374	R366-L370 PolarHBondContact O-N 2.96Å; H367-L370 WeakPolarHBondContact O-CB 3.41Å; H367-L370 PolarHBondContact O-N 3.28Å; H367-L370 VanDerWaalsContact O-N 3.13Å; L370-L373 PolarHBondContact O-N 3.48Å; L370-N374 WeakPolarHBondContact CD1-ND2 3.26Å; L370-N374 WeakPolarHBondContact O-CB 3.45Å; L370-N374 VanDerWaalsContact O-CG 3.29Å; L370-N374 PolarHBondContact O-N 3.29Å; L370-N374 PolarHBondContact O-ND2 3.3Å
371	D	95.6	Very high	96.1	Very high	19 Å²	19	45.7 Å²	45.7	10%	0.102	23%	0.231	C	C	.	.	H	α-helix	trans	-59.2	-46.7	171.8	-97.8	-32.3	0	0	0	112	F251 H367 S368 H369 L373 N374 K375 C378	F251-D371 HydrophobicContact CD2-CB 4.32Å; F251-D371 WeakPolarHBondContact CD2-OD2 3.29Å; H367-D371 PolarHBondContact O-N 2.78Å; S368-D371 WeakPolarHBondContact O-CB 3.33Å; S368-D371 PolarHBondContact O-N 3Å; H369-D371 VanDerWaalsContact C-N 3.35Å; H369-D371 PolarHBondContact O-N 3.19Å; D371-L373 VanDerWaalsContact C-N 3.34Å; D371-L373 PolarHBondContact O-N 3.01Å; D371-N374 PolarHBondContact O-N 3.11Å; D371-K375 WeakPolarHBondContact O-CB 3.44Å; D371-K375 PolarHBondContact O-N 2.87Å; D371-K375 WeakPolarHBondContact OD1-CD 3.06Å; D371-K375 VanDerWaalsContact OD1-CE 3.25Å; D371-K375 WeakPolarHBondContact OD1-CE 3.21Å; D371-K375 IonicContact OD1-NZ 3.28Å; D371-K375 PolarHBondContact OD1-NZ 2.65Å; D371-C378 HydrophobicContact CB-CB 4.35Å
372	L	95.1	Very high	96.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.3	-44.3	177.6	179.9	60.5	0	0	0	112.3	S368 H369 G376 C378 A399 I401 I413 W415	S368-L372 WeakPolarHBondContact O-CB 3.35Å; S368-L372 PolarHBondContact O-N 3.24Å; H369-L372 WeakPolarHBondContact O-CB 3.18Å; H369-L372 PolarHBondContact O-N 2.83Å; L372-G376 CarbonylContact O-C 3.57Å; L372-G376 WeakPolarHBondContact O-CA 3.29Å; L372-G376 PolarHBondContact O-N 2.73Å; L372-C378 HydrophobicContact CB-CB 4.1Å; L372-A399 HydrophobicContact CD1-CB 4.03Å; L372-A399 HydrophobicContact CD2-CB 3.69Å; L372-A399 HydrophobicContact CG-CB 4.48Å; L372-I401 HydrophobicContact CD1-CG1 4.19Å; L372-I401 HydrophobicContact CG-CG1 4.38Å; L372-I401 WeakPolarHBondContact O-CD1 3.39Å; L372-I413 HydrophobicContact CD2-CD1 3.66Å; L372-I413 HydrophobicContact CD2-CG1 4.01Å; L372-I413 HydrophobicContact CD2-CG2 3.8Å; L372-I413 HydrophobicContact CG-CD1 4.36Å; L372-W415 HydrophobicContact CD2-CE3 4.38Å; L372-W415 HydrophobicContact CD2-CZ3 4.06Å
373	L	94.1	Very high	96.1	Very high	73 Å²	73	49.5 Å²	49.5	38%	0.382	24%	0.24	S	C	.	.	H	α-helix	trans	-66.6	-41.4	177.9	-67	174.7	0	0	0	112.2	M326 H369 L370 D371	M326-L373 HydrophobicContact CE-CD2 3.41Å; M326-L373 VanDerWaalsContact CE-CD2 3.41Å; H369-L373 VanDerWaalsContact O-CG 3.32Å; H369-L373 WeakPolarHBondContact O-CG 3.19Å; H369-L373 PolarHBondContact O-N 3.15Å; L370-L373 PolarHBondContact O-N 3.48Å; D371-L373 VanDerWaalsContact C-N 3.34Å; D371-L373 PolarHBondContact O-N 3.01Å
374	N	94.2	Very high	96.2	Very high	95 Å²	95	46 Å²	46	51%	0.508	22%	0.222	S	C	.	.	H	α-helix	trans	-79.4	-33.8	-175.6	-73	-27.7	0	0	0	114.1	R253 L370 D371	R253-N374 PolarHBondContact NH1-O 3.04Å; L370-N374 WeakPolarHBondContact CD1-ND2 3.26Å; L370-N374 WeakPolarHBondContact O-CB 3.45Å; L370-N374 VanDerWaalsContact O-CG 3.29Å; L370-N374 PolarHBondContact O-N 3.29Å; L370-N374 PolarHBondContact O-ND2 3.3Å; D371-N374 PolarHBondContact O-N 3.11Å
375	K	93.2	Very high	96.2	Very high	20 Å²	20	45.1 Å²	45.1	9%	0.087	21%	0.212	C	C	.	.	H	α-helix	trans	-114.5	-20.6	-169.5	-61.8	166.8	-175.9	169.7	0	112.9	E192 F251 V272 D371	E192-K375 IonicContact OE1-NZ 2.7Å; E192-K375 PolarHBondContact OE1-NZ 2.78Å; E192-K375 WeakPolarHBondContact OE2-CE 3.42Å; E192-K375 IonicContact OE2-NZ 3.93Å; E192-K375 PolarHBondContact OE2-NZ 3.02Å; F251-K375 HydrophobicContact CB-CD 3.83Å; F251-K375 VanDerWaalsContact O-CD 3.32Å; F251-K375 WeakPolarHBondContact O-CD 3.48Å; F251-K375 WeakPolarHBondContact O-CE 3.23Å; F251-K375 PolarHBondContact O-NZ 2.93Å; V272-K375 HydrophobicContact CG2-CB 4.45Å; V272-K375 WeakPolarHBondContact CG2-O 3.32Å; D371-K375 WeakPolarHBondContact O-CB 3.44Å; D371-K375 PolarHBondContact O-N 2.87Å; D371-K375 WeakPolarHBondContact OD1-CD 3.06Å; D371-K375 VanDerWaalsContact OD1-CE 3.25Å; D371-K375 WeakPolarHBondContact OD1-CE 3.21Å; D371-K375 IonicContact OD1-NZ 3.28Å; D371-K375 PolarHBondContact OD1-NZ 2.65Å
376	G	91.4	Very high	96.2	Very high	22 Å²	22	45.7 Å²	45.7	23%	0.227	22%	0.215	C	C	.	.	S	Bend	trans	98	-15.6	173.1	0	0	0	0	0	115.4	L372 I401	L372-G376 CarbonylContact O-C 3.57Å; L372-G376 WeakPolarHBondContact O-CA 3.29Å; L372-G376 PolarHBondContact O-N 2.73Å; G376-I401 PolarHBondContact O-N 3.24Å
377	Q	93.1	Very high	96.1	Very high	22 Å²	22	40.1 Å²	40.1	10%	0.103	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	147.9	176.7	-52.1	-171.5	-98.2	0	0	109.2	V272 L305 P306 A399 T400	V272-Q377 HydrophobicContact CB-CB 4.05Å; V272-Q377 HydrophobicContact CB-CG 4.4Å; V272-Q377 HydrophobicContact CG1-CB 4.28Å; V272-Q377 HydrophobicContact CG2-CB 3.97Å; V272-Q377 HydrophobicContact CG2-CG 4.06Å; L305-Q377 HydrophobicContact CB-CB 4.34Å; L305-Q377 HydrophobicContact CD1-CB 3.62Å; P306-Q377 PolarHBondContact O-NE2 2.98Å; Q377-A399 VanDerWaalsContact CA-O 3.31Å; Q377-A399 WeakPolarHBondContact CA-O 3.42Å; Q377-T400 HydrophobicContact CG-CG2 3.97Å; Q377-T400 WeakPolarHBondContact CG-OG1 3.45Å; Q377-T400 PolarHBondContact NE2-OG1 3.44Å
378	C	94.8	Very high	95.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	168.5	171.3	79.8	0	0	0	0	111.2	F251 S368 D371 L372 A399	F251-C378 HydrophobicContact CE2-CB 4.46Å; F251-C378 HydrophobicContact CZ-CB 4.46Å; S368-C378 PolarHBondContact O-SG 3.3Å; S368-C378 VanDerWaalsContact O-SG 3.36Å; D371-C378 HydrophobicContact CB-CB 4.35Å; L372-C378 HydrophobicContact CB-CB 4.1Å; C378-A399 PolarHBondContact N-O 3.1Å; C378-A399 PolarHBondContact O-N 3.36Å
379	V	95.5	Very high	95.5	Very high	23 Å²	23	43.9 Å²	43.9	14%	0.139	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	131.7	164.4	178.9	0	0	0	0	107.5	F251 L305 Q396 S397	F251-V379 HydrophobicContact CE1-CB 4.21Å; F251-V379 HydrophobicContact CE1-CG2 4.41Å; F251-V379 HydrophobicContact CZ-CB 4.03Å; F251-V379 VanDerWaalsContact CZ-O 3.3Å; F251-V379 WeakPolarHBondContact CZ-O 3.46Å; L305-V379 HydrophobicContact CD1-CG2 4.3Å; L305-V379 HydrophobicContact CD2-CG2 3.52Å; V379-Q396 HydrophobicContact CG1-CG 4.06Å; V379-S397 WeakPolarHBondContact CA-O 3.43Å
380	T	97.3	Very high	95.3	Very high	4 Å²	4	43.2 Å²	43.2	3%	0.025	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-71.9	162.8	-178.8	68.5	0	0	0	0	111.5	I365 Y383 Q396 S397 W415	I365-T380 HydrophobicContact CD1-CG2 3.7Å; T380-Y383 HydrophobicContact CG2-CE1 4.34Å; T380-Q396 WeakPolarHBondContact O-CG 3.32Å; T380-Q396 PolarHBondContact O-NE2 3.29Å; T380-S397 PolarHBondContact N-O 3.35Å; T380-S397 PolarHBondContact OG1-N 3.33Å; T380-W415 HydrophobicContact CG2-CH2 3.83Å; T380-W415 HydrophobicContact CG2-CZ2 3.73Å
381	K	95.6	Very high	95.3	Very high	150 Å²	150	39.2 Å²	39.2	65%	0.652	19%	0.19	S	C	*	.	P	Polyproline II helix	trans	-62.9	169.1	152.9	-64.2	177.8	-177.4	174.7	0	109.6	Y383	K381-Y383 PolarHBondContact O-N 2.93Å
382	Y	97.9	Very high	95.4	Very high	146 Å²	146	39.1 Å²	39.1	57%	0.573	19%	0.188	S	C	*	.	P	Polyproline II helix	trans	-63.8	133.9	165.4	-51.1	-34.5	0	0	0	108.9	I395 Q396 L420	Y382-I395 WeakPolarHBondContact CA-O 3.5Å; Y382-Q396 HydrophobicContact CD1-CB 3.97Å; Y382-Q396 HydrophobicContact CD1-CG 4.17Å; Y382-Q396 HydrophobicContact CE1-CB 4.29Å; Y382-Q396 HydrophobicContact CE1-CG 4.37Å; Y382-L420 HydrophobicContact CD1-CD1 3.42Å; Y382-L420 VanDerWaalsContact CD1-CD1 3.42Å; Y382-L420 HydrophobicContact CE1-CD1 3.98Å; Y382-L420 HydrophobicContact CG-CD1 3.81Å
383	Y	98.6	Very high	95.5	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	161.6	-178.9	73.6	-83.1	0	0	0	111.1	I357 I365 T380 K381 W385 W394 I395 S397 W415	I357-Y383 HydrophobicContact CG1-CD2 4.07Å; I357-Y383 HydrophobicContact CG1-CE2 3.95Å; I357-Y383 HydrophobicContact CG2-CD2 4.43Å; I365-Y383 HydrophobicContact CD1-CD1 3.67Å; I365-Y383 HydrophobicContact CD1-CD2 4.24Å; I365-Y383 HydrophobicContact CD1-CE1 4.09Å; I365-Y383 HydrophobicContact CD1-CG 3.73Å; I365-Y383 HydrophobicContact CG1-CD2 4.38Å; I365-Y383 HydrophobicContact CG1-CG 4.23Å; T380-Y383 HydrophobicContact CG2-CE1 4.34Å; K381-Y383 PolarHBondContact O-N 2.93Å; Y383-W385 HydrophobicContact CE2-CB 4.5Å; Y383-W385 AromaticContact CE2-CE3 3.87Å; Y383-W385 HydrophobicContact CE2-CE3 3.87Å; Y383-W394 WeakPolarHBondContact O-CA 3.37Å; Y383-I395 HydrophobicContact CD1-CB 4.39Å; Y383-I395 VanDerWaalsContact CD1-O 3.31Å; Y383-I395 WeakPolarHBondContact CD1-O 3.4Å; Y383-I395 HydrophobicContact CE1-CB 3.98Å; Y383-I395 HydrophobicContact CE1-CG2 3.73Å; Y383-I395 PolarHBondContact N-O 3.38Å; Y383-I395 PolarHBondContact O-N 2.93Å; Y383-S397 PolarHBondContact OH-OG 3.1Å; Y383-S397 VanDerWaalsContact OH-OG 3.1Å; Y383-W415 PolarHBondContact OH-NE1 2.66Å
384	R	98.5	Very high	95.7	Very high	30 Å²	30	39 Å²	39	11%	0.113	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	121.2	-177.3	-66.5	162.3	-78.1	-170.8	-10.8	110.5	H358 E360 D361 Y392 I393 W394	H358-R384 HydrophobicContact CB-CB 3.64Å; H358-R384 PolarHBondContact CE1-NH1 3.07Å; H358-R384 VanDerWaalsContact CE1-NH1 3.28Å; H358-R384 PolarHBondContact N-O 3.04Å; H358-R384 VanDerWaalsContact ND1-CZ 3.26Å; H358-R384 PolarHBondContact ND1-NH1 3.04Å; E360-R384 IonicContact OE2-CZ 2.7Å; E360-R384 IonicContact OE2-NH1 2.69Å; E360-R384 PolarHBondContact OE2-NH1 3.42Å; E360-R384 IonicContact OE2-NH2 2.68Å; E360-R384 PolarHBondContact OE2-NH2 2.93Å; D361-R384 VanDerWaalsContact CG-NH2 3.31Å; D361-R384 IonicContact OD1-CZ 2.66Å; D361-R384 IonicContact OD1-NE 2.74Å; D361-R384 IonicContact OD1-NH2 3.1Å; D361-R384 PolarHBondContact OD1-NH2 3.31Å; D361-R384 WeakPolarHBondContact OD2-CB 3.49Å; D361-R384 IonicContact OD2-CZ 3.84Å; D361-R384 PolarHBondContact OD2-N 2.9Å; D361-R384 IonicContact OD2-NE 3.29Å; D361-R384 PolarHBondContact OD2-NE 2.91Å; D361-R384 IonicContact OD2-NH2 2.64Å; D361-R384 PolarHBondContact OD2-NH2 3.39Å; R384-Y392 HydrophobicContact CB-CD1 4.25Å; R384-Y392 HydrophobicContact CB-CD2 3.71Å; R384-Y392 HydrophobicContact CB-CE2 4.36Å; R384-Y392 HydrophobicContact CB-CG 3.68Å; R384-Y392 HydrophobicContact CG-CD1 4.25Å; R384-Y392 HydrophobicContact CG-CD2 3.46Å; R384-Y392 VanDerWaalsContact CG-CD2 3.46Å; R384-Y392 HydrophobicContact CG-CE1 4.35Å; R384-Y392 HydrophobicContact CG-CE2 3.62Å; R384-Y392 HydrophobicContact CG-CG 3.85Å; R384-I393 CarbonylContact C-O 3.47Å; R384-I393 WeakPolarHBondContact CA-O 3.49Å; R384-W394 HydrophobicContact CG-CD2 3.86Å; R384-W394 HydrophobicContact CG-CE3 3.77Å; R384-W394 HydrophobicContact CG-CH2 3.71Å; R384-W394 HydrophobicContact CG-CZ2 3.78Å; R384-W394 HydrophobicContact CG-CZ3 3.7Å
385	W	98.1	Very high	95.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	111.5	173.6	-167.9	-58.6	0	0	0	109.5	I330 M341 F356 Y383 Q387 Y392 I393 I395	I330-W385 HydrophobicContact CD1-CH2 4.26Å; I330-W385 HydrophobicContact CD1-CZ2 4.38Å; M341-W385 HydrophobicContact CE-CB 4.38Å; M341-W385 HydrophobicContact CE-CD2 3.86Å; M341-W385 HydrophobicContact CE-CG 3.74Å; M341-W385 HydrophobicContact SD-CG 4.36Å; F356-W385 HydrophobicContact CB-CD2 4.18Å; F356-W385 HydrophobicContact CB-CG 4.33Å; F356-W385 HydrophobicContact CB-CZ2 4.08Å; F356-W385 HydrophobicContact CD2-CZ2 4.04Å; F356-W385 HydrophobicContact CG-CZ2 4.15Å; F356-W385 AromaticContact CG-NE1 3.8Å; F356-W385 CarbonylContact O-C 3.49Å; F356-W385 WeakPolarHBondContact O-CA 3.4Å; Y383-W385 HydrophobicContact CE2-CB 4.5Å; Y383-W385 AromaticContact CE2-CE3 3.87Å; Y383-W385 HydrophobicContact CE2-CE3 3.87Å; W385-Q387 PolarHBondContact O-NE2 2.95Å; W385-Q387 VanDerWaalsContact O-NE2 3.09Å; W385-Y392 CarbonylContact O-C 3.6Å; W385-Y392 VanDerWaalsContact O-CA 3.26Å; W385-Y392 WeakPolarHBondContact O-CA 3.32Å; W385-Y392 WeakPolarHBondContact O-CB 3.39Å; W385-I393 HydrophobicContact CB-CG1 4.26Å; W385-I393 PolarHBondContact N-O 3.5Å; W385-I393 PolarHBondContact O-N 3.31Å; W385-I395 HydrophobicContact CB-CD1 3.59Å; W385-I395 HydrophobicContact CB-CG1 4.21Å; W385-I395 HydrophobicContact CD2-CD1 4.04Å; W385-I395 HydrophobicContact CE3-CD1 3.8Å; W385-I395 HydrophobicContact CG-CD1 3.99Å
386	M	97.6	Very high	96.1	Very high	15 Å²	15	36 Å²	36	7%	0.074	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	135.8	-175.4	-60.7	-170.9	-64.7	0	0	111.4	H355 F356 H358 G391 M430 D431	H355-M386 WeakPolarHBondContact O-CE 3.26Å; F356-M386 PolarHBondContact O-N 3.3Å; H358-M386 HydrophobicContact CB-CG 4.36Å; M386-G391 WeakPolarHBondContact CA-O 3.49Å; M386-M430 HydrophobicContact SD-CB 4.22Å; M386-D431 HydrophobicContact CE-CB 3.73Å; M386-D431 HydrophobicContact SD-CB 3.85Å
387	Q	96.3	Very high	96.3	Very high	6 Å²	6	35 Å²	35	3%	0.028	16%	0.155	C	C	.	.			trans	-86.4	176.3	-178.9	-62.6	-55.3	-64.2	0	0	111.8	W385 G391 I393 Q434	W385-Q387 PolarHBondContact O-NE2 2.95Å; W385-Q387 VanDerWaalsContact O-NE2 3.09Å; Q387-G391 PolarHBondContact N-O 3Å; Q387-I393 HydrophobicContact CG-CG2 4.33Å; Q387-Q434 WeakPolarHBondContact O-CG 3.26Å; Q387-Q434 PolarHBondContact O-NE2 3.44Å
388	K	94.2	Very high	96.3	Very high	92 Å²	92	34.4 Å²	34.4	40%	0.4	15%	0.154	S	C	.	.	S	Bend	trans	-70.2	-35.3	-179.1	-169.5	167.4	-178.3	163.5	0	113.7	D342 L343 D347	D342-K388 HydrophobicContact CB-CB 3.76Å; D342-K388 VanDerWaalsContact O-CB 3.3Å; D342-K388 WeakPolarHBondContact O-CB 3.47Å; D342-K388 VanDerWaalsContact O-CD 3.29Å; D342-K388 WeakPolarHBondContact O-CD 3.29Å; L343-K388 HydrophobicContact CD2-CB 3.78Å; L343-K388 HydrophobicContact CD2-CD 4.26Å; L343-K388 HydrophobicContact CD2-CG 4.16Å; L343-K388 HydrophobicContact CG-CB 4.15Å; D347-K388 IonicContact OD1-NZ 3.15Å; D347-K388 PolarHBondContact OD1-NZ 3.32Å
389	N	89.8	Confident	96.3	Very high	102 Å²	102	34.4 Å²	34.4	55%	0.545	15%	0.154	S	C	.	.	S	Bend	trans	-108.2	-1.3	-165.1	-57.4	-51.9	0	0	0	114.6	D342	D342-N389 PolarHBondContact OD2-ND2 3.22Å
390	G	94.1	Very high	96.1	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.01	15%	0.151	C	C	.	.	S	Bend	trans	132.7	158.2	-170.7	0	0	0	0	0	111.6	K426 T428	G390-K426 CarbonylContact C-O 3.59Å; G390-K426 WeakPolarHBondContact CA-O 3.3Å; G390-T428 WeakPolarHBondContact CA-O 3.49Å
391	G	97	Very high	95.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.157	C	C	.	.			trans	64.4	-161.4	179	0	0	0	0	0	115	M386 Q387 E424 Y425 T428 Q434	M386-G391 WeakPolarHBondContact CA-O 3.49Å; Q387-G391 PolarHBondContact N-O 3Å; G391-E424 VanDerWaalsContact CA-O 3.23Å; G391-E424 WeakPolarHBondContact CA-O 3.46Å; G391-Y425 VanDerWaalsContact CA-O 3.31Å; G391-Y425 WeakPolarHBondContact CA-O 3.22Å; G391-Y425 PolarHBondContact N-O 2.91Å; G391-T428 PolarHBondContact N-O 3.1Å; G391-Q434 PolarHBondContact O-NE2 2.6Å
392	Y	97.7	Very high	95.3	Very high	18 Å²	18	28.6 Å²	28.6	7%	0.071	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	172.1	-172.5	61.6	-104.7	0	0	0	112.8	R384 W385 W394 P423 E424 Y425	R384-Y392 HydrophobicContact CB-CD1 4.25Å; R384-Y392 HydrophobicContact CB-CD2 3.71Å; R384-Y392 HydrophobicContact CB-CE2 4.36Å; R384-Y392 HydrophobicContact CB-CG 3.68Å; R384-Y392 HydrophobicContact CG-CD1 4.25Å; R384-Y392 HydrophobicContact CG-CD2 3.46Å; R384-Y392 VanDerWaalsContact CG-CD2 3.46Å; R384-Y392 HydrophobicContact CG-CE1 4.35Å; R384-Y392 HydrophobicContact CG-CE2 3.62Å; R384-Y392 HydrophobicContact CG-CG 3.85Å; W385-Y392 CarbonylContact O-C 3.6Å; W385-Y392 VanDerWaalsContact O-CA 3.26Å; W385-Y392 WeakPolarHBondContact O-CA 3.32Å; W385-Y392 WeakPolarHBondContact O-CB 3.39Å; Y392-W394 AromaticContact CE2-CD1 3.93Å; Y392-W394 AromaticContact CE2-CE2 3.98Å; Y392-W394 HydrophobicContact CE2-CZ2 4.49Å; Y392-W394 AromaticContact CE2-NE1 3.53Å; Y392-P423 WeakPolarHBondContact O-CA 3.49Å; Y392-E424 HydrophobicContact CD2-CB 4.29Å; Y392-E424 HydrophobicContact CE2-CB 3.68Å; Y392-E424 HydrophobicContact CE2-CG 4.29Å; Y392-E424 WeakPolarHBondContact CE2-OE2 3.3Å; Y392-E424 PolarHBondContact N-O 3.45Å; Y392-E424 PolarHBondContact O-N 3.35Å; Y392-E424 PolarHBondContact OH-OE2 3.39Å; Y392-Y425 AromaticContact CE1-CD2 3.91Å; Y392-Y425 HydrophobicContact CE1-CD2 3.91Å; Y392-Y425 AromaticContact CZ-CD2 3.88Å; Y392-Y425 WeakPolarHBondContact OH-CD2 3.45Å; Y392-Y425 WeakPolarHBondContact OH-CE2 3.37Å
393	I	97.4	Very high	94.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	151.8	160.5	67	173.9	0	0	0	111.3	M341 R384 W385 Q387 I395 L419 P423	M341-I393 HydrophobicContact CE-CD1 3.8Å; M341-I393 HydrophobicContact CE-CG1 4.4Å; M341-I393 HydrophobicContact CG-CD1 3.9Å; R384-I393 CarbonylContact C-O 3.47Å; R384-I393 WeakPolarHBondContact CA-O 3.49Å; W385-I393 HydrophobicContact CB-CG1 4.26Å; W385-I393 PolarHBondContact N-O 3.5Å; W385-I393 PolarHBondContact O-N 3.31Å; Q387-I393 HydrophobicContact CG-CG2 4.33Å; I393-I395 HydrophobicContact CD1-CD1 4.05Å; I393-I395 HydrophobicContact CD1-CG1 4.16Å; I393-I395 HydrophobicContact CG1-CD1 4.1Å; I393-I395 HydrophobicContact CG1-CG1 3.99Å; I393-L419 HydrophobicContact CD1-CD1 3.62Å; I393-L419 HydrophobicContact CD1-CD2 4.09Å; I393-L419 HydrophobicContact CD1-CG 3.82Å; I393-P423 HydrophobicContact CG2-CB 4.27Å; I393-P423 HydrophobicContact CG2-CG 3.82Å
394	W	98.3	Very high	93.2	Very high	70 Å²	70	27.5 Å²	27.5	27%	0.265	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	132.6	172.1	-71.3	99.4	0	0	0	111.8	Y383 R384 Y392 L420 S421 E424	Y383-W394 WeakPolarHBondContact O-CA 3.37Å; R384-W394 HydrophobicContact CG-CD2 3.86Å; R384-W394 HydrophobicContact CG-CE3 3.77Å; R384-W394 HydrophobicContact CG-CH2 3.71Å; R384-W394 HydrophobicContact CG-CZ2 3.78Å; R384-W394 HydrophobicContact CG-CZ3 3.7Å; Y392-W394 AromaticContact CE2-CD1 3.93Å; Y392-W394 AromaticContact CE2-CE2 3.98Å; Y392-W394 HydrophobicContact CE2-CZ2 4.49Å; Y392-W394 AromaticContact CE2-NE1 3.53Å; W394-L420 HydrophobicContact CB-CB 3.8Å; W394-L420 HydrophobicContact CB-CD1 4.32Å; W394-L420 WeakPolarHBondContact O-CB 3.46Å; W394-L420 PolarHBondContact O-N 3.26Å; W394-S421 PolarHBondContact N-OG 3.28Å; W394-E424 VanDerWaalsContact CD1-OE1 3.24Å; W394-E424 PolarHBondContact NE1-OE1 2.8Å; W394-E424 PolarHBondContact NE1-OE2 2.82Å
395	I	97.9	Very high	91.9	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	147.6	179.1	-61	-172.4	0	0	0	109.9	F320 M341 Y382 Y383 W385 I393 S397 N417 Y418	F320-I395 HydrophobicContact CE1-CD1 4.36Å; F320-I395 HydrophobicContact CZ-CD1 4.45Å; M341-I395 HydrophobicContact CE-CD1 3.72Å; Y382-I395 WeakPolarHBondContact CA-O 3.5Å; Y383-I395 HydrophobicContact CD1-CB 4.39Å; Y383-I395 VanDerWaalsContact CD1-O 3.31Å; Y383-I395 WeakPolarHBondContact CD1-O 3.4Å; Y383-I395 HydrophobicContact CE1-CB 3.98Å; Y383-I395 HydrophobicContact CE1-CG2 3.73Å; Y383-I395 PolarHBondContact N-O 3.38Å; Y383-I395 PolarHBondContact O-N 2.93Å; W385-I395 HydrophobicContact CB-CD1 3.59Å; W385-I395 HydrophobicContact CB-CG1 4.21Å; W385-I395 HydrophobicContact CD2-CD1 4.04Å; W385-I395 HydrophobicContact CE3-CD1 3.8Å; W385-I395 HydrophobicContact CG-CD1 3.99Å; I393-I395 HydrophobicContact CD1-CD1 4.05Å; I393-I395 HydrophobicContact CD1-CG1 4.16Å; I393-I395 HydrophobicContact CG1-CD1 4.1Å; I393-I395 HydrophobicContact CG1-CG1 3.99Å; I395-S397 WeakPolarHBondContact CG2-OG 3.41Å; I395-N417 HydrophobicContact CG2-CB 4.01Å; I395-Y418 WeakPolarHBondContact CA-O 3.41Å
396	Q	96.8	Very high	90.8	Very high	52 Å²	52	40.6 Å²	40.6	24%	0.243	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	145.8	152.2	-165.1	171.7	29.8	0	0	108.6	V379 T380 Y382 Y418 L420	V379-Q396 HydrophobicContact CG1-CG 4.06Å; T380-Q396 WeakPolarHBondContact O-CG 3.32Å; T380-Q396 PolarHBondContact O-NE2 3.29Å; Y382-Q396 HydrophobicContact CD1-CB 3.97Å; Y382-Q396 HydrophobicContact CD1-CG 4.17Å; Y382-Q396 HydrophobicContact CE1-CB 4.29Å; Y382-Q396 HydrophobicContact CE1-CG 4.37Å; Q396-Y418 PolarHBondContact N-O 3.22Å; Q396-Y418 WeakPolarHBondContact O-CB 3.45Å; Q396-Y418 WeakPolarHBondContact O-CD2 3.46Å; Q396-Y418 PolarHBondContact O-N 3.17Å; Q396-L420 HydrophobicContact CB-CD1 4.26Å
397	S	95.8	Very high	89.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	138.8	176.1	-55.2	0	0	0	0	112.6	V379 T380 Y383 I395 W415 V416 N417	V379-S397 WeakPolarHBondContact CA-O 3.43Å; T380-S397 PolarHBondContact N-O 3.35Å; T380-S397 PolarHBondContact OG1-N 3.33Å; Y383-S397 PolarHBondContact OH-OG 3.1Å; Y383-S397 VanDerWaalsContact OH-OG 3.1Å; I395-S397 WeakPolarHBondContact CG2-OG 3.41Å; S397-W415 PolarHBondContact OG-NE1 3.08Å; S397-W415 VanDerWaalsContact OG-NE1 3.12Å; S397-V416 CarbonylContact C-O 3.59Å; S397-V416 WeakPolarHBondContact CA-O 3.37Å; S397-V416 WeakPolarHBondContact CB-O 3.42Å; S397-N417 PolarHBondContact OG-OD1 2.87Å
398	S	93.7	Very high	88.7	Confident	11 Å²	11	46.6 Å²	46.6	8%	0.077	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.8	169.3	-175.6	0	0	0	0	108.2	V416	S398-V416 PolarHBondContact N-O 3.38Å; S398-V416 PolarHBondContact O-N 3.03Å
399	A	93.6	Very high	87.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	145.3	-171.8	0	0	0	0	0	111.4	L372 Q377 C378 I413 I414 W415	L372-A399 HydrophobicContact CD1-CB 4.03Å; L372-A399 HydrophobicContact CD2-CB 3.69Å; L372-A399 HydrophobicContact CG-CB 4.48Å; Q377-A399 VanDerWaalsContact CA-O 3.31Å; Q377-A399 WeakPolarHBondContact CA-O 3.42Å; C378-A399 PolarHBondContact N-O 3.1Å; C378-A399 PolarHBondContact O-N 3.36Å; A399-I413 HydrophobicContact CB-CG2 4.25Å; A399-I414 WeakPolarHBondContact CA-O 3.27Å; A399-W415 HydrophobicContact CB-CD2 4.02Å; A399-W415 HydrophobicContact CB-CE3 3.33Å; A399-W415 HydrophobicContact CB-CZ3 3.62Å
400	T	92.1	Very high	87.4	Confident	12 Å²	12	47.7 Å²	47.7	7%	0.074	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	132.2	-176.1	-73.9	0	0	0	0	111.2	P308 Q377 A402 I413 I414	P308-T400 HydrophobicContact CB-CG2 3.56Å; P308-T400 HydrophobicContact CG-CG2 3.56Å; Q377-T400 HydrophobicContact CG-CG2 3.97Å; Q377-T400 WeakPolarHBondContact CG-OG1 3.45Å; Q377-T400 PolarHBondContact NE2-OG1 3.44Å; T400-A402 PolarHBondContact O-N 2.83Å; T400-I413 WeakPolarHBondContact O-CA 3.31Å; T400-I414 PolarHBondContact N-O 3.48Å; T400-I414 PolarHBondContact O-N 3.17Å
401	I	90.3	Very high	87	Confident	30 Å²	30	53 Å²	53	15%	0.154	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	114.6	173	-57.8	177.1	0	0	0	109	M326 L372 G376 K411 N412 I413	M326-I401 HydrophobicContact CE-CD1 3.8Å; M326-I401 HydrophobicContact CE-CG1 4.33Å; M326-I401 HydrophobicContact SD-CG2 4.43Å; L372-I401 HydrophobicContact CD1-CG1 4.19Å; L372-I401 HydrophobicContact CG-CG1 4.38Å; L372-I401 WeakPolarHBondContact O-CD1 3.39Å; G376-I401 PolarHBondContact O-N 3.24Å; I401-K411 HydrophobicContact CG2-CB 4.24Å; I401-K411 HydrophobicContact CG2-CG 4.49Å; I401-N412 CarbonylContact C-O 3.57Å; I401-I413 HydrophobicContact CG1-CG1 4.07Å
402	A	84.9	Confident	86.8	Confident	13 Å²	13	53.6 Å²	53.6	11%	0.107	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	127.4	169.5	0	0	0	0	0	110.4	T400 N412 I414	T400-A402 PolarHBondContact O-N 2.83Å; A402-N412 PolarHBondContact N-O 3.21Å; A402-N412 PolarHBondContact O-N 3.03Å; A402-N412 PolarHBondContact O-ND2 3.42Å; A402-N412 VanDerWaalsContact O-O 3.11Å; A402-I414 HydrophobicContact CB-CD1 3.74Å; A402-I414 HydrophobicContact CB-CG1 3.9Å
403	I	80.5	Confident	86.5	Confident	78 Å²	78	52.7 Å²	52.7	40%	0.4	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	128.7	172.7	-57.4	174	0	0	0	107.7	A405 A408	I403-A405 PolarHBondContact O-N 3.34Å; I403-A408 HydrophobicContact CG2-CB 4.33Å
404	N	72.7	Confident	86.3	Confident	47 Å²	47	53.9 Å²	53.9	25%	0.251	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	121.1	176.3	-176.5	-10.3	0	0	0	110.4	K406 N407 E410	N404-K406 PolarHBondContact O-N 2.88Å; N404-K406 VanDerWaalsContact O-N 3.14Å; N404-K406 PolarHBondContact OD1-N 2.91Å; N404-N407 CarbonylContact O-C 3.58Å; N404-N407 PolarHBondContact O-N 3.47Å; N404-N407 VanDerWaalsContact O-O 3.1Å; N404-E410 HydrophobicContact CB-CB 4.01Å; N404-E410 HydrophobicContact CB-CG 4.48Å; N404-E410 PolarHBondContact N-O 2.96Å; N404-E410 PolarHBondContact ND2-OE2 2.85Å
405	A	71.2	Confident	86.1	Confident	105 Å²	105	50.5 Å²	50.5	87%	0.868	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.2	179.8	0	0	0	0	0	114.1	I403	I403-A405 PolarHBondContact O-N 3.34Å
406	K	75.2	Confident	85.9	Confident	201 Å²	201	51 Å²	51	87%	0.874	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-22.1	174	-62.6	-175	179.9	-178.1	0	113.6	N404	N404-K406 PolarHBondContact O-N 2.88Å; N404-K406 VanDerWaalsContact O-N 3.14Å; N404-K406 PolarHBondContact OD1-N 2.91Å
407	N	73.6	Confident	85.8	Confident	79 Å²	79	48.6 Å²	48.6	42%	0.422	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	98.1	-176.7	-178.8	2.2	0	0	0	109.5	N404 N409 E410	N404-N407 CarbonylContact O-C 3.58Å; N404-N407 PolarHBondContact O-N 3.47Å; N404-N407 VanDerWaalsContact O-O 3.1Å; N407-N409 PolarHBondContact O-N 3.38Å; N407-N409 WeakPolarHBondContact OD1-CB 3.25Å; N407-N409 PolarHBondContact OD1-N 3.28Å; N407-E410 HydrophobicContact CB-CB 4.36Å; N407-E410 PolarHBondContact O-N 3.36Å
408	A	75.2	Confident	85.7	Confident	68 Å²	68	52.5 Å²	52.5	56%	0.562	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.3	-15.9	-175.3	0	0	0	0	0	114.3	I403	I403-A408 HydrophobicContact CG2-CB 4.33Å
409	N	75.9	Confident	85.7	Confident	145 Å²	145	53 Å²	53	78%	0.775	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	-24.5	176.3	-62.1	-7.8	0	0	0	112.1	N407 K411	N407-N409 PolarHBondContact O-N 3.38Å; N407-N409 WeakPolarHBondContact OD1-CB 3.25Å; N407-N409 PolarHBondContact OD1-N 3.28Å; N409-K411 PolarHBondContact O-N 2.88Å; N409-K411 VanDerWaalsContact O-N 3.17Å
410	E	82	Confident	85.8	Confident	72 Å²	72	57.1 Å²	57.1	34%	0.336	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	98.8	176	-169.7	-159.7	151	0	0	110.1	R323 N404 N407	R323-E410 IonicContact CZ-OE1 3.9Å; R323-E410 IonicContact NH1-OE1 3.93Å; R323-E410 IonicContact NH2-OE1 2.79Å; R323-E410 PolarHBondContact NH2-OE1 3.28Å; N404-E410 HydrophobicContact CB-CB 4.01Å; N404-E410 HydrophobicContact CB-CG 4.48Å; N404-E410 PolarHBondContact N-O 2.96Å; N404-E410 PolarHBondContact ND2-OE2 2.85Å; N407-E410 HydrophobicContact CB-CB 4.36Å; N407-E410 PolarHBondContact O-N 3.36Å
411	K	86.2	Confident	86	Confident	111 Å²	111	57.5 Å²	57.5	48%	0.483	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	137.9	172.1	-63.1	175.3	-174.1	170.5	0	109.9	M326 I401 N409	M326-K411 HydrophobicContact CG-CB 4.37Å; M326-K411 HydrophobicContact SD-CB 3.84Å; I401-K411 HydrophobicContact CG2-CB 4.24Å; I401-K411 HydrophobicContact CG2-CG 4.49Å; N409-K411 PolarHBondContact O-N 2.88Å; N409-K411 VanDerWaalsContact O-N 3.17Å
412	N	90.9	Very high	86.2	Confident	13 Å²	13	62.1 Å²	62.1	7%	0.07	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	158.4	174.2	59.9	107.1	0	0	0	108.6	R323 I401 A402	R323-N412 HydrophobicContact CG-CB 4.33Å; R323-N412 PolarHBondContact NE-OD1 3.01Å; R323-N412 PolarHBondContact NH2-ND2 2.87Å; R323-N412 PolarHBondContact NH2-OD1 3.13Å; I401-N412 CarbonylContact C-O 3.57Å; A402-N412 PolarHBondContact N-O 3.21Å; A402-N412 PolarHBondContact O-N 3.03Å; A402-N412 PolarHBondContact O-ND2 3.42Å; A402-N412 VanDerWaalsContact O-O 3.11Å
413	I	93	Very high	86.7	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	126.2	177.8	-70.2	159.2	0	0	0	108.2	R323 V324 M326 L328 L372 A399 T400 I401 W415	R323-I413 WeakPolarHBondContact CA-O 3.37Å; V324-I413 HydrophobicContact CG2-CB 3.62Å; V324-I413 HydrophobicContact CG2-CD1 4.46Å; V324-I413 HydrophobicContact CG2-CG2 3.72Å; V324-I413 PolarHBondContact N-O 2.7Å; V324-I413 PolarHBondContact O-N 3.36Å; M326-I413 HydrophobicContact SD-CD1 4.22Å; M326-I413 HydrophobicContact SD-CG1 4.17Å; L328-I413 HydrophobicContact CD2-CD1 4.1Å; L372-I413 HydrophobicContact CD2-CD1 3.66Å; L372-I413 HydrophobicContact CD2-CG1 4.01Å; L372-I413 HydrophobicContact CD2-CG2 3.8Å; L372-I413 HydrophobicContact CG-CD1 4.36Å; A399-I413 HydrophobicContact CB-CG2 4.25Å; T400-I413 WeakPolarHBondContact O-CA 3.31Å; I401-I413 HydrophobicContact CG1-CG1 4.07Å; I413-W415 HydrophobicContact CG2-CB 4.34Å; I413-W415 HydrophobicContact CG2-CE3 4Å
414	I	92.5	Very high	87.5	Confident	24 Å²	24	63.7 Å²	63.7	12%	0.123	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125.3	163.3	-58	173.5	0	0	0	106.2	P308 I310 V321 A399 T400 A402 V416	P308-I414 WeakPolarHBondContact O-CD1 3.41Å; I310-I414 HydrophobicContact CB-CD1 4.42Å; V321-I414 HydrophobicContact CG1-CG2 3.94Å; A399-I414 WeakPolarHBondContact CA-O 3.27Å; T400-I414 PolarHBondContact N-O 3.48Å; T400-I414 PolarHBondContact O-N 3.17Å; A402-I414 HydrophobicContact CB-CD1 3.74Å; A402-I414 HydrophobicContact CB-CG1 3.9Å; I414-V416 HydrophobicContact CG2-CG2 4.11Å
415	W	93.9	Very high	88.6	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	101.9	-174.6	-170	-80.1	0	0	0	108	T322 L328 I365 L372 T380 Y383 S397 A399 I413 N417	T322-W415 PolarHBondContact N-O 2.87Å; T322-W415 PolarHBondContact O-N 3.28Å; T322-W415 PolarHBondContact OG1-O 3.35Å; L328-W415 HydrophobicContact CD1-CH2 4.46Å; L328-W415 HydrophobicContact CD1-CZ3 4.39Å; L328-W415 HydrophobicContact CD2-CE3 4Å; L328-W415 HydrophobicContact CD2-CZ3 3.81Å; I365-W415 HydrophobicContact CG2-CH2 4.31Å; L372-W415 HydrophobicContact CD2-CE3 4.38Å; L372-W415 HydrophobicContact CD2-CZ3 4.06Å; T380-W415 HydrophobicContact CG2-CH2 3.83Å; T380-W415 HydrophobicContact CG2-CZ2 3.73Å; Y383-W415 PolarHBondContact OH-NE1 2.66Å; S397-W415 PolarHBondContact OG-NE1 3.08Å; S397-W415 VanDerWaalsContact OG-NE1 3.12Å; A399-W415 HydrophobicContact CB-CD2 4.02Å; A399-W415 HydrophobicContact CB-CE3 3.33Å; A399-W415 HydrophobicContact CB-CZ3 3.62Å; I413-W415 HydrophobicContact CG2-CB 4.34Å; I413-W415 HydrophobicContact CG2-CE3 4Å; W415-N417 PolarHBondContact NE1-OD1 3.22Å; W415-N417 VanDerWaalsContact NE1-OD1 3.09Å; W415-N417 PolarHBondContact O-ND2 3.01Å
416	V	93.1	Very high	89.7	Confident	11 Å²	11	69.2 Å²	69.2	7%	0.067	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	117	-175.3	-177.4	0	0	0	0	108.5	M319 V321 S397 S398 I414 Y418	M319-V416 HydrophobicContact CE-CG1 3.5Å; M319-V416 VanDerWaalsContact CE-CG1 3.5Å; V321-V416 HydrophobicContact CG2-CG2 4.4Å; S397-V416 CarbonylContact C-O 3.59Å; S397-V416 WeakPolarHBondContact CA-O 3.37Å; S397-V416 WeakPolarHBondContact CB-O 3.42Å; S398-V416 PolarHBondContact N-O 3.38Å; S398-V416 PolarHBondContact O-N 3.03Å; I414-V416 HydrophobicContact CG2-CG2 4.11Å; V416-Y418 HydrophobicContact CB-CE2 4.4Å; V416-Y418 HydrophobicContact CG1-CE2 4Å
417	N	95	Very high	90.6	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	129.9	-175.4	-51.9	-77.8	0	0	0	110.4	M319 F320 T322 I395 S397 W415	M319-N417 VanDerWaalsContact CA-O 3.26Å; M319-N417 WeakPolarHBondContact CA-O 3.47Å; F320-N417 HydrophobicContact CD1-CB 3.9Å; F320-N417 HydrophobicContact CD2-CB 4.47Å; F320-N417 HydrophobicContact CE1-CB 3.51Å; F320-N417 HydrophobicContact CE2-CB 4.14Å; F320-N417 VanDerWaalsContact CE2-ND2 3.29Å; F320-N417 WeakPolarHBondContact CE2-ND2 3.17Å; F320-N417 HydrophobicContact CG-CB 4.35Å; F320-N417 HydrophobicContact CZ-CB 3.64Å; F320-N417 PolarHBondContact N-O 2.78Å; F320-N417 VanDerWaalsContact N-O 3.15Å; F320-N417 WeakPolarHBondContact O-CB 3.32Å; F320-N417 PolarHBondContact O-N 2.96Å; F320-N417 PolarHBondContact O-ND2 3.46Å; F320-N417 VanDerWaalsContact O-ND2 3.09Å; T322-N417 PolarHBondContact OG1-ND2 2.99Å; I395-N417 HydrophobicContact CG2-CB 4.01Å; S397-N417 PolarHBondContact OG-OD1 2.87Å; W415-N417 PolarHBondContact NE1-OD1 3.22Å; W415-N417 VanDerWaalsContact NE1-OD1 3.09Å; W415-N417 PolarHBondContact O-ND2 3.01Å
418	Y	93.8	Very high	91.6	Very high	82 Å²	82	65.3 Å²	65.3	32%	0.322	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	119.4	175.3	-57.8	-98.8	0	0	0	108.3	M319 I395 Q396 V416	M319-Y418 HydrophobicContact CE-CD1 3.83Å; M319-Y418 HydrophobicContact CE-CE1 3.32Å; M319-Y418 HydrophobicContact CG-CD1 3.82Å; M319-Y418 HydrophobicContact CG-CE1 4.28Å; M319-Y418 HydrophobicContact CG-CG 4.46Å; M319-Y418 HydrophobicContact SD-CD1 3.71Å; M319-Y418 HydrophobicContact SD-CE1 3.59Å; M319-Y418 VanDerWaalsContact SD-CE1 3.59Å; I395-Y418 WeakPolarHBondContact CA-O 3.41Å; Q396-Y418 PolarHBondContact N-O 3.22Å; Q396-Y418 WeakPolarHBondContact O-CB 3.45Å; Q396-Y418 WeakPolarHBondContact O-CD2 3.46Å; Q396-Y418 PolarHBondContact O-N 3.17Å; V416-Y418 HydrophobicContact CB-CE2 4.4Å; V416-Y418 HydrophobicContact CG1-CE2 4Å
419	L	94.6	Very high	92.5	Very high	23 Å²	23	65.1 Å²	65.1	12%	0.12	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	133.9	178.3	-119.8	81.4	0	0	0	110.9	H318 F320 Y340 I393	H318-L419 HydrophobicContact CB-CB 3.92Å; H318-L419 WeakPolarHBondContact O-CB 3.35Å; H318-L419 PolarHBondContact O-N 3.17Å; F320-L419 HydrophobicContact CD1-CD1 4.24Å; F320-L419 HydrophobicContact CE1-CD1 3.96Å; Y340-L419 HydrophobicContact CD1-CD2 4.08Å; Y340-L419 HydrophobicContact CD2-CD1 4.18Å; Y340-L419 HydrophobicContact CD2-CD2 4.5Å; Y340-L419 HydrophobicContact CG-CD1 4.23Å; Y340-L419 HydrophobicContact CG-CD2 3.84Å; I393-L419 HydrophobicContact CD1-CD1 3.62Å; I393-L419 HydrophobicContact CD1-CD2 4.09Å; I393-L419 HydrophobicContact CD1-CG 3.82Å
420	L	95.5	Very high	93.4	Very high	86 Å²	86	61.9 Å²	61.9	45%	0.45	31%	0.309	S	S	.	.			trans	-113.3	-27.5	-179.7	-51.2	176.6	0	0	0	112.8	Y382 W394 Q396	Y382-L420 HydrophobicContact CD1-CD1 3.42Å; Y382-L420 VanDerWaalsContact CD1-CD1 3.42Å; Y382-L420 HydrophobicContact CE1-CD1 3.98Å; Y382-L420 HydrophobicContact CG-CD1 3.81Å; W394-L420 HydrophobicContact CB-CB 3.8Å; W394-L420 HydrophobicContact CB-CD1 4.32Å; W394-L420 WeakPolarHBondContact O-CB 3.46Å; W394-L420 PolarHBondContact O-N 3.26Å; Q396-L420 HydrophobicContact CB-CD1 4.26Å
421	S	95.9	Very high	94	Very high	20 Å²	20	61.3 Å²	61.3	14%	0.14	31%	0.308	C	S	.	.			trans	-135.8	169.1	179.7	79.9	0	0	0	0	113	W394	W394-S421 PolarHBondContact N-OG 3.28Å
422	N	94.8	Very high	94.3	Very high	127 Å²	127	61 Å²	61	68%	0.679	31%	0.311	S	S	*	.	S	Bend	trans	-82.4	174.1	157.7	-66.4	-7.8	0	0	0	109.5	E424	N422-E424 PolarHBondContact O-N 2.9Å
423	P	95.9	Very high	94.2	Very high	59 Å²	59	64.1 Å²	64.1	38%	0.383	34%	0.338	S	S	.	.			trans	-54.1	123.3	173.3	-30.6	38	0	0	0	114.2	Y392 I393	Y392-P423 WeakPolarHBondContact O-CA 3.49Å; I393-P423 HydrophobicContact CG2-CB 4.27Å; I393-P423 HydrophobicContact CG2-CG 3.82Å
424	E	96.9	Very high	94.2	Very high	65 Å²	65	64.7 Å²	64.7	30%	0.304	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-106.7	144.7	174.3	-70.1	176	-164.2	0	0	109.6	G391 Y392 W394 N422 K426	G391-E424 VanDerWaalsContact CA-O 3.23Å; G391-E424 WeakPolarHBondContact CA-O 3.46Å; Y392-E424 HydrophobicContact CD2-CB 4.29Å; Y392-E424 HydrophobicContact CE2-CB 3.68Å; Y392-E424 HydrophobicContact CE2-CG 4.29Å; Y392-E424 WeakPolarHBondContact CE2-OE2 3.3Å; Y392-E424 PolarHBondContact N-O 3.45Å; Y392-E424 PolarHBondContact O-N 3.35Å; Y392-E424 PolarHBondContact OH-OE2 3.39Å; W394-E424 VanDerWaalsContact CD1-OE1 3.24Å; W394-E424 PolarHBondContact NE1-OE1 2.8Å; W394-E424 PolarHBondContact NE1-OE2 2.82Å; N422-E424 PolarHBondContact O-N 2.9Å; E424-K426 PolarHBondContact O-N 3.48Å; E424-K426 VanDerWaalsContact O-N 3.11Å
425	Y	96.4	Very high	94.1	Very high	154 Å²	154	67.7 Å²	67.7	60%	0.604	36%	0.356	S	S	*	.	S	Bend	trans	52.7	30.4	177.7	-56.1	-80.5	0	0	0	115.6	G391 Y392 D427 T428	G391-Y425 VanDerWaalsContact CA-O 3.31Å; G391-Y425 WeakPolarHBondContact CA-O 3.22Å; G391-Y425 PolarHBondContact N-O 2.91Å; Y392-Y425 AromaticContact CE1-CD2 3.91Å; Y392-Y425 HydrophobicContact CE1-CD2 3.91Å; Y392-Y425 AromaticContact CZ-CD2 3.88Å; Y392-Y425 WeakPolarHBondContact OH-CD2 3.45Å; Y392-Y425 WeakPolarHBondContact OH-CE2 3.37Å; Y425-D427 PolarHBondContact O-N 3.12Å; Y425-T428 PolarHBondContact O-N 2.99Å
426	K	94.1	Very high	93.4	Very high	114 Å²	114	72.7 Å²	72.7	50%	0.496	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-25.7	-175.5	61.6	162.2	-175.8	64.9	0	116.5	G390 E424 T428	G390-K426 CarbonylContact C-O 3.59Å; G390-K426 WeakPolarHBondContact CA-O 3.3Å; E424-K426 PolarHBondContact O-N 3.48Å; E424-K426 VanDerWaalsContact O-N 3.11Å; K426-T428 VanDerWaalsContact C-N 3.34Å
427	D	93.8	Very high	91.7	Very high	128 Å²	128	81.2 Å²	81.2	68%	0.684	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	6.2	-177.5	-51.1	-65.5	0	0	0	112.7	Y425	Y425-D427 PolarHBondContact O-N 3.12Å
428	T	93.9	Very high	89.9	Confident	69 Å²	69	85.6 Å²	85.6	42%	0.423	45%	0.451	S	S	.	.	S	Bend	trans	-121.2	111.9	-178.7	-55.8	0	0	0	0	110.3	G390 G391 Y425 K426 M430	G390-T428 WeakPolarHBondContact CA-O 3.49Å; G391-T428 PolarHBondContact N-O 3.1Å; Y425-T428 PolarHBondContact O-N 2.99Å; K426-T428 VanDerWaalsContact C-N 3.34Å; T428-M430 HydrophobicContact CG2-CE 3.71Å; T428-M430 HydrophobicContact CG2-SD 4.11Å
429	P	94.6	Very high	87.8	Confident	65 Å²	65	86.7 Å²	86.7	42%	0.422	47%	0.468	S	S	.	.			trans	-71.3	133.8	173.1	29.4	-33.1	0	0	0	110.7	Q434 L435	P429-Q434 HydrophobicContact CB-CB 4.03Å; P429-L435 HydrophobicContact CB-CD2 3.82Å; P429-L435 HydrophobicContact CG-CD2 3.77Å
430	M	94.8	Very high	85.4	Confident	76 Å²	76	94.9 Å²	94.9	37%	0.374	51%	0.505	S	S	.	.			trans	-110.8	-24.9	-178.6	-54.2	-62.7	178.8	0	0	112.3	M386 T428	M386-M430 HydrophobicContact SD-CB 4.22Å; T428-M430 HydrophobicContact CG2-CE 3.71Å; T428-M430 HydrophobicContact CG2-SD 4.11Å
431	D	94.8	Very high	82.9	Confident	60 Å²	60	99.9 Å²	99.9	32%	0.321	52%	0.523	S	S	.	.	S	Bend	trans	-132.4	156.4	178.3	179.8	-105.4	0	0	0	111.5	M386 A433 Q434	M386-D431 HydrophobicContact CE-CB 3.73Å; M386-D431 HydrophobicContact SD-CB 3.85Å; D431-A433 PolarHBondContact O-N 3.09Å; D431-A433 WeakPolarHBondContact OD1-CB 3.32Å; D431-A433 PolarHBondContact OD1-N 2.95Å; D431-Q434 WeakPolarHBondContact O-CB 3.49Å; D431-Q434 PolarHBondContact O-N 2.86Å
432	I	92.5	Very high	80.1	Confident	105 Å²	105	104.9 Å²	104.9	54%	0.538	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-56.8	-33.2	178.3	-170	163.9	0	0	0	112.8	Q434 L435 L438	I432-Q434 PolarHBondContact O-N 2.98Å; I432-Q434 VanDerWaalsContact O-N 3.14Å; I432-L435 PolarHBondContact O-N 2.89Å; I432-L435 VanDerWaalsContact O-N 3.17Å; I432-L438 HydrophobicContact CD1-CD1 4.35Å; I432-L438 HydrophobicContact CD1-CD2 4.38Å; I432-L438 HydrophobicContact CG1-CD1 3.54Å; I432-L438 HydrophobicContact CG1-CD2 4.34Å; I432-L438 WeakPolarHBondContact O-CD1 3.44Å
433	A	89.3	Confident	77.5	Confident	78 Å²	78	104.6 Å²	104.6	65%	0.645	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-67.8	-9	177.6	0	0	0	0	0	114.4	D431	D431-A433 PolarHBondContact O-N 3.09Å; D431-A433 WeakPolarHBondContact OD1-CB 3.32Å; D431-A433 PolarHBondContact OD1-N 2.95Å
434	Q	92.9	Very high	74.8	Confident	13 Å²	13	110.4 Å²	110.4	6%	0.061	58%	0.583	C	S	.	*	G	3₁₀ helix	trans	-95.3	-4.5	176.2	-57.9	-175	-44.5	0	0	113.3	Q387 G391 P429 D431 I432	Q387-Q434 WeakPolarHBondContact O-CG 3.26Å; Q387-Q434 PolarHBondContact O-NE2 3.44Å; G391-Q434 PolarHBondContact O-NE2 2.6Å; P429-Q434 HydrophobicContact CB-CB 4.03Å; D431-Q434 WeakPolarHBondContact O-CB 3.49Å; D431-Q434 PolarHBondContact O-N 2.86Å; I432-Q434 PolarHBondContact O-N 2.98Å; I432-Q434 VanDerWaalsContact O-N 3.14Å
435	L	90.4	Very high	72.4	Confident	86 Å²	86	112.7 Å²	112.7	45%	0.45	61%	0.607	S	S	.	*	S	Bend	trans	-86.4	129.4	-179.4	-64.9	177.5	0	0	0	111.7	P429 I432 L438	P429-L435 HydrophobicContact CB-CD2 3.82Å; P429-L435 HydrophobicContact CG-CD2 3.77Å; I432-L435 PolarHBondContact O-N 2.89Å; I432-L435 VanDerWaalsContact O-N 3.17Å; L435-L438 HydrophobicContact CB-CD1 4.39Å
436	P	78.3	Confident	69.6	Low	105 Å²	105	110.9 Å²	110.9	68%	0.682	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	147	173.8	29.7	-34.5	0	0	0	111.4
437	H	57.3	Low	66.9	Low	190 Å²	190	113.9 Å²	113.9	88%	0.88	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.6	35.6	173.7	-53.6	-69.5	0	0	0	117.5
438	L	57.6	Low	64.1	Low	93 Å²	93	114 Å²	114	49%	0.487	64%	0.638	S	S	.	*			trans	-70.8	130.9	154.3	-73.4	158.8	0	0	0	109.8	I432 L435	I432-L438 HydrophobicContact CD1-CD1 4.35Å; I432-L438 HydrophobicContact CD1-CD2 4.38Å; I432-L438 HydrophobicContact CG1-CD1 3.54Å; I432-L438 HydrophobicContact CG1-CD2 4.34Å; I432-L438 WeakPolarHBondContact O-CD1 3.44Å; L435-L438 HydrophobicContact CB-CD1 4.39Å
439	P	49	Very low	61.2	Low	104 Å²	104	116 Å²	116	68%	0.675	65%	0.654	S	S	*	*			trans	-69.3	135.1	171.2	28.9	-33	0	0	0	109.7	K441	P439-K441 VanDerWaalsContact C-N 3.32Å; P439-K441 PolarHBondContact O-N 3.24Å
440	E	44	Very low	58.8	Low	196 Å²	196	120.1 Å²	120.1	92%	0.916	67%	0.673	S	S	*	*			trans	-64.9	91.8	170.5	-69.6	-174.4	129.3	0	0	109.5	T442	E440-T442 PolarHBondContact O-N 3.27Å; E440-T442 VanDerWaalsContact O-N 3.1Å
441	K	43.3	Very low	56	Low	190 Å²	190	121.1 Å²	121.1	83%	0.826	69%	0.688	S	S	*	*			trans	-66.6	109.1	164.3	-79	-167.6	173.5	-173.1	0	107.7	P439 S443	P439-K441 VanDerWaalsContact C-N 3.32Å; P439-K441 PolarHBondContact O-N 3.24Å; K441-S443 PolarHBondContact O-N 2.78Å
442	T	38.2	Very low	53.4	Low	126 Å²	126	128 Å²	128	77%	0.773	72%	0.718	S	S	*	*			trans	-50.3	106.2	170.5	45	0	0	0	0	109.7	E440 E444	E440-T442 PolarHBondContact O-N 3.27Å; E440-T442 VanDerWaalsContact O-N 3.1Å; T442-E444 PolarHBondContact O-N 3.24Å
443	S	39.4	Very low	50.7	Low	121 Å²	121	128.7 Å²	128.7	85%	0.846	73%	0.732	S	S	*	*			trans	-80.5	71	-178	61.1	0	0	0	0	110.5	K441	K441-S443 PolarHBondContact O-N 2.78Å
444	E	39.1	Very low	48	Very low	180 Å²	180	132.7 Å²	132.7	84%	0.841	74%	0.742	S	S	*	*			trans	-70.5	142.8	159.3	-65.5	-166.4	143.7	0	0	109.3	T442 S446	T442-E444 PolarHBondContact O-N 3.24Å; E444-S446 PolarHBondContact O-N 2.93Å
445	S	47.3	Very low	45.3	Very low	114 Å²	114	136.7 Å²	136.7	80%	0.797	77%	0.772	S	S	*	*			trans	-78.1	114.2	-174.3	50.1	0	0	0	0	111.6
446	S	36.8	Very low	42.8	Very low	115 Å²	115	142.3 Å²	142.3	80%	0.804	79%	0.792	S	S	*	*			trans	-95	105.7	158.2	58.5	0	0	0	0	109.2	E444	E444-S446 PolarHBondContact O-N 2.93Å
447	E	37.5	Very low	40.6	Very low	178 Å²	178	144.8 Å²	144.8	83%	0.832	80%	0.8	S	S	*	*			trans	-65.9	149.3	168.2	-61.7	-175	130.1	0	0	110.1	S449	E447-S449 PolarHBondContact O-N 2.92Å; E447-S449 VanDerWaalsContact O-N 3.08Å
448	T	34.4	Very low	39.4	Very low	131 Å²	131	142.7 Å²	142.7	80%	0.804	80%	0.801	S	S	*	*			trans	-76.5	96.4	179.9	48	0	0	0	0	110.5	D450	T448-D450 PolarHBondContact O-N 3.27Å
449	S	34.4	Very low	38.4	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	82%	0.817	S	S	*	*			trans	-78	103.3	160.8	-66.1	0	0	0	0	109.1	E447	E447-S449 PolarHBondContact O-N 2.92Å; E447-S449 VanDerWaalsContact O-N 3.08Å
450	D	43.1	Very low	37.5	Very low	152 Å²	152	141.9 Å²	141.9	81%	0.813	82%	0.815	S	S	*	*			trans	-63.2	135.8	166.7	-68	-52.1	0	0	0	109.1	T448	T448-D450 PolarHBondContact O-N 3.27Å
451	S	36.9	Very low	37.1	Very low	97 Å²	97	140.2 Å²	140.2	68%	0.678	81%	0.811	S	S	*	*			trans	-154	93.3	176.2	-75.2	0	0	0	0	109.4	S453	S451-S453 PolarHBondContact O-N 2.84Å; S451-S453 PolarHBondContact O-OG 3.07Å
452	E	40.3	Very low	36.7	Very low	205 Å²	205	136.1 Å²	136.1	96%	0.958	80%	0.802	S	S	*	*			trans	-57	128.7	174.3	-59.2	-171.1	126.5	0	0	109.9
453	S	35.3	Very low	36.5	Very low	118 Å²	118	137.7 Å²	137.7	83%	0.825	80%	0.8	S	S	*	*			trans	-129.5	100.4	179.8	19.4	0	0	0	0	108.6	S451	S451-S453 PolarHBondContact O-N 2.84Å; S451-S453 PolarHBondContact O-OG 3.07Å
454	D	32.7	Very low	36.1	Very low	163 Å²	163	139 Å²	139	87%	0.872	80%	0.798	S	S	*	*			trans	-72.2	151.4	-172	-140.7	-22.6	0	0	0	112.2
455	S	36	Very low	35.8	Very low	97 Å²	97	136.6 Å²	136.6	68%	0.678	79%	0.791	S	S	*	*			trans	-74.4	145.7	-171.2	64.1	0	0	0	0	114.1
456	K	37.4	Very low	35.1	Very low	203 Å²	203	138.5 Å²	138.5	88%	0.883	79%	0.787	S	S	*	*			trans	-163	104	149.6	-118	161.4	-170.6	164.8	0	114.5
457	D	32.7	Very low	34.7	Very low	157 Å²	157	139.6 Å²	139.6	84%	0.84	78%	0.784	S	S	*	*			trans	-73.2	143.6	162.2	-66.1	-71.7	0	0	0	111.5
458	T	32.5	Very low	34.5	Very low	146 Å²	146	136.6 Å²	136.6	90%	0.896	78%	0.783	S	S	*	*			trans	-154	148.7	154.5	-58.3	0	0	0	0	109.1
459	S	36.4	Very low	34.4	Very low	119 Å²	119	138.9 Å²	138.9	83%	0.832	78%	0.782	S	S	*	*			trans	-110.7	148.3	-154.2	56.6	0	0	0	0	117.3
460	G	30.9	Very low	34.3	Very low	62 Å²	62	139 Å²	139	64%	0.639	78%	0.783	S	S	*	*			trans	166.4	133.2	161.2	0	0	0	0	0	110.3
461	I	35.1	Very low	33.7	Very low	160 Å²	160	138 Å²	138	82%	0.821	78%	0.777	S	S	*	*			cis	65.7	114.4	38.3	-52.5	-178	0	0	0	109.6
462	T	35.2	Very low	33.4	Very low	104 Å²	104	140.4 Å²	140.4	64%	0.638	78%	0.778	S	S	*	*			cis	-151.5	165	15	3.7	0	0	0	0	113.7
463	E	33.8	Very low	32.9	Very low	159 Å²	159	138.9 Å²	138.9	74%	0.743	77%	0.768	S	S	*	*			trans	56.4	133.4	142.8	-73.1	154.6	-174.4	0	0	123.6
464	D	31	Very low	32.6	Very low	149 Å²	149	137 Å²	137	80%	0.797	77%	0.767	S	S	*	*			trans	60.3	157.3	133.9	-66.2	11.3	0	0	0	122.4
465	N	32.9	Very low	32.6	Very low	129 Å²	129	135.5 Å²	135.5	69%	0.69	76%	0.759	S	S	*	*			cis	-167.5	165.9	-26.7	179.2	27	0	0	0	107.4
466	E	32.6	Very low	32.3	Very low	155 Å²	155	139 Å²	139	72%	0.724	77%	0.765	S	S	*	*			trans	65.7	121	171.4	-45.1	-154.8	153.1	0	0	116.6
467	N	28	Very low	32.2	Very low	137 Å²	137	133.8 Å²	133.8	73%	0.733	75%	0.754	S	S	*	*				68.8	104.7	58.2	179.4	53.1	0	0	0	115.4
468	S	33.9	Very low	32	Very low	116 Å²	116	134.1 Å²	134.1	81%	0.811	75%	0.75	S	S	*	*			trans	-167.1	148.2	134.3	-87.1	0	0	0	0	113
469	K	30.4	Very low	31.8	Very low	178 Å²	178	134 Å²	134	77%	0.774	74%	0.744	S	S	*	*			trans	-92.9	142.9	171	-80.5	-177.3	166.3	-166.1	0	111.9
470	S	33.6	Very low	31.6	Very low	113 Å²	113	132.2 Å²	132.2	79%	0.79	73%	0.732	S	S	*	*			trans	-156.2	135.2	138.4	-22	0	0	0	0	106
471	D	30.1	Very low	31.6	Very low	130 Å²	130	137.4 Å²	137.4	70%	0.695	74%	0.739	S	S	*	*			cis	53.6	120.4	39.7	-61.6	-52.9	0	0	0	110.9
472	E	31.6	Very low	31.5	Very low	148 Å²	148	136.9 Å²	136.9	69%	0.692	74%	0.738	S	S	*	*			cis	-160.5	162	41.4	-173.6	163.2	136.4	0	0	114
473	K	29.4	Very low	32	Very low	174 Å²	174	137.5 Å²	137.5	76%	0.757	74%	0.744	S	S	*	*			trans	-8.2	149.1	166.2	-52	150.1	-157	153.8	0	120.5
474	G	29	Very low	32.1	Very low	78 Å²	78	137.3 Å²	137.3	80%	0.804	74%	0.743	S	S	*	*			trans	-167.5	89.1	160.9	0	0	0	0	0	115.4
475	N	31.8	Very low	32.8	Very low	131 Å²	131	135.9 Å²	135.9	70%	0.701	74%	0.742	S	S	*	*			trans	-24.3	145	171.5	-87.4	17.5	0	0	0	119.9
476	Q	30.3	Very low	32.8	Very low	171 Å²	171	134.1 Å²	134.1	80%	0.799	73%	0.732	S	S	*	*				52.7	139.2	93	-50.3	177	-33.7	0	0	114.2
477	S	34.3	Very low	32.8	Very low	93 Å²	93	135 Å²	135	65%	0.65	73%	0.729	S	S	*	*			cis	-156.3	143.6	26.2	58.6	0	0	0	0	111.5
478	E	29.9	Very low	33	Very low	165 Å²	165	137.1 Å²	137.1	77%	0.771	73%	0.732	S	S	*	*				95.1	140.9	102.7	-83.9	174	172.6	0	0	117.5
479	N	28.2	Very low	32.8	Very low	144 Å²	144	140.5 Å²	140.5	77%	0.77	73%	0.732	S	S	*	*			trans	64.4	149.3	152.6	-63.6	-16.4	0	0	0	121.1
480	S	32.3	Very low	32.7	Very low	81 Å²	81	137.6 Å²	137.6	57%	0.566	73%	0.734	S	S	*	*			cis	-164.6	168.1	-18.7	53.4	0	0	0	0	112.4
481	E	30.5	Very low	32.3	Very low	171 Å²	171	135.5 Å²	135.5	80%	0.799	73%	0.73	S	S	*	*			trans	65.1	108.5	151.2	-70.1	150.4	129.6	0	0	122.2
482	D	32.2	Very low	32.3	Very low	148 Å²	148	137.3 Å²	137.3	79%	0.791	74%	0.74	S	S	*	*				24.8	146.1	116.5	-126	9.5	0	0	0	120
483	P	47	Very low	32.2	Very low	117 Å²	117	135.1 Å²	135.1	76%	0.76	75%	0.747	S	S	*	*				-148.1	152.8	61.7	39.5	-19.9	0	0	0	119.1
484	E	35.1	Very low	32.4	Very low	155 Å²	155	132.2 Å²	132.2	72%	0.724	75%	0.748	S	S	*	*			trans	-71.6	162.3	153.8	-106.9	-146.5	177.5	0	0	112.6
485	P	47	Very low	32.3	Very low	119 Å²	119	135.2 Å²	135.2	77%	0.773	75%	0.745	S	S	*	*				-150.5	125.2	110.5	33.3	-14	0	0	0	118.1
486	D	31.9	Very low	32.2	Very low	93 Å²	93	135.2 Å²	135.2	50%	0.497	75%	0.745	S	S	.	*				60.1	117.2	125.5	-99.5	-20.6	0	0	0	123.1
487	R	32.8	Very low	32.2	Very low	174 Å²	174	133 Å²	133	66%	0.657	74%	0.739	S	S	*	*				88.9	114.9	124.2	-72	167.5	-166.7	166.2	25	124.8
488	K	32	Very low	32.3	Very low	181 Å²	181	136.1 Å²	136.1	79%	0.787	75%	0.745	S	S	*	*				68.7	155.4	126	-60.2	167.2	-178.4	164.6	0	116.1
489	K	29.7	Very low	32.3	Very low	186 Å²	186	135.6 Å²	135.6	81%	0.809	75%	0.748	S	S	*	*			cis	-163.3	163.4	23.6	-162.6	-178.7	177	-173.3	0	110.4
490	S	27.7	Very low	32.5	Very low	118 Å²	118	133 Å²	133	83%	0.825	74%	0.739	S	S	*	*			trans	63.3	160	163.1	34.4	0	0	0	0	117.8
491	G	26.7	Very low	32.4	Very low	69 Å²	69	135.7 Å²	135.7	71%	0.711	75%	0.748	S	S	*	*			cis	170	147.3	-10.2	0	0	0	0	0	114.3
492	N	29.3	Very low	32.6	Very low	167 Å²	167	133.6 Å²	133.6	89%	0.893	74%	0.742	S	S	*	*			trans	19.6	139.8	162.1	-73.3	27.2	0	0	0	123.9
493	A	29.1	Very low	32.7	Very low	103 Å²	103	133.5 Å²	133.5	85%	0.851	74%	0.742	S	S	*	*			trans	95.4	163.2	134.4	0	0	0	0	0	119.8
494	C	33.3	Very low	32.1	Very low	113 Å²	113	130.5 Å²	130.5	76%	0.764	73%	0.732	S	S	*	*			trans	-131.8	161.5	-165.4	52.4	0	0	0	0	110.8
495	D	27.3	Very low	31.9	Very low	140 Å²	140	131.5 Å²	131.5	75%	0.749	74%	0.736	S	S	*	*			trans	-138.4	132.9	156.3	-87.7	-58.5	0	0	0	105.3
496	N	30.1	Very low	31.2	Very low	132 Å²	132	130.1 Å²	130.1	71%	0.706	73%	0.729	S	S	*	*				64	136.7	78.9	-59.4	-41.5	0	0	0	111.7
497	D	30.2	Very low	31.5	Very low	125 Å²	125	130.9 Å²	130.9	67%	0.668	74%	0.742	S	S	*	*			cis	-160.6	178	21.1	-148.8	-21.5	0	0	0	113.1
498	M	35.8	Very low	31.3	Very low	157 Å²	157	128.3 Å²	128.3	77%	0.773	75%	0.75	S	S	*	*			trans	78.6	116.5	157.2	-63.6	-65.9	153.4	0	0	122.1
499	N	30.6	Very low	31.3	Very low	154 Å²	154	127.2 Å²	127.2	82%	0.824	75%	0.753	S	S	*	*			trans	-59.2	172.7	151.3	-131.6	1.2	0	0	0	110.8
500	C	31.8	Very low	32.5	Very low	89 Å²	89	123.2 Å²	123.2	60%	0.601	75%	0.747	S	S	*	*			cis	-166.7	-170.6	9.9	40.9	0	0	0	0	109.8
501	N	30.4	Very low	32.8	Very low	139 Å²	139	124.7 Å²	124.7	74%	0.743	75%	0.745	S	S	*	*			trans	77	147.6	160.9	-72.9	42.2	0	0	0	117.6
502	D	34.6	Very low	33.5	Very low	127 Å²	127	125.9 Å²	125.9	68%	0.679	74%	0.743	S	S	*	*			cis	-164.6	155	-20.4	-159.1	5.6	0	0	0	109.3
503	D	35	Very low	33.9	Very low	146 Å²	146	128.2 Å²	128.2	78%	0.781	74%	0.739	S	S	*	*			trans	50.9	159.9	174.2	-78.2	-34.2	0	0	0	118.9
504	G	33.8	Very low	34.1	Very low	54 Å²	54	129.4 Å²	129.4	56%	0.557	73%	0.731	S	S	*	*			cis	156.4	133.5	-8.5	0	0	0	0	0	112.2
505	H	32	Very low	34.4	Very low	176 Å²	176	129.2 Å²	129.2	82%	0.815	73%	0.731	S	S	*	*			trans	66.5	165.9	160.9	-57.2	-55.9	0	0	0	118.7
506	S	32.1	Very low	34.9	Very low	90 Å²	90	129.8 Å²	129.8	63%	0.629	73%	0.734	S	S	*	*			cis	-168.3	155.3	-32.1	-88.9	0	0	0	0	110.7
507	S	36.8	Very low	34.9	Very low	109 Å²	109	130.3 Å²	130.3	76%	0.762	74%	0.737	S	S	*	*			trans	40.3	136.2	144.6	65.2	0	0	0	0	123.9
508	S	30.2	Very low	35	Very low	119 Å²	119	128.5 Å²	128.5	83%	0.832	73%	0.734	S	S	*	*				-176.7	155.3	121.4	30.3	0	0	0	0	114.9
509	N	30.9	Very low	34.6	Very low	159 Å²	159	129.3 Å²	129.3	85%	0.85	73%	0.733	S	S	*	*			trans	-109.2	-161.4	170.5	-54.4	-21.7	0	0	0	109
510	P	55.5	Low	34.7	Very low	102 Å²	102	129.1 Å²	129.1	66%	0.662	73%	0.728	S	S	*	*			cis	-135.2	-162.6	-17	27.6	-1.4	0	0	0	114.4
511	D	33.2	Very low	34.6	Very low	149 Å²	149	132.8 Å²	132.8	80%	0.797	74%	0.735	S	S	*	*			trans	75.5	147.5	151.5	-68.4	-33.3	0	0	0	120.8
512	S	42.5	Very low	34.6	Very low	94 Å²	94	130 Å²	130	66%	0.657	73%	0.726	S	S	*	*			cis	-168.2	-178.5	-7.9	51.1	0	0	0	0	112.4
513	R	37	Very low	34.3	Very low	215 Å²	215	130.4 Å²	130.4	81%	0.811	73%	0.729	S	S	*	*			trans	85	149.7	162.7	-71.9	-174.8	175.1	152	4.2	119.6
514	D	33.9	Very low	33.9	Very low	129 Å²	129	131.7 Å²	131.7	69%	0.69	73%	0.728	S	S	*	*			cis	-154.2	163	7.7	-114.9	-21.7	0	0	0	114.7
515	S	38.7	Very low	33.6	Very low	109 Å²	109	136.7 Å²	136.7	76%	0.762	74%	0.736	S	S	*	*			trans	80.4	149.1	152.9	-63.1	0	0	0	0	125.4
516	D	37.8	Very low	33.3	Very low	152 Å²	152	135.4 Å²	135.4	81%	0.813	74%	0.736	S	S	*	*			trans	-85.6	-172.6	-169.2	-44.8	-88.6	0	0	0	114.7
517	D	30.5	Very low	34.1	Very low	143 Å²	143	135.3 Å²	135.3	77%	0.765	73%	0.733	S	S	*	*			cis	-164.6	157.8	23.9	-157	-6.8	0	0	0	115.6
518	S	31.6	Very low	33.6	Very low	86 Å²	86	139 Å²	139	60%	0.601	74%	0.736	S	S	*	*			trans	57.4	114.5	147	-74.7	0	0	0	0	127.9
519	F	28.9	Very low	33.5	Very low	174 Å²	174	138.3 Å²	138.3	76%	0.763	74%	0.737	S	S	*	*				69.3	114.2	123.8	-80.1	-89	0	0	0	126.8
520	E	32.4	Very low	33.4	Very low	151 Å²	151	134.2 Å²	134.2	71%	0.706	73%	0.732	S	S	*	*				73.4	137.1	129.5	-84.5	-176.9	-156.3	0	0	127
521	H	28.9	Very low	32.1	Very low	166 Å²	166	138.7 Å²	138.7	77%	0.769	74%	0.744	S	S	*	*			trans	32	150.2	137.5	-74	-52.4	0	0	0	123.3
522	S	30.4	Very low	31.8	Very low	79 Å²	79	139.7 Å²	139.7	55%	0.552	75%	0.749	S	S	*	*			cis	-169.3	-177	-2.6	48.4	0	0	0	0	111.5
523	D	27.8	Very low	31.1	Very low	136 Å²	136	138.3 Å²	138.3	73%	0.727	75%	0.749	S	S	*	*			trans	68.4	170.3	148.3	-61.4	-32.8	0	0	0	120.4
524	F	26.3	Very low	30.5	Very low	173 Å²	173	138.6 Å²	138.6	76%	0.759	76%	0.757	S	S	*	*				-162.1	168.4	-51.7	-149.9	-112.4	0	0	0	108.5
525	E	27.6	Very low	30	Very low	159 Å²	159	136.2 Å²	136.2	74%	0.743	76%	0.763	S	S	*	*			trans	54.4	119.4	162.8	-89.4	169	159.9	0	0	123.8
526	N	27	Very low	29.5	Very low	150 Å²	150	135.2 Å²	135.2	80%	0.802	76%	0.761	S	S	*	*				33.7	168.5	103.9	-115.2	-9.5	0	0	0	121.2
527	P	48.1	Very low	29.1	Very low	88 Å²	88	136.4 Å²	136.4	57%	0.571	77%	0.767	S	S	*	*			cis	-139.8	-162.5	-10.8	33	-8.3	0	0	0	115.3
528	K	26.5	Very low	28.9	Very low	187 Å²	187	133.4 Å²	133.4	81%	0.813	77%	0.77	S	S	*	*			trans	87.3	135	165.2	-55.6	166.4	-175.1	172.6	0	115.6
529	A	28.8	Very low	28.8	Very low	104 Å²	104	133.9 Å²	133.9	86%	0.86	78%	0.779	S	S	*	*			cis	81.6	130	37.5	0	0	0	0	0	114.3
530	G	27.1	Very low	28.7	Very low	72 Å²	72	134.6 Å²	134.6	74%	0.742	79%	0.787	S	S	*	*			cis	175.7	173.6	-5.4	0	0	0	0	0	114.3
531	E	29.3	Very low	28.5	Very low	197 Å²	197	136.1 Å²	136.1	92%	0.921	79%	0.794	S	S	*	*			trans	71	161.6	168.6	-60.5	-171.5	114	0	0	120.6
532	D	25.8	Very low	28.4	Very low	170 Å²	170	136.3 Å²	136.3	91%	0.909	80%	0.799	S	S	*	*			trans	60.7	143.4	-177.7	-64.3	-24	0	0	0	119.9
533	G	27.9	Very low	28.2	Very low	64 Å²	64	139.7 Å²	139.7	66%	0.66	80%	0.803	S	S	*	*			cis	172.9	105.8	-8.5	0	0	0	0	0	115.6
534	F	24.9	Very low	28.1	Very low	222 Å²	222	140.2 Å²	140.2	97%	0.974	81%	0.811	S	S	*	*			trans	57.2	131.4	162.5	-86.8	-92.5	0	0	0	122.4
535	G	24.5	Very low	28.1	Very low	79 Å²	79	138.7 Å²	138.7	81%	0.814	81%	0.807	S	S	*	*			trans	-169.5	104.5	166.2	0	0	0	0	0	111
536	A	28	Very low	27.9	Very low	88 Å²	88	142.6 Å²	142.6	73%	0.727	82%	0.815	S	S	*	*			trans	-87.4	163.9	-166.4	0	0	0	0	0	114.8
537	L	28.6	Very low	27.8	Very low	177 Å²	177	145.3 Å²	145.3	93%	0.927	82%	0.815	S	S	*	*				176.8	147.9	118.7	-94.1	164.8	0	0	0	114
538	G	26.6	Very low	26.8	Very low	80 Å²	80	147 Å²	147	83%	0.825	82%	0.823	S	S	*	*			trans	76.5	92.5	145.4	0	0	0	0	0	120
539	A	28.8	Very low	26.7	Very low	96 Å²	96	146.3 Å²	146.3	79%	0.793	82%	0.823	S	S	*	*			trans	-130.9	125	163.3	0	0	0	0	0	112
540	M	27.6	Very low	26.6	Very low	188 Å²	188	146.3 Å²	146.3	93%	0.926	82%	0.817	S	S	*	*			trans	-144.1	121.9	167.3	-69.3	-176.6	173	0	0	106.9
541	Q	27.6	Very low	26.8	Very low	184 Å²	184	152.4 Å²	152.4	86%	0.86	83%	0.826	S	S	*	*			cis	89.7	93.4	48.9	-77	-155.7	-10.5	0	0	115.2
542	I	27.3	Very low	26.8	Very low	170 Å²	170	148 Å²	148	87%	0.872	82%	0.817	S	S	*	*			trans	-141.9	93.5	145.2	-53.7	179.8	0	0	0	104.7
543	K	25.9	Very low	26.8	Very low	149 Å²	149	146.5 Å²	146.5	65%	0.648	81%	0.809	S	S	*	*				66.1	96.2	76.2	-158.3	-169.5	-175.8	-158.2	0	114.4	E545	K543-E545 VanDerWaalsContact CE-CD 3.44Å; K543-E545 WeakPolarHBondContact CE-OE1 3.22Å; K543-E545 VanDerWaalsContact NZ-CD 3.3Å; K543-E545 IonicContact NZ-OE1 2.65Å; K543-E545 PolarHBondContact NZ-OE1 3.34Å; K543-E545 IonicContact NZ-OE2 3.74Å
544	V	26.8	Very low	26.7	Very low	147 Å²	147	149 Å²	149	89%	0.891	81%	0.806	S	S	*	*			trans	-127.9	134.4	151.6	175.8	0	0	0	0	106.8
545	E	25	Very low	26.7	Very low	142 Å²	142	148 Å²	148	66%	0.664	80%	0.797	S	S	*	*			trans	-90.6	140.6	-174.3	-69.5	168.2	142.9	0	0	111.6	K543	K543-E545 VanDerWaalsContact CE-CD 3.44Å; K543-E545 WeakPolarHBondContact CE-OE1 3.22Å; K543-E545 VanDerWaalsContact NZ-CD 3.3Å; K543-E545 IonicContact NZ-OE1 2.65Å; K543-E545 PolarHBondContact NZ-OE1 3.34Å; K543-E545 IonicContact NZ-OE2 3.74Å
546	R	24.9	Very low	26.7	Very low	241 Å²	241	151.4 Å²	151.4	91%	0.909	80%	0.795	S	S	*	*			trans	-106.5	135.7	154.1	-79.4	-167.9	179.5	-171.2	1.5	108.1	V548	R546-V548 PolarHBondContact O-N 2.66Å
547	Y	23.1	Very low	26.5	Very low	206 Å²	206	155.7 Å²	155.7	81%	0.808	80%	0.8	S	S	*	*			trans	-60.7	131.7	168.2	-102.4	-117.1	0	0	0	110.4	E549	Y547-E549 HydrophobicContact CD1-CG 3.97Å; Y547-E549 HydrophobicContact CE1-CG 4.45Å
548	V	27.4	Very low	26.2	Very low	124 Å²	124	154.2 Å²	154.2	75%	0.752	79%	0.793	S	S	*	*			trans	-127.8	107.7	157.7	176.2	0	0	0	0	104.8	R546	R546-V548 PolarHBondContact O-N 2.66Å
549	E	25.6	Very low	26.2	Very low	172 Å²	172	155.7 Å²	155.7	80%	0.804	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-81.6	121.3	170.4	-67.9	-170	137.8	0	0	108.6	Y547	Y547-E549 HydrophobicContact CD1-CG 3.97Å; Y547-E549 HydrophobicContact CE1-CG 4.45Å
550	S	26.5	Very low	25.9	Very low	105 Å²	105	160.6 Å²	160.6	73%	0.734	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-83	152.2	178.9	-62.4	0	0	0	0	111.7
551	E	31.9	Very low	25.8	Very low	199 Å²	199	156.4 Å²	156.4	93%	0.93	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-74.1	137.2	164.1	-61.5	-174	126.3	0	0	111.7
552	S	27.7	Very low	25.7	Very low	104 Å²	104	155 Å²	155	73%	0.727	78%	0.783	S	S	*	*			trans	-161.2	113.7	166.1	52.9	0	0	0	0	106.2
553	D	25.4	Very low	25.7	Very low	140 Å²	140	153 Å²	153	75%	0.749	78%	0.779	S	S	*	*				-162.4	162.7	65.9	-95.5	2.8	0	0	0	109.1
554	L	26.5	Very low	26.1	Very low	115 Å²	115	150.8 Å²	150.8	60%	0.602	78%	0.781	S	S	*	*			cis	-166.3	-170.2	-5.3	-107	172.3	0	0	0	106.4
555	R	24.8	Very low	26	Very low	203 Å²	203	150.5 Å²	150.5	77%	0.766	78%	0.775	S	S	*	*			cis	-152.8	140.5	13.6	-145.9	167.7	-156.6	149.5	11.5	113
556	L	24.8	Very low	26.6	Very low	149 Å²	149	148.4 Å²	148.4	78%	0.78	78%	0.776	S	S	*	*			trans	31.7	134.8	146	-68	173.1	0	0	0	123.1
557	Q	23.3	Very low	27	Very low	179 Å²	179	141 Å²	141	84%	0.836	77%	0.766	S	S	*	*			trans	-67.6	163.1	149	-60.4	161.1	-12.2	0	0	109.5
558	N	23	Very low	27.7	Very low	146 Å²	146	139.9 Å²	139.9	78%	0.781	77%	0.766	S	S	*	*			cis	-166.7	-175.2	44.1	-162.7	17.7	0	0	0	112.2
559	C	26.1	Very low	27.7	Very low	110 Å²	110	139.9 Å²	139.9	74%	0.743	76%	0.762	S	S	*	*			trans	-46.5	148.8	-175.7	-54.5	0	0	0	0	119
560	E	22.5	Very low	28.2	Very low	200 Å²	200	136.9 Å²	136.9	94%	0.935	76%	0.76	S	S	*	*				-159.9	-177.6	119.5	-119.2	176.3	-166.6	0	0	111.9
561	S	25	Very low	28.3	Very low	99 Å²	99	138.9 Å²	138.9	69%	0.692	76%	0.762	S	S	*	*			trans	-137	156.9	-161.7	62.5	0	0	0	0	114.7
562	L	25.5	Very low	28.4	Very low	156 Å²	156	133.9 Å²	133.9	82%	0.817	75%	0.749	S	S	*	*				173.7	145.7	128.4	-92.4	167.5	0	0	0	114.9
563	T	28.5	Very low	28.5	Very low	128 Å²	128	133.8 Å²	133.8	79%	0.785	76%	0.755	S	S	*	*			trans	-9.6	161	157.8	56.8	0	0	0	0	121.8
564	S	33.5	Very low	28.7	Very low	101 Å²	101	130.5 Å²	130.5	71%	0.706	75%	0.753	S	S	*	*			cis	-140.5	-173.2	8.8	69.7	0	0	0	0	110.6
565	D	25.2	Very low	28.9	Very low	141 Å²	141	134.2 Å²	134.2	75%	0.754	77%	0.768	S	S	*	*			cis	-150.7	-163.4	18.3	-141.4	-62.8	0	0	0	113.1
566	S	37.8	Very low	29.1	Very low	98 Å²	98	129.2 Å²	129.2	69%	0.685	77%	0.77	S	S	*	*			trans	-116.3	156.4	-151	56.6	0	0	0	0	116.9
567	A	33.8	Very low	29.1	Very low	85 Å²	85	125.6 Å²	125.6	70%	0.702	77%	0.768	S	S	*	*				148	134.4	116.1	0	0	0	0	0	116
568	K	36.1	Very low	29.4	Very low	184 Å²	184	121.6 Å²	121.6	80%	0.8	77%	0.766	S	S	*	*			trans	70	148.4	159.1	-57.6	-168	170.4	-163.7	0	120.1
569	D	28.5	Very low	29.7	Very low	124 Å²	124	123.6 Å²	123.6	66%	0.663	77%	0.771	S	S	*	*			cis	-162.5	149.5	-21.3	-95.1	-27.1	0	0	0	108.1
570	S	36.5	Very low	29.9	Very low	109 Å²	109	122.9 Å²	122.9	76%	0.762	77%	0.773	S	S	*	*			trans	24	155.9	140.1	-58.2	0	0	0	0	122.9
571	D	28.6	Very low	30.2	Very low	147 Å²	147	118.1 Å²	118.1	79%	0.786	76%	0.761	S	S	*	*			cis	179.3	172.9	-25.4	-134.7	-19.7	0	0	0	106.1
572	S	33.4	Very low	30.5	Very low	93 Å²	93	117.7 Å²	117.7	65%	0.65	76%	0.758	S	S	*	*			cis	-161.3	174.8	-8.4	-147.7	0	0	0	0	110.6
573	A	30.8	Very low	30.8	Very low	103 Å²	103	119.5 Å²	119.5	85%	0.851	76%	0.76	S	S	*	*			trans	61.7	163.8	163.1	0	0	0	0	0	118.2
574	G	29.1	Very low	30.9	Very low	70 Å²	70	120.3 Å²	120.3	72%	0.722	75%	0.754	S	S	*	*			cis	177.6	151.5	-9.3	0	0	0	0	0	113.9
575	E	29.5	Very low	30.8	Very low	193 Å²	193	123.2 Å²	123.2	90%	0.902	76%	0.757	S	S	*	*			trans	42.6	133	157	-63.3	-145.5	112.3	0	0	125.2
576	A	28.9	Very low	31	Very low	99 Å²	99	124.6 Å²	124.6	82%	0.818	76%	0.756	S	S	*	*				61.9	135.4	129.8	0	0	0	0	0	124.1
577	G	26	Very low	30.7	Very low	72 Å²	72	131.1 Å²	131.1	74%	0.742	77%	0.766	S	S	*	*				127.3	135.8	118.3	0	0	0	0	0	118.6
578	A	30	Very low	30.6	Very low	96 Å²	96	136 Å²	136	79%	0.793	77%	0.771	S	S	*	*			trans	52.8	122.5	161.9	0	0	0	0	0	118.8
579	Q	28.1	Very low	30.4	Very low	188 Å²	188	135.3 Å²	135.3	88%	0.879	77%	0.768	S	S	*	*				59.8	135.3	67.8	-76.2	-159.6	-13.2	0	0	116.8
580	A	29.9	Very low	30.4	Very low	95 Å²	95	138.3 Å²	138.3	79%	0.785	77%	0.77	S	S	*	*			trans	67.5	154.7	158.6	0	0	0	0	0	118.4
581	S	28.8	Very low	30.1	Very low	99 Å²	99	142.1 Å²	142.1	69%	0.692	77%	0.768	S	S	*	*			cis	-164.7	160.5	-30.7	63.1	0	0	0	0	111.5
582	S	32.3	Very low	30.2	Very low	90 Å²	90	143.3 Å²	143.3	63%	0.629	77%	0.766	S	S	*	*			trans	74.8	137.8	151.6	93.5	0	0	0	0	117.6
583	K	31.8	Very low	29.9	Very low	194 Å²	194	148.9 Å²	148.9	84%	0.843	77%	0.773	S	S	*	*				71.4	140.1	101.9	-70.3	177.1	-167.5	169.3	0	114.7
584	H	29.5	Very low	29.8	Very low	145 Å²	145	152.3 Å²	152.3	67%	0.671	77%	0.771	S	S	*	*			cis	-168.1	178.2	-14.2	-164.9	68.6	0	0	0	109
585	Q	32.6	Very low	29.7	Very low	162 Å²	162	159.1 Å²	159.1	76%	0.757	78%	0.781	S	S	*	*			trans	72.5	135.7	170.9	-46.1	-173.3	20.1	0	0	115.7
586	K	29	Very low	29.5	Very low	171 Å²	171	153.7 Å²	153.7	74%	0.743	78%	0.776	S	S	*	*			cis	80.9	96.3	32.1	-63.7	175.5	175.8	166.4	0	115.6
587	R	31.4	Very low	29.4	Very low	235 Å²	235	152.4 Å²	152.4	89%	0.887	77%	0.773	S	S	*	*				174.9	114.1	110.2	-93.5	158.9	75.6	148.1	-1.1	117.1
588	K	32.3	Very low	29.4	Very low	186 Å²	186	154.8 Å²	154.8	81%	0.809	78%	0.778	S	S	*	*				40	126	124.2	-72.4	179.7	176.8	172.2	0	122
589	K	31.3	Very low	29.2	Very low	171 Å²	171	154.9 Å²	154.9	74%	0.743	78%	0.779	S	S	*	*				99	120.4	125.8	-85.4	179	172.7	178.2	0	121.3
590	R	28.3	Very low	29.1	Very low	187 Å²	187	150.8 Å²	150.8	71%	0.706	77%	0.771	S	S	*	*			trans	69	154	134.3	-75	179.1	150.9	-174	-3.4	116.9
591	R	31.4	Very low	29	Very low	189 Å²	189	156.8 Å²	156.8	71%	0.713	77%	0.774	S	S	*	*			cis	-163.9	154.5	9	-134.4	175.3	171.1	175.9	-5.9	112.3
592	K	28.9	Very low	28.8	Very low	171 Å²	171	163.1 Å²	163.1	74%	0.743	78%	0.782	S	S	*	*			trans	80.7	118.8	133	-164.6	-176.2	-179.6	-169.3	0	122
593	R	28.2	Very low	28.5	Very low	211 Å²	211	169.2 Å²	169.2	80%	0.796	79%	0.792	S	S	*	*			trans	92.8	122.5	143.1	-95.3	-172.8	172.7	-171	-4.1	123.6
594	Q	27.9	Very low	28.3	Very low	175 Å²	175	166.4 Å²	166.4	82%	0.818	79%	0.785	S	S	*	*			trans	-21	155.6	140.9	-60	161.9	-43.9	0	0	116.6
595	K	27.6	Very low	28	Very low	212 Å²	212	163.9 Å²	163.9	92%	0.922	78%	0.784	S	S	*	*				-176.2	153.4	66.8	-178.5	-177.5	178	-171.6	0	113.5
596	G	24.9	Very low	27.7	Very low	79 Å²	79	161.4 Å²	161.4	81%	0.814	79%	0.785	S	S	*	*			trans	98.3	151.6	167.9	0	0	0	0	0	114
597	G	26.6	Very low	27.5	Very low	72 Å²	72	157.4 Å²	157.4	74%	0.742	78%	0.783	S	S	*	*			cis	-147.4	155.6	-10.3	0	0	0	0	0	108.8
598	S	25.6	Very low	27.3	Very low	122 Å²	122	151.1 Å²	151.1	85%	0.853	78%	0.776	S	S	*	*				95.5	132.3	66.5	-167	0	0	0	0	113.5
599	A	27	Very low	27.1	Very low	99 Å²	99	147.8 Å²	147.8	82%	0.818	78%	0.776	S	S	*	*			trans	65.7	155.4	165.7	0	0	0	0	0	119.5
600	S	26.7	Very low	27.7	Very low	102 Å²	102	146.2 Å²	146.2	71%	0.713	78%	0.783	S	S	*	*			cis	-166.6	121.9	-30.2	-167.9	0	0	0	0	114.1
601	R	26.8	Very low	27.7	Very low	220 Å²	220	140.9 Å²	140.9	83%	0.83	79%	0.786	S	S	*	*			trans	37.8	120.4	132.8	-170.1	-162	-62.8	-167.2	-1.7	121.9
602	R	25.7	Very low	27.5	Very low	232 Å²	232	135.2 Å²	135.2	88%	0.875	79%	0.787	S	S	*	*			trans	-173	135.8	132.5	-93.6	149.2	-154.1	-130.7	7.7	108
603	R	25.7	Very low	27.8	Very low	218 Å²	218	135.6 Å²	135.6	82%	0.823	80%	0.796	S	S	*	*				66.5	135.6	71.4	-80.5	-166.1	174.4	-153.5	0.4	112.5
604	L	26	Very low	28	Very low	135 Å²	135	132.6 Å²	132.6	71%	0.707	80%	0.795	S	S	*	*			cis	-158.6	-179.9	19	-117.9	161.9	0	0	0	113.5
605	S	25.2	Very low	28.1	Very low	92 Å²	92	128.6 Å²	128.6	64%	0.643	79%	0.792	S	S	*	*			trans	-14.2	162.4	157.9	54.3	0	0	0	0	121.7
606	S	25.6	Very low	28.2	Very low	111 Å²	111	121.7 Å²	121.7	78%	0.776	78%	0.781	S	S	*	*			cis	178.9	166.2	-5.6	48.6	0	0	0	0	113.5
607	A	25.3	Very low	28.6	Very low	87 Å²	87	126.4 Å²	126.4	72%	0.719	79%	0.787	S	S	*	*			trans	87.2	131.4	144	0	0	0	0	0	124.1
608	S	26.5	Very low	28.8	Very low	103 Å²	103	129.5 Å²	129.5	72%	0.72	79%	0.791	S	S	*	*			trans	58.7	117.6	139.3	60.4	0	0	0	0	125.3
609	S	28	Very low	28.8	Very low	116 Å²	116	130.1 Å²	130.1	81%	0.811	78%	0.781	S	S	*	*				51.2	162	119.4	-51.6	0	0	0	0	122.2
610	P	44.6	Very low	29.6	Very low	137 Å²	137	130.3 Å²	130.3	89%	0.89	77%	0.773	S	S	*	*			cis	-108.5	-140.3	6.7	45.2	-34.7	0	0	0	112.8
611	G	27.7	Very low	30.4	Very low	75 Å²	75	130.6 Å²	130.6	77%	0.773	77%	0.773	S	S	*	*			cis	-174.7	-159.1	7.3	0	0	0	0	0	113.9
612	G	27.9	Very low	30.5	Very low	71 Å²	71	129.7 Å²	129.7	73%	0.732	77%	0.769	S	S	*	*			trans	-173.3	-159.5	-178.7	0	0	0	0	0	115.4
613	L	34.3	Very low	30.6	Very low	178 Å²	178	125.1 Å²	125.1	93%	0.932	76%	0.762	S	S	*	*			trans	90.3	148.9	179.6	-56.5	-177.8	0	0	0	116.9
614	D	32.6	Very low	30.5	Very low	148 Å²	148	122 Å²	122	79%	0.791	76%	0.76	S	S	*	*			cis	-170.7	174.4	-15.5	-177.5	35	0	0	0	112.6
615	A	30.9	Very low	30.5	Very low	91 Å²	91	121 Å²	121	75%	0.752	77%	0.765	S	S	*	*			trans	75.6	149.8	160.8	0	0	0	0	0	121.5
616	G	28.9	Very low	30.7	Very low	67 Å²	67	121.7 Å²	121.7	69%	0.691	77%	0.77	S	S	*	*			cis	168.8	149.7	-12.8	0	0	0	0	0	116.9
617	L	33.9	Very low	31.5	Very low	178 Å²	178	121.3 Å²	121.3	93%	0.932	77%	0.765	S	S	*	*			trans	74	166.4	171.7	-44.5	176.8	0	0	0	116.5
618	V	29.2	Very low	31.9	Very low	137 Å²	137	124.4 Å²	124.4	83%	0.83	77%	0.769	S	S	*	*			cis	-142.7	-140.7	4.2	75.5	0	0	0	0	113.7
619	E	27.6	Very low	32.1	Very low	136 Å²	136	124.2 Å²	124.2	64%	0.636	77%	0.768	S	S	*	*			trans	-160.4	-173	-164.2	-128.8	-158.7	146.6	0	0	110.5
620	P	42.9	Very low	32.2	Very low	102 Å²	102	123.3 Å²	123.3	66%	0.662	77%	0.767	S	S	*	*			cis	-134.2	-153.1	-12	46.2	-27.2	0	0	0	112.4
621	P	44.3	Very low	31.4	Very low	109 Å²	109	122.6 Å²	122.6	71%	0.708	77%	0.766	S	S	*	*			cis	-129.8	152.7	-18.8	38.7	-21.6	0	0	0	117.6
622	R	28.7	Very low	31.3	Very low	200 Å²	200	125.2 Å²	125.2	76%	0.755	77%	0.766	S	S	*	*			trans	7.1	162.4	133.4	-44.7	-175.5	178.5	-134.6	-5.6	121.5
623	L	26.8	Very low	31.2	Very low	136 Å²	136	129.1 Å²	129.1	71%	0.712	77%	0.77	S	S	*	*			cis	-161.2	152.2	37.2	-86.7	173.7	0	0	0	114.8
624	L	24.7	Very low	30.9	Very low	152 Å²	152	129.3 Å²	129.3	80%	0.796	76%	0.763	S	S	*	*			trans	62.7	159.1	143.2	-66.9	170.9	0	0	0	120.7
625	S	24.6	Very low	30.6	Very low	114 Å²	114	130.1 Å²	130.1	80%	0.797	77%	0.766	S	S	*	*			cis	-153	169.5	-0.6	26.8	0	0	0	0	113.1
626	S	29.7	Very low	30.4	Very low	107 Å²	107	133.6 Å²	133.6	75%	0.748	76%	0.764	S	S	*	*			trans	-125.7	163.8	168.7	-174.9	0	0	0	0	109.3
627	P	43.5	Very low	30.3	Very low	104 Å²	104	136.9 Å²	136.9	68%	0.675	77%	0.77	S	S	*	*				-160.3	161.3	104.1	40.9	-21.6	0	0	0	119.5
628	N	31.7	Very low	29.9	Very low	151 Å²	151	135.6 Å²	135.6	81%	0.807	76%	0.76	S	S	*	*			trans	69.3	151	139.3	-70.1	-0.6	0	0	0	122.1
629	S	32.1	Very low	29.9	Very low	100 Å²	100	136.6 Å²	136.6	70%	0.699	76%	0.759	S	S	*	*			cis	-165	161.6	-4.1	-113.5	0	0	0	0	115.4
630	A	29.2	Very low	29.9	Very low	96 Å²	96	135.6 Å²	135.6	79%	0.793	77%	0.767	S	S	*	*			trans	68.1	150.9	151.2	0	0	0	0	0	120.6
631	S	27.8	Very low	29.2	Very low	122 Å²	122	139.3 Å²	139.3	85%	0.853	78%	0.775	S	S	*	*			cis	-161.1	169	-11.1	43.9	0	0	0	0	112.6
632	V	26.9	Very low	28.6	Very low	130 Å²	130	140.1 Å²	140.1	79%	0.788	78%	0.78	S	S	*	*			trans	-90.2	157	-171.6	-117.4	0	0	0	0	114.7
633	L	25.7	Very low	28.8	Very low	153 Å²	153	137.7 Å²	137.7	80%	0.801	78%	0.781	S	S	*	*				-171.5	165.9	83.9	-77.5	169.9	0	0	0	109.4
634	K	27.5	Very low	28.8	Very low	182 Å²	182	137.6 Å²	137.6	79%	0.791	78%	0.781	S	S	*	*			cis	117.2	82.1	2.2	-169.3	-159.2	170.4	-174.7	0	115.6
635	I	26.4	Very low	29.1	Very low	166 Å²	166	139.3 Å²	139.3	85%	0.851	78%	0.782	S	S	*	*			trans	-145.9	111.9	166.6	-94.3	154.4	0	0	0	107.7
636	K	25.5	Very low	29.2	Very low	164 Å²	164	140.8 Å²	140.8	71%	0.713	78%	0.781	S	S	*	*				71.9	104.3	89.7	-155.1	-162.1	-173.7	-161.4	0	114.6	E638	K636-E638 WeakPolarHBondContact CE-OE1 3.32Å; K636-E638 IonicContact NZ-OE1 2.6Å; K636-E638 PolarHBondContact NZ-OE1 3.15Å
637	T	28.4	Very low	29.4	Very low	135 Å²	135	142.3 Å²	142.3	83%	0.828	78%	0.781	S	S	*	*			trans	-106.2	133.7	166.3	48.8	0	0	0	0	109.6
638	E	25	Very low	28.6	Very low	152 Å²	152	143.9 Å²	143.9	71%	0.71	78%	0.784	S	S	*	*			trans	-97.2	161.4	170.2	-79.9	172	-178.4	0	0	111.6	K636	K636-E638 WeakPolarHBondContact CE-OE1 3.32Å; K636-E638 IonicContact NZ-OE1 2.6Å; K636-E638 PolarHBondContact NZ-OE1 3.15Å
639	I	28	Very low	28.4	Very low	158 Å²	158	141.4 Å²	141.4	81%	0.81	78%	0.779	S	S	*	*			trans	-107.5	143.4	-175.2	-67	169.9	0	0	0	108.3
640	S	27.6	Very low	28.4	Very low	114 Å²	114	141.8 Å²	141.8	80%	0.797	78%	0.781	S	S	*	*			trans	-128.8	143.1	169.1	-52.8	0	0	0	0	108.9
641	E	30.3	Very low	28.4	Very low	180 Å²	180	144.8 Å²	144.8	84%	0.841	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-77.7	153	-168	-63.2	-175.7	138	0	0	112.8
642	P	30.6	Very low	28.8	Very low	126 Å²	126	150.1 Å²	150.1	82%	0.818	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-73.9	127.9	179.3	30	-34	0	0	0	111.6	N644	P642-N644 PolarHBondContact O-N 3.11Å
643	I	32	Very low	28.9	Very low	149 Å²	149	151.2 Å²	151.2	76%	0.764	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-71.8	125.1	169.1	-62.9	175.8	0	0	0	108.5	F645	I643-F645 HydrophobicContact CG2-CD2 4.15Å; I643-F645 HydrophobicContact CG2-CE2 4.18Å
644	N	27.8	Very low	29.3	Very low	134 Å²	134	153.9 Å²	153.9	72%	0.717	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-75.6	140	178.1	-158.8	32.9	0	0	0	110.5	P642	P642-N644 PolarHBondContact O-N 3.11Å
645	F	30.1	Very low	29.5	Very low	188 Å²	188	150.6 Å²	150.6	83%	0.825	78%	0.783	S	S	*	*			trans	-137.7	116.9	171.6	-106.1	-82.8	0	0	0	110.1	I643	I643-F645 HydrophobicContact CG2-CD2 4.15Å; I643-F645 HydrophobicContact CG2-CE2 4.18Å
646	D	27.5	Very low	30	Very low	145 Å²	145	148.6 Å²	148.6	78%	0.775	78%	0.781	S	S	*	*			trans	-72.7	153.4	177.7	-76.5	-67.8	0	0	0	112.5
647	N	33.8	Very low	30.2	Very low	139 Å²	139	148.7 Å²	148.7	74%	0.743	79%	0.79	S	S	*	*			trans	-84	113.2	174.9	168.5	100	0	0	0	110.2
648	D	26.7	Very low	30.4	Very low	137 Å²	137	154 Å²	154	73%	0.733	79%	0.794	S	S	*	*				-173.3	156.6	126.2	-106.9	-25.4	0	0	0	114.9
649	S	27.3	Very low	30.6	Very low	100 Å²	100	154.6 Å²	154.6	70%	0.699	80%	0.797	S	S	*	*			trans	68	121.5	158.4	66.6	0	0	0	0	121.6
650	S	33.5	Very low	30.6	Very low	107 Å²	107	155.1 Å²	155.1	75%	0.748	80%	0.8	S	S	*	*			trans	50.3	99.8	144.7	57.9	0	0	0	0	121.1
651	I	28.5	Very low	30.7	Very low	160 Å²	160	155 Å²	155	82%	0.821	80%	0.799	S	S	*	*			trans	-128.7	109.9	137.8	-78.8	99.3	0	0	0	109.4
652	W	34.9	Very low	30.7	Very low	234 Å²	234	158.1 Å²	158.1	89%	0.886	80%	0.803	S	S	*	*			trans	-107.5	120.4	146.3	-86.5	97.3	0	0	0	105.9
653	N	29.7	Very low	30.6	Very low	153 Å²	153	159.9 Å²	159.9	82%	0.818	81%	0.806	S	S	*	*			trans	-167.8	116.8	159.9	-98.5	-37.3	0	0	0	110.3
654	Y	33.7	Very low	30.4	Very low	208 Å²	208	162.2 Å²	162.2	82%	0.816	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-96.8	137	162.8	-93.4	-91.9	0	0	0	108.8
655	P	32.5	Very low	30.5	Very low	113 Å²	113	161.4 Å²	161.4	73%	0.734	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-74.3	147.1	161.3	32.2	-32.4	0	0	0	110.4
656	P	36.9	Very low	30.6	Very low	124 Å²	124	158 Å²	158	81%	0.805	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-85.4	165.4	-175.6	34.7	-36.8	0	0	0	113.7
657	N	30.1	Very low	30.6	Very low	167 Å²	167	162.6 Å²	162.6	89%	0.893	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-55.5	143.8	167.2	-71	-27	0	0	0	111.9
658	R	32.5	Very low	30.4	Very low	245 Å²	245	161.5 Å²	161.5	93%	0.925	83%	0.826	S	S	*	*			trans	-149.2	157.8	151.8	-139.8	176.1	-176.3	179.1	1.3	112.6
659	E	28.3	Very low	30.5	Very low	166 Å²	166	163.2 Å²	163.2	78%	0.776	83%	0.832	S	S	*	*			trans	-93.6	148.4	-165.6	-62	155.9	120.1	0	0	113.3
660	I	29	Very low	30.7	Very low	168 Å²	168	164.8 Å²	164.8	86%	0.862	84%	0.838	S	S	*	*			trans	29.6	98.3	138	-47.1	170.3	0	0	0	116.8
661	S	28.7	Very low	30.6	Very low	112 Å²	112	169.4 Å²	169.4	78%	0.783	84%	0.844	S	S	*	*			trans	-152.9	126.3	141	61.9	0	0	0	0	113.5
662	R	29.9	Very low	31.3	Very low	246 Å²	246	167.1 Å²	167.1	93%	0.928	84%	0.84	S	S	*	*			trans	15.5	131.4	157.4	-62.9	177.7	178	163.4	-0.5	120.4
663	N	29.5	Very low	31.9	Very low	162 Å²	162	161.6 Å²	161.6	87%	0.866	83%	0.834	S	S	*	*			trans	-60.7	134.4	157.8	-62.9	-7.6	0	0	0	111.2
664	E	28.1	Very low	31.8	Very low	198 Å²	198	160.2 Å²	160.2	93%	0.925	84%	0.837	S	S	*	*			trans	-155.8	134.3	144.1	-117.2	163.4	-136.2	0	0	108.6
665	S	29.4	Very low	31.6	Very low	117 Å²	117	155.2 Å²	155.2	82%	0.818	83%	0.832	S	S	*	*			trans	-101.6	131.5	-170.5	54.3	0	0	0	0	112
666	P	32.7	Very low	31.3	Very low	117 Å²	117	158.6 Å²	158.6	76%	0.76	84%	0.838	S	S	*	*			trans	-86.9	147.7	-170.1	34.2	-36	0	0	0	113.5
667	Y	27.2	Very low	30.9	Very low	241 Å²	241	159.4 Å²	159.4	95%	0.945	83%	0.831	S	S	*	*			trans	-156	147.7	151.6	-107.6	-69	0	0	0	114.3
668	S	29	Very low	30.8	Very low	116 Å²	116	159.7 Å²	159.7	81%	0.811	83%	0.825	S	S	*	*			trans	83.4	136.7	161.9	-144.1	0	0	0	0	119.8
669	M	30	Very low	31.4	Very low	173 Å²	173	153.3 Å²	153.3	85%	0.852	82%	0.815	S	S	*	*			trans	-125.9	148.2	170.4	-64.5	180	-76.9	0	0	108.4
670	T	30.1	Very low	31.5	Very low	134 Å²	134	150.4 Å²	150.4	82%	0.822	81%	0.813	S	S	*	*				-172.2	103.6	129.9	25.6	0	0	0	0	114
671	K	32	Very low	32.6	Very low	203 Å²	203	147.9 Å²	147.9	88%	0.883	81%	0.807	S	S	*	*			trans	60	161.5	133.6	-74.9	-165.7	171.8	-175.9	0	122.7
672	P	42.8	Very low	33	Very low	112 Å²	112	151.7 Å²	151.7	73%	0.727	81%	0.813	S	S	*	*			trans	-129	-145.8	-155.1	48.4	-30.9	0	0	0	110.9
673	P	48.8	Very low	33.1	Very low	118 Å²	118	143.3 Å²	143.3	77%	0.766	80%	0.803	S	S	*	*			cis	-128.4	175.7	-23.4	40	-25.1	0	0	0	114
674	S	26.5	Very low	33.1	Very low	125 Å²	125	139.8 Å²	139.8	87%	0.874	81%	0.805	S	S	*	*			trans	-155.5	159.8	151.1	58.8	0	0	0	0	111.7
675	S	28.9	Very low	33.2	Very low	103 Å²	103	134.2 Å²	134.2	72%	0.72	80%	0.8	S	S	*	*			trans	-148.3	146.5	-170	53.2	0	0	0	0	111.3
676	E	27.1	Very low	33.3	Very low	183 Å²	183	132.9 Å²	132.9	86%	0.855	81%	0.805	S	S	*	*			trans	66.2	154	161.4	-74.1	-178.6	-148.7	0	0	117.2
677	H	29.5	Very low	33.3	Very low	142 Å²	142	131.2 Å²	131.2	66%	0.657	81%	0.809	S	S	*	*			cis	-166.2	-170.1	-19.4	-175.3	44.8	0	0	0	108.7
678	F	26.3	Very low	33.5	Very low	173 Å²	173	123.6 Å²	123.6	76%	0.759	80%	0.804	S	S	*	*			trans	80.1	156.6	161.2	-80.6	-48.5	0	0	0	120
679	P	46.2	Very low	33.6	Very low	110 Å²	110	122.2 Å²	122.2	71%	0.714	81%	0.808	S	S	*	*				-140.2	-159.9	-116.3	49.5	-32.7	0	0	0	117.2
680	S	31	Very low	33.7	Very low	106 Å²	106	117.9 Å²	117.9	74%	0.741	81%	0.808	S	S	*	*			trans	-52.9	170.8	166.4	-20.3	0	0	0	0	115.2
681	P	51.2	Low	33.7	Very low	115 Å²	115	115.5 Å²	115.5	75%	0.747	81%	0.81	S	S	*	*				-135.3	-164.3	59.3	41.8	-23.6	0	0	0	112.3
682	Q	37.1	Very low	33.7	Very low	191 Å²	191	110 Å²	110	89%	0.893	81%	0.811	S	S	*	*			cis	-159.4	157.8	8.1	-148.8	164.6	42.8	0	0	107.3
683	G	31.6	Very low	33.1	Very low	70 Å²	70	108.6 Å²	108.6	72%	0.722	82%	0.817	S	S	*	*			cis	170.8	-176.9	-5.9	0	0	0	0	0	111.2
684	G	30.1	Very low	32.5	Very low	89 Å²	89	111.2 Å²	111.2	92%	0.918	82%	0.823	S	S	*	*			trans	105.4	129.5	174.4	0	0	0	0	0	114.9
685	G	30.5	Very low	32.6	Very low	80 Å²	80	114.2 Å²	114.2	83%	0.825	82%	0.823	S	S	*	*			cis	177.4	131	-9.9	0	0	0	0	0	114.2
686	G	30.7	Very low	32.7	Very low	89 Å²	89	115.7 Å²	115.7	92%	0.918	83%	0.827	S	S	*	*			trans	78.8	142.6	172.4	0	0	0	0	0	116
687	G	31.8	Very low	32.9	Very low	82 Å²	82	111.4 Å²	111.4	85%	0.845	82%	0.824	S	S	*	*			cis	168.5	150.4	-9.2	0	0	0	0	0	112.8
688	G	31.8	Very low	33.2	Very low	82 Å²	82	111.8 Å²	111.8	85%	0.845	83%	0.829	S	S	*	*			trans	105.5	124.3	174.5	0	0	0	0	0	114.7
689	G	31.9	Very low	33.9	Very low	86 Å²	86	109.3 Å²	109.3	89%	0.887	83%	0.83	S	S	*	*			trans	-87.5	-172.3	179.8	0	0	0	0	0	114
690	G	31.6	Very low	33.2	Very low	83 Å²	83	111.2 Å²	111.2	86%	0.856	83%	0.834	S	S	*	*			cis	156.6	154.9	-3.5	0	0	0	0	0	112.4
691	G	30.9	Very low	33.7	Very low	83 Å²	83	112 Å²	112	86%	0.856	84%	0.84	S	S	*	*			trans	110.7	91.5	166.1	0	0	0	0	0	117.6
692	G	31.8	Very low	32.9	Very low	88 Å²	88	112.2 Å²	112.2	91%	0.907	84%	0.839	S	S	*	*			trans	65.4	138.9	139.4	0	0	0	0	0	121.5
693	G	30.6	Very low	32.6	Very low	82 Å²	82	111.1 Å²	111.1	85%	0.845	84%	0.838	S	S	*	*			trans	147	124.8	160	0	0	0	0	0	115.3
694	L	34.7	Very low	32.9	Very low	173 Å²	173	114 Å²	114	91%	0.906	84%	0.842	S	S	*	*			trans	-77.8	131	170.1	-70.7	153	0	0	0	110.7
695	H	29.5	Very low	33.4	Very low	188 Å²	188	115.1 Å²	115.1	87%	0.87	83%	0.833	S	S	*	*			trans	-168.5	153.8	133.1	-122.1	-131.4	0	0	0	113.1
696	V	31.8	Very low	34.3	Very low	134 Å²	134	117.4 Å²	117.4	81%	0.812	83%	0.834	S	S	*	*			trans	-112.9	132	164	175.5	0	0	0	0	106.9
697	A	30.6	Very low	34.4	Very low	94 Å²	94	117.1 Å²	117.1	78%	0.777	83%	0.831	S	S	*	*			trans	-105.2	141.1	-174.8	0	0	0	0	0	112.1
698	I	35.9	Very low	34.7	Very low	150 Å²	150	118 Å²	118	77%	0.769	83%	0.829	S	S	*	*			trans	-115.6	132.8	169	-59.7	173.7	0	0	0	106.6
699	P	39.8	Very low	34.8	Very low	120 Å²	120	122.4 Å²	122.4	78%	0.779	83%	0.834	S	S	*	*			trans	-86.4	110.5	179.3	32.2	-31.8	0	0	0	111.9
700	D	32.1	Very low	34.7	Very low	150 Å²	150	122 Å²	122	80%	0.802	83%	0.83	S	S	*	*			trans	-79.2	143	161.9	-85.5	-46	0	0	0	110.9	V702	D700-V702 HydrophobicContact CB-CG2 4.27Å
701	S	41.3	Very low	34.8	Very low	124 Å²	124	123 Å²	123	87%	0.867	83%	0.83	S	S	*	*			trans	-139.8	128.7	161.4	48	0	0	0	0	109
702	V	34.6	Very low	34.7	Very low	119 Å²	119	124 Å²	124	72%	0.721	83%	0.83	S	S	*	*			trans	-119.5	148.4	-148.5	172.7	0	0	0	0	112.8	D700	D700-V702 HydrophobicContact CB-CG2 4.27Å
703	L	30.4	Very low	34.7	Very low	167 Å²	167	124 Å²	124	87%	0.874	82%	0.821	S	S	*	*			trans	-68.3	139	176	-62.7	160.4	0	0	0	112.5
704	T	37.9	Very low	34.7	Very low	131 Å²	131	131.5 Å²	131.5	80%	0.804	82%	0.824	S	S	*	*			trans	-142.8	121.7	167	-31.1	0	0	0	0	111.5
705	P	41.6	Very low	34.6	Very low	112 Å²	112	131.7 Å²	131.7	73%	0.727	82%	0.818	S	S	*	*			trans	-91	152.1	171.8	35.4	-32.8	0	0	0	112.1
706	P	49.7	Very low	34.5	Very low	129 Å²	129	127.5 Å²	127.5	84%	0.838	81%	0.805	S	S	*	*			trans	-78.4	152.1	173.4	32.5	-34.3	0	0	0	112.5
707	G	31.8	Very low	34.5	Very low	83 Å²	83	128.3 Å²	128.3	86%	0.856	80%	0.8	S	S	*	*			trans	-81.1	-179	175.1	0	0	0	0	0	113.9
708	A	38.6	Very low	34.4	Very low	99 Å²	99	133.2 Å²	133.2	82%	0.818	81%	0.805	S	S	*	*			trans	-124.4	143.8	-176.7	0	0	0	0	0	111.9
709	D	33.6	Very low	34	Very low	176 Å²	176	129.1 Å²	129.1	94%	0.941	80%	0.799	S	S	*	*			trans	-160.9	159.3	155.4	-126	-31.7	0	0	0	111.2
710	G	31.1	Very low	33.5	Very low	77 Å²	77	128.3 Å²	128.3	79%	0.794	80%	0.802	S	S	*	*			trans	105.2	118.6	173.8	0	0	0	0	0	115.7
711	A	32.3	Very low	33.4	Very low	104 Å²	104	126.9 Å²	126.9	86%	0.86	80%	0.804	S	S	*	*			trans	-127.1	132	-175.4	0	0	0	0	0	113.2
712	A	30.1	Very low	33	Very low	104 Å²	104	124.9 Å²	124.9	86%	0.86	80%	0.795	S	S	*	*			trans	-158.5	116.5	161.1	0	0	0	0	0	114
713	A	31	Very low	32.9	Very low	88 Å²	88	125.9 Å²	125.9	73%	0.727	80%	0.802	S	S	*	*			trans	14.9	147	145	0	0	0	0	0	123.9
714	R	31.5	Very low	32.9	Very low	239 Å²	239	122.5 Å²	122.5	90%	0.902	80%	0.798	S	S	*	*			trans	73.9	156.7	150.7	-72.6	171.8	-177.2	-169.9	2.9	117.6
715	K	30.6	Very low	32.6	Very low	178 Å²	178	120.5 Å²	120.5	77%	0.774	80%	0.795	S	S	*	*			cis	-170.8	140.6	-29.8	-157.4	-167.4	-179.2	-168.9	0	108.9
716	T	29.1	Very low	32	Very low	99 Å²	99	123.4 Å²	123.4	61%	0.607	80%	0.803	S	S	*	*			trans	48.2	130.6	152.2	44.6	0	0	0	0	123.4
717	Q	30.7	Very low	31.3	Very low	152 Å²	152	121.4 Å²	121.4	71%	0.71	80%	0.798	S	S	*	*			trans	83.3	133.8	133	-78.6	174.8	-51.6	0	0	123.2
718	F	29.2	Very low	32.1	Very low	197 Å²	197	123 Å²	123	86%	0.864	79%	0.792	S	S	*	*			trans	55.9	155.9	153.3	-62.4	-59.6	0	0	0	119.2
719	G	27.5	Very low	31.7	Very low	63 Å²	63	124.9 Å²	124.9	65%	0.649	79%	0.794	S	S	*	*			cis	167.6	170.9	-4	0	0	0	0	0	111.5
720	A	28.5	Very low	31.7	Very low	103 Å²	103	120.9 Å²	120.9	85%	0.851	79%	0.785	S	S	*	*			trans	64.8	138.3	-174.4	0	0	0	0	0	115.2
721	S	31	Very low	31.9	Very low	120 Å²	120	122.3 Å²	122.3	84%	0.839	78%	0.783	S	S	*	*			cis	94.1	154.9	30.5	-159.2	0	0	0	0	114.6
722	A	33	Very low	32	Very low	83 Å²	83	125.3 Å²	125.3	69%	0.686	79%	0.785	S	S	*	*			trans	70.4	131.8	-167	0	0	0	0	0	115.6
723	T	31.2	Very low	32.8	Very low	140 Å²	140	125.8 Å²	125.8	86%	0.859	78%	0.779	S	S	*	*			cis	98.6	95.7	18.4	70.6	0	0	0	0	117.2
724	A	31.6	Very low	32.9	Very low	95 Å²	95	129.9 Å²	129.9	79%	0.785	79%	0.788	S	S	*	*			trans	-165.2	138.8	153.1	0	0	0	0	0	106.6
725	A	30.9	Very low	33.2	Very low	90 Å²	90	124.1 Å²	124.1	74%	0.744	78%	0.784	S	S	*	*			cis	66.7	133.8	49.7	0	0	0	0	0	113
726	L	29.5	Very low	34	Very low	173 Å²	173	121.5 Å²	121.5	91%	0.906	79%	0.785	S	S	*	*			cis	-170.4	-170.4	-11.1	-120	170.6	0	0	0	107.6
727	A	35.2	Very low	35	Very low	87 Å²	87	122.1 Å²	122.1	72%	0.719	79%	0.791	S	S	*	*			trans	87	163.2	156.1	0	0	0	0	0	119
728	P	48.5	Very low	35	Very low	115 Å²	115	122.5 Å²	122.5	75%	0.747	80%	0.797	S	S	*	*				-152.8	-166.3	-109.5	42	-16.9	0	0	0	118.9
729	V	30.9	Very low	35.1	Very low	139 Å²	139	118.3 Å²	118.3	84%	0.842	79%	0.792	S	S	*	*			trans	68.8	120.8	157.3	-175.5	0	0	0	0	121.6
730	A	33.2	Very low	35.1	Very low	92 Å²	92	120.3 Å²	120.3	76%	0.76	80%	0.802	S	S	*	*			trans	-170	156.6	139.9	0	0	0	0	0	109.8
731	S	35.5	Very low	35.3	Very low	108 Å²	108	121 Å²	121	76%	0.755	80%	0.801	S	S	*	*			cis	-174.5	126.2	-36.8	52.7	0	0	0	0	109.3
732	D	32.8	Very low	36.5	Very low	167 Å²	167	120.5 Å²	120.5	89%	0.893	80%	0.795	S	S	*	*			trans	-85.8	158.6	-179.4	-95.6	-37.6	0	0	0	114.7
733	P	48.3	Very low	36.4	Very low	113 Å²	113	126.4 Å²	126.4	73%	0.734	80%	0.8	S	S	*	*			trans	-128.2	99.4	156.8	35.8	-20.7	0	0	0	114.7
734	L	32.3	Very low	36.6	Very low	174 Å²	174	125.2 Å²	125.2	91%	0.911	79%	0.788	S	S	*	*			trans	47.7	139.7	135.3	-58.9	173.8	0	0	0	123.2
735	S	37.2	Very low	36.5	Very low	118 Å²	118	130.7 Å²	130.7	83%	0.825	79%	0.794	S	S	*	*			trans	-118.6	154.9	168.8	-52.4	0	0	0	0	112.5
736	P	47.3	Very low	36.7	Very low	123 Å²	123	134.9 Å²	134.9	80%	0.799	80%	0.798	S	S	*	*			trans	-114.7	170	159.8	33.6	-19.7	0	0	0	112.8
737	P	51.3	Low	37.6	Very low	113 Å²	113	132.7 Å²	132.7	73%	0.734	79%	0.794	S	S	*	*				-133.3	165.1	-124.1	31.9	-10.8	0	0	0	120.1
738	L	30.7	Very low	37.5	Very low	159 Å²	159	131.7 Å²	131.7	83%	0.832	79%	0.792	S	S	*	*			trans	60.5	125.1	140.2	-67.9	171.4	0	0	0	124.4
739	S	30.4	Very low	36.7	Very low	110 Å²	110	134.6 Å²	134.6	77%	0.769	80%	0.802	S	S	*	*			trans	55.2	126.9	133.1	68.4	0	0	0	0	123.9
740	A	28.2	Very low	36.7	Very low	104 Å²	104	131.5 Å²	131.5	86%	0.86	80%	0.797	S	S	*	*				-177.3	158.7	123.5	0	0	0	0	0	114.4
741	S	31.9	Very low	36.7	Very low	117 Å²	117	131 Å²	131	82%	0.818	80%	0.801	S	S	*	*			trans	-167.8	169.3	168.3	-114.8	0	0	0	0	108.6
742	P	56.1	Low	36.5	Very low	110 Å²	110	130.1 Å²	130.1	71%	0.714	81%	0.809	S	S	*	*			cis	-137.3	-160.8	-7.8	29.6	-4	0	0	0	114
743	R	32.5	Very low	36.5	Very low	208 Å²	208	126 Å²	126	79%	0.785	81%	0.807	S	S	*	*			trans	96.6	127.2	152.4	-65.4	-173	95.3	139	9.5	123.4
744	D	34	Very low	35.8	Very low	115 Å²	115	124.9 Å²	124.9	62%	0.615	82%	0.815	S	S	*	*			trans	51.5	117.7	131.2	-50.7	-22	0	0	0	122.9
745	K	29.6	Very low	35.9	Very low	209 Å²	209	120.4 Å²	120.4	91%	0.909	81%	0.811	S	S	*	*				179.8	136.7	110.8	-99	164.8	-176	175.8	0	116.4
746	H	34.8	Very low	35.6	Very low	178 Å²	178	119 Å²	119	82%	0.824	82%	0.815	S	S	*	*			trans	-84.4	172	147	-103.7	-51.2	0	0	0	109.2
747	P	48.9	Very low	34.8	Very low	128 Å²	128	117.3 Å²	117.3	83%	0.831	82%	0.82	S	S	*	*			cis	-124.7	-167.4	18.8	39.5	-21.1	0	0	0	112.9
748	G	32.6	Very low	33.9	Very low	66 Å²	66	115.9 Å²	115.9	68%	0.68	83%	0.826	S	S	*	*			cis	153.2	170.3	-12.5	0	0	0	0	0	113.9
749	N	33.3	Very low	33.9	Very low	176 Å²	176	112 Å²	112	94%	0.941	83%	0.825	S	S	*	*			trans	78.2	143.1	164.7	-160.7	37.6	0	0	0	121.6
750	G	30.9	Very low	34	Very low	73 Å²	73	112.3 Å²	112.3	75%	0.753	83%	0.834	S	S	*	*			trans	95.1	132.3	163.2	0	0	0	0	0	117.5
751	G	31.7	Very low	34.2	Very low	82 Å²	82	110.7 Å²	110.7	85%	0.845	83%	0.827	S	S	*	*			cis	159.3	120	-13.6	0	0	0	0	0	115.3
752	G	31.8	Very low	34.2	Very low	89 Å²	89	110.3 Å²	110.3	92%	0.918	83%	0.831	S	S	*	*			trans	85.2	155.6	167.5	0	0	0	0	0	117.2
753	G	33.4	Very low	33	Very low	82 Å²	82	110.3 Å²	110.3	85%	0.845	84%	0.841	S	S	*	*			cis	167.4	145.2	-10.8	0	0	0	0	0	115.2
754	G	32.6	Very low	32.9	Very low	88 Å²	88	105 Å²	105	91%	0.907	84%	0.841	S	S	*	*			trans	86.5	150.5	168.3	0	0	0	0	0	117.1
755	G	33.7	Very low	33.5	Very low	81 Å²	81	105.1 Å²	105.1	84%	0.835	85%	0.848	S	S	*	*			cis	167.3	138.7	-11.1	0	0	0	0	0	114.9
756	G	31.3	Very low	33.4	Very low	88 Å²	88	99.4 Å²	99.4	91%	0.907	84%	0.84	S	S	*	*			trans	79.5	155.3	170.1	0	0	0	0	0	116.9
757	G	31.9	Very low	33.1	Very low	88 Å²	88	102.5 Å²	102.5	91%	0.907	84%	0.844	S	S	*	*			cis	155.4	126.8	-14.5	0	0	0	0	0	115.2
758	G	31.3	Very low	32.2	Very low	83 Å²	83	101.4 Å²	101.4	86%	0.856	84%	0.837	S	S	*	*			trans	118.4	122.7	153.1	0	0	0	0	0	120.1
759	G	31.7	Very low	32.1	Very low	78 Å²	78	103.8 Å²	103.8	80%	0.804	84%	0.838	S	S	*	*				97	112.1	122.4	0	0	0	0	0	122
760	A	32.4	Very low	32	Very low	116 Å²	116	101.3 Å²	101.3	96%	0.959	83%	0.832	S	S	*	*			trans	63.2	161.8	154.3	0	0	0	0	0	118.6
761	G	31.3	Very low	31.7	Very low	70 Å²	70	102.7 Å²	102.7	72%	0.722	83%	0.829	S	S	*	*			cis	170.6	107.2	-11.9	0	0	0	0	0	114.3
762	A	33.2	Very low	31.4	Very low	108 Å²	108	105.2 Å²	105.2	89%	0.893	83%	0.832	S	S	*	*			trans	47.9	109.3	160.3	0	0	0	0	0	121.3
763	A	30.6	Very low	31.2	Very low	111 Å²	111	106.5 Å²	106.5	92%	0.917	82%	0.822	S	S	*	*			trans	-156.8	145.7	144.6	0	0	0	0	0	112.2
764	A	30.6	Very low	30.9	Very low	95 Å²	95	110.2 Å²	110.2	79%	0.785	82%	0.822	S	S	*	*			trans	-142.8	173.6	173.1	0	0	0	0	0	107.3
765	P	46.2	Very low	30.5	Very low	119 Å²	119	109.5 Å²	109.5	77%	0.773	81%	0.814	S	S	*	*			cis	-143.3	-161.4	16.3	44.4	-24.2	0	0	0	115.6
766	A	27.5	Very low	30.1	Very low	88 Å²	88	111.4 Å²	111.4	73%	0.727	81%	0.81	S	S	*	*			trans	73.4	149	162.6	0	0	0	0	0	117.6
767	R	27.1	Very low	29.8	Very low	244 Å²	244	119 Å²	119	92%	0.921	81%	0.812	S	S	*	*			cis	-152.4	165.1	-9.6	-119.9	178.3	-177.3	-144.9	2.1	109.7
768	P	31.5	Very low	29.5	Very low	104 Å²	104	126.1 Å²	126.1	68%	0.675	81%	0.811	S	S	*	*			trans	-113.5	165.3	-164.3	42.3	-35.1	0	0	0	116.4
769	T	30.6	Very low	29.3	Very low	116 Å²	116	133.8 Å²	133.8	71%	0.712	81%	0.814	S	S	*	*			trans	67	160.6	166.8	69.5	0	0	0	0	116.5
770	P	30.7	Very low	28.9	Very low	124 Å²	124	136 Å²	136	81%	0.805	82%	0.816	S	S	*	*				-118.5	142.4	77.8	36.4	-33.8	0	0	0	114.8
771	C	24.6	Very low	28.8	Very low	103 Å²	103	142.7 Å²	142.7	70%	0.696	82%	0.816	S	S	*	*			trans	-90.4	135.8	159.4	-66.1	0	0	0	0	109.1	T773	C771-T773 PolarHBondContact O-N 3.08Å
772	C	25	Very low	28.6	Very low	134 Å²	134	142.6 Å²	142.6	91%	0.905	82%	0.815	S	S	*	*			trans	-90.3	100.3	165.4	-72.4	0	0	0	0	110.7
773	T	26.9	Very low	28.2	Very low	117 Å²	117	144 Å²	144	72%	0.718	82%	0.816	S	S	*	*			trans	-73	168.9	149.8	50.8	0	0	0	0	109	C771	C771-T773 PolarHBondContact O-N 3.08Å
774	L	27.2	Very low	28.1	Very low	160 Å²	160	149.8 Å²	149.8	84%	0.838	82%	0.815	S	S	*	*			cis	-132.9	169	8.7	-84.7	89.8	0	0	0	110.5
775	G	24.4	Very low	28	Very low	72 Å²	72	156.4 Å²	156.4	74%	0.742	82%	0.819	S	S	*	*			trans	-173.2	33.2	171.7	0	0	0	0	0	116.2	W777	G775-W777 PolarHBondContact O-N 3.33Å
776	T	26.5	Very low	27	Very low	122 Å²	122	155.8 Å²	155.8	75%	0.748	82%	0.824	S	S	*	*			trans	-69.9	117.4	-170.2	51.5	0	0	0	0	114.1
777	W	24.1	Very low	27.2	Very low	248 Å²	248	157.1 Å²	157.1	94%	0.939	82%	0.823	S	S	*	*			trans	-106	133.1	154.3	-98	63.2	0	0	0	110.6	G775 R779	G775-W777 PolarHBondContact O-N 3.33Å; W777-R779 PolarHBondContact O-N 3.49Å
778	R	25.1	Very low	27.1	Very low	236 Å²	236	151.5 Å²	151.5	89%	0.891	82%	0.822	S	S	*	*			trans	-78.7	107.7	-175.6	-65.7	-177.7	178.2	-144.4	-0.8	110.4	C780	R778-C780 PolarHBondContact O-N 2.84Å; R778-C780 VanDerWaalsContact O-N 3.17Å
779	R	27.6	Very low	26.9	Very low	245 Å²	245	151.9 Å²	151.9	93%	0.925	83%	0.826	S	S	*	*			trans	-63.9	112.4	164.9	-93.9	-175.6	169.3	175.9	-3.5	109.6	W777 R781	W777-R779 PolarHBondContact O-N 3.49Å; R779-R781 PolarHBondContact O-N 3.02Å
780	C	23.3	Very low	26.8	Very low	124 Å²	124	151.7 Å²	151.7	84%	0.838	83%	0.829	S	S	*	*			trans	-63.2	120.5	164.7	-72	0	0	0	0	109.6	R778 G782	R778-C780 PolarHBondContact O-N 2.84Å; R778-C780 VanDerWaalsContact O-N 3.17Å; C780-G782 PolarHBondContact O-N 2.7Å
781	R	31.2	Very low	26.7	Very low	257 Å²	257	156.7 Å²	156.7	97%	0.97	83%	0.832	S	S	*	*			trans	-73.4	110.8	163.2	-67.3	-179.1	176.4	-169.7	-1.1	107	R779	R779-R781 PolarHBondContact O-N 3.02Å
782	G	26.8	Very low	26.7	Very low	68 Å²	68	163.8 Å²	163.8	70%	0.701	84%	0.844	S	S	*	*			trans	-174.2	27.9	-169	0	0	0	0	0	119.8	C780	C780-G782 PolarHBondContact O-N 2.7Å
783	C	24.4	Very low	26.7	Very low	136 Å²	136	162.7 Å²	162.7	92%	0.919	84%	0.837	S	S	*	*			trans	-167.2	126.2	150.4	-101.1	0	0	0	0	110.8
784	R	28.2	Very low	26.7	Very low	234 Å²	234	163.6 Å²	163.6	88%	0.883	84%	0.842	S	S	*	*			trans	-124.3	143.1	164.9	-83.2	-174.6	172.5	-170.5	-2.7	107.2
785	R	30.2	Very low	26.8	Very low	233 Å²	233	163 Å²	163	88%	0.879	88%	0.875	S	S	*	*			trans	57.5	123.2	162.4	-65.2	179.8	174.5	-177	-4.2	117.6
786	A	24.9	Very low	26.9	Very low	106 Å²	106	167.6 Å²	167.6	88%	0.876	88%	0.881	S	S	*	*			trans	-140.1	60.5	146.9	0	0	0	0	0	109
787	T	30.5	Very low	26.9	Very low	116 Å²	116	169.9 Å²	169.9	71%	0.712	89%	0.888	S	S	*	*			trans	-70.2	129.6	162.7	32.5	0	0	0	0	108.4	C789	T787-C789 PolarHBondContact O-N 3.39Å
788	S	26.1	Very low	27	Very low	127 Å²	127	165.6 Å²	165.6	89%	0.888	89%	0.885	S	S	*	*			trans	-69.9	110.8	170.9	-173.4	0	0	0	0	108.8
789	C	27.6	Very low	27.2	Very low	112 Å²	112	161.5 Å²	161.5	76%	0.757	89%	0.885	S	S	*	*			trans	-119.6	101.9	171.2	-173.8	0	0	0	0	108.5	T787 R791	T787-C789 PolarHBondContact O-N 3.39Å; C789-R791 PolarHBondContact O-N 3.11Å
790	S	27	Very low	27.1	Very low	111 Å²	111	156.3 Å²	156.3	78%	0.776	88%	0.883	S	S	*	*			trans	-71.9	120.4	165.8	46.4	0	0	0	0	108.7
791	R	28.9	Very low	27.4	Very low	230 Å²	230	158.4 Å²	158.4	87%	0.868	89%	0.886	S	S	*	*			trans	-42.6	151.4	-177.4	-58.9	171	174.9	178.8	-4.4	113.6	C789	C789-R791 PolarHBondContact O-N 3.11Å
792	W	25.3	Very low	27.1	Very low	251 Å²	251	151.4 Å²	151.4	95%	0.951	88%	0.88	S	S	*	*				-141.8	-179	119.5	-117	48.4	0	0	0	109.5
793	C	24.2	Very low	27.1	Very low	111 Å²	111	157.8 Å²	157.8	75%	0.75	89%	0.893	S	S	*	*			trans	-63.5	156.4	-152.4	-55.6	0	0	0	0	118
794	T	28	Very low	27.4	Very low	137 Å²	137	159.6 Å²	159.6	84%	0.84	89%	0.891	S	S	*	*			trans	-119.1	120	144.8	51.8	0	0	0	0	108.7
795	G	27.6	Very low	27.3	Very low	147 Å²	147	152.8 Å²	152.8	100%	1.515	89%	0.892	S	S	*	*				-78.5	0	124.8	0	0	0	0	0	108.2

Retrieved 795 of 795 residues in 312.9 ms (Link to these results)

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