A0A077YXS8_TRITR Loading...

protein-tyrosine-phosphatase

AlphaFold DB , UniProt , Accession A0A077YXS8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 499 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	38.5	Very low	43.1	Very low	242 Å²	242	120.5 Å²	120.5	100%	1.192	66%	0.657	S	S	*	*				0	137.1	0	-68.9	173.1	176.2	0	0	107.8
2	L	39.9	Very low	43.5	Very low	173 Å²	173	118.5 Å²	118.5	91%	0.906	64%	0.644	S	S	*	*			trans	-88.7	117.9	179.8	-77	163.8	0	0	0	109.8	L4	L2-L4 PolarHBondContact O-N 3.08Å
3	L	42.6	Very low	43.5	Very low	175 Å²	175	119.7 Å²	119.7	92%	0.916	64%	0.642	S	S	*	*			trans	-74.7	107.7	173	-74.7	160.6	0	0	0	109.1
4	L	44	Very low	43.4	Very low	106 Å²	106	119.6 Å²	119.6	56%	0.555	64%	0.636	S	S	*	*			trans	-69.3	139.3	162.8	-104.7	74.8	0	0	0	109.1	L2 A8 I12	L2-L4 PolarHBondContact O-N 3.08Å; L4-A8 HydrophobicContact CD2-CB 4.4Å; L4-I12 HydrophobicContact CD2-CD1 4Å
5	P	47.2	Very low	43.2	Very low	91 Å²	91	116.9 Å²	116.9	59%	0.591	62%	0.622	S	S	*	*			trans	-58.1	140.8	171.2	-24.2	34.3	0	0	0	111.5	A7 A8 A9	P5-A7 PolarHBondContact O-N 3.16Å; P5-A7 VanDerWaalsContact O-N 3.11Å; P5-A8 WeakPolarHBondContact O-CA 3.37Å; P5-A8 WeakPolarHBondContact O-CB 3.41Å; P5-A8 PolarHBondContact O-N 3.37Å; P5-A9 PolarHBondContact O-N 3.47Å
6	V	48	Very low	43.1	Very low	106 Å²	106	116.6 Å²	116.6	64%	0.642	62%	0.619	S	S	*	*	H	α-helix	trans	-55.1	-34.5	-177.7	179.4	0	0	0	0	112.4	A9 R10	V6-A9 PolarHBondContact O-N 3.3Å; V6-R10 WeakPolarHBondContact O-CG 3.41Å; V6-R10 PolarHBondContact O-N 3.31Å
7	A	39.1	Very low	42.7	Very low	77 Å²	77	116.5 Å²	116.5	64%	0.636	62%	0.617	S	S	*	*	H	α-helix	trans	-64.5	-38.4	174.4	0	0	0	0	0	113.2	P5 H11	P5-A7 PolarHBondContact O-N 3.16Å; P5-A7 VanDerWaalsContact O-N 3.11Å; A7-H11 WeakPolarHBondContact O-CB 3.32Å; A7-H11 PolarHBondContact O-N 3.44Å
8	A	44.6	Very low	42.2	Very low	38 Å²	38	117.7 Å²	117.7	31%	0.314	62%	0.616	S	S	.	*	H	α-helix	trans	-72.6	-37.3	176.6	0	0	0	0	0	111.6	L4 P5 H11 I12	L4-A8 HydrophobicContact CD2-CB 4.4Å; P5-A8 WeakPolarHBondContact O-CA 3.37Å; P5-A8 WeakPolarHBondContact O-CB 3.41Å; P5-A8 PolarHBondContact O-N 3.37Å; A8-H11 PolarHBondContact O-N 2.99Å; A8-I12 WeakPolarHBondContact O-CD1 3.22Å; A8-I12 VanDerWaalsContact O-CG1 3.26Å; A8-I12 WeakPolarHBondContact O-CG1 3.47Å; A8-I12 PolarHBondContact O-N 3.37Å; A8-I12 VanDerWaalsContact O-N 3.09Å
9	A	44.2	Very low	41.8	Very low	40 Å²	40	118.7 Å²	118.7	33%	0.331	62%	0.615	S	S	.	*	H	α-helix	trans	-60.6	-51.7	172.5	0	0	0	0	0	111.2	P5 V6 H11 I12 E13	P5-A9 PolarHBondContact O-N 3.47Å; V6-A9 PolarHBondContact O-N 3.3Å; A9-H11 PolarHBondContact O-N 3.21Å; A9-I12 PolarHBondContact O-N 3.4Å; A9-I12 VanDerWaalsContact O-N 3.13Å; A9-E13 PolarHBondContact O-N 3.04Å
10	R	44.1	Very low	41.4	Very low	163 Å²	163	117.1 Å²	117.1	62%	0.615	61%	0.61	S	S	*	*	H	α-helix	trans	-57	-46.1	175.8	-77.6	-177.1	172.8	176.6	-2.5	112.6	V6 I12 E13 E14	V6-R10 WeakPolarHBondContact O-CG 3.41Å; V6-R10 PolarHBondContact O-N 3.31Å; R10-I12 PolarHBondContact O-N 3.41Å; R10-E13 PolarHBondContact O-N 3.18Å; R10-E14 WeakPolarHBondContact O-CB 3.34Å; R10-E14 VanDerWaalsContact O-CG 3.3Å; R10-E14 WeakPolarHBondContact O-CG 3.23Å; R10-E14 PolarHBondContact O-N 2.71Å
11	H	41.6	Very low	41	Very low	114 Å²	114	116.6 Å²	116.6	53%	0.528	60%	0.604	S	S	.	*	H	α-helix	trans	-68	-23.5	-178.8	-156.7	4.6	0	0	0	112.9	A7 A8 A9 E14 N15	A7-H11 WeakPolarHBondContact O-CB 3.32Å; A7-H11 PolarHBondContact O-N 3.44Å; A8-H11 PolarHBondContact O-N 2.99Å; A9-H11 PolarHBondContact O-N 3.21Å; H11-E14 IonicContact ND1-OE2 3.71Å; H11-N15 PolarHBondContact ND1-ND2 3.18Å; H11-N15 WeakPolarHBondContact O-CB 3.22Å; H11-N15 PolarHBondContact O-N 2.89Å; H11-N15 PolarHBondContact O-ND2 3.36Å
12	I	48.5	Very low	40.7	Very low	97 Å²	97	107.6 Å²	107.6	50%	0.497	56%	0.564	S	S	.	*	H	α-helix	trans	-77.9	-45.9	170.4	-69.3	166.7	0	0	0	110.9	L4 A8 A9 R10 N15 L16	L4-I12 HydrophobicContact CD2-CD1 4Å; A8-I12 WeakPolarHBondContact O-CD1 3.22Å; A8-I12 VanDerWaalsContact O-CG1 3.26Å; A8-I12 WeakPolarHBondContact O-CG1 3.47Å; A8-I12 PolarHBondContact O-N 3.37Å; A8-I12 VanDerWaalsContact O-N 3.09Å; A9-I12 PolarHBondContact O-N 3.4Å; A9-I12 VanDerWaalsContact O-N 3.13Å; R10-I12 PolarHBondContact O-N 3.41Å; I12-N15 PolarHBondContact O-N 3.24Å; I12-L16 WeakPolarHBondContact O-CB 3.4Å; I12-L16 PolarHBondContact O-N 3.46Å
13	E	43.2	Very low	40.4	Very low	134 Å²	134	105.6 Å²	105.6	63%	0.626	55%	0.55	S	S	*	*	H	α-helix	trans	-59.9	-45.4	175.8	-73.1	-173.6	132.4	0	0	111.9	A9 R10 N15 L16 M17	A9-E13 PolarHBondContact O-N 3.04Å; R10-E13 PolarHBondContact O-N 3.18Å; E13-N15 PolarHBondContact O-N 3.48Å; E13-L16 PolarHBondContact O-N 3.16Å; E13-M17 WeakPolarHBondContact O-CB 3.32Å; E13-M17 PolarHBondContact O-N 2.94Å
14	E	42.5	Very low	40	Very low	118 Å²	118	99.3 Å²	99.3	55%	0.551	53%	0.528	S	S	*	.	H	α-helix	trans	-54.8	-49.2	172.8	-76.4	170.5	-178.8	0	0	111	R10 H11 L16 F18	R10-E14 WeakPolarHBondContact O-CB 3.34Å; R10-E14 VanDerWaalsContact O-CG 3.3Å; R10-E14 WeakPolarHBondContact O-CG 3.23Å; R10-E14 PolarHBondContact O-N 2.71Å; H11-E14 IonicContact ND1-OE2 3.71Å; E14-L16 VanDerWaalsContact C-N 3.35Å; E14-L16 PolarHBondContact O-N 2.8Å; E14-F18 VanDerWaalsContact O-CB 3.23Å; E14-F18 WeakPolarHBondContact O-CB 3.26Å; E14-F18 PolarHBondContact O-N 2.77Å
15	N	39.9	Very low	39.6	Very low	80 Å²	80	95.7 Å²	95.7	43%	0.428	51%	0.513	S	S	.	.	H	α-helix	trans	-66.6	-31.6	178.1	-90.5	-72.6	0	0	0	113.7	H11 I12 E13 K19	H11-N15 PolarHBondContact ND1-ND2 3.18Å; H11-N15 WeakPolarHBondContact O-CB 3.22Å; H11-N15 PolarHBondContact O-N 2.89Å; H11-N15 PolarHBondContact O-ND2 3.36Å; I12-N15 PolarHBondContact O-N 3.24Å; E13-N15 PolarHBondContact O-N 3.48Å; N15-K19 WeakPolarHBondContact O-CG 3.38Å; N15-K19 PolarHBondContact O-N 3.03Å
16	L	42.5	Very low	38.9	Very low	111 Å²	111	100.2 Å²	100.2	58%	0.581	52%	0.519	S	S	*	.	H	α-helix	trans	-77.8	-41.5	179.4	-138.1	72.9	0	0	0	111.3	I12 E13 E14 F18 K19 T20	I12-L16 WeakPolarHBondContact O-CB 3.4Å; I12-L16 PolarHBondContact O-N 3.46Å; E13-L16 PolarHBondContact O-N 3.16Å; E14-L16 VanDerWaalsContact C-N 3.35Å; E14-L16 PolarHBondContact O-N 2.8Å; L16-F18 VanDerWaalsContact C-N 3.34Å; L16-K19 PolarHBondContact O-N 3Å; L16-T20 PolarHBondContact O-N 2.89Å; L16-T20 VanDerWaalsContact O-N 3.11Å; L16-T20 PolarHBondContact O-OG1 3.39Å
17	M	36.1	Very low	38.4	Very low	116 Å²	116	105.7 Å²	105.7	57%	0.571	53%	0.528	S	S	*	.	H	α-helix	trans	-58.6	-44.3	165.3	-89.4	-162.1	170.6	0	0	111.2	E13 K19 T20 F21	E13-M17 WeakPolarHBondContact O-CB 3.32Å; E13-M17 PolarHBondContact O-N 2.94Å; M17-K19 VanDerWaalsContact C-N 3.26Å; M17-K19 PolarHBondContact O-N 2.83Å; M17-T20 PolarHBondContact O-N 2.96Å; M17-T20 PolarHBondContact O-OG1 3.32Å; M17-F21 HydrophobicContact CB-CD2 4.04Å; M17-F21 HydrophobicContact CB-CE2 4.38Å; M17-F21 HydrophobicContact CE-CE2 4.39Å; M17-F21 HydrophobicContact CG-CD2 4.29Å; M17-F21 HydrophobicContact CG-CE2 4.15Å; M17-F21 VanDerWaalsContact O-CB 3.27Å; M17-F21 WeakPolarHBondContact O-CB 3.37Å; M17-F21 WeakPolarHBondContact O-CD2 3.15Å; M17-F21 PolarHBondContact O-N 3.26Å; M17-F21 HydrophobicContact SD-CD2 4.49Å; M17-F21 HydrophobicContact SD-CE2 3.93Å
18	F	33.2	Very low	38.5	Very low	138 Å²	138	106.3 Å²	106.3	61%	0.605	53%	0.527	S	S	*	.	H	α-helix	trans	-58.5	-40.3	-179.2	-155.7	-93.9	0	0	0	111.4	E14 L16 S22	E14-F18 VanDerWaalsContact O-CB 3.23Å; E14-F18 WeakPolarHBondContact O-CB 3.26Å; E14-F18 PolarHBondContact O-N 2.77Å; L16-F18 VanDerWaalsContact C-N 3.34Å; F18-S22 VanDerWaalsContact O-CB 3.24Å; F18-S22 WeakPolarHBondContact O-CB 3.32Å; F18-S22 PolarHBondContact O-N 2.81Å; F18-S22 PolarHBondContact O-OG 3.05Å
19	K	33.8	Very low	38.3	Very low	136 Å²	136	106.8 Å²	106.8	59%	0.591	53%	0.531	S	S	*	.	H	α-helix	trans	-65.8	-55.3	174.4	-74.8	175.4	179.8	174.4	0	112.3	N15 L16 M17 F21 S22 E23	N15-K19 WeakPolarHBondContact O-CG 3.38Å; N15-K19 PolarHBondContact O-N 3.03Å; L16-K19 PolarHBondContact O-N 3Å; M17-K19 VanDerWaalsContact C-N 3.26Å; M17-K19 PolarHBondContact O-N 2.83Å; K19-F21 PolarHBondContact O-N 2.63Å; K19-S22 PolarHBondContact O-N 2.58Å; K19-S22 VanDerWaalsContact O-N 3.08Å; K19-S22 PolarHBondContact O-OG 3.06Å; K19-E23 PolarHBondContact O-N 2.98Å; K19-E23 VanDerWaalsContact O-N 3.17Å
20	T	35.4	Very low	38.2	Very low	86 Å²	86	109.3 Å²	109.3	53%	0.528	55%	0.547	S	S	.	.	H	α-helix	trans	-66.2	-36.5	-177.1	54.7	0	0	0	0	112.8	L16 M17 E23 G24	L16-T20 PolarHBondContact O-N 2.89Å; L16-T20 VanDerWaalsContact O-N 3.11Å; L16-T20 PolarHBondContact O-OG1 3.39Å; M17-T20 PolarHBondContact O-N 2.96Å; M17-T20 PolarHBondContact O-OG1 3.32Å; T20-E23 PolarHBondContact O-N 3.44Å; T20-G24 PolarHBondContact O-N 3.32Å; T20-G24 VanDerWaalsContact O-N 3.09Å
21	F	31.4	Very low	38.4	Very low	108 Å²	108	107.3 Å²	107.3	47%	0.474	54%	0.544	S	S	.	.	H	α-helix	trans	-69.5	-28.3	171.1	-83.5	-70	0	0	0	113.3	M17 K19 G24 A25 R113	M17-F21 HydrophobicContact CB-CD2 4.04Å; M17-F21 HydrophobicContact CB-CE2 4.38Å; M17-F21 HydrophobicContact CE-CE2 4.39Å; M17-F21 HydrophobicContact CG-CD2 4.29Å; M17-F21 HydrophobicContact CG-CE2 4.15Å; M17-F21 VanDerWaalsContact O-CB 3.27Å; M17-F21 WeakPolarHBondContact O-CB 3.37Å; M17-F21 WeakPolarHBondContact O-CD2 3.15Å; M17-F21 PolarHBondContact O-N 3.26Å; M17-F21 HydrophobicContact SD-CD2 4.49Å; M17-F21 HydrophobicContact SD-CE2 3.93Å; K19-F21 PolarHBondContact O-N 2.63Å; F21-G24 PolarHBondContact O-N 2.89Å; F21-A25 WeakPolarHBondContact O-CB 3.48Å; F21-A25 PolarHBondContact O-N 3.12Å; F21-R113 VanDerWaalsContact CD1-NH2 3.32Å
22	S	33	Very low	38.8	Very low	52 Å²	52	103.2 Å²	103.2	36%	0.364	53%	0.527	S	S	.	.	H	α-helix	trans	-68.8	-35.7	173.5	75.6	0	0	0	0	112.3	F18 K19 R26	F18-S22 VanDerWaalsContact O-CB 3.24Å; F18-S22 WeakPolarHBondContact O-CB 3.32Å; F18-S22 PolarHBondContact O-N 2.81Å; F18-S22 PolarHBondContact O-OG 3.05Å; K19-S22 PolarHBondContact O-N 2.58Å; K19-S22 VanDerWaalsContact O-N 3.08Å; K19-S22 PolarHBondContact O-OG 3.06Å; S22-R26 WeakPolarHBondContact O-CG 3.49Å; S22-R26 PolarHBondContact O-N 3.41Å
23	E	33.5	Very low	38.7	Very low	131 Å²	131	104.5 Å²	104.5	61%	0.612	54%	0.535	S	S	*	.	H	α-helix	trans	-70.4	-35.4	173.7	-66.3	-176.3	148.8	0	0	111.8	K19 T20	K19-E23 PolarHBondContact O-N 2.98Å; K19-E23 VanDerWaalsContact O-N 3.17Å; T20-E23 PolarHBondContact O-N 3.44Å
24	G	33.8	Very low	39.6	Very low	43 Å²	43	105.7 Å²	105.7	44%	0.443	54%	0.54	S	S	.	.	H	α-helix	trans	-66.8	-48.4	170.5	0	0	0	0	0	113.4	T20 F21 R26 R27	T20-G24 PolarHBondContact O-N 3.32Å; T20-G24 VanDerWaalsContact O-N 3.09Å; F21-G24 PolarHBondContact O-N 2.89Å; G24-R26 VanDerWaalsContact C-N 3.29Å; G24-R26 PolarHBondContact O-N 2.94Å; G24-R27 WeakPolarHBondContact O-CB 3.41Å; G24-R27 PolarHBondContact O-N 3.33Å
25	A	35.8	Very low	41.2	Very low	30 Å²	30	104.8 Å²	104.8	25%	0.248	54%	0.539	C	S	.	.	H	α-helix	trans	-65.1	-29.4	-176.5	0	0	0	0	0	113.3	F21 R27 S28 A29	F21-A25 WeakPolarHBondContact O-CB 3.48Å; F21-A25 PolarHBondContact O-N 3.12Å; A25-R27 PolarHBondContact O-N 3.18Å; A25-R27 VanDerWaalsContact O-N 3.11Å; A25-S28 PolarHBondContact O-N 3.27Å; A25-S28 VanDerWaalsContact O-N 3.08Å; A25-S28 PolarHBondContact O-OG 2.93Å; A25-A29 PolarHBondContact O-N 2.92Å
26	R	33.6	Very low	43.5	Very low	187 Å²	187	102.7 Å²	102.7	71%	0.706	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-22	171.2	-84.6	175.2	168.9	176.7	-3.7	114	S22 G24 S30	S22-R26 WeakPolarHBondContact O-CG 3.49Å; S22-R26 PolarHBondContact O-N 3.41Å; G24-R26 VanDerWaalsContact C-N 3.29Å; G24-R26 PolarHBondContact O-N 2.94Å; R26-S30 WeakPolarHBondContact O-CB 3.24Å
27	R	36.4	Very low	45.8	Very low	220 Å²	220	97.7 Å²	97.7	83%	0.83	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-10.5	178	-61.9	-176.1	175.8	-175.4	-2	114.6	G24 A25 S30	G24-R27 WeakPolarHBondContact O-CB 3.41Å; G24-R27 PolarHBondContact O-N 3.33Å; A25-R27 PolarHBondContact O-N 3.18Å; A25-R27 VanDerWaalsContact O-N 3.11Å; R27-S30 PolarHBondContact O-OG 2.76Å
28	S	41.4	Very low	48.5	Very low	90 Å²	90	94.5 Å²	94.5	63%	0.629	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-20.8	172.9	63.8	0	0	0	0	112.8	A25 S30	A25-S28 PolarHBondContact O-N 3.27Å; A25-S28 VanDerWaalsContact O-N 3.08Å; A25-S28 PolarHBondContact O-OG 2.93Å; S28-S30 VanDerWaalsContact C-N 3.34Å
29	A	41.6	Very low	51.3	Low	48 Å²	48	88.6 Å²	88.6	40%	0.397	47%	0.469	S	S	.	.	S	Bend	trans	-82.5	-9.6	173.7	0	0	0	0	0	113.4	A25 E31 V32	A25-A29 PolarHBondContact O-N 2.92Å; A29-E31 PolarHBondContact O-N 3.47Å; A29-V32 PolarHBondContact O-N 2.82Å
30	S	41.7	Very low	54.1	Low	94 Å²	94	83.6 Å²	83.6	66%	0.657	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	5.7	-175.3	54.1	0	0	0	0	115.9	R26 R27 S28	R26-S30 WeakPolarHBondContact O-CB 3.24Å; R27-S30 PolarHBondContact O-OG 2.76Å; S28-S30 VanDerWaalsContact C-N 3.34Å
31	E	47.1	Very low	56.9	Low	121 Å²	121	81.3 Å²	81.3	57%	0.565	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-10.3	169.4	-70.9	-170.3	161	0	0	113.5	A29 K45	A29-E31 PolarHBondContact O-N 3.47Å; E31-K45 IonicContact OE2-NZ 3.75Å; E31-K45 PolarHBondContact OE2-NZ 3.42Å
32	V	51.2	Low	59.8	Low	27 Å²	27	76.1 Å²	76.1	16%	0.164	42%	0.416	C	S	.	.	S	Bend	trans	-98.5	105.4	177.9	179.8	0	0	0	0	108	A29 V37 W41 A158	A29-V32 PolarHBondContact O-N 2.82Å; V32-V37 HydrophobicContact CG1-CG1 3.96Å; V32-V37 HydrophobicContact CG2-CG1 4.28Å; V32-W41 HydrophobicContact CG2-CH2 4.27Å; V32-W41 HydrophobicContact CG2-CZ2 3.87Å; V32-A158 HydrophobicContact CG1-CB 3.67Å
33	D	46.4	Very low	62.6	Low	124 Å²	124	73.7 Å²	73.7	66%	0.663	40%	0.399	S	S	*	.	B	Isolated β-bridge	trans	-68.5	146	172	-165.7	12.2	0	0	0	109.9	D35 S36	D33-D35 PolarHBondContact O-N 2.93Å; D33-S36 PolarHBondContact O-N 2.62Å
34	H	60.5	Low	65.3	Low	159 Å²	159	70.8 Å²	70.8	74%	0.736	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-11.7	-130.7	-113.1	-52.3	0	0	0	117.1	Y147	H34-Y147 PolarHBondContact O-OH 3.07Å
35	D	77.8	Confident	68	Low	99 Å²	99	71.5 Å²	71.5	53%	0.529	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	-8.9	174.4	-62.4	-66.8	0	0	0	114.2	D33 Y147 F159	D33-D35 PolarHBondContact O-N 2.93Å; D35-Y147 WeakPolarHBondContact CA-OH 3.35Å; D35-Y147 WeakPolarHBondContact OD1-CE1 2.94Å; D35-Y147 VanDerWaalsContact OD1-CZ 3.25Å; D35-Y147 PolarHBondContact OD1-OH 3.25Å; D35-F159 PolarHBondContact O-N 2.91Å
36	S	87.5	Confident	70.5	Confident	36 Å²	36	70.6 Å²	70.6	25%	0.252	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	153.3	-170.2	69.9	0	0	0	0	116.5	D33 F159 Q161	D33-S36 PolarHBondContact O-N 2.62Å; S36-F159 CarbonylContact C-O 3.53Å; S36-F159 WeakPolarHBondContact CA-O 3.43Å; S36-F159 WeakPolarHBondContact CB-O 3.23Å; S36-Q161 PolarHBondContact OG-NE2 2.77Å
37	V	91.6	Very high	73	Confident	6 Å²	6	67.6 Å²	67.6	4%	0.036	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	141.1	177.7	-68.2	0	0	0	0	112.1	V32 W41 V117 A158 F159 Q161	V32-V37 HydrophobicContact CG1-CG1 3.96Å; V32-V37 HydrophobicContact CG2-CG1 4.28Å; V37-W41 HydrophobicContact CB-CD2 4.24Å; V37-W41 HydrophobicContact CB-CE3 3.74Å; V37-W41 HydrophobicContact CB-CZ3 4.21Å; V37-W41 HydrophobicContact CG1-CD2 4.1Å; V37-W41 HydrophobicContact CG1-CE3 3.75Å; V37-W41 HydrophobicContact CG1-CH2 4.28Å; V37-W41 HydrophobicContact CG1-CZ3 3.87Å; V37-W41 HydrophobicContact CG2-CE3 4.13Å; V37-W41 HydrophobicContact CG2-CZ3 4.31Å; V37-V117 HydrophobicContact CG2-CB 4.49Å; V37-V117 HydrophobicContact CG2-CG1 3.71Å; V37-V117 HydrophobicContact CG2-CG2 3.94Å; V37-A158 HydrophobicContact CG1-CB 3.93Å; V37-F159 PolarHBondContact N-O 3.39Å; V37-Q161 WeakPolarHBondContact O-CB 3.38Å; V37-Q161 WeakPolarHBondContact O-CG 3.36Å; V37-Q161 PolarHBondContact O-N 3.31Å
38	S	91.9	Very high	75.1	Confident	49 Å²	49	60.6 Å²	60.6	34%	0.343	35%	0.348	S	S	.	.			trans	-75.6	154	-179.6	68.4	0	0	0	0	113	G40 W41 L42	S38-G40 VanDerWaalsContact C-N 3.29Å; S38-G40 PolarHBondContact O-N 2.86Å; S38-W41 WeakPolarHBondContact O-CB 3.4Å; S38-W41 PolarHBondContact O-N 3.43Å; S38-W41 VanDerWaalsContact O-N 3.08Å; S38-W41 WeakPolarHBondContact OG-CB 3.26Å; S38-W41 PolarHBondContact OG-N 3.46Å; S38-L42 PolarHBondContact O-N 3.06Å; S38-L42 VanDerWaalsContact O-N 3.09Å
39	P	92.4	Very high	76.5	Confident	14 Å²	14	59.7 Å²	59.7	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-50	-46.9	173.1	-31.8	37.9	0	0	0	113.2	W41 L42 A43 L160 Q161 F167 Y171	P39-W41 VanDerWaalsContact C-N 3.35Å; P39-W41 PolarHBondContact O-N 2.97Å; P39-L42 PolarHBondContact O-N 3.2Å; P39-A43 WeakPolarHBondContact O-CB 3.27Å; P39-A43 PolarHBondContact O-N 3.02Å; P39-L160 HydrophobicContact CG-CD1 4.39Å; P39-Q161 WeakPolarHBondContact CG-O 3.37Å; P39-F167 HydrophobicContact CB-CD2 3.86Å; P39-F167 WeakPolarHBondContact O-CE2 3.15Å; P39-Y171 HydrophobicContact CB-CD2 4.4Å; P39-Y171 HydrophobicContact CB-CE2 3.75Å
40	G	92.8	Very high	77.4	Confident	32 Å²	32	63.5 Å²	63.5	33%	0.33	34%	0.339	S	S	.	.	H	α-helix	trans	-64	-33.3	178.4	0	0	0	0	0	114.4	S38 S44 Y171	S38-G40 VanDerWaalsContact C-N 3.29Å; S38-G40 PolarHBondContact O-N 2.86Å; G40-S44 VanDerWaalsContact O-CB 3.28Å; G40-S44 WeakPolarHBondContact O-CB 3.44Å; G40-S44 PolarHBondContact O-N 3.29Å; G40-Y171 WeakPolarHBondContact CA-OH 3.48Å
41	W	92.9	Very high	78	Confident	37 Å²	37	62.6 Å²	62.6	14%	0.14	34%	0.344	C	S	.	.	H	α-helix	trans	-66.2	-49.3	173	-177.2	99.4	0	0	0	110.5	V32 V37 S38 P39 A43 S44 K45 P115 V117	V32-W41 HydrophobicContact CG2-CH2 4.27Å; V32-W41 HydrophobicContact CG2-CZ2 3.87Å; V37-W41 HydrophobicContact CB-CD2 4.24Å; V37-W41 HydrophobicContact CB-CE3 3.74Å; V37-W41 HydrophobicContact CB-CZ3 4.21Å; V37-W41 HydrophobicContact CG1-CD2 4.1Å; V37-W41 HydrophobicContact CG1-CE3 3.75Å; V37-W41 HydrophobicContact CG1-CH2 4.28Å; V37-W41 HydrophobicContact CG1-CZ3 3.87Å; V37-W41 HydrophobicContact CG2-CE3 4.13Å; V37-W41 HydrophobicContact CG2-CZ3 4.31Å; S38-W41 WeakPolarHBondContact O-CB 3.4Å; S38-W41 PolarHBondContact O-N 3.43Å; S38-W41 VanDerWaalsContact O-N 3.08Å; S38-W41 WeakPolarHBondContact OG-CB 3.26Å; S38-W41 PolarHBondContact OG-N 3.46Å; P39-W41 VanDerWaalsContact C-N 3.35Å; P39-W41 PolarHBondContact O-N 2.97Å; W41-A43 PolarHBondContact O-N 2.54Å; W41-S44 WeakPolarHBondContact O-CB 3.38Å; W41-S44 PolarHBondContact O-N 3.01Å; W41-K45 HydrophobicContact CD2-CG 4.01Å; W41-K45 HydrophobicContact CE3-CG 4.07Å; W41-K45 HydrophobicContact CH2-CG 4.01Å; W41-K45 HydrophobicContact CZ2-CD 4.34Å; W41-K45 HydrophobicContact CZ2-CG 3.95Å; W41-K45 HydrophobicContact CZ3-CG 4.06Å; W41-K45 WeakPolarHBondContact O-CG 3.27Å; W41-K45 PolarHBondContact O-N 3.46Å; W41-P115 HydrophobicContact CH2-CB 3.88Å; W41-P115 HydrophobicContact CH2-CG 4Å; W41-P115 HydrophobicContact CZ2-CG 4.5Å; W41-V117 HydrophobicContact CZ3-CG2 4.09Å
42	L	92.6	Very high	78.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.6	-46.8	179.8	177.8	59.6	0	0	0	111.2	S38 P39 S44 K45 L46 P59 V61 I75 V117 L160 F167	S38-L42 PolarHBondContact O-N 3.06Å; S38-L42 VanDerWaalsContact O-N 3.09Å; P39-L42 PolarHBondContact O-N 3.2Å; L42-S44 VanDerWaalsContact C-N 3.31Å; L42-S44 PolarHBondContact O-N 3.23Å; L42-K45 PolarHBondContact O-N 3.07Å; L42-L46 HydrophobicContact CD1-CD1 3.84Å; L42-L46 HydrophobicContact CD1-CD2 4.45Å; L42-L46 HydrophobicContact CD1-CG 3.88Å; L42-L46 HydrophobicContact CD2-CD1 4.48Å; L42-L46 HydrophobicContact CG-CD1 3.81Å; L42-L46 HydrophobicContact CG-CG 4.27Å; L42-L46 WeakPolarHBondContact O-CB 3.47Å; L42-L46 WeakPolarHBondContact O-CG 3.41Å; L42-L46 PolarHBondContact O-N 3.27Å; L42-P59 HydrophobicContact CD1-CB 4.49Å; L42-P59 HydrophobicContact CD1-CG 3.81Å; L42-V61 HydrophobicContact CD1-CG2 4.02Å; L42-V61 HydrophobicContact CD2-CG2 4.46Å; L42-I75 HydrophobicContact CD2-CD1 3.94Å; L42-V117 HydrophobicContact CD1-CG2 4.28Å; L42-V117 HydrophobicContact CD2-CG1 4.22Å; L42-L160 HydrophobicContact CD2-CD1 3.9Å; L42-L160 HydrophobicContact CD2-CD2 4.18Å; L42-F167 HydrophobicContact CB-CE2 3.94Å; L42-F167 HydrophobicContact CD2-CD2 4.19Å; L42-F167 HydrophobicContact CD2-CE2 3.74Å; L42-F167 HydrophobicContact CD2-CZ 4.05Å; L42-F167 HydrophobicContact CG-CE2 3.85Å; L42-F167 HydrophobicContact CG-CZ 4.1Å
43	A	92.2	Very high	78.1	Confident	0 Å²	0	67 Å²	67	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-57.8	-41.1	175.6	0	0	0	0	0	112.4	P39 W41 L46 R47 F167 Y171 F174	P39-A43 WeakPolarHBondContact O-CB 3.27Å; P39-A43 PolarHBondContact O-N 3.02Å; W41-A43 PolarHBondContact O-N 2.54Å; A43-L46 PolarHBondContact O-N 2.86Å; A43-R47 WeakPolarHBondContact O-CB 3.46Å; A43-R47 WeakPolarHBondContact O-CD 3.3Å; A43-R47 PolarHBondContact O-N 3.22Å; A43-F167 HydrophobicContact CB-CE2 4.29Å; A43-F167 HydrophobicContact CB-CZ 4.45Å; A43-Y171 HydrophobicContact CB-CD1 3.77Å; A43-Y171 HydrophobicContact CB-CD2 3.67Å; A43-Y171 HydrophobicContact CB-CE1 3.87Å; A43-Y171 HydrophobicContact CB-CE2 3.75Å; A43-Y171 HydrophobicContact CB-CG 3.66Å; A43-F174 HydrophobicContact CB-CE2 3.77Å; A43-F174 HydrophobicContact CB-CZ 4.41Å; A43-F174 WeakPolarHBondContact O-CZ 3.34Å
44	S	90.4	Very high	78	Confident	71 Å²	71	63.6 Å²	63.6	50%	0.497	36%	0.362	S	S	.	.	H	α-helix	trans	-62.2	-47.5	176.1	-174.7	0	0	0	0	112.3	G40 W41 L42 R47 S48	G40-S44 VanDerWaalsContact O-CB 3.28Å; G40-S44 WeakPolarHBondContact O-CB 3.44Å; G40-S44 PolarHBondContact O-N 3.29Å; W41-S44 WeakPolarHBondContact O-CB 3.38Å; W41-S44 PolarHBondContact O-N 3.01Å; L42-S44 VanDerWaalsContact C-N 3.31Å; L42-S44 PolarHBondContact O-N 3.23Å; S44-R47 PolarHBondContact O-N 2.93Å; S44-S48 PolarHBondContact O-N 3.47Å
45	K	89.3	Confident	77.6	Confident	58 Å²	58	60.3 Å²	60.3	25%	0.252	35%	0.348	S	S	.	.	H	α-helix	trans	-72.4	-25.9	178.6	-52.6	-62.2	-175.5	-177.3	0	113.3	E31 W41 L42 S48 P59	E31-K45 IonicContact OE2-NZ 3.75Å; E31-K45 PolarHBondContact OE2-NZ 3.42Å; W41-K45 HydrophobicContact CD2-CG 4.01Å; W41-K45 HydrophobicContact CE3-CG 4.07Å; W41-K45 HydrophobicContact CH2-CG 4.01Å; W41-K45 HydrophobicContact CZ2-CD 4.34Å; W41-K45 HydrophobicContact CZ2-CG 3.95Å; W41-K45 HydrophobicContact CZ3-CG 4.06Å; W41-K45 WeakPolarHBondContact O-CG 3.27Å; W41-K45 PolarHBondContact O-N 3.46Å; L42-K45 PolarHBondContact O-N 3.07Å; K45-S48 PolarHBondContact O-OG 3.36Å; K45-P59 HydrophobicContact CB-CG 3.84Å
46	L	88.5	Confident	76.4	Confident	10 Å²	10	62.6 Å²	62.6	5%	0.052	36%	0.355	C	S	.	.	H	α-helix	trans	-78	-35.2	173.9	-69.9	175.9	0	0	0	112.3	L42 A43 S48 R49 P59 I75 F167 F174	L42-L46 HydrophobicContact CD1-CD1 3.84Å; L42-L46 HydrophobicContact CD1-CD2 4.45Å; L42-L46 HydrophobicContact CD1-CG 3.88Å; L42-L46 HydrophobicContact CD2-CD1 4.48Å; L42-L46 HydrophobicContact CG-CD1 3.81Å; L42-L46 HydrophobicContact CG-CG 4.27Å; L42-L46 WeakPolarHBondContact O-CB 3.47Å; L42-L46 WeakPolarHBondContact O-CG 3.41Å; L42-L46 PolarHBondContact O-N 3.27Å; A43-L46 PolarHBondContact O-N 2.86Å; L46-S48 VanDerWaalsContact C-N 3.35Å; L46-S48 PolarHBondContact O-N 3.43Å; L46-R49 WeakPolarHBondContact O-CB 3.31Å; L46-R49 PolarHBondContact O-N 3.11Å; L46-P59 HydrophobicContact CD2-CG 4.31Å; L46-I75 HydrophobicContact CD1-CG2 3.87Å; L46-F167 HydrophobicContact CD1-CZ 4.2Å; L46-F174 HydrophobicContact CB-CD1 3.84Å; L46-F174 HydrophobicContact CB-CE1 3.32Å; L46-F174 HydrophobicContact CB-CE2 4.37Å; L46-F174 HydrophobicContact CB-CZ 3.61Å; L46-F174 HydrophobicContact CD1-CD1 4.15Å; L46-F174 HydrophobicContact CD1-CD2 4.45Å; L46-F174 HydrophobicContact CD1-CE1 4.39Å; L46-F174 HydrophobicContact CD1-CG 4.16Å; L46-F174 HydrophobicContact CG-CE1 4.49Å
47	R	87.6	Confident	75.3	Confident	125 Å²	125	63.2 Å²	63.2	47%	0.472	37%	0.367	S	S	.	.	H	α-helix	trans	-59.3	-42.2	172.5	-91.2	147.3	-166.6	177.9	1.8	112	A43 S44 R49 K50 E173 F174	A43-R47 WeakPolarHBondContact O-CB 3.46Å; A43-R47 WeakPolarHBondContact O-CD 3.3Å; A43-R47 PolarHBondContact O-N 3.22Å; S44-R47 PolarHBondContact O-N 2.93Å; R47-R49 VanDerWaalsContact C-N 3.26Å; R47-R49 PolarHBondContact O-N 2.97Å; R47-K50 PolarHBondContact O-N 2.9Å; R47-E173 IonicContact CZ-OE1 3.15Å; R47-E173 IonicContact NE-OE1 2.84Å; R47-E173 PolarHBondContact NE-OE1 2.75Å; R47-E173 IonicContact NH2-OE1 2.65Å; R47-E173 PolarHBondContact NH2-OE1 3.08Å; R47-F174 HydrophobicContact CG-CE1 4.47Å; R47-F174 HydrophobicContact CG-CZ 3.84Å
48	S	79.1	Confident	74.4	Confident	73 Å²	73	63.2 Å²	63.2	51%	0.51	37%	0.368	S	S	.	.	H	α-helix	trans	-64.1	-29.6	178.5	65.6	0	0	0	0	113.1	S44 K45 L46 K50 G51 S52	S44-S48 PolarHBondContact O-N 3.47Å; K45-S48 PolarHBondContact O-OG 3.36Å; L46-S48 VanDerWaalsContact C-N 3.35Å; L46-S48 PolarHBondContact O-N 3.43Å; S48-K50 PolarHBondContact O-N 3.33Å; S48-G51 PolarHBondContact O-N 2.86Å; S48-S52 PolarHBondContact O-N 2.89Å
49	R	71.5	Confident	74.1	Confident	71 Å²	71	61 Å²	61	27%	0.268	35%	0.353	S	S	.	.	H	α-helix	trans	-60.6	-40.9	173.5	-165.4	-176	-177.6	179.9	3.6	112.4	L46 R47 G51 A58	L46-R49 WeakPolarHBondContact O-CB 3.31Å; L46-R49 PolarHBondContact O-N 3.11Å; R47-R49 VanDerWaalsContact C-N 3.26Å; R47-R49 PolarHBondContact O-N 2.97Å; R49-G51 PolarHBondContact O-N 3.39Å; R49-A58 HydrophobicContact CB-CB 3.73Å; R49-A58 HydrophobicContact CG-CB 3.75Å
50	K	60.7	Low	73.8	Confident	127 Å²	127	61.8 Å²	61.8	55%	0.552	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-9.8	-179.6	-69.6	-171.9	175.6	-175.7	0	113.6	R47 S48 E76 E173	R47-K50 PolarHBondContact O-N 2.9Å; S48-K50 PolarHBondContact O-N 3.33Å; K50-E76 WeakPolarHBondContact CE-OE2 3.45Å; K50-E76 IonicContact NZ-OE2 2.75Å; K50-E76 PolarHBondContact NZ-OE2 2.9Å; K50-E173 PolarHBondContact NZ-O 2.88Å
51	G	54.3	Low	73.6	Confident	75 Å²	75	60.5 Å²	60.5	77%	0.773	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	-1.9	-179.7	0	0	0	0	0	116.3	S48 R49	S48-G51 PolarHBondContact O-N 2.86Å; R49-G51 PolarHBondContact O-N 3.39Å
52	S	51.6	Low	73.4	Confident	61 Å²	61	59.1 Å²	59.1	43%	0.427	34%	0.335	S	S	.	.			trans	-120.5	130.4	-173.8	179.9	0	0	0	0	112.6	S48 A54	S48-S52 PolarHBondContact O-N 2.89Å; S52-A54 WeakPolarHBondContact CB-O 3.47Å; S52-A54 PolarHBondContact O-N 2.89Å; S52-A54 PolarHBondContact OG-N 3.19Å; S52-A54 PolarHBondContact OG-O 2.85Å
53	I	48.2	Very low	73.2	Confident	181 Å²	181	59.1 Å²	59.1	93%	0.928	34%	0.335	S	S	*	.	S	Bend	trans	-66.2	-30.9	171.8	-62	173.6	0	0	0	110.6
54	A	45.3	Very low	73	Confident	51 Å²	51	59.5 Å²	59.5	42%	0.421	34%	0.337	S	S	.	.	S	Bend	trans	-87.8	115.5	171.2	0	0	0	0	0	110.3	S52 Q56	S52-A54 WeakPolarHBondContact CB-O 3.47Å; S52-A54 PolarHBondContact O-N 2.89Å; S52-A54 PolarHBondContact OG-N 3.19Å; S52-A54 PolarHBondContact OG-O 2.85Å; A54-Q56 HydrophobicContact CB-CG 4.47Å; A54-Q56 PolarHBondContact O-N 3.47Å
55	Q	50.8	Low	72.9	Confident	91 Å²	91	57 Å²	57	43%	0.425	32%	0.316	S	S	.	.			trans	-71.6	18.5	176.9	-60.2	-163.7	59.3	0	0	114.3
56	Q	54.3	Low	72.5	Confident	146 Å²	146	59 Å²	59	68%	0.682	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	129.1	-171.7	-67.1	-179.7	-1	0	0	111.8	A54 A58	A54-Q56 HydrophobicContact CB-CG 4.47Å; A54-Q56 PolarHBondContact O-N 3.47Å; Q56-A58 PolarHBondContact O-N 3.21Å
57	G	63.3	Low	72	Confident	49 Å²	49	60.8 Å²	60.8	51%	0.505	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	-5.5	170	0	0	0	0	0	116.9
58	A	73.2	Confident	71.4	Confident	7 Å²	7	60 Å²	60	6%	0.058	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-70.4	137.3	171.1	0	0	0	0	0	110.9	R49 Q56 T114	R49-A58 HydrophobicContact CB-CB 3.73Å; R49-A58 HydrophobicContact CG-CB 3.75Å; Q56-A58 PolarHBondContact O-N 3.21Å; A58-T114 WeakPolarHBondContact O-CG2 3.21Å
59	P	85	Confident	71.6	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.019	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-67.2	146.3	-174.9	27.5	-35.9	0	0	0	112.5	L42 K45 L46 P115 V117	L42-P59 HydrophobicContact CD1-CB 4.49Å; L42-P59 HydrophobicContact CD1-CG 3.81Å; K45-P59 HydrophobicContact CB-CG 3.84Å; L46-P59 HydrophobicContact CD2-CG 4.31Å; P59-P115 CarbonylContact C-O 3.58Å; P59-P115 VanDerWaalsContact CA-O 3.24Å; P59-P115 WeakPolarHBondContact CA-O 3.48Å; P59-P115 HydrophobicContact CB-CB 4.24Å; P59-V117 HydrophobicContact CB-CG2 4.04Å
60	Y	86.1	Confident	72.3	Confident	30 Å²	30	56.9 Å²	56.9	12%	0.118	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	121.2	170.2	-75.3	-98.3	0	0	0	109.4	M105 V108 T114 P115 L116 V117	Y60-M105 HydrophobicContact CE1-CE 3.84Å; Y60-M105 HydrophobicContact CE1-SD 3.78Å; Y60-V108 HydrophobicContact CD1-CG2 3.8Å; Y60-V108 HydrophobicContact CD2-CG2 3.85Å; Y60-V108 HydrophobicContact CE1-CG2 3.47Å; Y60-V108 VanDerWaalsContact CE1-CG2 3.47Å; Y60-V108 HydrophobicContact CE2-CG2 3.55Å; Y60-V108 HydrophobicContact CG-CG2 3.98Å; Y60-T114 HydrophobicContact CD2-CG2 3.67Å; Y60-T114 HydrophobicContact CE2-CG2 3.87Å; Y60-P115 PolarHBondContact N-O 3.13Å; Y60-L116 WeakPolarHBondContact O-CA 3.29Å; Y60-V117 PolarHBondContact O-N 2.85Å
61	V	88.9	Confident	73.2	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.03	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	123.2	179	-179.2	0	0	0	0	109.4	L42 I75 S78 V79 V117 V119	L42-V61 HydrophobicContact CD1-CG2 4.02Å; L42-V61 HydrophobicContact CD2-CG2 4.46Å; V61-I75 HydrophobicContact CG1-CD1 4.17Å; V61-I75 HydrophobicContact CG2-CG2 4.3Å; V61-S78 CarbonylContact O-C 3.47Å; V61-S78 WeakPolarHBondContact O-CA 3.48Å; V61-S78 WeakPolarHBondContact O-CB 3.46Å; V61-V79 PolarHBondContact O-N 3.37Å; V61-V117 CarbonylContact C-O 3.59Å; V61-V117 WeakPolarHBondContact CA-O 3.44Å; V61-V117 HydrophobicContact CG2-CB 4.45Å; V61-V119 HydrophobicContact CG1-CG2 3.79Å
62	L	88.3	Confident	74.6	Confident	7 Å²	7	61 Å²	61	4%	0.037	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	111.5	-178.6	-58.6	178.7	0	0	0	108.8	F64 V79 V81 I102 L116 V117 L118 V119 L150	L62-F64 HydrophobicContact CB-CE2 3.8Å; L62-V79 HydrophobicContact CD2-CB 4.38Å; L62-V81 HydrophobicContact CB-CG2 3.97Å; L62-V81 HydrophobicContact CD2-CG2 4.02Å; L62-V81 HydrophobicContact CG-CG2 4.5Å; L62-I102 HydrophobicContact CD1-CG2 4Å; L62-I102 HydrophobicContact CD2-CG2 4.28Å; L62-L116 HydrophobicContact CD1-CB 4.48Å; L62-V117 PolarHBondContact N-O 3.26Å; L62-L118 HydrophobicContact CB-CD1 4.41Å; L62-L118 HydrophobicContact CD1-CD1 4.12Å; L62-L118 WeakPolarHBondContact O-CA 3.43Å; L62-V119 PolarHBondContact O-N 3.04Å; L62-L150 HydrophobicContact CD1-CD1 4.37Å
63	D	89	Confident	76.3	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	110.6	-171.8	-167.4	-28.9	0	0	0	111.1	R65 F70 V79 N80 V81 V119	D63-R65 VanDerWaalsContact OD1-CB 3.3Å; D63-R65 WeakPolarHBondContact OD1-CB 3.4Å; D63-R65 VanDerWaalsContact OD1-CG 3.23Å; D63-R65 WeakPolarHBondContact OD1-CG 3.3Å; D63-R65 IonicContact OD1-CZ 3.63Å; D63-R65 PolarHBondContact OD1-N 3.3Å; D63-R65 VanDerWaalsContact OD1-N 3.11Å; D63-R65 IonicContact OD1-NE 3.83Å; D63-R65 PolarHBondContact OD1-NE 3.29Å; D63-R65 IonicContact OD1-NH2 3.61Å; D63-R65 IonicContact OD2-CZ 3.33Å; D63-R65 IonicContact OD2-NE 2.67Å; D63-R65 PolarHBondContact OD2-NE 2.82Å; D63-R65 VanDerWaalsContact OD2-NE 3.11Å; D63-R65 IonicContact OD2-NH2 3.63Å; D63-R65 PolarHBondContact OD2-NH2 3.29Å; D63-F70 HydrophobicContact CB-CD2 3.81Å; D63-F70 HydrophobicContact CB-CE2 3.94Å; D63-V79 PolarHBondContact N-O 3.17Å; D63-N80 CarbonylContact O-C 3.58Å; D63-N80 VanDerWaalsContact O-CA 3.29Å; D63-N80 WeakPolarHBondContact O-CA 3.47Å; D63-N80 PolarHBondContact O-ND2 2.97Å; D63-V81 PolarHBondContact O-N 2.97Å; D63-V119 HydrophobicContact CB-CB 4.38Å
64	F	88.5	Confident	78.2	Confident	8 Å²	8	51.9 Å²	51.9	4%	0.035	26%	0.255	C	S	.	.			trans	-91.5	-1	-175.8	-74.1	-91.4	0	0	0	113.9	L62 V81 V83 L118 V119 D120 I142 V146	L62-F64 HydrophobicContact CB-CE2 3.8Å; F64-V81 HydrophobicContact CD1-CB 4.07Å; F64-V81 HydrophobicContact CD1-CG1 4.25Å; F64-V81 HydrophobicContact CD2-CB 4.5Å; F64-V81 HydrophobicContact CE1-CB 3.6Å; F64-V81 HydrophobicContact CE1-CG1 3.41Å; F64-V81 VanDerWaalsContact CE1-CG1 3.41Å; F64-V81 HydrophobicContact CE1-CG2 4.49Å; F64-V81 HydrophobicContact CE2-CB 4.06Å; F64-V81 HydrophobicContact CE2-CG1 4.47Å; F64-V81 HydrophobicContact CE2-CG2 4.18Å; F64-V81 HydrophobicContact CG-CB 4.49Å; F64-V81 HydrophobicContact CZ-CB 3.57Å; F64-V81 HydrophobicContact CZ-CG1 3.52Å; F64-V81 HydrophobicContact CZ-CG2 3.97Å; F64-V83 HydrophobicContact CE1-CG2 4.4Å; F64-L118 HydrophobicContact CD2-CG 4.35Å; F64-L118 HydrophobicContact CE2-CD2 4.39Å; F64-L118 HydrophobicContact CE2-CG 3.92Å; F64-V119 WeakPolarHBondContact CB-O 3.23Å; F64-V119 PolarHBondContact N-O 3.45Å; F64-D120 HydrophobicContact CB-CB 4.45Å; F64-I142 HydrophobicContact CD1-CG2 3.8Å; F64-I142 HydrophobicContact CE1-CG2 3.83Å; F64-V146 HydrophobicContact CE1-CB 4.35Å; F64-V146 HydrophobicContact CE1-CG2 3.88Å; F64-V146 HydrophobicContact CZ-CB 4.08Å; F64-V146 HydrophobicContact CZ-CG1 3.8Å; F64-V146 HydrophobicContact CZ-CG2 4.01Å
65	R	86.5	Confident	80.3	Confident	18 Å²	18	49.6 Å²	49.6	7%	0.068	24%	0.236	C	C	.	.	S	Bend	trans	-64.7	160.4	175.4	-56.2	176.7	-59.8	133.1	6.2	111	D63 E69 A73 N80 D120 E121	D63-R65 VanDerWaalsContact OD1-CB 3.3Å; D63-R65 WeakPolarHBondContact OD1-CB 3.4Å; D63-R65 VanDerWaalsContact OD1-CG 3.23Å; D63-R65 WeakPolarHBondContact OD1-CG 3.3Å; D63-R65 IonicContact OD1-CZ 3.63Å; D63-R65 PolarHBondContact OD1-N 3.3Å; D63-R65 VanDerWaalsContact OD1-N 3.11Å; D63-R65 IonicContact OD1-NE 3.83Å; D63-R65 PolarHBondContact OD1-NE 3.29Å; D63-R65 IonicContact OD1-NH2 3.61Å; D63-R65 IonicContact OD2-CZ 3.33Å; D63-R65 IonicContact OD2-NE 2.67Å; D63-R65 PolarHBondContact OD2-NE 2.82Å; D63-R65 VanDerWaalsContact OD2-NE 3.11Å; D63-R65 IonicContact OD2-NH2 3.63Å; D63-R65 PolarHBondContact OD2-NH2 3.29Å; R65-E69 HydrophobicContact CB-CB 4.39Å; R65-E69 PolarHBondContact NH1-O 3.45Å; R65-A73 PolarHBondContact NH1-O 3.14Å; R65-A73 PolarHBondContact NH2-O 3.25Å; R65-N80 PolarHBondContact O-ND2 2.94Å; R65-D120 VanDerWaalsContact CG-C 3.49Å; R65-E121 HydrophobicContact CB-CG 4.06Å; R65-E121 HydrophobicContact CG-CG 3.84Å
66	R	81.1	Confident	81.9	Confident	100 Å²	100	50.1 Å²	50.1	38%	0.377	24%	0.238	S	C	.	.			trans	-52	140.4	177.5	-67.6	173.9	-159.1	90.8	17.4	111.6	Q68 E69 F70 E121 N137	R66-Q68 PolarHBondContact O-N 3.37Å; R66-E69 HydrophobicContact CB-CG 4.47Å; R66-E69 WeakPolarHBondContact CD-OE1 3.34Å; R66-E69 IonicContact CZ-OE1 3.75Å; R66-E69 IonicContact NH1-OE1 2.69Å; R66-E69 PolarHBondContact NH1-OE1 2.89Å; R66-E69 WeakPolarHBondContact O-CB 3.44Å; R66-E69 PolarHBondContact O-N 2.92Å; R66-F70 PolarHBondContact O-N 2.83Å; R66-F70 VanDerWaalsContact O-N 3.14Å; R66-E121 WeakPolarHBondContact CG-OE1 3.35Å; R66-E121 VanDerWaalsContact CZ-CD 3.43Å; R66-E121 IonicContact CZ-OE1 3.34Å; R66-E121 IonicContact CZ-OE2 3.25Å; R66-E121 PolarHBondContact N-OE1 3.29Å; R66-E121 IonicContact NE-OE1 2.82Å; R66-E121 IonicContact NH1-OE1 2.91Å; R66-E121 PolarHBondContact NH1-OE1 3.23Å; R66-E121 IonicContact NH1-OE2 3.11Å; R66-E121 PolarHBondContact NH1-OE2 2.92Å; R66-E121 IonicContact NH2-OE1 3.21Å; R66-E121 PolarHBondContact NH2-OE1 3.4Å; R66-E121 IonicContact NH2-OE2 2.66Å; R66-E121 PolarHBondContact NH2-OE2 2.8Å; R66-N137 PolarHBondContact NH2-OD1 3.37Å
67	P	79.6	Confident	83.2	Confident	48 Å²	48	45.4 Å²	45.4	31%	0.312	23%	0.229	S	C	.	.	H	α-helix	trans	-57.2	-18.9	177.9	-26.5	33.8	0	0	0	115.1	R71 N80 V82	P67-R71 WeakPolarHBondContact O-CG 3.44Å; P67-R71 PolarHBondContact O-N 3.42Å; P67-R71 PolarHBondContact O-NE 3.28Å; P67-N80 WeakPolarHBondContact CA-OD1 3.49Å; P67-N80 WeakPolarHBondContact CG-OD1 3.24Å; P67-V82 HydrophobicContact CG-CG2 3.64Å
68	Q	74.9	Confident	84.3	Confident	109 Å²	109	43.6 Å²	43.6	51%	0.509	21%	0.208	S	C	.	.	H	α-helix	trans	-69.2	-38.1	171.3	-70.5	75.7	-0.2	0	0	112	R66 R72	R66-Q68 PolarHBondContact O-N 3.37Å; Q68-R72 WeakPolarHBondContact O-CG 3.35Å; Q68-R72 PolarHBondContact O-N 2.86Å
69	E	82.9	Confident	84.8	Confident	46 Å²	46	46.3 Å²	46.3	22%	0.215	22%	0.224	C	C	.	.	H	α-helix	trans	-83.3	-37.8	-177.4	-66.4	166.2	-137.3	0	0	111.4	R65 R66 R71 R72 A73	R65-E69 HydrophobicContact CB-CB 4.39Å; R65-E69 PolarHBondContact NH1-O 3.45Å; R66-E69 HydrophobicContact CB-CG 4.47Å; R66-E69 WeakPolarHBondContact CD-OE1 3.34Å; R66-E69 IonicContact CZ-OE1 3.75Å; R66-E69 IonicContact NH1-OE1 2.69Å; R66-E69 PolarHBondContact NH1-OE1 2.89Å; R66-E69 WeakPolarHBondContact O-CB 3.44Å; R66-E69 PolarHBondContact O-N 2.92Å; E69-R71 VanDerWaalsContact C-N 3.32Å; E69-R71 PolarHBondContact O-N 3.36Å; E69-R72 WeakPolarHBondContact O-CB 3.35Å; E69-R72 PolarHBondContact O-N 3.33Å; E69-A73 PolarHBondContact O-N 3.13Å; E69-A73 VanDerWaalsContact O-N 3.14Å
70	F	85.1	Confident	84.8	Confident	31 Å²	31	48.1 Å²	48.1	14%	0.136	23%	0.234	C	C	.	.	H	α-helix	trans	-55.7	-44.9	169.7	-174.5	-92.9	0	0	0	112.3	D63 R66 R72 A73 H74 S78 N80	D63-F70 HydrophobicContact CB-CD2 3.81Å; D63-F70 HydrophobicContact CB-CE2 3.94Å; R66-F70 PolarHBondContact O-N 2.83Å; R66-F70 VanDerWaalsContact O-N 3.14Å; F70-R72 PolarHBondContact O-N 3.25Å; F70-A73 CarbonylContact O-C 3.59Å; F70-H74 HydrophobicContact CD1-CB 4.43Å; F70-H74 HydrophobicContact CD2-CB 3.52Å; F70-H74 HydrophobicContact CE1-CB 4.38Å; F70-H74 AromaticContact CE1-CD2 3.79Å; F70-H74 AromaticContact CE1-CG 3.83Å; F70-H74 AromaticContact CE1-ND1 3.99Å; F70-H74 AromaticContact CE1-NE2 3.97Å; F70-H74 HydrophobicContact CE2-CB 3.47Å; F70-H74 VanDerWaalsContact CE2-CB 3.47Å; F70-H74 AromaticContact CE2-CD2 3.8Å; F70-H74 AromaticContact CE2-CG 3.71Å; F70-H74 HydrophobicContact CG-CB 4.03Å; F70-H74 HydrophobicContact CZ-CB 3.92Å; F70-H74 AromaticContact CZ-CD2 3.35Å; F70-H74 WeakPolarHBondContact CZ-CD2 3.36Å; F70-H74 AromaticContact CZ-CG 3.59Å; F70-H74 AromaticContact CZ-NE2 3.94Å; F70-H74 PolarHBondContact O-ND1 2.98Å; F70-S78 WeakPolarHBondContact CE2-OG 3.46Å; F70-N80 HydrophobicContact CB-CB 4.27Å; F70-N80 HydrophobicContact CD1-CB 3.83Å; F70-N80 HydrophobicContact CD2-CB 3.62Å; F70-N80 HydrophobicContact CE1-CB 4.01Å; F70-N80 HydrophobicContact CE2-CB 3.8Å; F70-N80 HydrophobicContact CG-CB 3.63Å; F70-N80 HydrophobicContact CZ-CB 3.99Å
71	R	80.9	Confident	84.6	Confident	102 Å²	102	47.4 Å²	47.4	39%	0.385	23%	0.233	S	C	.	.	H	α-helix	trans	-63.5	-38.9	176.3	-79.5	178.6	-73.4	170.9	-5.1	113	P67 E69 T178	P67-R71 WeakPolarHBondContact O-CG 3.44Å; P67-R71 PolarHBondContact O-N 3.42Å; P67-R71 PolarHBondContact O-NE 3.28Å; E69-R71 VanDerWaalsContact C-N 3.32Å; E69-R71 PolarHBondContact O-N 3.36Å; R71-T178 PolarHBondContact O-N 3.27Å; R71-T178 VanDerWaalsContact O-N 3.1Å; R71-T178 PolarHBondContact O-OG1 3.33Å
72	R	83.8	Confident	84.1	Confident	188 Å²	188	50.8 Å²	50.8	71%	0.709	25%	0.253	S	S	*	.	H	α-helix	trans	-60.2	-53.2	177	-74	170.5	175.1	170.5	-2.8	111.3	Q68 E69 F70 C177	Q68-R72 WeakPolarHBondContact O-CG 3.35Å; Q68-R72 PolarHBondContact O-N 2.86Å; E69-R72 WeakPolarHBondContact O-CB 3.35Å; E69-R72 PolarHBondContact O-N 3.33Å; F70-R72 PolarHBondContact O-N 3.25Å; R72-C177 WeakPolarHBondContact O-CA 3.42Å; R72-C177 VanDerWaalsContact O-CB 3.29Å; R72-C177 WeakPolarHBondContact O-CB 3.41Å
73	A	86	Confident	83.5	Confident	22 Å²	22	51 Å²	51	18%	0.182	25%	0.254	C	S	.	.	S	Bend	trans	-156.7	134.8	176.1	0	0	0	0	0	110.6	R65 E69 F70 L168 A176	R65-A73 PolarHBondContact NH1-O 3.14Å; R65-A73 PolarHBondContact NH2-O 3.25Å; E69-A73 PolarHBondContact O-N 3.13Å; E69-A73 VanDerWaalsContact O-N 3.14Å; F70-A73 CarbonylContact O-C 3.59Å; A73-L168 HydrophobicContact CB-CD1 4.02Å; A73-A176 WeakPolarHBondContact CA-O 3.15Å
74	H	88.4	Confident	82.6	Confident	28 Å²	28	53.1 Å²	53.1	13%	0.13	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	171.1	173.1	59.4	-75.7	0	0	0	110.9	F70 A176	F70-H74 HydrophobicContact CD1-CB 4.43Å; F70-H74 HydrophobicContact CD2-CB 3.52Å; F70-H74 HydrophobicContact CE1-CB 4.38Å; F70-H74 AromaticContact CE1-CD2 3.79Å; F70-H74 AromaticContact CE1-CG 3.83Å; F70-H74 AromaticContact CE1-ND1 3.99Å; F70-H74 AromaticContact CE1-NE2 3.97Å; F70-H74 HydrophobicContact CE2-CB 3.47Å; F70-H74 VanDerWaalsContact CE2-CB 3.47Å; F70-H74 AromaticContact CE2-CD2 3.8Å; F70-H74 AromaticContact CE2-CG 3.71Å; F70-H74 HydrophobicContact CG-CB 4.03Å; F70-H74 HydrophobicContact CZ-CB 3.92Å; F70-H74 AromaticContact CZ-CD2 3.35Å; F70-H74 WeakPolarHBondContact CZ-CD2 3.36Å; F70-H74 AromaticContact CZ-CG 3.59Å; F70-H74 AromaticContact CZ-NE2 3.94Å; F70-H74 PolarHBondContact O-ND1 2.98Å; H74-A176 PolarHBondContact CE1-O 3.06Å; H74-A176 PolarHBondContact N-O 3.18Å; H74-A176 PolarHBondContact ND1-O 3.06Å; H74-A176 VanDerWaalsContact ND1-O 3.08Å; H74-A176 PolarHBondContact O-N 3.09Å
75	I	90.5	Very high	81.7	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	133	170.1	-76.9	160.5	0	0	0	109.5	L42 L46 V61 G77 S78 L164 F167 L168 F174	L42-I75 HydrophobicContact CD2-CD1 3.94Å; L46-I75 HydrophobicContact CD1-CG2 3.87Å; V61-I75 HydrophobicContact CG1-CD1 4.17Å; V61-I75 HydrophobicContact CG2-CG2 4.3Å; I75-G77 PolarHBondContact O-N 3.37Å; I75-S78 VanDerWaalsContact O-CB 3.24Å; I75-S78 WeakPolarHBondContact O-CB 3.42Å; I75-S78 PolarHBondContact O-N 2.63Å; I75-S78 PolarHBondContact O-OG 3.36Å; I75-L164 HydrophobicContact CD1-CD1 3.49Å; I75-L164 VanDerWaalsContact CD1-CD1 3.49Å; I75-L164 HydrophobicContact CG1-CD1 3.82Å; I75-F167 HydrophobicContact CD1-CD1 3.73Å; I75-F167 HydrophobicContact CD1-CE1 3.63Å; I75-F167 HydrophobicContact CD1-CG 4.44Å; I75-F167 HydrophobicContact CD1-CZ 4.24Å; I75-F167 HydrophobicContact CG1-CD1 3.93Å; I75-F167 HydrophobicContact CG1-CE1 3.69Å; I75-L168 HydrophobicContact CG1-CD2 4.17Å; I75-F174 CarbonylContact C-O 3.49Å; I75-F174 WeakPolarHBondContact CA-O 3.16Å
76	E	84.6	Confident	80.8	Confident	102 Å²	102	58.1 Å²	58.1	48%	0.477	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	118.2	177.9	-171.6	-173.5	-173.8	0	0	111.3	K50 S78 F174 A176	K50-E76 WeakPolarHBondContact CE-OE2 3.45Å; K50-E76 IonicContact NZ-OE2 2.75Å; K50-E76 PolarHBondContact NZ-OE2 2.9Å; E76-S78 VanDerWaalsContact C-N 3.35Å; E76-F174 PolarHBondContact N-O 2.93Å; E76-A176 HydrophobicContact CB-CB 4.43Å
77	G	80.8	Confident	80.3	Confident	47 Å²	47	53.7 Å²	53.7	49%	0.485	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	13.9	-177.6	0	0	0	0	0	115.3	I75	I75-G77 PolarHBondContact O-N 3.37Å
78	S	86	Confident	80.2	Confident	11 Å²	11	53.3 Å²	53.3	8%	0.077	28%	0.277	C	S	.	.			trans	-74.8	160.1	162.3	63.5	0	0	0	0	111.8	V61 F70 I75 E76	V61-S78 CarbonylContact O-C 3.47Å; V61-S78 WeakPolarHBondContact O-CA 3.48Å; V61-S78 WeakPolarHBondContact O-CB 3.46Å; F70-S78 WeakPolarHBondContact CE2-OG 3.46Å; I75-S78 VanDerWaalsContact O-CB 3.24Å; I75-S78 WeakPolarHBondContact O-CB 3.42Å; I75-S78 PolarHBondContact O-N 2.63Å; I75-S78 PolarHBondContact O-OG 3.36Å; E76-S78 VanDerWaalsContact C-N 3.35Å
79	V	82.8	Confident	80.3	Confident	64 Å²	64	54.3 Å²	54.3	39%	0.388	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	124.2	-179.1	-179.4	0	0	0	0	109.4	V61 L62 D63 V81	V61-V79 PolarHBondContact O-N 3.37Å; L62-V79 HydrophobicContact CD2-CB 4.38Å; D63-V79 PolarHBondContact N-O 3.17Å; V79-V81 PolarHBondContact O-N 3.49Å
80	N	85.2	Confident	79.8	Confident	41 Å²	41	52.5 Å²	52.5	22%	0.219	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	121.9	173.2	-171.8	-141.5	0	0	0	110.4	D63 R65 P67 F70	D63-N80 CarbonylContact O-C 3.58Å; D63-N80 VanDerWaalsContact O-CA 3.29Å; D63-N80 WeakPolarHBondContact O-CA 3.47Å; D63-N80 PolarHBondContact O-ND2 2.97Å; R65-N80 PolarHBondContact O-ND2 2.94Å; P67-N80 WeakPolarHBondContact CA-OD1 3.49Å; P67-N80 WeakPolarHBondContact CG-OD1 3.24Å; F70-N80 HydrophobicContact CB-CB 4.27Å; F70-N80 HydrophobicContact CD1-CB 3.83Å; F70-N80 HydrophobicContact CD2-CB 3.62Å; F70-N80 HydrophobicContact CE1-CB 4.01Å; F70-N80 HydrophobicContact CE2-CB 3.8Å; F70-N80 HydrophobicContact CG-CB 3.63Å; F70-N80 HydrophobicContact CZ-CB 3.99Å
81	V	82.6	Confident	79.6	Confident	16 Å²	16	51 Å²	51	10%	0.097	26%	0.261	C	S	.	.			trans	-106.5	100.8	-175.9	-173.7	0	0	0	0	110.4	L62 D63 F64 V79 V83 I102	L62-V81 HydrophobicContact CB-CG2 3.97Å; L62-V81 HydrophobicContact CD2-CG2 4.02Å; L62-V81 HydrophobicContact CG-CG2 4.5Å; D63-V81 PolarHBondContact O-N 2.97Å; F64-V81 HydrophobicContact CD1-CB 4.07Å; F64-V81 HydrophobicContact CD1-CG1 4.25Å; F64-V81 HydrophobicContact CD2-CB 4.5Å; F64-V81 HydrophobicContact CE1-CB 3.6Å; F64-V81 HydrophobicContact CE1-CG1 3.41Å; F64-V81 VanDerWaalsContact CE1-CG1 3.41Å; F64-V81 HydrophobicContact CE1-CG2 4.49Å; F64-V81 HydrophobicContact CE2-CB 4.06Å; F64-V81 HydrophobicContact CE2-CG1 4.47Å; F64-V81 HydrophobicContact CE2-CG2 4.18Å; F64-V81 HydrophobicContact CG-CB 4.49Å; F64-V81 HydrophobicContact CZ-CB 3.57Å; F64-V81 HydrophobicContact CZ-CG1 3.52Å; F64-V81 HydrophobicContact CZ-CG2 3.97Å; V79-V81 PolarHBondContact O-N 3.49Å; V81-V83 HydrophobicContact CG1-CG2 4.03Å; V81-I102 HydrophobicContact CB-CG2 4.47Å; V81-I102 HydrophobicContact CG1-CB 4.46Å; V81-I102 HydrophobicContact CG1-CD1 4.36Å; V81-I102 HydrophobicContact CG1-CG1 4.05Å; V81-I102 HydrophobicContact CG1-CG2 3.74Å; V81-I102 HydrophobicContact CG2-CG2 3.82Å
82	V	77.8	Confident	79.6	Confident	75 Å²	75	50.8 Å²	50.8	46%	0.455	26%	0.264	S	S	.	.			trans	-96.2	124.8	168.9	-179.6	0	0	0	0	108.6	P67 P84 F433	P67-V82 HydrophobicContact CG-CG2 3.64Å; V82-P84 WeakPolarHBondContact O-CD 3.28Å; V82-F433 WeakPolarHBondContact O-CZ 3.39Å
83	V	75.5	Confident	79.5	Confident	12 Å²	12	50.4 Å²	50.4	7%	0.073	26%	0.262	C	S	.	.			trans	-107.5	106.4	177.2	-176.2	0	0	0	0	109.8	F64 V81 L87 L91 I142	F64-V83 HydrophobicContact CE1-CG2 4.4Å; V81-V83 HydrophobicContact CG1-CG2 4.03Å; V83-L87 HydrophobicContact CG1-CB 3.94Å; V83-L91 HydrophobicContact CG1-CD1 4.05Å; V83-I142 HydrophobicContact CB-CG2 3.82Å; V83-I142 HydrophobicContact CG2-CG2 3.55Å
84	P	70.5	Confident	79	Confident	46 Å²	46	51.2 Å²	51.2	30%	0.299	27%	0.273	S	S	.	.			trans	-54.6	147.3	174.5	-27.1	34.7	0	0	0	112.4	V82 L86 L87 Y88 F433	V82-P84 WeakPolarHBondContact O-CD 3.28Å; P84-L86 CarbonylContact O-C 3.49Å; P84-L86 PolarHBondContact O-N 3Å; P84-L87 HydrophobicContact CG-CD1 4.29Å; P84-L87 WeakPolarHBondContact O-CA 3.26Å; P84-L87 PolarHBondContact O-N 3.05Å; P84-Y88 PolarHBondContact O-N 3Å; P84-F433 HydrophobicContact CG-CZ 4.49Å
85	T	71.2	Confident	78.3	Confident	97 Å²	97	52 Å²	52	60%	0.595	28%	0.282	S	S	*	.	H	α-helix	trans	-54.2	-33.5	-175.5	-45	0	0	0	0	113.4	R89	T85-R89 VanDerWaalsContact O-CG 3.28Å; T85-R89 WeakPolarHBondContact O-CG 3.11Å; T85-R89 PolarHBondContact O-N 2.81Å
86	L	66.9	Low	77.3	Confident	33 Å²	33	52.5 Å²	52.5	17%	0.173	29%	0.285	C	S	.	.	H	α-helix	trans	-59.4	-55.1	170.5	170.6	53.9	0	0	0	112	P84 Y88 R89 R90 L415 D416	P84-L86 CarbonylContact O-C 3.49Å; P84-L86 PolarHBondContact O-N 3Å; L86-Y88 VanDerWaalsContact C-N 3.29Å; L86-Y88 PolarHBondContact O-N 3.42Å; L86-R89 PolarHBondContact O-N 2.9Å; L86-R90 VanDerWaalsContact CD1-CD 3.44Å; L86-R90 HydrophobicContact CD1-CG 4.01Å; L86-R90 VanDerWaalsContact O-CG 3.31Å; L86-R90 WeakPolarHBondContact O-CG 3.47Å; L86-R90 PolarHBondContact O-N 3.25Å; L86-L415 HydrophobicContact CD2-CD2 3.96Å; L86-L415 HydrophobicContact CD2-CG 4.25Å; L86-D416 WeakPolarHBondContact CD1-OD1 3.43Å; L86-D416 WeakPolarHBondContact CD2-OD1 3.34Å
87	L	70.1	Confident	77	Confident	7 Å²	7	49.3 Å²	49.3	4%	0.037	27%	0.274	C	S	.	.	H	α-helix	trans	-65.2	-34.9	-179.2	-76.6	166.3	0	0	0	111.5	V83 P84 R90 L91 V101 F433 L436	V83-L87 HydrophobicContact CG1-CB 3.94Å; P84-L87 HydrophobicContact CG-CD1 4.29Å; P84-L87 WeakPolarHBondContact O-CA 3.26Å; P84-L87 PolarHBondContact O-N 3.05Å; L87-R90 PolarHBondContact O-N 2.92Å; L87-L91 WeakPolarHBondContact O-CB 2.95Å; L87-L91 VanDerWaalsContact O-CG 3.3Å; L87-L91 WeakPolarHBondContact O-CG 3.1Å; L87-L91 PolarHBondContact O-N 2.87Å; L87-V101 HydrophobicContact CB-CG1 4.31Å; L87-V101 HydrophobicContact CD1-CG1 4.2Å; L87-V101 HydrophobicContact CD2-CG1 4.34Å; L87-V101 HydrophobicContact CD2-CG2 3.83Å; L87-F433 HydrophobicContact CD1-CD2 3.99Å; L87-F433 HydrophobicContact CD1-CE2 3.82Å; L87-L436 HydrophobicContact CD1-CB 4.44Å; L87-L436 HydrophobicContact CD1-CD1 4.11Å; L87-L436 HydrophobicContact CD2-CD1 3.73Å; L87-L436 HydrophobicContact CG-CD1 4.47Å
88	Y	78.7	Confident	77	Confident	41 Å²	41	47.1 Å²	47.1	16%	0.161	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-52.2	171.1	180	-110.2	0	0	0	111.8	P84 L86 R90 L91 Q92 I142 L145	P84-Y88 PolarHBondContact O-N 3Å; L86-Y88 VanDerWaalsContact C-N 3.29Å; L86-Y88 PolarHBondContact O-N 3.42Å; Y88-R90 PolarHBondContact O-N 2.83Å; Y88-L91 PolarHBondContact O-N 3.11Å; Y88-Q92 HydrophobicContact CE1-CG 4.26Å; Y88-Q92 HydrophobicContact CE2-CG 4.4Å; Y88-Q92 VanDerWaalsContact CZ-NE2 3.3Å; Y88-Q92 WeakPolarHBondContact O-CG 3.33Å; Y88-Q92 PolarHBondContact O-N 2.92Å; Y88-Q92 PolarHBondContact OH-NE2 3.21Å; Y88-I142 HydrophobicContact CD2-CG1 3.7Å; Y88-I142 HydrophobicContact CE2-CG1 3.88Å; Y88-I142 HydrophobicContact CG-CG1 4.45Å; Y88-L145 HydrophobicContact CD2-CD2 3.5Å; Y88-L145 HydrophobicContact CE2-CB 4.32Å; Y88-L145 HydrophobicContact CE2-CD2 3.42Å; Y88-L145 VanDerWaalsContact CE2-CD2 3.42Å; Y88-L145 HydrophobicContact CG-CD2 4.46Å
89	R	76	Confident	76.6	Confident	129 Å²	129	47 Å²	47	49%	0.487	25%	0.251	S	S	.	.	H	α-helix	trans	-56.7	-35.3	174.7	-72.3	167.9	178.4	178	0.9	112.6	T85 L86 R93	T85-R89 VanDerWaalsContact O-CG 3.28Å; T85-R89 WeakPolarHBondContact O-CG 3.11Å; T85-R89 PolarHBondContact O-N 2.81Å; L86-R89 PolarHBondContact O-N 2.9Å; R89-R93 VanDerWaalsContact O-CG 3.27Å; R89-R93 WeakPolarHBondContact O-CG 3.24Å; R89-R93 PolarHBondContact O-N 2.84Å
90	R	72.6	Confident	75.9	Confident	8 Å²	8	44.8 Å²	44.8	3%	0.03	24%	0.237	C	C	.	.	H	α-helix	trans	-78.5	-36.2	-178.7	-71	176.4	57.3	164.8	-3	113	L86 L87 Y88 R93 G94 S95 V96 Y419	L86-R90 VanDerWaalsContact CD1-CD 3.44Å; L86-R90 HydrophobicContact CD1-CG 4.01Å; L86-R90 VanDerWaalsContact O-CG 3.31Å; L86-R90 WeakPolarHBondContact O-CG 3.47Å; L86-R90 PolarHBondContact O-N 3.25Å; L87-R90 PolarHBondContact O-N 2.92Å; Y88-R90 PolarHBondContact O-N 2.83Å; R90-R93 PolarHBondContact O-N 2.82Å; R90-G94 PolarHBondContact O-N 3.38Å; R90-S95 PolarHBondContact O-N 3.47Å; R90-V96 HydrophobicContact CB-CG2 4.04Å; R90-Y419 PolarHBondContact NH2-OH 2.83Å
91	L	80.7	Confident	75	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-65.8	-39.8	168	-71.8	170.6	0	0	0	111.3	V83 L87 Y88 R93 G94 A98 V101 L145 R149	V83-L91 HydrophobicContact CG1-CD1 4.05Å; L87-L91 WeakPolarHBondContact O-CB 2.95Å; L87-L91 VanDerWaalsContact O-CG 3.3Å; L87-L91 WeakPolarHBondContact O-CG 3.1Å; L87-L91 PolarHBondContact O-N 2.87Å; Y88-L91 PolarHBondContact O-N 3.11Å; L91-R93 PolarHBondContact O-N 2.85Å; L91-G94 PolarHBondContact O-N 2.9Å; L91-A98 HydrophobicContact CD2-CB 4.09Å; L91-V101 HydrophobicContact CD1-CB 4.47Å; L91-V101 HydrophobicContact CD1-CG1 4.19Å; L91-V101 HydrophobicContact CD2-CB 4.38Å; L91-V101 HydrophobicContact CD2-CG2 4.01Å; L91-V101 HydrophobicContact CG-CG2 4.31Å; L91-L145 HydrophobicContact CB-CD2 3.79Å; L91-L145 HydrophobicContact CB-CG 4.27Å; L91-R149 PolarHBondContact O-NE 3.45Å; L91-R149 PolarHBondContact O-NH2 2.85Å
92	Q	81.2	Confident	74.3	Confident	97 Å²	97	42.8 Å²	42.8	45%	0.453	23%	0.226	S	C	.	.	H	α-helix	trans	-57.9	-47.3	172.3	-74.9	-178.2	-36.9	0	0	111	Y88 G94 L145 R149	Y88-Q92 HydrophobicContact CE1-CG 4.26Å; Y88-Q92 HydrophobicContact CE2-CG 4.4Å; Y88-Q92 VanDerWaalsContact CZ-NE2 3.3Å; Y88-Q92 WeakPolarHBondContact O-CG 3.33Å; Y88-Q92 PolarHBondContact O-N 2.92Å; Y88-Q92 PolarHBondContact OH-NE2 3.21Å; Q92-G94 VanDerWaalsContact C-N 3.32Å; Q92-G94 PolarHBondContact O-N 3.07Å; Q92-L145 HydrophobicContact CB-CD2 4.47Å; Q92-L145 HydrophobicContact CG-CD1 4.42Å; Q92-L145 HydrophobicContact CG-CD2 3.63Å; Q92-R149 PolarHBondContact O-NH2 3.14Å
93	R	81.2	Confident	73.5	Confident	179 Å²	179	39.6 Å²	39.6	68%	0.675	21%	0.207	S	C	*	.	H	α-helix	trans	-71.6	-20	176.7	-68.2	169.2	-171.4	169.7	2.5	114.3	R89 R90 L91 S95	R89-R93 VanDerWaalsContact O-CG 3.27Å; R89-R93 WeakPolarHBondContact O-CG 3.24Å; R89-R93 PolarHBondContact O-N 2.84Å; R90-R93 PolarHBondContact O-N 2.82Å; L91-R93 PolarHBondContact O-N 2.85Å; R93-S95 VanDerWaalsContact C-N 3.34Å
94	G	76.3	Confident	72.5	Confident	40 Å²	40	40.3 Å²	40.3	41%	0.412	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	20.4	-173.9	0	0	0	0	0	114	R90 L91 Q92 V96	R90-G94 PolarHBondContact O-N 3.38Å; L91-G94 PolarHBondContact O-N 2.9Å; Q92-G94 VanDerWaalsContact C-N 3.32Å; Q92-G94 PolarHBondContact O-N 3.07Å; G94-V96 PolarHBondContact O-N 2.83Å
95	S	74.1	Confident	71.5	Confident	45 Å²	45	40.5 Å²	40.5	32%	0.315	21%	0.21	S	C	.	.	S	Bend	trans	-80.7	-4.8	177.6	67.1	0	0	0	0	113.7	R90 R93	R90-S95 PolarHBondContact O-N 3.47Å; R93-S95 VanDerWaalsContact C-N 3.34Å
96	V	68.8	Low	70.5	Confident	12 Å²	12	40 Å²	40	7%	0.073	20%	0.203	C	C	.	.	S	Bend	trans	-141.8	149.3	173.2	-163	0	0	0	0	108.5	R90 G94 S100 V101	R90-V96 HydrophobicContact CB-CG2 4.04Å; G94-V96 PolarHBondContact O-N 2.83Å; V96-S100 VanDerWaalsContact CG1-OG 3.26Å; V96-S100 WeakPolarHBondContact CG1-OG 3.33Å; V96-V101 HydrophobicContact CB-CG2 4.06Å; V96-V101 HydrophobicContact CG1-CG2 3.46Å; V96-V101 VanDerWaalsContact CG1-CG2 3.46Å
97	S	78.2	Confident	69.6	Low	35 Å²	35	43.4 Å²	43.4	25%	0.245	22%	0.218	C	C	.	.			trans	-78.5	144.1	175.2	144.9	0	0	0	0	111	S99 S100 V101 E153	S97-S99 PolarHBondContact OG-N 3.46Å; S97-S99 VanDerWaalsContact OG-N 3.15Å; S97-S99 PolarHBondContact OG-OG 3.25Å; S97-S100 PolarHBondContact O-N 2.9Å; S97-S100 PolarHBondContact O-OG 2.73Å; S97-S100 PolarHBondContact OG-N 2.78Å; S97-V101 WeakPolarHBondContact O-CG2 3.45Å; S97-V101 PolarHBondContact O-N 3.25Å; S97-E153 VanDerWaalsContact C-OE1 3.27Å; S97-E153 WeakPolarHBondContact CA-OE1 3.46Å; S97-E153 WeakPolarHBondContact CB-OE1 3.35Å; S97-E153 PolarHBondContact OG-OE1 2.87Å; S97-E153 PolarHBondContact OG-OE2 3.26Å
98	A	80.5	Confident	68.8	Low	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.3	-38.8	171.9	0	0	0	0	0	111.9	L91 S100 V101 I102 R149 L150 E153	L91-A98 HydrophobicContact CD2-CB 4.09Å; A98-S100 VanDerWaalsContact C-N 3.26Å; A98-S100 PolarHBondContact O-N 2.99Å; A98-V101 PolarHBondContact O-N 3.01Å; A98-I102 HydrophobicContact CB-CD1 4.4Å; A98-I102 VanDerWaalsContact O-CB 3.32Å; A98-I102 WeakPolarHBondContact O-CB 3.38Å; A98-I102 PolarHBondContact O-N 3.5Å; A98-R149 HydrophobicContact CB-CB 3.45Å; A98-R149 VanDerWaalsContact CB-CB 3.45Å; A98-L150 HydrophobicContact CB-CD2 3.84Å; A98-L150 HydrophobicContact CB-CG 3.89Å; A98-E153 PolarHBondContact N-OE1 3.34Å
99	S	77.9	Confident	67.6	Low	10 Å²	10	45 Å²	45	7%	0.07	22%	0.224	C	C	.	.	H	α-helix	trans	-67.6	-25.7	172.7	65.7	0	0	0	0	113	S97 I103 R109 E153 Y155	S97-S99 PolarHBondContact OG-N 3.46Å; S97-S99 VanDerWaalsContact OG-N 3.15Å; S97-S99 PolarHBondContact OG-OG 3.25Å; S99-I103 VanDerWaalsContact O-CB 3.28Å; S99-I103 WeakPolarHBondContact O-CB 3.19Å; S99-I103 PolarHBondContact O-N 3.31Å; S99-R109 PolarHBondContact O-NH2 3.09Å; S99-E153 VanDerWaalsContact CB-OE2 3.26Å; S99-E153 WeakPolarHBondContact CB-OE2 3.49Å; S99-E153 PolarHBondContact N-OE2 3.32Å; S99-E153 PolarHBondContact OG-OE2 2.87Å; S99-Y155 VanDerWaalsContact CB-OH 3.26Å; S99-Y155 WeakPolarHBondContact CB-OH 3.2Å; S99-Y155 WeakPolarHBondContact OG-CE2 3.31Å; S99-Y155 PolarHBondContact OG-OH 3.24Å
100	S	67.5	Low	66.4	Low	16 Å²	16	46.1 Å²	46.1	11%	0.112	24%	0.236	C	C	.	.	H	α-helix	trans	-79.8	-28	173.3	87.7	0	0	0	0	113.9	V96 S97 A98 R109 S430	V96-S100 VanDerWaalsContact CG1-OG 3.26Å; V96-S100 WeakPolarHBondContact CG1-OG 3.33Å; S97-S100 PolarHBondContact O-N 2.9Å; S97-S100 PolarHBondContact O-OG 2.73Å; S97-S100 PolarHBondContact OG-N 2.78Å; A98-S100 VanDerWaalsContact C-N 3.26Å; A98-S100 PolarHBondContact O-N 2.99Å; S100-R109 PolarHBondContact O-NH2 3.11Å; S100-S430 WeakPolarHBondContact CB-OG 3.39Å; S100-S430 PolarHBondContact OG-OG 3.09Å
101	V	67.1	Low	65.8	Low	2 Å²	2	49.7 Å²	49.7	1%	0.012	25%	0.253	C	S	.	.	H	α-helix	trans	-81.2	-36.6	174.1	175.8	0	0	0	0	113.8	L87 L91 V96 S97 A98 F433	L87-V101 HydrophobicContact CB-CG1 4.31Å; L87-V101 HydrophobicContact CD1-CG1 4.2Å; L87-V101 HydrophobicContact CD2-CG1 4.34Å; L87-V101 HydrophobicContact CD2-CG2 3.83Å; L91-V101 HydrophobicContact CD1-CB 4.47Å; L91-V101 HydrophobicContact CD1-CG1 4.19Å; L91-V101 HydrophobicContact CD2-CB 4.38Å; L91-V101 HydrophobicContact CD2-CG2 4.01Å; L91-V101 HydrophobicContact CG-CG2 4.31Å; V96-V101 HydrophobicContact CB-CG2 4.06Å; V96-V101 HydrophobicContact CG1-CG2 3.46Å; V96-V101 VanDerWaalsContact CG1-CG2 3.46Å; S97-V101 WeakPolarHBondContact O-CG2 3.45Å; S97-V101 PolarHBondContact O-N 3.25Å; A98-V101 PolarHBondContact O-N 3.01Å; V101-F433 HydrophobicContact CG1-CD2 4.12Å; V101-F433 HydrophobicContact CG1-CE2 4.49Å; V101-F433 VanDerWaalsContact O-CB 3.3Å; V101-F433 WeakPolarHBondContact O-CB 3.38Å; V101-F433 WeakPolarHBondContact O-CD2 3.37Å; V101-F433 WeakPolarHBondContact O-CG 3.41Å
102	I	68	Low	65	Low	14 Å²	14	54 Å²	54	7%	0.072	27%	0.269	C	S	.	.	H	α-helix	trans	-112.9	-24.4	-163.1	-61.2	168.8	0	0	0	112.1	L62 V81 A98 V146	L62-I102 HydrophobicContact CD1-CG2 4Å; L62-I102 HydrophobicContact CD2-CG2 4.28Å; V81-I102 HydrophobicContact CB-CG2 4.47Å; V81-I102 HydrophobicContact CG1-CB 4.46Å; V81-I102 HydrophobicContact CG1-CD1 4.36Å; V81-I102 HydrophobicContact CG1-CG1 4.05Å; V81-I102 HydrophobicContact CG1-CG2 3.74Å; V81-I102 HydrophobicContact CG2-CG2 3.82Å; A98-I102 HydrophobicContact CB-CD1 4.4Å; A98-I102 VanDerWaalsContact O-CB 3.32Å; A98-I102 WeakPolarHBondContact O-CB 3.38Å; A98-I102 PolarHBondContact O-N 3.5Å; I102-V146 HydrophobicContact CD1-CB 3.91Å; I102-V146 HydrophobicContact CD1-CG1 3.37Å; I102-V146 HydrophobicContact CD1-CG2 3.24Å
103	I	61.1	Low	64.6	Low	8 Å²	8	56.7 Å²	56.7	4%	0.041	28%	0.275	C	S	.	.			trans	-107.1	86.6	-174.9	-54.2	179.8	0	0	0	107.8	S99 M105 V108 R109 L116 L150 Y155	S99-I103 VanDerWaalsContact O-CB 3.28Å; S99-I103 WeakPolarHBondContact O-CB 3.19Å; S99-I103 PolarHBondContact O-N 3.31Å; I103-M105 PolarHBondContact O-N 3.01Å; I103-V108 HydrophobicContact CD1-CG1 4.06Å; I103-V108 HydrophobicContact CG2-CB 3.33Å; I103-V108 HydrophobicContact CG2-CG1 3.42Å; I103-V108 VanDerWaalsContact CG2-CG1 3.42Å; I103-V108 HydrophobicContact CG2-CG2 4.03Å; I103-R109 HydrophobicContact CG2-CG 4.34Å; I103-R109 VanDerWaalsContact O-CZ 3.23Å; I103-R109 PolarHBondContact O-NE 2.98Å; I103-R109 PolarHBondContact O-NH2 2.87Å; I103-L116 HydrophobicContact CD1-CD1 3.66Å; I103-L116 HydrophobicContact CD1-CD2 4.36Å; I103-L150 HydrophobicContact CD1-CD2 4.02Å; I103-Y155 HydrophobicContact CD1-CD1 4.37Å; I103-Y155 HydrophobicContact CD1-CE1 4.07Å
104	S	53.4	Low	64.4	Low	27 Å²	27	48.7 Å²	48.7	19%	0.189	25%	0.246	C	C	.	.			trans	-83.4	12.3	179.6	58	0	0	0	0	114.1
105	M	50.7	Low	64.9	Low	50 Å²	50	48 Å²	48	25%	0.246	23%	0.234	C	C	.	.			trans	-113.4	120	177.8	-68.1	177.5	64.7	0	0	110.7	Y60 I103 E107 V108 R109	Y60-M105 HydrophobicContact CE1-CE 3.84Å; Y60-M105 HydrophobicContact CE1-SD 3.78Å; I103-M105 PolarHBondContact O-N 3.01Å; M105-E107 HydrophobicContact CE-CB 4.47Å; M105-E107 WeakPolarHBondContact CE-OE2 3.35Å; M105-E107 PolarHBondContact O-N 3.03Å; M105-V108 HydrophobicContact CB-CG2 3.98Å; M105-V108 PolarHBondContact O-N 3.1Å; M105-R109 PolarHBondContact O-N 3.47Å
106	D	50.3	Low	65.6	Low	86 Å²	86	45.9 Å²	45.9	46%	0.46	22%	0.22	S	C	.	.	H	α-helix	trans	-58.3	-33.6	173.2	-74.2	-41.1	0	0	0	111.6	V108 R109 M110	D106-V108 VanDerWaalsContact C-N 3.26Å; D106-V108 PolarHBondContact O-N 2.95Å; D106-R109 PolarHBondContact O-N 3.23Å; D106-M110 VanDerWaalsContact O-CG 3.29Å; D106-M110 WeakPolarHBondContact O-CG 3.35Å; D106-M110 PolarHBondContact O-N 2.98Å
107	E	48.1	Very low	66.7	Low	104 Å²	104	45.4 Å²	45.4	49%	0.486	22%	0.217	S	C	.	.	H	α-helix	trans	-53.5	-40.2	176.7	-61.2	-176.5	142.9	0	0	112.8	M105 H111	M105-E107 HydrophobicContact CE-CB 4.47Å; M105-E107 WeakPolarHBondContact CE-OE2 3.35Å; M105-E107 PolarHBondContact O-N 3.03Å; E107-H111 WeakPolarHBondContact O-CB 3.27Å; E107-H111 PolarHBondContact O-N 3Å; E107-H111 PolarHBondContact O-ND1 3.26Å
108	V	52.6	Low	67.3	Low	3 Å²	3	43.8 Å²	43.8	2%	0.018	21%	0.205	C	C	.	.	H	α-helix	trans	-78.5	-32.3	178.8	-174.7	0	0	0	0	111.6	Y60 I103 M105 D106 H111 R112 L116	Y60-V108 HydrophobicContact CD1-CG2 3.8Å; Y60-V108 HydrophobicContact CD2-CG2 3.85Å; Y60-V108 HydrophobicContact CE1-CG2 3.47Å; Y60-V108 VanDerWaalsContact CE1-CG2 3.47Å; Y60-V108 HydrophobicContact CE2-CG2 3.55Å; Y60-V108 HydrophobicContact CG-CG2 3.98Å; I103-V108 HydrophobicContact CD1-CG1 4.06Å; I103-V108 HydrophobicContact CG2-CB 3.33Å; I103-V108 HydrophobicContact CG2-CG1 3.42Å; I103-V108 VanDerWaalsContact CG2-CG1 3.42Å; I103-V108 HydrophobicContact CG2-CG2 4.03Å; M105-V108 HydrophobicContact CB-CG2 3.98Å; M105-V108 PolarHBondContact O-N 3.1Å; D106-V108 VanDerWaalsContact C-N 3.26Å; D106-V108 PolarHBondContact O-N 2.95Å; V108-H111 CarbonylContact O-C 3.51Å; V108-H111 PolarHBondContact O-N 3.4Å; V108-R112 PolarHBondContact O-N 3.11Å; V108-L116 HydrophobicContact CG1-CD2 4.09Å
109	R	53.9	Low	67.8	Low	79 Å²	79	44 Å²	44	30%	0.298	21%	0.206	S	C	.	.	H	α-helix	trans	-68.3	-39.2	175.2	-64.5	177.8	-179.3	-180	-1.6	111.3	S99 S100 I103 M105 D106	S99-R109 PolarHBondContact O-NH2 3.09Å; S100-R109 PolarHBondContact O-NH2 3.11Å; I103-R109 HydrophobicContact CG2-CG 4.34Å; I103-R109 VanDerWaalsContact O-CZ 3.23Å; I103-R109 PolarHBondContact O-NE 2.98Å; I103-R109 PolarHBondContact O-NH2 2.87Å; M105-R109 PolarHBondContact O-N 3.47Å; D106-R109 PolarHBondContact O-N 3.23Å
110	M	51.2	Low	68.1	Low	152 Å²	152	44.6 Å²	44.6	75%	0.749	21%	0.209	S	C	*	.	H	α-helix	trans	-67.5	-46.2	171.2	-62.9	-59.7	171.4	0	0	111	D106 R112	D106-M110 VanDerWaalsContact O-CG 3.29Å; D106-M110 WeakPolarHBondContact O-CG 3.35Å; D106-M110 PolarHBondContact O-N 2.98Å; M110-R112 VanDerWaalsContact C-N 3.32Å; M110-R112 PolarHBondContact O-N 2.88Å
111	H	58.3	Low	68.4	Low	83 Å²	83	45 Å²	45	38%	0.384	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	59.4	177.5	-58.2	89.2	0	0	0	112	E107 V108 R113 T114	E107-H111 WeakPolarHBondContact O-CB 3.27Å; E107-H111 PolarHBondContact O-N 3Å; E107-H111 PolarHBondContact O-ND1 3.26Å; V108-H111 CarbonylContact O-C 3.51Å; V108-H111 PolarHBondContact O-N 3.4Å; H111-R113 PolarHBondContact O-N 2.87Å; H111-T114 WeakPolarHBondContact CB-OG1 3.08Å; H111-T114 WeakPolarHBondContact O-CB 3.45Å; H111-T114 PolarHBondContact O-N 2.89Å; H111-T114 PolarHBondContact O-OG1 2.86Å
112	R	64.9	Low	68.1	Low	92 Å²	92	50.4 Å²	50.4	35%	0.347	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-1.8	179.1	-136.1	176.5	-171.9	-119.6	-3.2	115.8	V108 M110 E153 Y155 P156	V108-R112 PolarHBondContact O-N 3.11Å; M110-R112 VanDerWaalsContact C-N 3.32Å; M110-R112 PolarHBondContact O-N 2.88Å; R112-E153 PolarHBondContact NH1-O 3.41Å; R112-E153 PolarHBondContact NH2-O 3.39Å; R112-Y155 HydrophobicContact CB-CE1 4.4Å; R112-Y155 HydrophobicContact CG-CD1 4.03Å; R112-Y155 HydrophobicContact CG-CE1 3.44Å; R112-Y155 VanDerWaalsContact CG-CE1 3.44Å; R112-Y155 HydrophobicContact CG-CE2 4.14Å; R112-Y155 VanDerWaalsContact CG-CZ 3.48Å; R112-Y155 PolarHBondContact NE-OH 3.33Å; R112-P156 WeakPolarHBondContact O-CD 3.33Å
113	R	71.7	Confident	67.1	Low	154 Å²	154	53.4 Å²	53.4	58%	0.581	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-8.4	176.3	-63.3	-178.9	-178.3	153.5	3.9	113.6	F21 H111 P156	F21-R113 VanDerWaalsContact CD1-NH2 3.32Å; H111-R113 PolarHBondContact O-N 2.87Å; R113-P156 WeakPolarHBondContact O-CG 3.27Å
114	T	78	Confident	65.8	Low	10 Å²	10	59 Å²	59	6%	0.061	29%	0.293	C	S	.	.	S	Bend	trans	-72.3	129	-179.7	-54.7	0	0	0	0	109.9	A58 Y60 H111	A58-T114 WeakPolarHBondContact O-CG2 3.21Å; Y60-T114 HydrophobicContact CD2-CG2 3.67Å; Y60-T114 HydrophobicContact CE2-CG2 3.87Å; H111-T114 WeakPolarHBondContact CB-OG1 3.08Å; H111-T114 WeakPolarHBondContact O-CB 3.45Å; H111-T114 PolarHBondContact O-N 2.89Å; H111-T114 PolarHBondContact O-OG1 2.86Å
115	P	86.8	Confident	64.7	Low	25 Å²	25	62.8 Å²	62.8	16%	0.162	32%	0.32	C	S	.	.			trans	-62.8	139.6	-178.5	-22.9	33.9	0	0	0	113	W41 P59 Y60 P156	W41-P115 HydrophobicContact CH2-CB 3.88Å; W41-P115 HydrophobicContact CH2-CG 4Å; W41-P115 HydrophobicContact CZ2-CG 4.5Å; P59-P115 CarbonylContact C-O 3.58Å; P59-P115 VanDerWaalsContact CA-O 3.24Å; P59-P115 WeakPolarHBondContact CA-O 3.48Å; P59-P115 HydrophobicContact CB-CB 4.24Å; Y60-P115 PolarHBondContact N-O 3.13Å; P115-P156 CarbonylContact C-O 3.6Å; P115-P156 WeakPolarHBondContact CA-O 3.21Å
116	L	88.9	Confident	63.7	Low	2 Å²	2	65.5 Å²	65.5	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.6	174.4	-54.7	-179.6	0	0	0	108.5	Y60 L62 I103 V108 L150 Y155 P156 V157 A158	Y60-L116 WeakPolarHBondContact O-CA 3.29Å; L62-L116 HydrophobicContact CD1-CB 4.48Å; I103-L116 HydrophobicContact CD1-CD1 3.66Å; I103-L116 HydrophobicContact CD1-CD2 4.36Å; V108-L116 HydrophobicContact CG1-CD2 4.09Å; L116-L150 HydrophobicContact CD1-CD1 3.84Å; L116-L150 HydrophobicContact CD1-CD2 4.05Å; L116-L150 HydrophobicContact CD1-CG 4.41Å; L116-Y155 HydrophobicContact CD1-CD1 3.85Å; L116-Y155 HydrophobicContact CD1-CG 4.01Å; L116-P156 PolarHBondContact N-O 3.49Å; L116-V157 HydrophobicContact CB-CB 4.14Å; L116-V157 HydrophobicContact CB-CG2 3.95Å; L116-V157 VanDerWaalsContact O-CA 3.29Å; L116-V157 WeakPolarHBondContact O-CA 3.34Å; L116-A158 PolarHBondContact O-N 3.4Å
117	V	91.4	Very high	62.6	Low	1 Å²	1	66.5 Å²	66.5	1%	0.006	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	117.7	-177.3	-179.3	0	0	0	0	109.6	V37 W41 L42 P59 Y60 V61 L62 A158 L160	V37-V117 HydrophobicContact CG2-CB 4.49Å; V37-V117 HydrophobicContact CG2-CG1 3.71Å; V37-V117 HydrophobicContact CG2-CG2 3.94Å; W41-V117 HydrophobicContact CZ3-CG2 4.09Å; L42-V117 HydrophobicContact CD1-CG2 4.28Å; L42-V117 HydrophobicContact CD2-CG1 4.22Å; P59-V117 HydrophobicContact CB-CG2 4.04Å; Y60-V117 PolarHBondContact O-N 2.85Å; V61-V117 CarbonylContact C-O 3.59Å; V61-V117 WeakPolarHBondContact CA-O 3.44Å; V61-V117 HydrophobicContact CG2-CB 4.45Å; L62-V117 PolarHBondContact N-O 3.26Å; V117-A158 CarbonylContact C-O 3.16Å; V117-A158 WeakPolarHBondContact CA-O 3.44Å; V117-L160 HydrophobicContact CG1-CB 4.13Å
118	L	91.6	Very high	61.5	Low	1 Å²	1	68.9 Å²	68.9	1%	0.005	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	129.9	-178.7	-83.1	56.4	0	0	0	110.1	L62 F64 V146 V157 A158 F159 L160	L62-L118 HydrophobicContact CB-CD1 4.41Å; L62-L118 HydrophobicContact CD1-CD1 4.12Å; L62-L118 WeakPolarHBondContact O-CA 3.43Å; F64-L118 HydrophobicContact CD2-CG 4.35Å; F64-L118 HydrophobicContact CE2-CD2 4.39Å; F64-L118 HydrophobicContact CE2-CG 3.92Å; L118-V146 HydrophobicContact CD2-CG1 4.47Å; L118-V157 HydrophobicContact CD1-CG2 3.4Å; L118-V157 HydrophobicContact CD2-CG2 4.43Å; L118-A158 PolarHBondContact N-O 2.9Å; L118-F159 HydrophobicContact CB-CD1 3.6Å; L118-F159 HydrophobicContact CB-CE1 3.78Å; L118-F159 HydrophobicContact CB-CG 4.2Å; L118-F159 HydrophobicContact CD2-CD1 4.42Å; L118-F159 HydrophobicContact CD2-CE1 3.85Å; L118-F159 HydrophobicContact CD2-CE2 4.39Å; L118-F159 HydrophobicContact CD2-CZ 3.83Å; L118-F159 HydrophobicContact CG-CE1 4.46Å; L118-F159 WeakPolarHBondContact O-CA 3.43Å; L118-L160 PolarHBondContact O-N 3.42Å
119	V	90.2	Very high	60.6	Low	4 Å²	4	73.2 Å²	73.2	2%	0.024	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	137.3	168.6	173.9	0	0	0	0	107.2	V61 L62 D63 F64 L160 L164	V61-V119 HydrophobicContact CG1-CG2 3.79Å; L62-V119 PolarHBondContact O-N 3.04Å; D63-V119 HydrophobicContact CB-CB 4.38Å; F64-V119 WeakPolarHBondContact CB-O 3.23Å; F64-V119 PolarHBondContact N-O 3.45Å; V119-L160 HydrophobicContact CG2-CB 4.17Å; V119-L160 HydrophobicContact CG2-CD2 3.93Å; V119-L164 HydrophobicContact CG1-CB 3.97Å; V119-L164 HydrophobicContact CG1-CD1 4.02Å; V119-L164 HydrophobicContact CG1-CD2 4.2Å; V119-L164 HydrophobicContact CG1-CG 4.29Å; V119-L164 HydrophobicContact CG2-CD1 4.21Å
120	D	84.7	Confident	59.5	Low	23 Å²	23	78.3 Å²	78.3	12%	0.123	44%	0.442	C	S	.	.			trans	-139.7	179.9	177.6	-157.8	-9.9	0	0	0	109	F64 R65 N139 L140 S143	F64-D120 HydrophobicContact CB-CB 4.45Å; R65-D120 VanDerWaalsContact CG-C 3.49Å; D120-N139 WeakPolarHBondContact OD1-CB 3.47Å; D120-L140 WeakPolarHBondContact OD2-CA 3.39Å; D120-S143 WeakPolarHBondContact OD2-CB 3.35Å; D120-S143 PolarHBondContact OD2-OG 3.46Å
121	E	73.5	Confident	58.5	Low	25 Å²	25	76 Å²	76	12%	0.117	44%	0.438	C	S	.	.			trans	-68.8	155.4	172.4	-74.8	173	-141.1	0	0	112.2	R65 R66 S123 N137 N139	R65-E121 HydrophobicContact CB-CG 4.06Å; R65-E121 HydrophobicContact CG-CG 3.84Å; R66-E121 WeakPolarHBondContact CG-OE1 3.35Å; R66-E121 VanDerWaalsContact CZ-CD 3.43Å; R66-E121 IonicContact CZ-OE1 3.34Å; R66-E121 IonicContact CZ-OE2 3.25Å; R66-E121 PolarHBondContact N-OE1 3.29Å; R66-E121 IonicContact NE-OE1 2.82Å; R66-E121 IonicContact NH1-OE1 2.91Å; R66-E121 PolarHBondContact NH1-OE1 3.23Å; R66-E121 IonicContact NH1-OE2 3.11Å; R66-E121 PolarHBondContact NH1-OE2 2.92Å; R66-E121 IonicContact NH2-OE1 3.21Å; R66-E121 PolarHBondContact NH2-OE1 3.4Å; R66-E121 IonicContact NH2-OE2 2.66Å; R66-E121 PolarHBondContact NH2-OE2 2.8Å; E121-S123 PolarHBondContact O-N 2.95Å; E121-S123 VanDerWaalsContact O-N 3.07Å; E121-N137 PolarHBondContact OE2-ND2 3.28Å; E121-N139 PolarHBondContact OE1-ND2 2.84Å
122	E	61.8	Low	57.1	Low	116 Å²	116	76.1 Å²	76.1	54%	0.542	45%	0.449	S	S	.	.			trans	-60.7	111.9	179	-68.4	176.8	-172	0	0	110.4	S163 N165	E122-S163 WeakPolarHBondContact OE1-CB 3.32Å; E122-S163 PolarHBondContact OE1-OG 3.36Å; E122-N165 PolarHBondContact OE1-ND2 3.17Å
123	S	46.3	Very low	56	Low	77 Å²	77	76.6 Å²	76.6	54%	0.538	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-54.1	124.4	161.2	-83.1	0	0	0	0	108.1	E121 S125	E121-S123 PolarHBondContact O-N 2.95Å; E121-S123 VanDerWaalsContact O-N 3.07Å; S123-S125 PolarHBondContact O-N 3.4Å; S123-S125 VanDerWaalsContact O-N 3.17Å
124	P	34.4	Very low	54.4	Low	124 Å²	124	73.5 Å²	73.5	81%	0.805	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-59.3	123.8	-177.3	23.2	-33	0	0	0	109.7	A126	P124-A126 PolarHBondContact O-N 2.85Å
125	S	30.4	Very low	52.4	Low	107 Å²	107	79.3 Å²	79.3	75%	0.748	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-69	130.6	-167.9	46	0	0	0	0	112.5	S123 C127	S123-S125 PolarHBondContact O-N 3.4Å; S123-S125 VanDerWaalsContact O-N 3.17Å; S125-C127 PolarHBondContact O-N 3.37Å
126	A	28.5	Very low	50.1	Low	107 Å²	107	81.5 Å²	81.5	88%	0.884	52%	0.518	S	S	*	.			trans	45.8	56.3	157.2	0	0	0	0	0	117.2	P124	P124-A126 PolarHBondContact O-N 2.85Å
127	C	26.7	Very low	48.4	Very low	107 Å²	107	84.1 Å²	84.1	72%	0.723	53%	0.532	S	S	*	.			trans	-112	118.4	165.1	-73.2	0	0	0	0	111	S125 S129	S125-C127 PolarHBondContact O-N 3.37Å; C127-S129 PolarHBondContact O-N 2.82Å; C127-S129 VanDerWaalsContact O-N 3.11Å
128	T	26.7	Very low	46.8	Very low	154 Å²	154	89.5 Å²	89.5	95%	0.945	56%	0.561	S	S	*	*			trans	-82.9	80.7	179.6	50	0	0	0	0	111.6
129	S	33.6	Very low	45.3	Very low	95 Å²	95	91 Å²	91	66%	0.664	57%	0.569	S	S	*	*	S	Bend	trans	-152	139.1	167.4	51	0	0	0	0	110.7	C127	C127-S129 PolarHBondContact O-N 2.82Å; C127-S129 VanDerWaalsContact O-N 3.11Å
130	E	29.4	Very low	43.9	Very low	185 Å²	185	93.4 Å²	93.4	86%	0.864	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-50.9	128.8	174.8	-74.9	-81.3	123.9	0	0	111	S132	E130-S132 PolarHBondContact O-N 2.66Å
131	P	30.5	Very low	43.4	Very low	103 Å²	103	95.6 Å²	95.6	67%	0.669	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-73.2	118.2	-177.6	28.2	-33.4	0	0	0	111.3	A133	P131-A133 PolarHBondContact O-N 3.21Å
132	S	28.4	Very low	43.9	Very low	86 Å²	86	95.6 Å²	95.6	60%	0.601	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-62.1	130.7	170.7	47.4	0	0	0	0	110.9	E130 S134	E130-S132 PolarHBondContact O-N 2.66Å; S132-S134 PolarHBondContact O-N 2.82Å
133	A	42.9	Very low	45.1	Very low	103 Å²	103	90.1 Å²	90.1	85%	0.851	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	16	-164.9	0	0	0	0	0	116.8	P131	P131-A133 PolarHBondContact O-N 3.21Å
134	S	38.8	Very low	47.1	Very low	89 Å²	89	89.8 Å²	89.8	62%	0.622	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-34	178.3	44.1	0	0	0	0	113.9	S132	S132-S134 PolarHBondContact O-N 2.82Å
135	D	34.3	Very low	49.6	Very low	131 Å²	131	84.4 Å²	84.4	70%	0.701	53%	0.525	S	S	*	.			trans	-120.5	20.2	-161.3	-62.4	-78.1	0	0	0	114.2	N137	D135-N137 PolarHBondContact O-N 3.3Å
136	T	38.7	Very low	52.3	Low	72 Å²	72	79.3 Å²	79.3	44%	0.442	49%	0.489	S	S	.	.			trans	-63.5	97.6	167.9	37.8	0	0	0	0	110.1	N138	T136-N138 PolarHBondContact O-N 3.17Å; T136-N138 VanDerWaalsContact O-N 3.13Å
137	N	53.1	Low	55.3	Low	57 Å²	57	75.7 Å²	75.7	31%	0.305	45%	0.452	S	S	.	.			trans	-43.6	115.6	-176	-167.3	6.2	0	0	0	110.7	R66 E121 D135 N139 L140	R66-N137 PolarHBondContact NH2-OD1 3.37Å; E121-N137 PolarHBondContact OE2-ND2 3.28Å; D135-N137 PolarHBondContact O-N 3.3Å; N137-N139 PolarHBondContact O-N 2.86Å; N137-L140 VanDerWaalsContact O-CB 3.29Å; N137-L140 WeakPolarHBondContact O-CB 3.44Å; N137-L140 PolarHBondContact O-N 3.27Å
138	N	59.3	Low	58.3	Low	114 Å²	114	77.1 Å²	77.1	61%	0.61	44%	0.443	S	S	*	.	H	α-helix	trans	-57.8	-29.1	-168.2	-79.1	-68.7	0	0	0	113	T136 L140 L141 I142	T136-N138 PolarHBondContact O-N 3.17Å; T136-N138 VanDerWaalsContact O-N 3.13Å; N138-L140 VanDerWaalsContact C-N 3.34Å; N138-L140 PolarHBondContact O-N 3.22Å; N138-L141 PolarHBondContact O-N 3.23Å; N138-I142 WeakPolarHBondContact O-CG1 3.31Å; N138-I142 PolarHBondContact O-N 2.98Å
139	N	58.4	Low	61.2	Low	31 Å²	31	72.1 Å²	72.1	17%	0.166	41%	0.406	C	S	.	.	H	α-helix	trans	-60.8	-42.5	176.6	-61.4	-7.1	0	0	0	111.2	D120 E121 N137 L141 I142 S143	D120-N139 WeakPolarHBondContact OD1-CB 3.47Å; E121-N139 PolarHBondContact OE1-ND2 2.84Å; N137-N139 PolarHBondContact O-N 2.86Å; N139-L141 VanDerWaalsContact C-N 3.3Å; N139-L141 PolarHBondContact O-N 3.35Å; N139-I142 CarbonylContact O-C 3.56Å; N139-I142 WeakPolarHBondContact O-CA 3.43Å; N139-I142 WeakPolarHBondContact O-CB 3.45Å; N139-I142 PolarHBondContact O-N 3.03Å; N139-S143 PolarHBondContact O-N 3.45Å; N139-S143 PolarHBondContact O-OG 3.4Å
140	L	60.8	Low	63.7	Low	56 Å²	56	67.6 Å²	67.6	29%	0.293	38%	0.375	S	S	.	.	H	α-helix	trans	-61	-36.8	176.3	-131.6	81.3	0	0	0	112.5	D120 N137 N138 S143 N144	D120-L140 WeakPolarHBondContact OD2-CA 3.39Å; N137-L140 VanDerWaalsContact O-CB 3.29Å; N137-L140 WeakPolarHBondContact O-CB 3.44Å; N137-L140 PolarHBondContact O-N 3.27Å; N138-L140 VanDerWaalsContact C-N 3.34Å; N138-L140 PolarHBondContact O-N 3.22Å; L140-S143 PolarHBondContact O-OG 3.23Å; L140-N144 WeakPolarHBondContact O-CB 3.49Å; L140-N144 PolarHBondContact O-N 3.4Å; L140-N144 PolarHBondContact O-ND2 2.82Å
141	L	74.3	Confident	66.6	Low	69 Å²	69	61.1 Å²	61.1	36%	0.361	35%	0.35	S	S	.	.	H	α-helix	trans	-73.4	-32.2	176.2	-63.9	176.3	0	0	0	112	N138 N139 L145	N138-L141 PolarHBondContact O-N 3.23Å; N139-L141 VanDerWaalsContact C-N 3.3Å; N139-L141 PolarHBondContact O-N 3.35Å; L141-L145 VanDerWaalsContact O-CB 3.3Å; L141-L145 WeakPolarHBondContact O-CB 3.45Å; L141-L145 PolarHBondContact O-N 3.22Å
142	I	83.8	Confident	69.3	Low	25 Å²	25	61.7 Å²	61.7	13%	0.128	34%	0.344	C	S	.	.	H	α-helix	trans	-70.6	-54.5	174.3	-67.1	163.1	0	0	0	110	F64 V83 Y88 N138 N139 N144 L145 V146	F64-I142 HydrophobicContact CD1-CG2 3.8Å; F64-I142 HydrophobicContact CE1-CG2 3.83Å; V83-I142 HydrophobicContact CB-CG2 3.82Å; V83-I142 HydrophobicContact CG2-CG2 3.55Å; Y88-I142 HydrophobicContact CD2-CG1 3.7Å; Y88-I142 HydrophobicContact CE2-CG1 3.88Å; Y88-I142 HydrophobicContact CG-CG1 4.45Å; N138-I142 WeakPolarHBondContact O-CG1 3.31Å; N138-I142 PolarHBondContact O-N 2.98Å; N139-I142 CarbonylContact O-C 3.56Å; N139-I142 WeakPolarHBondContact O-CA 3.43Å; N139-I142 WeakPolarHBondContact O-CB 3.45Å; N139-I142 PolarHBondContact O-N 3.03Å; I142-N144 PolarHBondContact O-N 2.89Å; I142-L145 WeakPolarHBondContact O-CB 3.36Å; I142-L145 PolarHBondContact O-N 3.18Å; I142-L145 VanDerWaalsContact O-N 3.11Å; I142-V146 HydrophobicContact CG2-CG2 4.31Å; I142-V146 VanDerWaalsContact O-CG2 3.31Å; I142-V146 WeakPolarHBondContact O-CG2 3.32Å; I142-V146 PolarHBondContact O-N 2.89Å
143	S	87.8	Confident	71.9	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.007	32%	0.324	C	S	.	.	H	α-helix	trans	-60	-42.2	-176.4	67.3	0	0	0	0	112.3	D120 N139 L140 V146 Y147	D120-S143 WeakPolarHBondContact OD2-CB 3.35Å; D120-S143 PolarHBondContact OD2-OG 3.46Å; N139-S143 PolarHBondContact O-N 3.45Å; N139-S143 PolarHBondContact O-OG 3.4Å; L140-S143 PolarHBondContact O-OG 3.23Å; S143-V146 PolarHBondContact O-N 3.45Å; S143-Y147 VanDerWaalsContact O-CB 3.31Å; S143-Y147 WeakPolarHBondContact O-CB 3.41Å; S143-Y147 PolarHBondContact O-N 3.2Å
144	N	88.2	Confident	73.9	Confident	69 Å²	69	56.9 Å²	56.9	37%	0.369	31%	0.308	S	S	.	.	H	α-helix	trans	-67.1	-35	175.2	-83.4	-90.6	0	0	0	113.4	L140 I142 R148	L140-N144 WeakPolarHBondContact O-CB 3.49Å; L140-N144 PolarHBondContact O-N 3.4Å; L140-N144 PolarHBondContact O-ND2 2.82Å; I142-N144 PolarHBondContact O-N 2.89Å; N144-R148 WeakPolarHBondContact O-CB 3.3Å; N144-R148 PolarHBondContact O-N 2.84Å; N144-R148 VanDerWaalsContact O-N 3.16Å
145	L	87.9	Confident	76.2	Confident	12 Å²	12	53.3 Å²	53.3	6%	0.063	28%	0.281	C	S	.	.	H	α-helix	trans	-66.7	-43.1	172.7	174.2	64.8	0	0	0	110.9	Y88 L91 Q92 L141 I142 R148 R149	Y88-L145 HydrophobicContact CD2-CD2 3.5Å; Y88-L145 HydrophobicContact CE2-CB 4.32Å; Y88-L145 HydrophobicContact CE2-CD2 3.42Å; Y88-L145 VanDerWaalsContact CE2-CD2 3.42Å; Y88-L145 HydrophobicContact CG-CD2 4.46Å; L91-L145 HydrophobicContact CB-CD2 3.79Å; L91-L145 HydrophobicContact CB-CG 4.27Å; Q92-L145 HydrophobicContact CB-CD2 4.47Å; Q92-L145 HydrophobicContact CG-CD1 4.42Å; Q92-L145 HydrophobicContact CG-CD2 3.63Å; L141-L145 VanDerWaalsContact O-CB 3.3Å; L141-L145 WeakPolarHBondContact O-CB 3.45Å; L141-L145 PolarHBondContact O-N 3.22Å; I142-L145 WeakPolarHBondContact O-CB 3.36Å; I142-L145 PolarHBondContact O-N 3.18Å; I142-L145 VanDerWaalsContact O-N 3.11Å; L145-R148 PolarHBondContact O-N 2.96Å; L145-R149 HydrophobicContact CD1-CG 4.26Å; L145-R149 WeakPolarHBondContact O-CG 3.41Å; L145-R149 PolarHBondContact O-N 3.03Å
146	V	87.1	Confident	78.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-50.7	177.9	167.6	0	0	0	0	111.2	F64 I102 L118 I142 S143 R148 R149 L150	F64-V146 HydrophobicContact CE1-CB 4.35Å; F64-V146 HydrophobicContact CE1-CG2 3.88Å; F64-V146 HydrophobicContact CZ-CB 4.08Å; F64-V146 HydrophobicContact CZ-CG1 3.8Å; F64-V146 HydrophobicContact CZ-CG2 4.01Å; I102-V146 HydrophobicContact CD1-CB 3.91Å; I102-V146 HydrophobicContact CD1-CG1 3.37Å; I102-V146 HydrophobicContact CD1-CG2 3.24Å; L118-V146 HydrophobicContact CD2-CG1 4.47Å; I142-V146 HydrophobicContact CG2-CG2 4.31Å; I142-V146 VanDerWaalsContact O-CG2 3.31Å; I142-V146 WeakPolarHBondContact O-CG2 3.32Å; I142-V146 PolarHBondContact O-N 2.89Å; S143-V146 PolarHBondContact O-N 3.45Å; V146-R148 VanDerWaalsContact C-N 3.34Å; V146-R148 PolarHBondContact O-N 2.89Å; V146-R149 PolarHBondContact O-N 2.95Å; V146-R149 VanDerWaalsContact O-N 3.15Å; V146-L150 HydrophobicContact CG1-CD1 3.55Å; V146-L150 HydrophobicContact CG1-CG 4.17Å; V146-L150 WeakPolarHBondContact O-CB 3.49Å; V146-L150 WeakPolarHBondContact O-CG 3.26Å; V146-L150 PolarHBondContact O-N 2.75Å
147	Y	90.8	Very high	81.3	Confident	30 Å²	30	45.6 Å²	45.6	12%	0.118	24%	0.239	C	C	.	.	H	α-helix	trans	-48.2	-56.3	174.8	174.3	-106.9	0	0	0	110.8	H34 D35 S143 R149 L150 S151 V157 F159	H34-Y147 PolarHBondContact O-OH 3.07Å; D35-Y147 WeakPolarHBondContact CA-OH 3.35Å; D35-Y147 WeakPolarHBondContact OD1-CE1 2.94Å; D35-Y147 VanDerWaalsContact OD1-CZ 3.25Å; D35-Y147 PolarHBondContact OD1-OH 3.25Å; S143-Y147 VanDerWaalsContact O-CB 3.31Å; S143-Y147 WeakPolarHBondContact O-CB 3.41Å; S143-Y147 PolarHBondContact O-N 3.2Å; Y147-R149 PolarHBondContact O-N 2.82Å; Y147-L150 PolarHBondContact O-N 3.02Å; Y147-S151 PolarHBondContact O-N 3.08Å; Y147-S151 PolarHBondContact O-OG 2.89Å; Y147-V157 HydrophobicContact CD2-CB 4.47Å; Y147-V157 HydrophobicContact CD2-CG1 3.85Å; Y147-V157 HydrophobicContact CD2-CG2 3.97Å; Y147-V157 HydrophobicContact CE2-CG1 3.81Å; Y147-V157 HydrophobicContact CE2-CG2 4.48Å; Y147-V157 WeakPolarHBondContact CE2-O 3.23Å; Y147-F159 HydrophobicContact CD1-CE2 4.06Å; Y147-F159 HydrophobicContact CD2-CD2 4.16Å; Y147-F159 AromaticContact CD2-CE2 3.79Å; Y147-F159 HydrophobicContact CD2-CE2 3.79Å; Y147-F159 HydrophobicContact CG-CD2 4.36Å; Y147-F159 AromaticContact CG-CE2 3.57Å; Y147-F159 HydrophobicContact CG-CE2 3.57Å; Y147-F159 HydrophobicContact CG-CZ 4.26Å
148	R	88.9	Confident	83.1	Confident	137 Å²	137	43 Å²	43	52%	0.517	23%	0.226	S	C	.	.	H	α-helix	trans	-56.2	-46.4	179	-173.1	-177.4	-59.7	128.3	8.5	112.5	N144 L145 V146 S151 E152	N144-R148 WeakPolarHBondContact O-CB 3.3Å; N144-R148 PolarHBondContact O-N 2.84Å; N144-R148 VanDerWaalsContact O-N 3.16Å; L145-R148 PolarHBondContact O-N 2.96Å; V146-R148 VanDerWaalsContact C-N 3.34Å; V146-R148 PolarHBondContact O-N 2.89Å; R148-S151 PolarHBondContact O-N 3.38Å; R148-E152 WeakPolarHBondContact CG-OE1 3.22Å; R148-E152 WeakPolarHBondContact O-CB 3.32Å; R148-E152 VanDerWaalsContact O-CG 3.28Å; R148-E152 WeakPolarHBondContact O-CG 3.38Å; R148-E152 PolarHBondContact O-N 3.5Å
149	R	87.5	Confident	84.7	Confident	49 Å²	49	39.6 Å²	39.6	19%	0.185	21%	0.205	C	C	.	.	H	α-helix	trans	-69.5	-35.7	-178.6	-71.4	-57.8	-167.8	-160.9	-1.7	113.2	L91 Q92 A98 L145 V146 Y147 E152 E153	L91-R149 PolarHBondContact O-NE 3.45Å; L91-R149 PolarHBondContact O-NH2 2.85Å; Q92-R149 PolarHBondContact O-NH2 3.14Å; A98-R149 HydrophobicContact CB-CB 3.45Å; A98-R149 VanDerWaalsContact CB-CB 3.45Å; L145-R149 HydrophobicContact CD1-CG 4.26Å; L145-R149 WeakPolarHBondContact O-CG 3.41Å; L145-R149 PolarHBondContact O-N 3.03Å; V146-R149 PolarHBondContact O-N 2.95Å; V146-R149 VanDerWaalsContact O-N 3.15Å; Y147-R149 PolarHBondContact O-N 2.82Å; R149-E152 VanDerWaalsContact CD-OE2 3.24Å; R149-E152 WeakPolarHBondContact CD-OE2 3.5Å; R149-E152 IonicContact CZ-OE2 2.72Å; R149-E152 IonicContact NE-OE2 3.76Å; R149-E152 IonicContact NH1-OE1 3.18Å; R149-E152 IonicContact NH1-OE2 3.33Å; R149-E152 PolarHBondContact NH1-OE2 3.11Å; R149-E153 WeakPolarHBondContact O-CB 3.35Å; R149-E153 WeakPolarHBondContact O-CG 2.96Å; R149-E153 PolarHBondContact O-N 3.45Å
150	L	87.6	Confident	86.4	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.2	-40.1	174.1	-70.4	171.9	0	0	0	111.3	L62 A98 I103 L116 V146 Y147 E153 G154 Y155 V157	L62-L150 HydrophobicContact CD1-CD1 4.37Å; A98-L150 HydrophobicContact CB-CD2 3.84Å; A98-L150 HydrophobicContact CB-CG 3.89Å; I103-L150 HydrophobicContact CD1-CD2 4.02Å; L116-L150 HydrophobicContact CD1-CD1 3.84Å; L116-L150 HydrophobicContact CD1-CD2 4.05Å; L116-L150 HydrophobicContact CD1-CG 4.41Å; V146-L150 HydrophobicContact CG1-CD1 3.55Å; V146-L150 HydrophobicContact CG1-CG 4.17Å; V146-L150 WeakPolarHBondContact O-CB 3.49Å; V146-L150 WeakPolarHBondContact O-CG 3.26Å; V146-L150 PolarHBondContact O-N 2.75Å; Y147-L150 PolarHBondContact O-N 3.02Å; L150-E153 PolarHBondContact O-N 2.9Å; L150-G154 PolarHBondContact O-N 3.26Å; L150-G154 VanDerWaalsContact O-N 3.12Å; L150-Y155 HydrophobicContact CD2-CD2 4.12Å; L150-Y155 HydrophobicContact CD2-CG 4.41Å; L150-Y155 PolarHBondContact O-N 2.71Å; L150-V157 HydrophobicContact CB-CB 4.26Å; L150-V157 HydrophobicContact CB-CG1 3.97Å; L150-V157 HydrophobicContact CB-CG2 4.32Å; L150-V157 HydrophobicContact CD1-CG2 4.07Å
151	S	89	Confident	87.7	Confident	50 Å²	50	40.1 Å²	40.1	35%	0.35	21%	0.206	S	C	.	.	H	α-helix	trans	-64.6	-43.6	172.6	-63.6	0	0	0	0	112.6	Y147 R148 E153 G154 V157	Y147-S151 PolarHBondContact O-N 3.08Å; Y147-S151 PolarHBondContact O-OG 2.89Å; R148-S151 PolarHBondContact O-N 3.38Å; S151-E153 VanDerWaalsContact C-N 3.26Å; S151-E153 PolarHBondContact O-N 2.79Å; S151-G154 PolarHBondContact O-N 3.34Å; S151-V157 WeakPolarHBondContact OG-CG1 3.17Å
152	E	87.1	Confident	88.3	Confident	114 Å²	114	39.5 Å²	39.5	53%	0.533	22%	0.216	S	C	.	.	H	α-helix	trans	-59.8	-35.4	173.2	-77.9	172.2	-165.8	0	0	112.4	R148 R149 G154	R148-E152 WeakPolarHBondContact CG-OE1 3.22Å; R148-E152 WeakPolarHBondContact O-CB 3.32Å; R148-E152 VanDerWaalsContact O-CG 3.28Å; R148-E152 WeakPolarHBondContact O-CG 3.38Å; R148-E152 PolarHBondContact O-N 3.5Å; R149-E152 VanDerWaalsContact CD-OE2 3.24Å; R149-E152 WeakPolarHBondContact CD-OE2 3.5Å; R149-E152 IonicContact CZ-OE2 2.72Å; R149-E152 IonicContact NE-OE2 3.76Å; R149-E152 IonicContact NH1-OE1 3.18Å; R149-E152 IonicContact NH1-OE2 3.33Å; R149-E152 PolarHBondContact NH1-OE2 3.11Å; E152-G154 VanDerWaalsContact C-N 3.28Å
153	E	84	Confident	88.4	Confident	38 Å²	38	39.3 Å²	39.3	18%	0.178	22%	0.217	C	C	.	.	H	α-helix	trans	-76.8	-12.8	175.3	-77.7	173.3	-144.6	0	0	113.5	S97 A98 S99 R112 R149 L150 S151 Y155	S97-E153 VanDerWaalsContact C-OE1 3.27Å; S97-E153 WeakPolarHBondContact CA-OE1 3.46Å; S97-E153 WeakPolarHBondContact CB-OE1 3.35Å; S97-E153 PolarHBondContact OG-OE1 2.87Å; S97-E153 PolarHBondContact OG-OE2 3.26Å; A98-E153 PolarHBondContact N-OE1 3.34Å; S99-E153 VanDerWaalsContact CB-OE2 3.26Å; S99-E153 WeakPolarHBondContact CB-OE2 3.49Å; S99-E153 PolarHBondContact N-OE2 3.32Å; S99-E153 PolarHBondContact OG-OE2 2.87Å; R112-E153 PolarHBondContact NH1-O 3.41Å; R112-E153 PolarHBondContact NH2-O 3.39Å; R149-E153 WeakPolarHBondContact O-CB 3.35Å; R149-E153 WeakPolarHBondContact O-CG 2.96Å; R149-E153 PolarHBondContact O-N 3.45Å; L150-E153 PolarHBondContact O-N 2.9Å; S151-E153 VanDerWaalsContact C-N 3.26Å; S151-E153 PolarHBondContact O-N 2.79Å; E153-Y155 HydrophobicContact CB-CD2 3.85Å; E153-Y155 HydrophobicContact CB-CE2 3.98Å
154	G	85.2	Confident	88.4	Confident	51 Å²	51	39.5 Å²	39.5	53%	0.526	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	24.1	178.1	0	0	0	0	0	115.1	L150 S151 E152	L150-G154 PolarHBondContact O-N 3.26Å; L150-G154 VanDerWaalsContact O-N 3.12Å; S151-G154 PolarHBondContact O-N 3.34Å; E152-G154 VanDerWaalsContact C-N 3.28Å
155	Y	86.8	Confident	88.4	Confident	13 Å²	13	41 Å²	41	5%	0.051	23%	0.226	C	C	.	.			trans	-81	140.7	168.8	-71.3	-94.9	0	0	0	110.5	S99 I103 R112 L116 L150 E153 V157	S99-Y155 VanDerWaalsContact CB-OH 3.26Å; S99-Y155 WeakPolarHBondContact CB-OH 3.2Å; S99-Y155 WeakPolarHBondContact OG-CE2 3.31Å; S99-Y155 PolarHBondContact OG-OH 3.24Å; I103-Y155 HydrophobicContact CD1-CD1 4.37Å; I103-Y155 HydrophobicContact CD1-CE1 4.07Å; R112-Y155 HydrophobicContact CB-CE1 4.4Å; R112-Y155 HydrophobicContact CG-CD1 4.03Å; R112-Y155 HydrophobicContact CG-CE1 3.44Å; R112-Y155 VanDerWaalsContact CG-CE1 3.44Å; R112-Y155 HydrophobicContact CG-CE2 4.14Å; R112-Y155 VanDerWaalsContact CG-CZ 3.48Å; R112-Y155 PolarHBondContact NE-OH 3.33Å; L116-Y155 HydrophobicContact CD1-CD1 3.85Å; L116-Y155 HydrophobicContact CD1-CG 4.01Å; L150-Y155 HydrophobicContact CD2-CD2 4.12Å; L150-Y155 HydrophobicContact CD2-CG 4.41Å; L150-Y155 PolarHBondContact O-N 2.71Å; E153-Y155 HydrophobicContact CB-CD2 3.85Å; E153-Y155 HydrophobicContact CB-CE2 3.98Å; Y155-V157 PolarHBondContact O-N 2.88Å
156	P	88.2	Confident	88.4	Confident	33 Å²	33	44.4 Å²	44.4	21%	0.214	24%	0.242	C	C	.	.			trans	-71.4	107.8	166.5	27.3	-27.4	0	0	0	108.5	R112 R113 P115 L116	R112-P156 WeakPolarHBondContact O-CD 3.33Å; R113-P156 WeakPolarHBondContact O-CG 3.27Å; P115-P156 CarbonylContact C-O 3.6Å; P115-P156 WeakPolarHBondContact CA-O 3.21Å; L116-P156 PolarHBondContact N-O 3.49Å
157	V	90.9	Very high	88.7	Confident	9 Å²	9	44.4 Å²	44.4	6%	0.055	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	144.4	-174.7	62.4	0	0	0	0	110	L116 L118 Y147 L150 S151 Y155	L116-V157 HydrophobicContact CB-CB 4.14Å; L116-V157 HydrophobicContact CB-CG2 3.95Å; L116-V157 VanDerWaalsContact O-CA 3.29Å; L116-V157 WeakPolarHBondContact O-CA 3.34Å; L118-V157 HydrophobicContact CD1-CG2 3.4Å; L118-V157 HydrophobicContact CD2-CG2 4.43Å; Y147-V157 HydrophobicContact CD2-CB 4.47Å; Y147-V157 HydrophobicContact CD2-CG1 3.85Å; Y147-V157 HydrophobicContact CD2-CG2 3.97Å; Y147-V157 HydrophobicContact CE2-CG1 3.81Å; Y147-V157 HydrophobicContact CE2-CG2 4.48Å; Y147-V157 WeakPolarHBondContact CE2-O 3.23Å; L150-V157 HydrophobicContact CB-CB 4.26Å; L150-V157 HydrophobicContact CB-CG1 3.97Å; L150-V157 HydrophobicContact CB-CG2 4.32Å; L150-V157 HydrophobicContact CD1-CG2 4.07Å; S151-V157 WeakPolarHBondContact OG-CG1 3.17Å; Y155-V157 PolarHBondContact O-N 2.88Å
158	A	92.4	Very high	88.8	Confident	2 Å²	2	44.2 Å²	44.2	2%	0.017	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	158.4	-179.3	0	0	0	0	0	111.2	V32 V37 L116 V117 L118	V32-A158 HydrophobicContact CG1-CB 3.67Å; V37-A158 HydrophobicContact CG1-CB 3.93Å; L116-A158 PolarHBondContact O-N 3.4Å; V117-A158 CarbonylContact C-O 3.16Å; V117-A158 WeakPolarHBondContact CA-O 3.44Å; L118-A158 PolarHBondContact N-O 2.9Å
159	F	93.2	Very high	88.8	Confident	42 Å²	42	42 Å²	42	18%	0.184	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	149.3	170.5	-72.3	-87.7	0	0	0	112.2	D35 S36 V37 L118 Y147	D35-F159 PolarHBondContact O-N 2.91Å; S36-F159 CarbonylContact C-O 3.53Å; S36-F159 WeakPolarHBondContact CA-O 3.43Å; S36-F159 WeakPolarHBondContact CB-O 3.23Å; V37-F159 PolarHBondContact N-O 3.39Å; L118-F159 HydrophobicContact CB-CD1 3.6Å; L118-F159 HydrophobicContact CB-CE1 3.78Å; L118-F159 HydrophobicContact CB-CG 4.2Å; L118-F159 HydrophobicContact CD2-CD1 4.42Å; L118-F159 HydrophobicContact CD2-CE1 3.85Å; L118-F159 HydrophobicContact CD2-CE2 4.39Å; L118-F159 HydrophobicContact CD2-CZ 3.83Å; L118-F159 HydrophobicContact CG-CE1 4.46Å; L118-F159 WeakPolarHBondContact O-CA 3.43Å; Y147-F159 HydrophobicContact CD1-CE2 4.06Å; Y147-F159 HydrophobicContact CD2-CD2 4.16Å; Y147-F159 AromaticContact CD2-CE2 3.79Å; Y147-F159 HydrophobicContact CD2-CE2 3.79Å; Y147-F159 HydrophobicContact CG-CD2 4.36Å; Y147-F159 AromaticContact CG-CE2 3.57Å; Y147-F159 HydrophobicContact CG-CE2 3.57Å; Y147-F159 HydrophobicContact CG-CZ 4.26Å
160	L	92.7	Very high	89.1	Confident	19 Å²	19	43.7 Å²	43.7	10%	0.099	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	129.1	165.9	177.7	57.7	0	0	0	109.9	P39 L42 V117 L118 V119 L164 F167	P39-L160 HydrophobicContact CG-CD1 4.39Å; L42-L160 HydrophobicContact CD2-CD1 3.9Å; L42-L160 HydrophobicContact CD2-CD2 4.18Å; V117-L160 HydrophobicContact CG1-CB 4.13Å; L118-L160 PolarHBondContact O-N 3.42Å; V119-L160 HydrophobicContact CG2-CB 4.17Å; V119-L160 HydrophobicContact CG2-CD2 3.93Å; L160-L164 HydrophobicContact CD2-CD1 4.26Å; L160-F167 HydrophobicContact CD1-CD2 4.16Å; L160-F167 HydrophobicContact CD2-CB 4Å; L160-F167 HydrophobicContact CD2-CD2 4.26Å; L160-F167 HydrophobicContact CD2-CG 4.15Å
161	Q	89.4	Confident	89.3	Confident	80 Å²	80	45.9 Å²	45.9	37%	0.374	27%	0.266	S	S	.	.	S	Bend	trans	-74.7	142.4	171.7	-65.1	173.5	-9.6	0	0	111	S36 V37 P39	S36-Q161 PolarHBondContact OG-NE2 2.77Å; V37-Q161 WeakPolarHBondContact O-CB 3.38Å; V37-Q161 WeakPolarHBondContact O-CG 3.36Å; V37-Q161 PolarHBondContact O-N 3.31Å; P39-Q161 WeakPolarHBondContact CG-O 3.37Å
162	G	85.3	Confident	89.5	Confident	55 Å²	55	47.6 Å²	47.6	57%	0.567	28%	0.277	S	S	*	.	S	Bend	trans	76.8	-162.5	-172.1	0	0	0	0	0	111.5
163	S	86.2	Confident	89.6	Confident	21 Å²	21	46 Å²	46	15%	0.147	27%	0.269	C	S	.	.			trans	-105.8	162.8	175	86.4	0	0	0	0	112.7	E122 N165 Q166 F167	E122-S163 WeakPolarHBondContact OE1-CB 3.32Å; E122-S163 PolarHBondContact OE1-OG 3.36Å; S163-N165 PolarHBondContact O-N 2.81Å; S163-N165 PolarHBondContact OG-N 2.84Å; S163-Q166 WeakPolarHBondContact O-CB 3.37Å; S163-Q166 PolarHBondContact O-N 3.05Å; S163-Q166 PolarHBondContact OG-N 2.87Å; S163-F167 PolarHBondContact O-N 3.41Å
164	L	89	Confident	89.9	Confident	6 Å²	6	44.4 Å²	44.4	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-33.7	174	-166.9	69.6	0	0	0	111.9	I75 V119 L160 Q166 F167 L168	I75-L164 HydrophobicContact CD1-CD1 3.49Å; I75-L164 VanDerWaalsContact CD1-CD1 3.49Å; I75-L164 HydrophobicContact CG1-CD1 3.82Å; V119-L164 HydrophobicContact CG1-CB 3.97Å; V119-L164 HydrophobicContact CG1-CD1 4.02Å; V119-L164 HydrophobicContact CG1-CD2 4.2Å; V119-L164 HydrophobicContact CG1-CG 4.29Å; V119-L164 HydrophobicContact CG2-CD1 4.21Å; L160-L164 HydrophobicContact CD2-CD1 4.26Å; L164-Q166 VanDerWaalsContact C-N 3.33Å; L164-F167 HydrophobicContact CD1-CD1 4.49Å; L164-F167 PolarHBondContact O-N 3.21Å; L164-L168 HydrophobicContact CD1-CG 4.44Å; L164-L168 HydrophobicContact CD2-CD1 4.14Å; L164-L168 HydrophobicContact CG-CD1 3.94Å; L164-L168 HydrophobicContact CG-CG 4.18Å; L164-L168 WeakPolarHBondContact O-CB 3.41Å; L164-L168 WeakPolarHBondContact O-CG 3.29Å; L164-L168 PolarHBondContact O-N 2.74Å
165	N	87	Confident	89.9	Confident	100 Å²	100	43.8 Å²	43.8	54%	0.535	26%	0.255	S	S	.	.	H	α-helix	trans	-63.4	-42.3	176.3	-59	-50.5	0	0	0	110.6	E122 S163 S169	E122-N165 PolarHBondContact OE1-ND2 3.17Å; S163-N165 PolarHBondContact O-N 2.81Å; S163-N165 PolarHBondContact OG-N 2.84Å; N165-S169 WeakPolarHBondContact O-CB 3.45Å; N165-S169 PolarHBondContact O-N 3.07Å; N165-S169 PolarHBondContact O-OG 3.04Å
166	Q	89.1	Confident	89.7	Confident	84 Å²	84	44.3 Å²	44.3	39%	0.393	26%	0.262	S	S	.	.	H	α-helix	trans	-60.6	-53.5	171.9	-177	-176.4	-8.5	0	0	111	S163 L164 L168 S169 E170	S163-Q166 WeakPolarHBondContact O-CB 3.37Å; S163-Q166 PolarHBondContact O-N 3.05Å; S163-Q166 PolarHBondContact OG-N 2.87Å; L164-Q166 VanDerWaalsContact C-N 3.33Å; Q166-L168 VanDerWaalsContact C-N 3.33Å; Q166-L168 PolarHBondContact O-N 2.97Å; Q166-S169 PolarHBondContact O-N 2.88Å; Q166-S169 PolarHBondContact O-OG 3.03Å; Q166-E170 VanDerWaalsContact CG-OE1 3.26Å; Q166-E170 WeakPolarHBondContact CG-OE1 3.33Å; Q166-E170 PolarHBondContact NE2-OE1 2.84Å; Q166-E170 PolarHBondContact O-N 3.22Å
167	F	92.8	Very high	88.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-54.7	-45.4	179.9	177.3	-85	0	0	0	112.8	P39 L42 A43 L46 I75 L160 S163 L164 S169 E170 Y171 F174	P39-F167 HydrophobicContact CB-CD2 3.86Å; P39-F167 WeakPolarHBondContact O-CE2 3.15Å; L42-F167 HydrophobicContact CB-CE2 3.94Å; L42-F167 HydrophobicContact CD2-CD2 4.19Å; L42-F167 HydrophobicContact CD2-CE2 3.74Å; L42-F167 HydrophobicContact CD2-CZ 4.05Å; L42-F167 HydrophobicContact CG-CE2 3.85Å; L42-F167 HydrophobicContact CG-CZ 4.1Å; A43-F167 HydrophobicContact CB-CE2 4.29Å; A43-F167 HydrophobicContact CB-CZ 4.45Å; L46-F167 HydrophobicContact CD1-CZ 4.2Å; I75-F167 HydrophobicContact CD1-CD1 3.73Å; I75-F167 HydrophobicContact CD1-CE1 3.63Å; I75-F167 HydrophobicContact CD1-CG 4.44Å; I75-F167 HydrophobicContact CD1-CZ 4.24Å; I75-F167 HydrophobicContact CG1-CD1 3.93Å; I75-F167 HydrophobicContact CG1-CE1 3.69Å; L160-F167 HydrophobicContact CD1-CD2 4.16Å; L160-F167 HydrophobicContact CD2-CB 4Å; L160-F167 HydrophobicContact CD2-CD2 4.26Å; L160-F167 HydrophobicContact CD2-CG 4.15Å; S163-F167 PolarHBondContact O-N 3.41Å; L164-F167 HydrophobicContact CD1-CD1 4.49Å; L164-F167 PolarHBondContact O-N 3.21Å; F167-S169 VanDerWaalsContact C-N 3.31Å; F167-S169 PolarHBondContact O-N 2.94Å; F167-E170 PolarHBondContact O-N 3.48Å; F167-Y171 AromaticContact CD2-CD2 3.93Å; F167-Y171 HydrophobicContact CD2-CD2 3.93Å; F167-Y171 AromaticContact CE2-CD2 3.72Å; F167-Y171 HydrophobicContact CE2-CD2 3.72Å; F167-Y171 HydrophobicContact CE2-CE2 4.41Å; F167-Y171 HydrophobicContact CG-CD2 4.49Å; F167-Y171 HydrophobicContact CZ-CD2 4.13Å; F167-Y171 PolarHBondContact O-N 3.03Å; F167-F174 HydrophobicContact CE1-CB 4.23Å; F167-F174 AromaticContact CE1-CD2 4Å; F167-F174 HydrophobicContact CE1-CD2 4Å; F167-F174 AromaticContact CZ-CD2 3.82Å; F167-F174 HydrophobicContact CZ-CD2 3.82Å; F167-F174 HydrophobicContact CZ-CE2 4.34Å
168	L	92.1	Very high	87.1	Confident	25 Å²	25	50.7 Å²	50.7	13%	0.131	30%	0.303	C	S	.	.	H	α-helix	trans	-74.1	-21	179.7	-68.1	178.3	0	0	0	113.1	A73 I75 L164 Q166 P172	A73-L168 HydrophobicContact CB-CD1 4.02Å; I75-L168 HydrophobicContact CG1-CD2 4.17Å; L164-L168 HydrophobicContact CD1-CG 4.44Å; L164-L168 HydrophobicContact CD2-CD1 4.14Å; L164-L168 HydrophobicContact CG-CD1 3.94Å; L164-L168 HydrophobicContact CG-CG 4.18Å; L164-L168 WeakPolarHBondContact O-CB 3.41Å; L164-L168 WeakPolarHBondContact O-CG 3.29Å; L164-L168 PolarHBondContact O-N 2.74Å; Q166-L168 VanDerWaalsContact C-N 3.33Å; Q166-L168 PolarHBondContact O-N 2.97Å; L168-P172 WeakPolarHBondContact O-CA 3.14Å
169	S	89.9	Confident	84.8	Confident	91 Å²	91	53.8 Å²	53.8	64%	0.636	34%	0.335	S	S	*	.	H	α-helix	trans	-77.3	-32.2	170.2	76.3	0	0	0	0	112.8	N165 Q166 F167	N165-S169 WeakPolarHBondContact O-CB 3.45Å; N165-S169 PolarHBondContact O-N 3.07Å; N165-S169 PolarHBondContact O-OG 3.04Å; Q166-S169 PolarHBondContact O-N 2.88Å; Q166-S169 PolarHBondContact O-OG 3.03Å; F167-S169 VanDerWaalsContact C-N 3.31Å; F167-S169 PolarHBondContact O-N 2.94Å
170	E	92.9	Very high	82.1	Confident	85 Å²	85	57.5 Å²	57.5	40%	0.397	36%	0.362	S	S	.	.	H	α-helix	trans	-81.2	-33.3	175.8	-68.8	176.4	-160.8	0	0	112.4	Q166 F167	Q166-E170 VanDerWaalsContact CG-OE1 3.26Å; Q166-E170 WeakPolarHBondContact CG-OE1 3.33Å; Q166-E170 PolarHBondContact NE2-OE1 2.84Å; Q166-E170 PolarHBondContact O-N 3.22Å; F167-E170 PolarHBondContact O-N 3.48Å
171	Y	93.2	Very high	79.1	Confident	45 Å²	45	63.5 Å²	63.5	18%	0.176	40%	0.399	C	S	.	.			trans	-135.6	65.9	-173.9	-52.4	-63.9	0	0	0	112.9	P39 G40 A43 F167 E173 F174	P39-Y171 HydrophobicContact CB-CD2 4.4Å; P39-Y171 HydrophobicContact CB-CE2 3.75Å; G40-Y171 WeakPolarHBondContact CA-OH 3.48Å; A43-Y171 HydrophobicContact CB-CD1 3.77Å; A43-Y171 HydrophobicContact CB-CD2 3.67Å; A43-Y171 HydrophobicContact CB-CE1 3.87Å; A43-Y171 HydrophobicContact CB-CE2 3.75Å; A43-Y171 HydrophobicContact CB-CG 3.66Å; F167-Y171 AromaticContact CD2-CD2 3.93Å; F167-Y171 HydrophobicContact CD2-CD2 3.93Å; F167-Y171 AromaticContact CE2-CD2 3.72Å; F167-Y171 HydrophobicContact CE2-CD2 3.72Å; F167-Y171 HydrophobicContact CE2-CE2 4.41Å; F167-Y171 HydrophobicContact CG-CD2 4.49Å; F167-Y171 HydrophobicContact CZ-CD2 4.13Å; F167-Y171 PolarHBondContact O-N 3.03Å; Y171-E173 VanDerWaalsContact C-OE2 3.26Å; Y171-E173 WeakPolarHBondContact CA-OE2 3.29Å; Y171-E173 PolarHBondContact O-N 3.34Å; Y171-E173 VanDerWaalsContact O-N 3.15Å; Y171-F174 HydrophobicContact CG-CE2 4.47Å; Y171-F174 PolarHBondContact O-N 3.13Å
172	P	91.4	Very high	76.2	Confident	87 Å²	87	65.9 Å²	65.9	57%	0.565	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-65.3	-15.7	-176.7	27	-35.6	0	0	0	113.9	L168 F174 G175	L168-P172 WeakPolarHBondContact O-CA 3.14Å; P172-F174 PolarHBondContact O-N 3.13Å; P172-F174 VanDerWaalsContact O-N 3.13Å; P172-G175 PolarHBondContact O-N 2.57Å
173	E	90.2	Very high	73.5	Confident	80 Å²	80	68.4 Å²	68.4	37%	0.374	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-72.1	-1	178.3	81.3	-84.7	-154.1	0	0	114.7	R47 K50 Y171	R47-E173 IonicContact CZ-OE1 3.15Å; R47-E173 IonicContact NE-OE1 2.84Å; R47-E173 PolarHBondContact NE-OE1 2.75Å; R47-E173 IonicContact NH2-OE1 2.65Å; R47-E173 PolarHBondContact NH2-OE1 3.08Å; K50-E173 PolarHBondContact NZ-O 2.88Å; Y171-E173 VanDerWaalsContact C-OE2 3.26Å; Y171-E173 WeakPolarHBondContact CA-OE2 3.29Å; Y171-E173 PolarHBondContact O-N 3.34Å; Y171-E173 VanDerWaalsContact O-N 3.15Å
174	F	90.5	Very high	71	Confident	5 Å²	5	73.9 Å²	73.9	2%	0.022	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-110.1	3	168	-50.8	-67.5	0	0	0	113	A43 L46 R47 I75 E76 F167 Y171 P172	A43-F174 HydrophobicContact CB-CE2 3.77Å; A43-F174 HydrophobicContact CB-CZ 4.41Å; A43-F174 WeakPolarHBondContact O-CZ 3.34Å; L46-F174 HydrophobicContact CB-CD1 3.84Å; L46-F174 HydrophobicContact CB-CE1 3.32Å; L46-F174 HydrophobicContact CB-CE2 4.37Å; L46-F174 HydrophobicContact CB-CZ 3.61Å; L46-F174 HydrophobicContact CD1-CD1 4.15Å; L46-F174 HydrophobicContact CD1-CD2 4.45Å; L46-F174 HydrophobicContact CD1-CE1 4.39Å; L46-F174 HydrophobicContact CD1-CG 4.16Å; L46-F174 HydrophobicContact CG-CE1 4.49Å; R47-F174 HydrophobicContact CG-CE1 4.47Å; R47-F174 HydrophobicContact CG-CZ 3.84Å; I75-F174 CarbonylContact C-O 3.49Å; I75-F174 WeakPolarHBondContact CA-O 3.16Å; E76-F174 PolarHBondContact N-O 2.93Å; F167-F174 HydrophobicContact CE1-CB 4.23Å; F167-F174 AromaticContact CE1-CD2 4Å; F167-F174 HydrophobicContact CE1-CD2 4Å; F167-F174 AromaticContact CZ-CD2 3.82Å; F167-F174 HydrophobicContact CZ-CD2 3.82Å; F167-F174 HydrophobicContact CZ-CE2 4.34Å; Y171-F174 HydrophobicContact CG-CE2 4.47Å; Y171-F174 PolarHBondContact O-N 3.13Å; P172-F174 PolarHBondContact O-N 3.13Å; P172-F174 VanDerWaalsContact O-N 3.13Å
175	G	86	Confident	68.1	Low	37 Å²	37	80 Å²	80	38%	0.381	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	125.1	-179.7	0	0	0	0	0	112.7	P172	P172-G175 PolarHBondContact O-N 2.57Å
176	A	81.7	Confident	65.3	Low	24 Å²	24	80.3 Å²	80.3	20%	0.198	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	116.8	169.6	0	0	0	0	0	109.8	A73 H74 E76	A73-A176 WeakPolarHBondContact CA-O 3.15Å; H74-A176 PolarHBondContact CE1-O 3.06Å; H74-A176 PolarHBondContact N-O 3.18Å; H74-A176 PolarHBondContact ND1-O 3.06Å; H74-A176 VanDerWaalsContact ND1-O 3.08Å; H74-A176 PolarHBondContact O-N 3.09Å; E76-A176 HydrophobicContact CB-CB 4.43Å
177	C	71.2	Confident	62.3	Low	87 Å²	87	79.6 Å²	79.6	59%	0.588	52%	0.52	S	S	*	.			trans	-122.6	124.4	-177.8	-57.6	0	0	0	0	109.7	R72 G179	R72-C177 WeakPolarHBondContact O-CA 3.42Å; R72-C177 VanDerWaalsContact O-CB 3.29Å; R72-C177 WeakPolarHBondContact O-CB 3.41Å; C177-G179 VanDerWaalsContact C-N 3.26Å; C177-G179 PolarHBondContact O-N 3.21Å
178	T	53.9	Low	59.4	Low	90 Å²	90	84.4 Å²	84.4	55%	0.552	56%	0.56	S	S	*	*			trans	-93.4	52.1	175.5	57.8	0	0	0	0	112.1	R71	R71-T178 PolarHBondContact O-N 3.27Å; R71-T178 VanDerWaalsContact O-N 3.1Å; R71-T178 PolarHBondContact O-OG1 3.33Å
179	G	44	Very low	56.4	Low	67 Å²	67	92.9 Å²	92.9	69%	0.691	60%	0.599	S	S	*	*			trans	-82	118.8	169	0	0	0	0	0	111	C177	C177-G179 VanDerWaalsContact C-N 3.26Å; C177-G179 PolarHBondContact O-N 3.21Å
180	T	36.1	Very low	53.5	Low	120 Å²	120	92 Å²	92	74%	0.736	60%	0.604	S	S	*	*			trans	-64.1	161	169.6	41.2	0	0	0	0	111.6	D182	T180-D182 PolarHBondContact O-N 3.22Å
181	T	29.5	Very low	50.6	Low	145 Å²	145	95.4 Å²	95.4	89%	0.89	63%	0.63	S	S	*	*	S	Bend	trans	-50.1	87.9	-178.5	50.6	0	0	0	0	115.1
182	D	28.9	Very low	47.4	Very low	130 Å²	130	97.9 Å²	97.9	70%	0.695	66%	0.66	S	S	*	*			trans	-115.9	121.1	164.8	-80.4	-50	0	0	0	109.4	T180 V184	T180-D182 PolarHBondContact O-N 3.22Å; D182-V184 VanDerWaalsContact C-N 3.28Å; D182-V184 PolarHBondContact O-N 2.84Å
183	P	28.6	Very low	44.5	Very low	108 Å²	108	97.6 Å²	97.6	70%	0.701	67%	0.673	S	S	*	*	S	Bend	trans	-82.2	65.7	-171	34	-36.8	0	0	0	112.8
184	V	33.6	Very low	41.4	Very low	135 Å²	135	99.2 Å²	99.2	82%	0.818	69%	0.693	S	S	*	*	S	Bend	trans	-121.8	35.2	171.9	-161.3	0	0	0	0	111.1	D182	D182-V184 VanDerWaalsContact C-N 3.28Å; D182-V184 PolarHBondContact O-N 2.84Å
185	C	28.3	Very low	38.6	Very low	134 Å²	134	107.6 Å²	107.6	91%	0.905	74%	0.737	S	S	*	*	S	Bend	trans	-162.4	36.4	167.3	-123.2	0	0	0	0	111.9	G187	C185-G187 PolarHBondContact O-N 2.88Å
186	S	28.1	Very low	35.6	Very low	108 Å²	108	114.8 Å²	114.8	76%	0.755	76%	0.761	S	S	*	*			trans	-85.9	93.7	-172.7	55	0	0	0	0	112.9
187	G	26.2	Very low	33.1	Very low	68 Å²	68	122.3 Å²	122.3	70%	0.701	80%	0.797	S	S	*	*			trans	-125	144.9	160.6	0	0	0	0	0	110.1	C185	C185-G187 PolarHBondContact O-N 2.88Å
188	A	31.7	Very low	31	Very low	102 Å²	102	122.3 Å²	122.3	84%	0.843	80%	0.803	S	S	*	*	S	Bend	trans	67.7	87.9	-175.5	0	0	0	0	0	116.5
189	E	28.9	Very low	29.8	Very low	202 Å²	202	123.7 Å²	123.7	94%	0.944	81%	0.814	S	S	*	*			trans	-3.3	140.9	138.9	-51	174.9	143.7	0	0	118.3
190	G	29.2	Very low	29	Very low	72 Å²	72	126.8 Å²	126.8	74%	0.742	81%	0.814	S	S	*	*			trans	-170.7	5.2	179.8	0	0	0	0	0	123.5
191	V	31.5	Very low	28.6	Very low	158 Å²	158	132.7 Å²	132.7	96%	0.958	82%	0.823	S	S	*	*			trans	66.9	147.3	173.3	-173.7	0	0	0	0	116.4
192	A	27.2	Very low	28.6	Very low	97 Å²	97	132.5 Å²	132.5	80%	0.802	82%	0.817	S	S	*	*			trans	-106.9	161.1	-172.2	0	0	0	0	0	114.4
193	G	29.5	Very low	28.5	Very low	81 Å²	81	130 Å²	130	84%	0.835	81%	0.814	S	S	*	*			trans	-164.3	86	174.4	0	0	0	0	0	113.2
194	S	25.9	Very low	28.4	Very low	114 Å²	114	134.7 Å²	134.7	80%	0.797	82%	0.824	S	S	*	*			trans	-81.6	134.5	-179	-57.1	0	0	0	0	113.2
195	L	30.3	Very low	28.2	Very low	180 Å²	180	134.4 Å²	134.4	94%	0.942	83%	0.825	S	S	*	*			trans	-139.9	124.3	151.7	-78.4	-179.3	0	0	0	110.1
196	Q	24.1	Very low	28.2	Very low	188 Å²	188	132.9 Å²	132.9	88%	0.879	82%	0.822	S	S	*	*			trans	-95.6	149.7	171	-62.5	165.5	-67.6	0	0	109.6
197	L	28.7	Very low	28.4	Very low	182 Å²	182	133 Å²	133	95%	0.953	82%	0.822	S	S	*	*			trans	-157.1	138.2	153.5	-109.6	158.4	0	0	0	109.5
198	A	27.7	Very low	28.7	Very low	87 Å²	87	134.6 Å²	134.6	72%	0.719	82%	0.823	S	S	*	*			trans	-95.7	156.4	-165.6	0	0	0	0	0	113.4
199	P	27.8	Very low	28.5	Very low	120 Å²	120	139.2 Å²	139.2	78%	0.779	83%	0.825	S	S	*	*			trans	-77.5	149.8	174.1	33.1	-35.2	0	0	0	112
200	N	27.5	Very low	28.5	Very low	132 Å²	132	134.6 Å²	134.6	71%	0.706	81%	0.814	S	S	*	*			trans	-121.9	117.3	171.5	-176.7	-2	0	0	0	109.1	N202	N200-N202 PolarHBondContact OD1-ND2 3.37Å
201	W	27.3	Very low	28.3	Very low	244 Å²	244	135.3 Å²	135.3	92%	0.924	81%	0.813	S	S	*	*			trans	-124.2	112.9	172.1	-86.9	76.1	0	0	0	109
202	N	29.3	Very low	28.1	Very low	140 Å²	140	133 Å²	133	75%	0.749	80%	0.804	S	S	*	*			trans	-145.4	140.2	172.9	-80.6	-71.9	0	0	0	107.3	N200	N200-N202 PolarHBondContact OD1-ND2 3.37Å
203	A	27.4	Very low	28	Very low	77 Å²	77	139.3 Å²	139.3	64%	0.636	81%	0.809	S	S	*	*			cis	-161	160.1	-9.5	0	0	0	0	0	110
204	F	26.2	Very low	27.7	Very low	207 Å²	207	145 Å²	145	91%	0.908	81%	0.814	S	S	*	*			trans	-139.9	145.1	144.7	-89.2	-74	0	0	0	108.8
205	P	30.6	Very low	27.8	Very low	129 Å²	129	144.5 Å²	144.5	84%	0.838	81%	0.81	S	S	*	*			trans	-77.2	153.9	-167.2	-15.7	32.2	0	0	0	114
206	A	26.9	Very low	27.6	Very low	102 Å²	102	140 Å²	140	84%	0.843	79%	0.794	S	S	*	*			trans	-88.4	156.4	-176.7	0	0	0	0	0	113.8
207	S	32.5	Very low	27.8	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	79%	0.793	S	S	*	*			trans	-145.8	122.4	143	54	0	0	0	0	112.3
208	S	31.8	Very low	27.8	Very low	103 Å²	103	133.9 Å²	133.9	72%	0.72	78%	0.778	S	S	*	*			trans	69.1	136.1	156.6	76.7	0	0	0	0	122
209	F	28.8	Very low	27.8	Very low	199 Å²	199	134.8 Å²	134.8	87%	0.873	78%	0.779	S	S	*	*			trans	71.2	92.4	160.8	-66	-71.2	0	0	0	123.3
210	S	28.8	Very low	27.8	Very low	104 Å²	104	133.6 Å²	133.6	73%	0.727	77%	0.772	S	S	*	*				72.3	85.4	116.1	-167	0	0	0	0	121.1
211	A	25.3	Very low	27.7	Very low	87 Å²	87	133.6 Å²	133.6	72%	0.719	78%	0.776	S	S	*	*				59.5	144	120.2	0	0	0	0	0	122.6
212	S	25.9	Very low	27.7	Very low	111 Å²	111	127.4 Å²	127.4	78%	0.776	77%	0.765	S	S	*	*			trans	62.1	88	165.9	58.2	0	0	0	0	118.6
213	Y	26	Very low	27.4	Very low	229 Å²	229	129.8 Å²	129.8	90%	0.898	77%	0.769	S	S	*	*				-158.5	116.1	111.5	-123.1	-85.5	0	0	0	110.1
214	Q	24	Very low	27.4	Very low	199 Å²	199	133.5 Å²	133.5	93%	0.93	78%	0.775	S	S	*	*			trans	-84.5	117.3	170.5	-73.6	-178.9	-13.6	0	0	109
215	S	27.9	Very low	27.4	Very low	104 Å²	104	132.9 Å²	132.9	73%	0.727	77%	0.772	S	S	*	*			trans	-133.7	107.5	169.2	-171.4	0	0	0	0	109.2	T217	S215-T217 PolarHBondContact O-N 3.11Å
216	S	25.6	Very low	27.1	Very low	87 Å²	87	131.7 Å²	131.7	61%	0.608	77%	0.773	S	S	*	*			trans	-87.3	90.6	-170.7	55.4	0	0	0	0	112.2	T218	S216-T218 PolarHBondContact O-N 3.3Å
217	T	27.9	Very low	27.1	Very low	139 Å²	139	134.5 Å²	134.5	85%	0.853	77%	0.773	S	S	*	*			trans	-85.3	59.6	162.9	38.6	0	0	0	0	111	S215 S219	S215-T217 PolarHBondContact O-N 3.11Å; T217-S219 PolarHBondContact O-N 2.79Å
218	T	27.7	Very low	26.6	Very low	102 Å²	102	139.8 Å²	139.8	63%	0.626	78%	0.776	S	S	*	*			trans	-68.3	100.9	170.8	45.6	0	0	0	0	110.2	S216 C220	S216-T218 PolarHBondContact O-N 3.3Å; T218-C220 PolarHBondContact O-N 3Å
219	S	29.7	Very low	26.5	Very low	106 Å²	106	142.8 Å²	142.8	74%	0.741	78%	0.783	S	S	*	*			trans	-62.1	120.6	163.6	-178.7	0	0	0	0	109.2	T217 V221	T217-S219 PolarHBondContact O-N 2.79Å; S219-V221 PolarHBondContact O-N 2.89Å
220	C	26.8	Very low	26.5	Very low	95 Å²	95	141 Å²	141	64%	0.642	78%	0.777	S	S	*	*			trans	-82.7	110.6	-175.5	-71.1	0	0	0	0	111	T218 V222	T218-C220 PolarHBondContact O-N 3Å; C220-V222 PolarHBondContact O-N 3.25Å; C220-V222 VanDerWaalsContact O-N 3.14Å
221	V	25.6	Very low	26.4	Very low	131 Å²	131	144.9 Å²	144.9	79%	0.794	78%	0.784	S	S	*	*			trans	-70.6	104	178.9	-178.8	0	0	0	0	110.9	S219	S219-V221 PolarHBondContact O-N 2.89Å
222	V	27.8	Very low	26.6	Very low	114 Å²	114	147.6 Å²	147.6	69%	0.691	79%	0.792	S	S	*	*			trans	-85.1	112.6	168.8	-179.6	0	0	0	0	109.6	C220	C220-V222 PolarHBondContact O-N 3.25Å; C220-V222 VanDerWaalsContact O-N 3.14Å
223	K	23.3	Very low	26.9	Very low	191 Å²	191	147.5 Å²	147.5	83%	0.83	79%	0.788	S	S	*	*			trans	-101	83	-170.3	-173.5	179.7	-176.4	174.1	0	111.5
224	M	27.1	Very low	27	Very low	154 Å²	154	143.8 Å²	143.8	76%	0.759	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-73.5	130.7	170.2	-74.7	-161.8	173.7	0	0	111.3
225	K	24.8	Very low	27.5	Very low	195 Å²	195	140.4 Å²	140.4	85%	0.848	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-75.2	122.5	170.5	-83.7	176.3	170.9	175.6	0	109.2	L227	K225-L227 PolarHBondContact O-N 3.39Å
226	A	25.5	Very low	27.8	Very low	103 Å²	103	142.8 Å²	142.8	85%	0.851	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-69.3	117.9	160.3	0	0	0	0	0	109.1
227	L	25.8	Very low	28.2	Very low	161 Å²	161	143 Å²	143	84%	0.843	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-82.3	124.8	161.8	-73.3	169	0	0	0	107.6	K225	K225-L227 PolarHBondContact O-N 3.39Å
228	R	23.3	Very low	28.6	Very low	222 Å²	222	141.7 Å²	141.7	84%	0.838	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-72.5	132.1	163.8	-77.1	-176.6	167.2	93.5	-3.9	108.6
229	L	29.1	Very low	28.9	Very low	166 Å²	166	141.9 Å²	141.9	87%	0.869	79%	0.788	S	S	*	*			trans	-117.6	141.7	144.2	-107.8	82.8	0	0	0	107.1
230	E	28.6	Very low	29.3	Very low	161 Å²	161	142.8 Å²	142.8	75%	0.752	79%	0.794	S	S	*	*			trans	-79.8	153.6	178.7	-57.4	-73.1	113	0	0	110.6
231	E	26.1	Very low	29.7	Very low	186 Å²	186	142.6 Å²	142.6	87%	0.869	79%	0.794	S	S	*	*			trans	-83.8	149.4	175.3	-60.2	178.3	138.1	0	0	111.7
232	T	31	Very low	30.2	Very low	144 Å²	144	146.1 Å²	146.1	88%	0.883	79%	0.793	S	S	*	*			trans	-158.5	151.2	144.4	9.2	0	0	0	0	109.5
233	P	31.5	Very low	30.5	Very low	108 Å²	108	150.7 Å²	150.7	70%	0.701	80%	0.798	S	S	*	*			trans	-109.9	163.8	-152.2	40.6	-36.1	0	0	0	116.9
234	D	28.3	Very low	31	Very low	151 Å²	151	148.1 Å²	148.1	81%	0.807	80%	0.798	S	S	*	*			trans	34.2	124.2	146.3	-58.2	-30.4	0	0	0	121.6
235	T	34.5	Very low	31.5	Very low	129 Å²	129	145.3 Å²	145.3	79%	0.791	80%	0.8	S	S	*	*				-160	137.5	127.2	1.6	0	0	0	0	114
236	D	33.2	Very low	31.9	Very low	154 Å²	154	142.7 Å²	142.7	82%	0.824	80%	0.795	S	S	*	*			trans	56.3	120.9	149.2	-57.9	-21.3	0	0	0	124.1
237	A	34.3	Very low	32.6	Very low	91 Å²	91	144.2 Å²	144.2	75%	0.752	79%	0.794	S	S	*	*			trans	-95.7	-165	153.3	0	0	0	0	0	108.4
238	P	36.7	Very low	32.9	Very low	112 Å²	112	139.6 Å²	139.6	73%	0.727	79%	0.785	S	S	*	*			cis	-149.9	-178	15.5	44.8	-23.5	0	0	0	119.1
239	S	34.2	Very low	33.5	Very low	105 Å²	105	135.8 Å²	135.8	73%	0.734	79%	0.786	S	S	*	*			trans	79.5	117.5	140.4	74.9	0	0	0	0	122.1
240	S	37.9	Very low	33.9	Very low	125 Å²	125	134 Å²	134	87%	0.874	78%	0.778	S	S	*	*				163.2	165.3	120.3	52.5	0	0	0	0	110.7
241	S	35.4	Very low	34.2	Very low	92 Å²	92	134 Å²	134	64%	0.643	78%	0.777	S	S	*	*			cis	-172.9	144.7	-43.3	-168.8	0	0	0	0	108.1
242	R	35.4	Very low	34.5	Very low	204 Å²	204	137.3 Å²	137.3	77%	0.77	78%	0.782	S	S	*	*			trans	72.3	155.3	167.4	-59.8	154.1	-177.5	-155.8	-1.9	116.2
243	R	34.5	Very low	34.4	Very low	210 Å²	210	141.8 Å²	141.8	79%	0.792	78%	0.782	S	S	*	*			cis	-147.1	170.9	-4.6	-139.2	178.6	-106.3	177.7	-4.8	112.1
244	V	33.2	Very low	34.6	Very low	137 Å²	137	142.5 Å²	142.5	83%	0.83	79%	0.79	S	S	*	*			trans	-107.7	142.6	179.2	173.9	0	0	0	0	111.7
245	A	37.6	Very low	34.7	Very low	96 Å²	96	144.8 Å²	144.8	79%	0.793	79%	0.793	S	S	*	*			trans	-163.4	142.6	147.7	0	0	0	0	0	107.1
246	D	33.3	Very low	34.4	Very low	140 Å²	140	142.1 Å²	142.1	75%	0.749	79%	0.791	S	S	*	*			cis	126.8	151.6	-1.1	-170.7	31.5	0	0	0	111.2
247	T	40.1	Very low	34.4	Very low	135 Å²	135	141 Å²	141	83%	0.828	79%	0.793	S	S	*	*			trans	68.5	143.2	-170.8	74.5	0	0	0	0	115.7
248	G	31.7	Very low	34	Very low	64 Å²	64	142.9 Å²	142.9	66%	0.66	79%	0.794	S	S	*	*			cis	164.5	168.5	-9.9	0	0	0	0	0	111.8
249	V	37.3	Very low	33.4	Very low	142 Å²	142	143.8 Å²	143.8	86%	0.861	80%	0.802	S	S	*	*			trans	70.7	135.2	160.1	-179.7	0	0	0	0	116.3
250	D	36.3	Very low	32.9	Very low	129 Å²	129	150.4 Å²	150.4	69%	0.69	81%	0.811	S	S	*	*			cis	-154	170.6	-12.9	-130.4	-13.2	0	0	0	116.3
251	H	34.7	Very low	32.4	Very low	160 Å²	160	152.4 Å²	152.4	74%	0.741	81%	0.811	S	S	*	*			trans	-22.9	135.4	164.2	-68.3	71.3	0	0	0	120.1
252	R	32.8	Very low	32	Very low	255 Å²	255	152.8 Å²	152.8	96%	0.962	81%	0.814	S	S	*	*				-168.9	153.3	104.1	-101.3	170.2	-165.8	-141	2	113.3
253	R	29.2	Very low	31.6	Very low	238 Å²	238	152.8 Å²	152.8	90%	0.898	82%	0.819	S	S	*	*			trans	-140.9	120.6	-175.6	-175.4	-174.5	-172.5	-169.1	6.2	111
254	S	35.4	Very low	31.3	Very low	123 Å²	123	150.2 Å²	150.2	86%	0.86	82%	0.821	S	S	*	*			trans	-105.5	172	169	54.1	0	0	0	0	111
255	K	32	Very low	30.9	Very low	199 Å²	199	147.9 Å²	147.9	87%	0.865	82%	0.816	S	S	*	*			trans	-130.5	133	-165.4	-71.4	179	176.5	175.8	0	114.4
256	G	28.2	Very low	30.5	Very low	74 Å²	74	152 Å²	152	76%	0.763	82%	0.824	S	S	*	*			trans	77	-175.5	146.3	0	0	0	0	0	117.4
257	P	31.5	Very low	30.1	Very low	131 Å²	131	150.2 Å²	150.2	85%	0.851	82%	0.822	S	S	*	*			cis	-111.6	179.8	-0.2	40	-29.9	0	0	0	114.2
258	T	26.1	Very low	29.5	Very low	129 Å²	129	149.9 Å²	149.9	79%	0.791	82%	0.821	S	S	*	*			trans	-89.9	158.5	175.6	49.6	0	0	0	0	112.5
259	C	25.2	Very low	29.3	Very low	131 Å²	131	152.2 Å²	152.2	89%	0.885	82%	0.824	S	S	*	*			trans	-130	143.9	160.1	-84.1	0	0	0	0	110.7
260	R	23.4	Very low	28.7	Very low	244 Å²	244	152.3 Å²	152.3	92%	0.921	83%	0.825	S	S	*	*			trans	-127.9	127.8	172.9	-69.3	-176.3	-179	-174.5	1.7	109.1
261	L	27.3	Very low	28.3	Very low	168 Å²	168	153.9 Å²	153.9	88%	0.88	83%	0.832	S	S	*	*			trans	-154.5	152.2	167.3	-86.8	149.4	0	0	0	107
262	S	27.9	Very low	27.7	Very low	100 Å²	100	149.4 Å²	149.4	70%	0.699	83%	0.829	S	S	*	*			cis	-155.6	150.1	-45.1	50.8	0	0	0	0	107.3
263	K	25.3	Very low	27.4	Very low	204 Å²	204	145.2 Å²	145.2	89%	0.887	83%	0.825	S	S	*	*			trans	-83	128	-179.2	-69.7	-177.6	177.6	-177.6	0	111
264	N	29.1	Very low	27.2	Very low	156 Å²	156	140.1 Å²	140.1	83%	0.834	82%	0.82	S	S	*	*			trans	-147.9	121.3	145.4	-84.3	-34.2	0	0	0	105.8
265	A	25.9	Very low	26.8	Very low	88 Å²	88	140.4 Å²	140.4	73%	0.727	82%	0.816	S	S	*	*			cis	84.1	95.7	49.3	0	0	0	0	0	112.9
266	L	28.9	Very low	26.6	Very low	182 Å²	182	136.1 Å²	136.1	95%	0.953	81%	0.809	S	S	*	*			trans	-145.5	147.1	153	-138.2	72.8	0	0	0	107.6
267	S	24.8	Very low	26.5	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	81%	0.812	S	S	*	*			trans	-140.6	-164.5	-167.2	64.3	0	0	0	0	111.9
268	T	27.7	Very low	26.6	Very low	129 Å²	129	137 Å²	137	79%	0.791	81%	0.806	S	S	*	*			trans	88.9	154.8	179.5	78	0	0	0	0	115.7
269	P	27.4	Very low	26.6	Very low	113 Å²	113	136.4 Å²	136.4	73%	0.734	81%	0.806	S	S	*	*				-134.6	157.3	-63.2	36.6	-22	0	0	0	114.3
270	T	23.5	Very low	26.8	Very low	143 Å²	143	135.9 Å²	135.9	88%	0.877	80%	0.802	S	S	*	*			trans	-84.1	139.4	172	-50.8	0	0	0	0	111.7
271	I	28.5	Very low	27.2	Very low	162 Å²	162	128.4 Å²	128.4	83%	0.831	79%	0.793	S	S	*	*			trans	-108.6	145.2	165.9	-64.3	174.1	0	0	0	108.5
272	G	22.5	Very low	27.6	Very low	66 Å²	66	126 Å²	126	68%	0.68	79%	0.787	S	S	*	*			trans	-160.8	157.3	178	0	0	0	0	0	114.5
273	L	25.4	Very low	28	Very low	168 Å²	168	125.9 Å²	125.9	88%	0.88	78%	0.784	S	S	*	*			trans	-155.4	155.8	179	-70.9	176.3	0	0	0	107.5
274	V	24.8	Very low	28.5	Very low	130 Å²	130	124.8 Å²	124.8	79%	0.788	78%	0.779	S	S	*	*			cis	-165.1	152.9	-32.4	121.6	0	0	0	0	105.6
275	V	27.4	Very low	28.7	Very low	129 Å²	129	123.8 Å²	123.8	78%	0.782	77%	0.774	S	S	*	*			trans	-101.7	171.1	-178.9	-149.2	0	0	0	0	110.8
276	P	28.5	Very low	29.1	Very low	110 Å²	110	125.6 Å²	125.6	71%	0.714	77%	0.77	S	S	*	*				-157.7	162.5	102.4	40.2	-21.8	0	0	0	119.1
277	S	26.6	Very low	29.5	Very low	120 Å²	120	124.1 Å²	124.1	84%	0.839	76%	0.758	S	S	*	*			trans	69.7	149	150.1	-61	0	0	0	0	119.7
278	S	32	Very low	29.9	Very low	103 Å²	103	126.5 Å²	126.5	72%	0.72	76%	0.763	S	S	*	*			cis	-153.1	155.4	23.4	61.9	0	0	0	0	114.7
279	C	27.2	Very low	30.1	Very low	117 Å²	117	124.1 Å²	124.1	79%	0.791	76%	0.764	S	S	*	*			trans	43.3	141.6	147.3	-59.2	0	0	0	0	121.7
280	C	29.3	Very low	30.1	Very low	120 Å²	120	131 Å²	131	81%	0.811	78%	0.775	S	S	*	*			cis	-174.6	171.1	-1.1	-104.7	0	0	0	0	107.5
281	A	30.5	Very low	30.5	Very low	87 Å²	87	130.6 Å²	130.6	72%	0.719	77%	0.773	S	S	*	*			cis	-161.8	166	-11.6	0	0	0	0	0	109.8
282	P	36.1	Very low	30.7	Very low	118 Å²	118	128.1 Å²	128.1	77%	0.766	78%	0.777	S	S	*	*			trans	-109.9	-175.2	-174.5	46.1	-37.5	0	0	0	112.6
283	P	36.1	Very low	31.1	Very low	97 Å²	97	129.4 Å²	129.4	63%	0.63	78%	0.781	S	S	*	*				-160.5	170.7	77.6	45.4	-25.2	0	0	0	118.8
284	K	35.6	Very low	31.4	Very low	181 Å²	181	125.7 Å²	125.7	79%	0.787	77%	0.769	S	S	*	*			trans	67.9	139.9	165.4	-56.2	163	-165	179.1	0	114.8
285	N	34.4	Very low	31.7	Very low	134 Å²	134	127.8 Å²	127.8	72%	0.717	78%	0.775	S	S	*	*			cis	-168.9	163.3	3.5	-107.7	7.2	0	0	0	106.9
286	I	34.5	Very low	31.7	Very low	127 Å²	127	128 Å²	128	65%	0.651	77%	0.771	S	S	*	*			cis	-161.5	173.5	-2.8	-131.2	171.7	0	0	0	110.1
287	H	36.6	Very low	31.8	Very low	151 Å²	151	132.8 Å²	132.8	70%	0.699	78%	0.777	S	S	*	*			trans	61.8	117.2	165.9	-80.4	-45	0	0	0	123.2
288	N	32.7	Very low	31.8	Very low	151 Å²	151	135.5 Å²	135.5	81%	0.807	77%	0.773	S	S	*	*			trans	65.2	128	132	-55.8	3.8	0	0	0	121.6
289	G	32.1	Very low	31.8	Very low	80 Å²	80	134.3 Å²	134.3	83%	0.825	76%	0.762	S	S	*	*			trans	123.6	77.9	159	0	0	0	0	0	115.7
290	R	27.1	Very low	31.8	Very low	256 Å²	256	136 Å²	136	97%	0.966	76%	0.758	S	S	*	*			trans	-89.8	107	171.3	-87.2	-177.3	171.2	162.1	-4.1	111.7
291	T	32.6	Very low	32	Very low	136 Å²	136	136.6 Å²	136.6	83%	0.834	75%	0.753	S	S	*	*			trans	-132.8	137.2	147.4	44.6	0	0	0	0	107.9	A293	T291-A293 PolarHBondContact O-N 3.03Å
292	A	31.8	Very low	32.5	Very low	109 Å²	109	135.3 Å²	135.3	90%	0.901	74%	0.739	S	S	*	*			trans	-74.4	109	-179.4	0	0	0	0	0	109.4
293	A	32.8	Very low	33.3	Very low	94 Å²	94	132.4 Å²	132.4	78%	0.777	73%	0.731	S	S	*	*			trans	-66.7	143.6	172.1	0	0	0	0	0	110.3	T291 L295	T291-A293 PolarHBondContact O-N 3.03Å; A293-L295 PolarHBondContact O-N 2.99Å
294	S	30.2	Very low	35	Very low	89 Å²	89	134.1 Å²	134.1	62%	0.622	73%	0.73	S	S	*	*			trans	-59.2	130.7	172.2	-174.8	0	0	0	0	110.1	D296	S294-D296 WeakPolarHBondContact CB-OD1 3.46Å; S294-D296 PolarHBondContact O-N 3.39Å; S294-D296 PolarHBondContact OG-OD1 3.3Å
295	L	32.4	Very low	37.5	Very low	175 Å²	175	129.9 Å²	129.9	92%	0.916	71%	0.712	S	S	*	*			trans	-78.6	81	161.9	-96.5	165	0	0	0	107.5	A293 Y297	A293-L295 PolarHBondContact O-N 2.99Å; L295-Y297 VanDerWaalsContact C-N 3.27Å; L295-Y297 PolarHBondContact O-N 3.38Å
296	D	27	Very low	40.3	Very low	132 Å²	132	123.9 Å²	123.9	71%	0.706	68%	0.68	S	S	*	*			trans	-65.9	84	177.7	-75.9	-8	0	0	0	110.3	S294 K298	S294-D296 WeakPolarHBondContact CB-OD1 3.46Å; S294-D296 PolarHBondContact O-N 3.39Å; S294-D296 PolarHBondContact OG-OD1 3.3Å; D296-K298 PolarHBondContact O-N 3.22Å
297	Y	29.8	Very low	43.3	Very low	211 Å²	211	119.6 Å²	119.6	83%	0.827	66%	0.66	S	S	*	*			trans	-71	83.6	169.4	-163.7	-89.1	0	0	0	109.1	L295 V299	L295-Y297 VanDerWaalsContact C-N 3.27Å; L295-Y297 PolarHBondContact O-N 3.38Å; Y297-V299 HydrophobicContact CD1-CG2 3.95Å; Y297-V299 HydrophobicContact CE1-CG2 4.26Å; Y297-V299 PolarHBondContact O-N 2.87Å
298	K	26.1	Very low	46.2	Very low	177 Å²	177	116.1 Å²	116.1	77%	0.77	64%	0.644	S	S	*	*			trans	-72.2	87.2	-174.6	-169.7	-175.2	-178.1	-169.8	0	110.1	D296 E300	D296-K298 PolarHBondContact O-N 3.22Å; K298-E300 PolarHBondContact O-N 3.5Å
299	V	33	Very low	49.3	Very low	78 Å²	78	109.1 Å²	109.1	47%	0.473	61%	0.606	S	S	.	*			trans	-58.9	106	176.1	-179.9	0	0	0	0	109.6	Y297 N301	Y297-V299 HydrophobicContact CD1-CG2 3.95Å; Y297-V299 HydrophobicContact CE1-CG2 4.26Å; Y297-V299 PolarHBondContact O-N 2.87Å; V299-N301 PolarHBondContact O-N 3.36Å; V299-N301 VanDerWaalsContact O-N 3.11Å
300	E	26.6	Very low	52.4	Low	153 Å²	153	106.3 Å²	106.3	72%	0.715	57%	0.572	S	S	*	*			trans	-71.8	103	170.3	-65.6	-160.4	158.5	0	0	109	K298 S302	K298-E300 PolarHBondContact O-N 3.5Å; E300-S302 PolarHBondContact O-N 3.18Å
301	N	33.6	Very low	55.8	Low	133 Å²	133	98.1 Å²	98.1	71%	0.711	55%	0.552	S	S	*	*			trans	-73.8	53.2	173.8	-171.2	76.7	0	0	0	111.3	V299 G303	V299-N301 PolarHBondContact O-N 3.36Å; V299-N301 VanDerWaalsContact O-N 3.11Å; N301-G303 PolarHBondContact O-N 3.5Å
302	S	41.7	Very low	58.9	Low	59 Å²	59	94.9 Å²	94.9	41%	0.413	53%	0.526	S	S	.	.			trans	-87.6	94.5	178.1	-67	0	0	0	0	108.5	E300 H304 F305	E300-S302 PolarHBondContact O-N 3.18Å; S302-H304 PolarHBondContact O-N 3.04Å; S302-F305 PolarHBondContact O-N 3.26Å
303	G	52.2	Low	62.1	Low	58 Å²	58	89.7 Å²	89.7	60%	0.598	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	5.7	-179.2	0	0	0	0	0	116.2	N301	N301-G303 PolarHBondContact O-N 3.5Å
304	H	71.9	Confident	65.2	Low	133 Å²	133	86 Å²	86	62%	0.616	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-37	174.7	-120.2	-72.3	0	0	0	113.2	S302 N320 I326	S302-H304 PolarHBondContact O-N 3.04Å; H304-N320 PolarHBondContact O-ND2 2.8Å; H304-I326 WeakPolarHBondContact O-CD1 3.26Å
305	F	88.8	Confident	68.4	Low	91 Å²	91	81.9 Å²	81.9	40%	0.399	42%	0.42	S	S	.	.	S	Bend	trans	-109.9	147.4	-170.5	-57.2	-60.4	0	0	0	112.8	S302 I326 Y330	S302-F305 PolarHBondContact O-N 3.26Å; F305-I326 HydrophobicContact CD1-CD1 3.9Å; F305-I326 HydrophobicContact CD1-CG1 4.09Å; F305-I326 HydrophobicContact CE1-CD1 4.35Å; F305-I326 HydrophobicContact CE1-CG1 4.34Å; F305-Y330 HydrophobicContact CD1-CE2 4.15Å
306	P	93.9	Very high	71.5	Confident	8 Å²	8	73.7 Å²	73.7	5%	0.052	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-71.6	151.3	168.8	33	-35.1	0	0	0	110.1	Y314 N320 I326 Y330 I332 L389	P306-Y314 HydrophobicContact CG-CD1 4.41Å; P306-N320 HydrophobicContact CB-CB 4.14Å; P306-N320 HydrophobicContact CG-CB 4.45Å; P306-I326 VanDerWaalsContact CD-CG2 3.49Å; P306-I326 HydrophobicContact CG-CG2 3.81Å; P306-Y330 HydrophobicContact CG-CD2 4.27Å; P306-Y330 HydrophobicContact CG-CE2 4.47Å; P306-I332 HydrophobicContact CG-CD1 4.38Å; P306-L389 HydrophobicContact CB-CD1 3.72Å
307	V	95.5	Very high	74.7	Confident	37 Å²	37	69 Å²	69	22%	0.224	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	122	-176.7	-175.9	0	0	0	0	109.3	I309 Y314 L315 H425 K426	V307-I309 HydrophobicContact CB-CD1 4.36Å; V307-I309 HydrophobicContact CG1-CD1 3.88Å; V307-Y314 CarbonylContact O-C 3.37Å; V307-Y314 WeakPolarHBondContact O-CA 3.49Å; V307-L315 PolarHBondContact N-O 2.96Å; V307-L315 PolarHBondContact O-N 2.75Å; V307-H425 HydrophobicContact CG1-CB 3.76Å; V307-H425 WeakPolarHBondContact CG1-O 3.18Å; V307-K426 HydrophobicContact CG2-CB 4.46Å; V307-K426 HydrophobicContact CG2-CD 4.24Å; V307-K426 HydrophobicContact CG2-CG 4.48Å
308	E	97.8	Very high	77.8	Confident	78 Å²	78	60.1 Å²	60.1	36%	0.364	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	129.6	168.9	-161.2	164	-167.9	0	0	109.6	I310 P311 F312 Y314 H425	E308-I310 WeakPolarHBondContact CG-O 3.3Å; E308-P311 WeakPolarHBondContact OE1-CA 3.39Å; E308-F312 PolarHBondContact OE1-N 2.67Å; E308-Y314 HydrophobicContact CB-CD1 3.8Å; E308-Y314 HydrophobicContact CB-CE1 3.58Å; E308-Y314 HydrophobicContact CG-CD1 4.14Å; E308-Y314 HydrophobicContact CG-CE1 3.78Å; E308-Y314 PolarHBondContact OE1-OH 2.71Å; E308-Y314 PolarHBondContact OE2-OH 3.04Å; E308-H425 PolarHBondContact O-CD2 3.49Å; E308-H425 VanDerWaalsContact O-CD2 3.29Å
309	I	98.1	Very high	81.1	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.021	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-40.6	-174.6	-59.6	-56.5	0	0	0	111	V307 L313 L315 T403 L407 L421 V422 H425	V307-I309 HydrophobicContact CB-CD1 4.36Å; V307-I309 HydrophobicContact CG1-CD1 3.88Å; I309-L313 PolarHBondContact N-O 2.91Å; I309-L315 HydrophobicContact CD1-CB 4.09Å; I309-L315 HydrophobicContact CD1-CD2 4.07Å; I309-L315 HydrophobicContact CG1-CB 3.76Å; I309-L315 HydrophobicContact CG1-CD2 4.36Å; I309-T403 HydrophobicContact CG1-CG2 4.25Å; I309-T403 HydrophobicContact CG2-CG2 4.1Å; I309-L407 HydrophobicContact CG2-CD1 4Å; I309-L421 HydrophobicContact CG2-CD2 3.58Å; I309-V422 HydrophobicContact CD1-CG1 4.07Å; I309-V422 HydrophobicContact CG2-CG2 4.01Å; I309-H425 HydrophobicContact CD1-CB 3.69Å
310	I	97.3	Very high	84	Confident	22 Å²	22	52.2 Å²	52.2	11%	0.113	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	162.9	168.3	59.1	174.2	0	0	0	107	E308 F312 L313 Y406 L407 L411 L421	E308-I310 WeakPolarHBondContact CG-O 3.3Å; I310-F312 PolarHBondContact O-N 2.84Å; I310-L313 HydrophobicContact CD1-CD2 4.22Å; I310-L313 HydrophobicContact CG1-CB 3.78Å; I310-L313 HydrophobicContact CG1-CD2 4Å; I310-L313 HydrophobicContact CG1-CG 4.47Å; I310-L313 PolarHBondContact O-N 3.24Å; I310-Y406 HydrophobicContact CD1-CE1 4.17Å; I310-L407 HydrophobicContact CD1-CD2 3.9Å; I310-L407 HydrophobicContact CG1-CD2 4.45Å; I310-L407 HydrophobicContact CG2-CD2 4.11Å; I310-L411 HydrophobicContact CD1-CD1 4.06Å; I310-L411 HydrophobicContact CD1-CG 4.48Å; I310-L411 HydrophobicContact CG2-CD1 4.15Å; I310-L421 HydrophobicContact CG2-CD2 4.35Å
311	P	97.8	Very high	87.4	Confident	83 Å²	83	45.1 Å²	45.1	54%	0.539	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.5	124.8	-176.8	-33.9	37.8	0	0	0	114.1	E308 L313 R382	E308-P311 WeakPolarHBondContact OE1-CA 3.39Å; P311-L313 VanDerWaalsContact C-N 3.28Å; P311-L313 PolarHBondContact O-N 2.97Å; P311-R382 PolarHBondContact O-NE 3.35Å; P311-R382 PolarHBondContact O-NH2 2.97Å
312	F	98.1	Very high	90.4	Very high	68 Å²	68	41.5 Å²	41.5	30%	0.298	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	4.1	-177.8	-45	-75	0	0	0	116.5	E308 I310 R382 K385 G387 V388	E308-F312 PolarHBondContact OE1-N 2.67Å; I310-F312 PolarHBondContact O-N 2.84Å; F312-R382 HydrophobicContact CB-CG 4.12Å; F312-K385 HydrophobicContact CE1-CB 3.98Å; F312-K385 WeakPolarHBondContact CE1-O 3.26Å; F312-K385 HydrophobicContact CE2-CB 4.16Å; F312-K385 HydrophobicContact CE2-CG 4.16Å; F312-K385 HydrophobicContact CZ-CB 3.73Å; F312-K385 HydrophobicContact CZ-CG 4.07Å; F312-G387 WeakPolarHBondContact O-CA 3.47Å; F312-V388 WeakPolarHBondContact O-CG1 3.37Å; F312-V388 PolarHBondContact O-N 3.34Å
313	L	98.7	Very high	92.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	111.5	176.4	178.4	57.6	0	0	0	111.2	I309 I310 P311 I378 V388 V390 T403 Y406	I309-L313 PolarHBondContact N-O 2.91Å; I310-L313 HydrophobicContact CD1-CD2 4.22Å; I310-L313 HydrophobicContact CG1-CB 3.78Å; I310-L313 HydrophobicContact CG1-CD2 4Å; I310-L313 HydrophobicContact CG1-CG 4.47Å; I310-L313 PolarHBondContact O-N 3.24Å; P311-L313 VanDerWaalsContact C-N 3.28Å; P311-L313 PolarHBondContact O-N 2.97Å; L313-I378 HydrophobicContact CD1-CG2 4.09Å; L313-V388 HydrophobicContact CD1-CG1 3.94Å; L313-V390 HydrophobicContact CD1-CG2 3.82Å; L313-T403 HydrophobicContact CD2-CG2 4.29Å; L313-Y406 HydrophobicContact CD2-CD1 3.52Å; L313-Y406 HydrophobicContact CD2-CE1 3.82Å
314	Y	98.7	Very high	95	Very high	18 Å²	18	40.1 Å²	40.1	7%	0.071	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	141	-178.5	-63.1	-89.8	0	0	0	111.5	P306 V307 E308 Y330 I332 V388 L389 V390	P306-Y314 HydrophobicContact CG-CD1 4.41Å; V307-Y314 CarbonylContact O-C 3.37Å; V307-Y314 WeakPolarHBondContact O-CA 3.49Å; E308-Y314 HydrophobicContact CB-CD1 3.8Å; E308-Y314 HydrophobicContact CB-CE1 3.58Å; E308-Y314 HydrophobicContact CG-CD1 4.14Å; E308-Y314 HydrophobicContact CG-CE1 3.78Å; E308-Y314 PolarHBondContact OE1-OH 2.71Å; E308-Y314 PolarHBondContact OE2-OH 3.04Å; Y314-Y330 AromaticContact CE1-CD1 3.7Å; Y314-Y330 HydrophobicContact CE1-CD1 3.7Å; Y314-Y330 HydrophobicContact CE1-CE1 4.48Å; Y314-Y330 HydrophobicContact CE1-CG 4.01Å; Y314-I332 HydrophobicContact CD2-CD1 4.21Å; Y314-I332 HydrophobicContact CD2-CG1 3.95Å; Y314-I332 HydrophobicContact CE2-CG1 4.27Å; Y314-I332 HydrophobicContact CG-CD1 4.22Å; Y314-I332 HydrophobicContact CG-CG1 4.46Å; Y314-V388 PolarHBondContact N-O 2.9Å; Y314-L389 WeakPolarHBondContact O-CA 3.44Å; Y314-V390 PolarHBondContact O-N 3.1Å
315	L	98.4	Very high	96.1	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.6	178.1	171.1	62.5	0	0	0	109.7	V307 I309 S399 V400 V422 K426 I429	V307-L315 PolarHBondContact N-O 2.96Å; V307-L315 PolarHBondContact O-N 2.75Å; I309-L315 HydrophobicContact CD1-CB 4.09Å; I309-L315 HydrophobicContact CD1-CD2 4.07Å; I309-L315 HydrophobicContact CG1-CB 3.76Å; I309-L315 HydrophobicContact CG1-CD2 4.36Å; L315-S399 WeakPolarHBondContact CD1-OG 3.45Å; L315-V400 HydrophobicContact CD1-CG2 4.24Å; L315-V400 HydrophobicContact CD2-CG2 4.13Å; L315-V422 HydrophobicContact CD2-CG1 3.53Å; L315-K426 HydrophobicContact CD2-CD 3.8Å; L315-K426 HydrophobicContact CG-CD 4.16Å; L315-I429 HydrophobicContact CD2-CG2 4.38Å
316	G	96.3	Very high	96.4	Very high	3 Å²	3	36.1 Å²	36.1	3%	0.031	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	-173	-173.8	0	0	0	0	0	116.1	N320 V390 H391 G395	G316-N320 VanDerWaalsContact CA-OD1 3.23Å; G316-N320 WeakPolarHBondContact CA-OD1 3.3Å; G316-V390 PolarHBondContact N-O 2.95Å; G316-H391 WeakPolarHBondContact O-CA 3.39Å; G316-G395 WeakPolarHBondContact O-CA 3.3Å
317	N	93.8	Very high	96.6	Very high	34 Å²	34	35.8 Å²	35.8	18%	0.182	21%	0.209	C	C	.	.			trans	-111.7	-179	178.4	66.5	31.3	0	0	0	111	S319 N320 A321 C392 L393	N317-S319 VanDerWaalsContact C-N 3.31Å; N317-S319 PolarHBondContact O-N 2.81Å; N317-S319 WeakPolarHBondContact OD1-CA 3.32Å; N317-S319 WeakPolarHBondContact OD1-CB 3.31Å; N317-S319 PolarHBondContact OD1-N 3.25Å; N317-N320 VanDerWaalsContact CG-OD1 3.27Å; N317-N320 PolarHBondContact N-OD1 3.14Å; N317-N320 PolarHBondContact O-N 3.4Å; N317-N320 VanDerWaalsContact OD1-CG 3.24Å; N317-N320 PolarHBondContact OD1-N 3.1Å; N317-N320 PolarHBondContact OD1-OD1 3.49Å; N317-N320 VanDerWaalsContact OD1-OD1 3.08Å; N317-A321 PolarHBondContact O-N 3.35Å; N317-C392 CarbonylContact C-O 3.27Å; N317-L393 WeakPolarHBondContact CB-O 3.23Å
318	A	94.8	Very high	96.6	Very high	25 Å²	25	38.4 Å²	38.4	21%	0.207	22%	0.224	C	C	.	.	H	α-helix	trans	-58.6	-39.8	178.8	0	0	0	0	0	113.2	N320 A321 A322 L342 C392 L393	A318-N320 PolarHBondContact O-N 2.77Å; A318-A321 PolarHBondContact O-N 2.96Å; A318-A322 PolarHBondContact O-N 3.06Å; A318-L342 HydrophobicContact CB-CD1 3.62Å; A318-C392 PolarHBondContact N-O 3.45Å; A318-L393 HydrophobicContact CB-CD1 4.29Å; A318-L393 PolarHBondContact N-O 2.85Å
319	S	95.3	Very high	96.5	Very high	85 Å²	85	40.6 Å²	40.6	59%	0.594	23%	0.233	S	C	*	.	H	α-helix	trans	-64.7	-39	179.3	-51.7	0	0	0	0	112.1	N317 A321 A322 D323	N317-S319 VanDerWaalsContact C-N 3.31Å; N317-S319 PolarHBondContact O-N 2.81Å; N317-S319 WeakPolarHBondContact OD1-CA 3.32Å; N317-S319 WeakPolarHBondContact OD1-CB 3.31Å; N317-S319 PolarHBondContact OD1-N 3.25Å; S319-A321 VanDerWaalsContact C-N 3.26Å; S319-A321 PolarHBondContact O-N 2.85Å; S319-A322 PolarHBondContact O-N 3.14Å; S319-D323 WeakPolarHBondContact O-CB 3.45Å; S319-D323 PolarHBondContact O-N 3.01Å
320	N	95.7	Very high	96.5	Very high	3 Å²	3	43.1 Å²	43.1	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-65.9	-28.7	176.4	-49	132.6	0	0	0	112.7	H304 P306 G316 N317 A318 L389	H304-N320 PolarHBondContact O-ND2 2.8Å; P306-N320 HydrophobicContact CB-CB 4.14Å; P306-N320 HydrophobicContact CG-CB 4.45Å; G316-N320 VanDerWaalsContact CA-OD1 3.23Å; G316-N320 WeakPolarHBondContact CA-OD1 3.3Å; N317-N320 VanDerWaalsContact CG-OD1 3.27Å; N317-N320 PolarHBondContact N-OD1 3.14Å; N317-N320 PolarHBondContact O-N 3.4Å; N317-N320 VanDerWaalsContact OD1-CG 3.24Å; N317-N320 PolarHBondContact OD1-N 3.1Å; N317-N320 PolarHBondContact OD1-OD1 3.49Å; N317-N320 VanDerWaalsContact OD1-OD1 3.08Å; A318-N320 PolarHBondContact O-N 2.77Å; N320-L389 HydrophobicContact CB-CD2 4.3Å
321	A	97	Very high	96.5	Very high	5 Å²	5	45.2 Å²	45.2	4%	0.041	25%	0.254	C	S	.	.	H	α-helix	trans	-85	-13.4	179	0	0	0	0	0	113.6	N317 A318 S319 L389 H391	N317-A321 PolarHBondContact O-N 3.35Å; A318-A321 PolarHBondContact O-N 2.96Å; S319-A321 VanDerWaalsContact C-N 3.26Å; S319-A321 PolarHBondContact O-N 2.85Å; A321-L389 HydrophobicContact CB-CD2 3.94Å; A321-H391 HydrophobicContact CB-CB 4.44Å
322	A	95.9	Very high	96.5	Very high	57 Å²	57	41.5 Å²	41.5	47%	0.471	23%	0.229	S	C	.	.	S	Bend	trans	-105.2	10	177.1	0	0	0	0	0	113.2	A318 S319 A345 F346	A318-A322 PolarHBondContact O-N 3.06Å; S319-A322 PolarHBondContact O-N 3.14Å; A322-A345 HydrophobicContact CB-CB 4.09Å; A322-F346 WeakPolarHBondContact O-CZ 3.2Å
323	D	95.6	Very high	96.5	Very high	45 Å²	45	42.3 Å²	42.3	24%	0.241	23%	0.233	C	C	.	.			trans	-114.2	100.7	-178.9	-175.9	-35.2	0	0	0	109.8	S319 D325 I326 L327	S319-D323 WeakPolarHBondContact O-CB 3.45Å; S319-D323 PolarHBondContact O-N 3.01Å; D323-D325 VanDerWaalsContact C-N 3.32Å; D323-D325 PolarHBondContact O-N 3.13Å; D323-D325 PolarHBondContact OD1-N 2.82Å; D323-D325 VanDerWaalsContact OD1-N 3.11Å; D323-I326 HydrophobicContact CB-CB 4.03Å; D323-I326 HydrophobicContact CB-CD1 3.97Å; D323-I326 HydrophobicContact CB-CG1 4.17Å; D323-I326 VanDerWaalsContact CG-CG1 3.47Å; D323-I326 PolarHBondContact O-N 2.9Å; D323-I326 WeakPolarHBondContact OD1-CG1 3.45Å; D323-I326 PolarHBondContact OD1-N 3.26Å; D323-I326 WeakPolarHBondContact OD2-CD1 3.17Å; D323-I326 WeakPolarHBondContact OD2-CG1 3.36Å; D323-L327 WeakPolarHBondContact O-CG 3.1Å; D323-L327 PolarHBondContact O-N 3.34Å; D323-L327 VanDerWaalsContact O-N 3.07Å
324	M	95.7	Very high	96.5	Very high	42 Å²	42	43.1 Å²	43.1	21%	0.207	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-32.6	-178	-179.3	61.3	70.2	0	0	112.5	I326 L327 V328 F346 D349 L352	M324-I326 VanDerWaalsContact C-N 3.33Å; M324-I326 PolarHBondContact O-N 3.49Å; M324-L327 PolarHBondContact O-N 2.85Å; M324-V328 HydrophobicContact CG-CG2 4.32Å; M324-V328 WeakPolarHBondContact O-CB 3.39Å; M324-V328 WeakPolarHBondContact O-CG2 3.36Å; M324-V328 PolarHBondContact O-N 3.46Å; M324-V328 HydrophobicContact SD-CG2 4.02Å; M324-F346 HydrophobicContact CB-CE1 4.27Å; M324-F346 HydrophobicContact CB-CE2 4.18Å; M324-F346 HydrophobicContact CB-CZ 3.84Å; M324-F346 HydrophobicContact CE-CB 3.95Å; M324-F346 HydrophobicContact CE-CD1 3.69Å; M324-F346 HydrophobicContact CE-CD2 3.81Å; M324-F346 HydrophobicContact CE-CE1 4.11Å; M324-F346 HydrophobicContact CE-CE2 4.21Å; M324-F346 HydrophobicContact CE-CG 3.53Å; M324-F346 HydrophobicContact CE-CZ 4.35Å; M324-D349 WeakPolarHBondContact CE-OD2 3.49Å; M324-L352 HydrophobicContact CE-CD1 3.84Å
325	D	96.1	Very high	96.5	Very high	135 Å²	135	42.2 Å²	42.2	72%	0.722	23%	0.233	S	C	*	.	H	α-helix	trans	-67.6	-38.1	179.5	-69.8	-33.5	0	0	0	110.5	D323 K329	D323-D325 VanDerWaalsContact C-N 3.32Å; D323-D325 PolarHBondContact O-N 3.13Å; D323-D325 PolarHBondContact OD1-N 2.82Å; D323-D325 VanDerWaalsContact OD1-N 3.11Å; D325-K329 WeakPolarHBondContact O-CB 3.12Å; D325-K329 PolarHBondContact O-N 2.98Å
326	I	94.8	Very high	96.5	Very high	5 Å²	5	42.2 Å²	42.2	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-63.1	-49.2	169.4	-73.8	179.6	0	0	0	111.3	H304 F305 P306 D323 M324 V328 K329 Y330	H304-I326 WeakPolarHBondContact O-CD1 3.26Å; F305-I326 HydrophobicContact CD1-CD1 3.9Å; F305-I326 HydrophobicContact CD1-CG1 4.09Å; F305-I326 HydrophobicContact CE1-CD1 4.35Å; F305-I326 HydrophobicContact CE1-CG1 4.34Å; P306-I326 VanDerWaalsContact CD-CG2 3.49Å; P306-I326 HydrophobicContact CG-CG2 3.81Å; D323-I326 HydrophobicContact CB-CB 4.03Å; D323-I326 HydrophobicContact CB-CD1 3.97Å; D323-I326 HydrophobicContact CB-CG1 4.17Å; D323-I326 VanDerWaalsContact CG-CG1 3.47Å; D323-I326 PolarHBondContact O-N 2.9Å; D323-I326 WeakPolarHBondContact OD1-CG1 3.45Å; D323-I326 PolarHBondContact OD1-N 3.26Å; D323-I326 WeakPolarHBondContact OD2-CD1 3.17Å; D323-I326 WeakPolarHBondContact OD2-CG1 3.36Å; M324-I326 VanDerWaalsContact C-N 3.33Å; M324-I326 PolarHBondContact O-N 3.49Å; I326-V328 VanDerWaalsContact C-N 3.32Å; I326-V328 PolarHBondContact O-N 2.9Å; I326-K329 PolarHBondContact O-N 2.72Å; I326-Y330 HydrophobicContact CG2-CD2 3.94Å; I326-Y330 HydrophobicContact CG2-CE2 4.22Å; I326-Y330 VanDerWaalsContact O-CD2 3.27Å; I326-Y330 WeakPolarHBondContact O-CD2 3.05Å; I326-Y330 PolarHBondContact O-N 3.22Å; I326-Y330 VanDerWaalsContact O-N 3.09Å
327	L	96.9	Very high	96.6	Very high	2 Å²	2	42 Å²	42	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-58.4	-45	-179.1	-66.8	172.2	0	0	0	111.3	D323 M324 N331 I332 I335 F346 L352 L389	D323-L327 WeakPolarHBondContact O-CG 3.1Å; D323-L327 PolarHBondContact O-N 3.34Å; D323-L327 VanDerWaalsContact O-N 3.07Å; M324-L327 PolarHBondContact O-N 2.85Å; L327-N331 PolarHBondContact O-N 3.26Å; L327-I332 HydrophobicContact CB-CB 4.46Å; L327-I332 HydrophobicContact CD2-CB 3.82Å; L327-I332 HydrophobicContact CD2-CD1 4.09Å; L327-I332 HydrophobicContact CD2-CG2 3.56Å; L327-I332 PolarHBondContact O-N 3.36Å; L327-I335 HydrophobicContact CD1-CD1 3.78Å; L327-I335 HydrophobicContact CD2-CD1 3.72Å; L327-I335 HydrophobicContact CD2-CG1 4.32Å; L327-I335 HydrophobicContact CG-CD1 4.43Å; L327-F346 HydrophobicContact CD1-CD2 3.64Å; L327-F346 HydrophobicContact CD1-CE2 3.74Å; L327-L352 HydrophobicContact CD1-CD1 4.02Å; L327-L389 HydrophobicContact CD2-CD2 4.03Å
328	V	96.2	Very high	96.9	Very high	91 Å²	91	40.4 Å²	40.4	55%	0.552	22%	0.222	S	C	*	.	H	α-helix	trans	-64.9	-48.1	175.2	172.3	0	0	0	0	111.5	M324 I326 Y330 N331	M324-V328 HydrophobicContact CG-CG2 4.32Å; M324-V328 WeakPolarHBondContact O-CB 3.39Å; M324-V328 WeakPolarHBondContact O-CG2 3.36Å; M324-V328 PolarHBondContact O-N 3.46Å; M324-V328 HydrophobicContact SD-CG2 4.02Å; I326-V328 VanDerWaalsContact C-N 3.32Å; I326-V328 PolarHBondContact O-N 2.9Å; V328-Y330 VanDerWaalsContact C-N 3.27Å; V328-Y330 PolarHBondContact O-N 2.89Å; V328-N331 PolarHBondContact O-N 3.46Å
329	K	96.3	Very high	96.8	Very high	124 Å²	124	39.4 Å²	39.4	54%	0.539	21%	0.213	S	C	.	.	H	α-helix	trans	-55.7	-38.4	-178.4	176.4	-174.7	176.2	-162.2	0	113.2	D325 I326	D325-K329 WeakPolarHBondContact O-CB 3.12Å; D325-K329 PolarHBondContact O-N 2.98Å; I326-K329 PolarHBondContact O-N 2.72Å
330	Y	96.5	Very high	96.8	Very high	57 Å²	57	40.2 Å²	40.2	22%	0.224	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	11.5	-179.8	-63.4	-75.2	0	0	0	113.4	F305 P306 Y314 I326 V328 I332	F305-Y330 HydrophobicContact CD1-CE2 4.15Å; P306-Y330 HydrophobicContact CG-CD2 4.27Å; P306-Y330 HydrophobicContact CG-CE2 4.47Å; Y314-Y330 AromaticContact CE1-CD1 3.7Å; Y314-Y330 HydrophobicContact CE1-CD1 3.7Å; Y314-Y330 HydrophobicContact CE1-CE1 4.48Å; Y314-Y330 HydrophobicContact CE1-CG 4.01Å; I326-Y330 HydrophobicContact CG2-CD2 3.94Å; I326-Y330 HydrophobicContact CG2-CE2 4.22Å; I326-Y330 VanDerWaalsContact O-CD2 3.27Å; I326-Y330 WeakPolarHBondContact O-CD2 3.05Å; I326-Y330 PolarHBondContact O-N 3.22Å; I326-Y330 VanDerWaalsContact O-N 3.09Å; V328-Y330 VanDerWaalsContact C-N 3.27Å; V328-Y330 PolarHBondContact O-N 2.89Å; Y330-I332 PolarHBondContact O-N 3.11Å
331	N	97.3	Very high	96.4	Very high	67 Å²	67	46.2 Å²	46.2	36%	0.358	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	36.8	-177.1	178.6	51.9	0	0	0	112.5	L327 V328 K333 K385 G387	L327-N331 PolarHBondContact O-N 3.26Å; V328-N331 PolarHBondContact O-N 3.46Å; N331-K333 PolarHBondContact O-N 2.54Å; N331-K333 VanDerWaalsContact OD1-CE 3.23Å; N331-K333 WeakPolarHBondContact OD1-CE 3.43Å; N331-K333 PolarHBondContact OD1-NZ 3.27Å; N331-K333 VanDerWaalsContact OD1-NZ 3.11Å; N331-K385 PolarHBondContact ND2-O 2.81Å; N331-G387 PolarHBondContact O-N 3.2Å
332	I	98.3	Very high	96.2	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	121.5	178.1	-62.6	162.1	0	0	0	108.1	P306 Y314 L327 Y330 Y334 I335 L352 G387 L389	P306-I332 HydrophobicContact CG-CD1 4.38Å; Y314-I332 HydrophobicContact CD2-CD1 4.21Å; Y314-I332 HydrophobicContact CD2-CG1 3.95Å; Y314-I332 HydrophobicContact CE2-CG1 4.27Å; Y314-I332 HydrophobicContact CG-CD1 4.22Å; Y314-I332 HydrophobicContact CG-CG1 4.46Å; L327-I332 HydrophobicContact CB-CB 4.46Å; L327-I332 HydrophobicContact CD2-CB 3.82Å; L327-I332 HydrophobicContact CD2-CD1 4.09Å; L327-I332 HydrophobicContact CD2-CG2 3.56Å; L327-I332 PolarHBondContact O-N 3.36Å; Y330-I332 PolarHBondContact O-N 3.11Å; I332-Y334 WeakPolarHBondContact CG2-O 3.45Å; I332-I335 HydrophobicContact CG2-CG1 4.16Å; I332-L352 WeakPolarHBondContact O-CD2 3.34Å; I332-G387 WeakPolarHBondContact CA-O 3.44Å; I332-L389 HydrophobicContact CD1-CB 4.26Å; I332-L389 HydrophobicContact CG2-CB 3.77Å
333	K	98.3	Very high	96.1	Very high	86 Å²	86	50.6 Å²	50.6	37%	0.374	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	-0.9	178.7	-64.1	177.8	-178.7	158.1	0	113.3	N331 K353 C386 G387	N331-K333 PolarHBondContact O-N 2.54Å; N331-K333 VanDerWaalsContact OD1-CE 3.23Å; N331-K333 WeakPolarHBondContact OD1-CE 3.43Å; N331-K333 PolarHBondContact OD1-NZ 3.27Å; N331-K333 VanDerWaalsContact OD1-NZ 3.11Å; K333-K353 PolarHBondContact O-N 2.82Å; K333-C386 HydrophobicContact CB-CB 4.23Å; K333-C386 HydrophobicContact CD-CB 4.39Å; K333-G387 PolarHBondContact N-O 3.26Å
334	Y	98.7	Very high	96.2	Very high	16 Å²	16	49 Å²	49	6%	0.063	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	131	-179.3	-79.3	-111.3	0	0	0	108	I332 K353 F377 E380 A381 K384 C386 G387 V388 L389	I332-Y334 WeakPolarHBondContact CG2-O 3.45Å; Y334-K353 CarbonylContact C-O 3.6Å; Y334-K353 VanDerWaalsContact CA-O 3.31Å; Y334-K353 WeakPolarHBondContact CA-O 3.3Å; Y334-K353 HydrophobicContact CD1-CB 4.18Å; Y334-K353 HydrophobicContact CD1-CD 4.08Å; Y334-K353 HydrophobicContact CE1-CB 4.21Å; Y334-K353 HydrophobicContact CE1-CD 3.47Å; Y334-K353 VanDerWaalsContact CE1-CD 3.47Å; Y334-K353 HydrophobicContact CE1-CG 4.41Å; Y334-K353 HydrophobicContact CG-CB 4.39Å; Y334-F377 HydrophobicContact CD1-CD1 4.08Å; Y334-F377 HydrophobicContact CD1-CD2 4.41Å; Y334-F377 AromaticContact CD1-CE1 3.67Å; Y334-F377 HydrophobicContact CD1-CE1 3.67Å; Y334-F377 HydrophobicContact CD1-CE2 4.03Å; Y334-F377 HydrophobicContact CD1-CG 4.45Å; Y334-F377 AromaticContact CD1-CZ 3.65Å; Y334-F377 HydrophobicContact CD1-CZ 3.65Å; Y334-F377 HydrophobicContact CE1-CE2 4.43Å; Y334-F377 HydrophobicContact CE1-CZ 4.45Å; Y334-F377 HydrophobicContact CG-CE1 4.28Å; Y334-F377 HydrophobicContact CG-CZ 4.39Å; Y334-E380 HydrophobicContact CE1-CB 4.15Å; Y334-E380 HydrophobicContact CE1-CG 4.15Å; Y334-E380 VanDerWaalsContact OH-CD 3.3Å; Y334-E380 PolarHBondContact OH-OE1 2.87Å; Y334-A381 HydrophobicContact CD1-CB 3.66Å; Y334-A381 HydrophobicContact CD2-CB 3.6Å; Y334-A381 HydrophobicContact CE1-CB 4.2Å; Y334-A381 HydrophobicContact CE2-CB 4.17Å; Y334-A381 HydrophobicContact CG-CB 3.35Å; Y334-K384 PolarHBondContact OH-NZ 3.44Å; Y334-C386 HydrophobicContact CD2-CB 4.36Å; Y334-G387 PolarHBondContact N-O 2.88Å; Y334-V388 CarbonylContact O-C 3.13Å; Y334-V388 VanDerWaalsContact O-CA 3.24Å; Y334-V388 WeakPolarHBondContact O-CA 3.47Å; Y334-L389 PolarHBondContact O-N 3.24Å
335	I	98.7	Very high	96.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	121.9	-177.6	-56.8	178.7	0	0	0	109.4	L327 I332 L352 K353 Y354 L355 L389	L327-I335 HydrophobicContact CD1-CD1 3.78Å; L327-I335 HydrophobicContact CD2-CD1 3.72Å; L327-I335 HydrophobicContact CD2-CG1 4.32Å; L327-I335 HydrophobicContact CG-CD1 4.43Å; I332-I335 HydrophobicContact CG2-CG1 4.16Å; I335-L352 HydrophobicContact CD1-CD1 4.42Å; I335-K353 PolarHBondContact N-O 3.23Å; I335-Y354 HydrophobicContact CB-CD1 3.76Å; I335-Y354 HydrophobicContact CB-CE1 3.7Å; I335-Y354 HydrophobicContact CB-CG 4.47Å; I335-Y354 HydrophobicContact CD1-CE1 3.84Å; I335-Y354 HydrophobicContact CD1-CE2 4.42Å; I335-Y354 HydrophobicContact CG1-CE1 4.31Å; I335-Y354 HydrophobicContact CG2-CD1 3.95Å; I335-Y354 HydrophobicContact CG2-CE1 3.68Å; I335-Y354 CarbonylContact O-C 3.6Å; I335-Y354 WeakPolarHBondContact O-CA 3.44Å; I335-L355 PolarHBondContact O-N 2.87Å; I335-L389 WeakPolarHBondContact CA-O 3.5Å
336	V	98.8	Very high	96.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	101.9	174.5	-173.5	0	0	0	0	108.5	V338 L355 I357 F377 I378 V388 L389 V390 H391	V336-V338 HydrophobicContact CG1-CG2 3.9Å; V336-V338 PolarHBondContact O-N 2.87Å; V336-L355 CarbonylContact C-O 3.56Å; V336-L355 VanDerWaalsContact CA-O 3.32Å; V336-L355 WeakPolarHBondContact CA-O 3.24Å; V336-L355 HydrophobicContact CG1-CD2 4.35Å; V336-L355 HydrophobicContact CG1-CG 4.43Å; V336-L355 HydrophobicContact CG2-CD2 4.48Å; V336-I357 HydrophobicContact CG1-CD1 3.86Å; V336-F377 HydrophobicContact CG2-CD1 3.49Å; V336-F377 VanDerWaalsContact CG2-CD1 3.49Å; V336-F377 HydrophobicContact CG2-CE1 3.71Å; V336-I378 HydrophobicContact CG2-CG1 4.39Å; V336-V388 HydrophobicContact CG2-CG2 4.05Å; V336-L389 PolarHBondContact N-O 2.87Å; V336-V390 HydrophobicContact CB-CB 4.47Å; V336-V390 HydrophobicContact CB-CG1 4.25Å; V336-V390 HydrophobicContact CB-CG2 4.28Å; V336-V390 HydrophobicContact CG1-CG1 4.41Å; V336-V390 HydrophobicContact CG2-CG2 4.34Å; V336-H391 PolarHBondContact O-CD2 3.36Å; V336-H391 PolarHBondContact O-N 2.76Å
337	N	98.6	Very high	96.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	95	177.4	177.1	2	0	0	0	109.5	T339 L342 N344 L355 Q356 I357 H391	N337-T339 PolarHBondContact O-N 2.97Å; N337-T339 PolarHBondContact OD1-N 3.47Å; N337-T339 PolarHBondContact OD1-OG1 3.26Å; N337-L342 PolarHBondContact ND2-O 3.39Å; N337-N344 WeakPolarHBondContact CB-OD1 3.14Å; N337-N344 PolarHBondContact ND2-OD1 3.34Å; N337-L355 PolarHBondContact N-O 3.39Å; N337-Q356 HydrophobicContact CB-CB 4.46Å; N337-Q356 HydrophobicContact CB-CG 4.22Å; N337-Q356 WeakPolarHBondContact O-CA 3.42Å; N337-I357 PolarHBondContact O-N 3.37Å; N337-H391 WeakPolarHBondContact CA-NE2 3.49Å; N337-H391 WeakPolarHBondContact CB-NE2 3.5Å
338	V	98.5	Very high	95.9	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.298	C	S	.	.			trans	-85.9	58	177.7	-159.5	0	0	0	0	110.1	V336 I357 L367 V390 H391 C392 R398 V402	V336-V338 HydrophobicContact CG1-CG2 3.9Å; V336-V338 PolarHBondContact O-N 2.87Å; V338-I357 CarbonylContact C-O 3.55Å; V338-I357 HydrophobicContact CG1-CB 4.25Å; V338-I357 HydrophobicContact CG1-CG2 4.14Å; V338-L367 HydrophobicContact CG1-CD1 3.72Å; V338-L367 HydrophobicContact CG1-CD2 4.35Å; V338-V390 HydrophobicContact CG2-CG1 4.1Å; V338-H391 PolarHBondContact N-O 3.38Å; V338-C392 HydrophobicContact CB-CB 4.47Å; V338-C392 WeakPolarHBondContact O-CB 3.39Å; V338-R398 HydrophobicContact CB-CB 4.12Å; V338-R398 HydrophobicContact CG1-CB 3.76Å; V338-R398 HydrophobicContact CG1-CG 4.31Å; V338-R398 VanDerWaalsContact O-CD 3.3Å; V338-R398 WeakPolarHBondContact O-CD 3.45Å; V338-V402 HydrophobicContact CG1-CG2 4.22Å; V338-V402 HydrophobicContact CG2-CG2 3.97Å
339	T	94.6	Very high	95.9	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.018	28%	0.281	C	S	.	.			trans	-146.2	152.7	171.5	78	0	0	0	0	112.3	N337 L342 Q356 I357 C392	N337-T339 PolarHBondContact O-N 2.97Å; N337-T339 PolarHBondContact OD1-N 3.47Å; N337-T339 PolarHBondContact OD1-OG1 3.26Å; T339-L342 HydrophobicContact CG2-CD1 3.84Å; T339-L342 HydrophobicContact CG2-CG 4.12Å; T339-L342 VanDerWaalsContact OG1-CB 3.3Å; T339-L342 WeakPolarHBondContact OG1-CB 3.32Å; T339-L342 PolarHBondContact OG1-N 2.94Å; T339-Q356 WeakPolarHBondContact O-CG 3.45Å; T339-Q356 PolarHBondContact O-NE2 2.84Å; T339-I357 PolarHBondContact N-O 3.3Å; T339-C392 HydrophobicContact CG2-CB 3.95Å
340	R	93.7	Very high	95.7	Very high	103 Å²	103	59 Å²	59	39%	0.389	30%	0.299	S	S	.	.	S	Bend	trans	-74.6	-42.7	168.4	-170.5	-173.8	-50.6	-57	-11.1	113.3	Q356 P358 D360	R340-Q356 PolarHBondContact O-NE2 3.42Å; R340-P358 HydrophobicContact CB-CB 4.32Å; R340-P358 HydrophobicContact CG-CB 4.3Å; R340-P358 PolarHBondContact NH1-O 2.82Å; R340-P358 PolarHBondContact NH2-O 3.33Å; R340-P358 VanDerWaalsContact NH2-O 3.1Å; R340-D360 IonicContact CZ-OD2 3.09Å; R340-D360 IonicContact NE-OD1 2.67Å; R340-D360 IonicContact NE-OD2 2.65Å; R340-D360 PolarHBondContact NE-OD2 3.49Å; R340-D360 IonicContact NH2-OD2 2.71Å; R340-D360 PolarHBondContact NH2-OD2 3.16Å
341	N	88.5	Confident	95.7	Very high	128 Å²	128	63.8 Å²	63.8	68%	0.684	32%	0.317	S	S	*	.	S	Bend	trans	-108.9	-1.1	-158.8	-59.7	-15.1	0	0	0	115.2
342	L	92.3	Very high	95.7	Very high	46 Å²	46	61.5 Å²	61.5	24%	0.241	31%	0.305	C	S	.	.	S	Bend	trans	-95.5	133	172.9	-55.6	-178.3	0	0	0	110.2	A318 N337 T339 Q356 L393	A318-L342 HydrophobicContact CB-CD1 3.62Å; N337-L342 PolarHBondContact ND2-O 3.39Å; T339-L342 HydrophobicContact CG2-CD1 3.84Å; T339-L342 HydrophobicContact CG2-CG 4.12Å; T339-L342 VanDerWaalsContact OG1-CB 3.3Å; T339-L342 WeakPolarHBondContact OG1-CB 3.32Å; T339-L342 PolarHBondContact OG1-N 2.94Å; L342-Q356 PolarHBondContact O-NE2 3.01Å; L342-L393 HydrophobicContact CD1-CB 4.36Å; L342-L393 HydrophobicContact CD1-CD1 4.15Å; L342-L393 HydrophobicContact CD2-CD1 4.35Å
343	P	94.2	Very high	95.7	Very high	108 Å²	108	65.6 Å²	65.6	70%	0.701	32%	0.322	S	S	*	.			trans	-70.7	154.1	175.9	31.1	-35.5	0	0	0	111.4	A345	P343-A345 PolarHBondContact O-N 2.96Å; P343-A345 VanDerWaalsContact O-N 3.09Å
344	N	97.2	Very high	95.7	Very high	12 Å²	12	63.2 Å²	63.2	6%	0.064	31%	0.311	C	S	.	.			trans	-75.1	94.2	167.9	-68.5	-24.4	0	0	0	108	N337 F346 E347 Y354	N337-N344 WeakPolarHBondContact CB-OD1 3.14Å; N337-N344 PolarHBondContact ND2-OD1 3.34Å; N344-F346 PolarHBondContact O-N 3.27Å; N344-E347 HydrophobicContact CB-CB 3.77Å; N344-E347 HydrophobicContact CB-CG 4.17Å; N344-E347 PolarHBondContact ND2-OE1 3.19Å; N344-E347 WeakPolarHBondContact O-CB 3.48Å; N344-E347 PolarHBondContact O-N 2.82Å; N344-Y354 HydrophobicContact CB-CD1 3.49Å; N344-Y354 VanDerWaalsContact CB-CD1 3.49Å; N344-Y354 HydrophobicContact CB-CD2 4.27Å; N344-Y354 HydrophobicContact CB-CE1 3.55Å; N344-Y354 HydrophobicContact CB-CE2 4.32Å; N344-Y354 HydrophobicContact CB-CG 3.86Å; N344-Y354 WeakPolarHBondContact OD1-CD1 3.47Å
345	A	95.5	Very high	95.7	Very high	50 Å²	50	63.2 Å²	63.2	41%	0.413	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-25.4	-164	0	0	0	0	0	116	A322 P343	A322-A345 HydrophobicContact CB-CB 4.09Å; P343-A345 PolarHBondContact O-N 2.96Å; P343-A345 VanDerWaalsContact O-N 3.09Å
346	F	96.9	Very high	95.7	Very high	52 Å²	52	66.6 Å²	66.6	23%	0.228	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	33.8	-178.4	-51.6	-65.2	0	0	0	111.9	A322 M324 L327 N344 H348 D349 L352 Y354	A322-F346 WeakPolarHBondContact O-CZ 3.2Å; M324-F346 HydrophobicContact CB-CE1 4.27Å; M324-F346 HydrophobicContact CB-CE2 4.18Å; M324-F346 HydrophobicContact CB-CZ 3.84Å; M324-F346 HydrophobicContact CE-CB 3.95Å; M324-F346 HydrophobicContact CE-CD1 3.69Å; M324-F346 HydrophobicContact CE-CD2 3.81Å; M324-F346 HydrophobicContact CE-CE1 4.11Å; M324-F346 HydrophobicContact CE-CE2 4.21Å; M324-F346 HydrophobicContact CE-CG 3.53Å; M324-F346 HydrophobicContact CE-CZ 4.35Å; L327-F346 HydrophobicContact CD1-CD2 3.64Å; L327-F346 HydrophobicContact CD1-CE2 3.74Å; N344-F346 PolarHBondContact O-N 3.27Å; F346-H348 PolarHBondContact O-N 3.15Å; F346-D349 HydrophobicContact CB-CB 4.31Å; F346-D349 WeakPolarHBondContact O-CB 3.48Å; F346-D349 PolarHBondContact O-N 2.87Å; F346-L352 HydrophobicContact CB-CD1 3.6Å; F346-L352 HydrophobicContact CD2-CD1 4.15Å; F346-L352 HydrophobicContact CG-CD1 4.22Å; F346-Y354 PolarHBondContact N-OH 3.15Å; F346-Y354 VanDerWaalsContact N-OH 3.08Å
347	E	92.2	Very high	95.6	Very high	111 Å²	111	66.6 Å²	66.6	52%	0.519	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-15.8	-176.9	-168.5	154.6	-123.6	0	0	114.8	N344	N344-E347 HydrophobicContact CB-CB 3.77Å; N344-E347 HydrophobicContact CB-CG 4.17Å; N344-E347 PolarHBondContact ND2-OE1 3.19Å; N344-E347 WeakPolarHBondContact O-CB 3.48Å; N344-E347 PolarHBondContact O-N 2.82Å
348	H	93.2	Very high	95.5	Very high	188 Å²	188	69.3 Å²	69.3	87%	0.87	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	7.6	174.9	-53	-37.3	0	0	0	113.6	F346	F346-H348 PolarHBondContact O-N 3.15Å
349	D	94.8	Very high	95.2	Very high	36 Å²	36	69.8 Å²	69.8	19%	0.193	35%	0.348	C	S	.	.			trans	-101.8	103.7	177.8	-169.4	-27	0	0	0	110.3	M324 F346 R351 L352	M324-D349 WeakPolarHBondContact CE-OD2 3.49Å; F346-D349 HydrophobicContact CB-CB 4.31Å; F346-D349 WeakPolarHBondContact O-CB 3.48Å; F346-D349 PolarHBondContact O-N 2.87Å; D349-R351 PolarHBondContact O-N 2.69Å; D349-R351 WeakPolarHBondContact OD1-CB 3.3Å; D349-R351 WeakPolarHBondContact OD1-CG 3.03Å; D349-R351 IonicContact OD1-CZ 2.72Å; D349-R351 PolarHBondContact OD1-N 2.9Å; D349-R351 VanDerWaalsContact OD1-N 3.11Å; D349-R351 IonicContact OD1-NE 2.73Å; D349-R351 PolarHBondContact OD1-NE 3Å; D349-R351 IonicContact OD1-NH2 3.71Å; D349-R351 IonicContact OD2-CZ 3.97Å; D349-R351 IonicContact OD2-NE 2.98Å; D349-R351 PolarHBondContact OD2-NE 2.58Å; D349-R351 IonicContact OD2-NH2 3.28Å; D349-R351 PolarHBondContact OD2-NH2 3.19Å; D349-L352 HydrophobicContact CB-CD1 4.45Å; D349-L352 PolarHBondContact O-N 3.29Å
350	D	93.8	Very high	94.8	Very high	173 Å²	173	71.3 Å²	71.3	93%	0.925	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-13.1	-178.7	-65.3	-45.5	0	0	0	114.4	L352	D350-L352 VanDerWaalsContact C-N 3.29Å
351	R	94.5	Very high	94.3	Very high	156 Å²	156	68.2 Å²	68.2	59%	0.589	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-14.3	175.3	-52.9	175.6	-63.2	163	5.7	112.8	D349	D349-R351 PolarHBondContact O-N 2.69Å; D349-R351 WeakPolarHBondContact OD1-CB 3.3Å; D349-R351 WeakPolarHBondContact OD1-CG 3.03Å; D349-R351 IonicContact OD1-CZ 2.72Å; D349-R351 PolarHBondContact OD1-N 2.9Å; D349-R351 VanDerWaalsContact OD1-N 3.11Å; D349-R351 IonicContact OD1-NE 2.73Å; D349-R351 PolarHBondContact OD1-NE 3Å; D349-R351 IonicContact OD1-NH2 3.71Å; D349-R351 IonicContact OD2-CZ 3.97Å; D349-R351 IonicContact OD2-NE 2.98Å; D349-R351 PolarHBondContact OD2-NE 2.58Å; D349-R351 IonicContact OD2-NH2 3.28Å; D349-R351 PolarHBondContact OD2-NH2 3.19Å
352	L	97.8	Very high	93.7	Very high	20 Å²	20	64.2 Å²	64.2	11%	0.105	33%	0.326	C	S	.	.			trans	-120.5	119.7	-174	-60.9	-179.7	0	0	0	111.5	M324 L327 I332 I335 F346 D349 D350 Y354	M324-L352 HydrophobicContact CE-CD1 3.84Å; L327-L352 HydrophobicContact CD1-CD1 4.02Å; I332-L352 WeakPolarHBondContact O-CD2 3.34Å; I335-L352 HydrophobicContact CD1-CD1 4.42Å; F346-L352 HydrophobicContact CB-CD1 3.6Å; F346-L352 HydrophobicContact CD2-CD1 4.15Å; F346-L352 HydrophobicContact CG-CD1 4.22Å; D349-L352 HydrophobicContact CB-CD1 4.45Å; D349-L352 PolarHBondContact O-N 3.29Å; D350-L352 VanDerWaalsContact C-N 3.29Å; L352-Y354 HydrophobicContact CB-CE2 4.05Å
353	K	98.2	Very high	92.5	Very high	90 Å²	90	68.2 Å²	68.2	39%	0.391	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	129.2	171.7	-159.4	-175.3	-170.5	179.6	0	110	K333 Y334 I335 F377 E380	K333-K353 PolarHBondContact O-N 2.82Å; Y334-K353 CarbonylContact C-O 3.6Å; Y334-K353 VanDerWaalsContact CA-O 3.31Å; Y334-K353 WeakPolarHBondContact CA-O 3.3Å; Y334-K353 HydrophobicContact CD1-CB 4.18Å; Y334-K353 HydrophobicContact CD1-CD 4.08Å; Y334-K353 HydrophobicContact CE1-CB 4.21Å; Y334-K353 HydrophobicContact CE1-CD 3.47Å; Y334-K353 VanDerWaalsContact CE1-CD 3.47Å; Y334-K353 HydrophobicContact CE1-CG 4.41Å; Y334-K353 HydrophobicContact CG-CB 4.39Å; I335-K353 PolarHBondContact N-O 3.23Å; K353-F377 HydrophobicContact CB-CZ 4.31Å; K353-F377 HydrophobicContact CD-CE2 3.77Å; K353-F377 HydrophobicContact CD-CZ 4.33Å; K353-F377 HydrophobicContact CG-CE2 3.91Å; K353-F377 HydrophobicContact CG-CZ 4.15Å; K353-E380 IonicContact NZ-OE1 2.77Å; K353-E380 PolarHBondContact NZ-OE1 3.39Å; K353-E380 IonicContact NZ-OE2 3.01Å; K353-E380 PolarHBondContact NZ-OE2 3.39Å
354	Y	98.5	Very high	91.4	Very high	35 Å²	35	66.1 Å²	66.1	14%	0.137	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	149.6	176.2	-78.6	-92.4	0	0	0	112.9	I335 N344 F346 L352 F377	I335-Y354 HydrophobicContact CB-CD1 3.76Å; I335-Y354 HydrophobicContact CB-CE1 3.7Å; I335-Y354 HydrophobicContact CB-CG 4.47Å; I335-Y354 HydrophobicContact CD1-CE1 3.84Å; I335-Y354 HydrophobicContact CD1-CE2 4.42Å; I335-Y354 HydrophobicContact CG1-CE1 4.31Å; I335-Y354 HydrophobicContact CG2-CD1 3.95Å; I335-Y354 HydrophobicContact CG2-CE1 3.68Å; I335-Y354 CarbonylContact O-C 3.6Å; I335-Y354 WeakPolarHBondContact O-CA 3.44Å; N344-Y354 HydrophobicContact CB-CD1 3.49Å; N344-Y354 VanDerWaalsContact CB-CD1 3.49Å; N344-Y354 HydrophobicContact CB-CD2 4.27Å; N344-Y354 HydrophobicContact CB-CE1 3.55Å; N344-Y354 HydrophobicContact CB-CE2 4.32Å; N344-Y354 HydrophobicContact CB-CG 3.86Å; N344-Y354 WeakPolarHBondContact OD1-CD1 3.47Å; F346-Y354 PolarHBondContact N-OH 3.15Å; F346-Y354 VanDerWaalsContact N-OH 3.08Å; L352-Y354 HydrophobicContact CB-CE2 4.05Å; Y354-F377 VanDerWaalsContact C-CZ 3.5Å
355	L	98.4	Very high	90.7	Very high	17 Å²	17	67 Å²	67	9%	0.089	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	113.4	161.7	166.8	59.9	0	0	0	107.8	I335 V336 N337 I357 Q373 F377	I335-L355 PolarHBondContact O-N 2.87Å; V336-L355 CarbonylContact C-O 3.56Å; V336-L355 VanDerWaalsContact CA-O 3.32Å; V336-L355 WeakPolarHBondContact CA-O 3.24Å; V336-L355 HydrophobicContact CG1-CD2 4.35Å; V336-L355 HydrophobicContact CG1-CG 4.43Å; V336-L355 HydrophobicContact CG2-CD2 4.48Å; N337-L355 PolarHBondContact N-O 3.39Å; L355-I357 HydrophobicContact CD1-CG1 4.44Å; L355-I357 HydrophobicContact CD2-CD1 4.33Å; L355-I357 HydrophobicContact CG-CD1 4.5Å; L355-I357 HydrophobicContact CG-CG1 4.24Å; L355-Q373 HydrophobicContact CD1-CG 4.16Å; L355-Q373 HydrophobicContact CD2-CG 4.26Å; L355-F377 HydrophobicContact CB-CD1 3.92Å; L355-F377 HydrophobicContact CB-CD2 3.75Å; L355-F377 HydrophobicContact CB-CE1 3.79Å; L355-F377 HydrophobicContact CB-CE2 3.62Å; L355-F377 HydrophobicContact CB-CG 3.88Å; L355-F377 HydrophobicContact CB-CZ 3.64Å; L355-F377 HydrophobicContact CD2-CB 3.62Å; L355-F377 HydrophobicContact CD2-CD1 4.11Å; L355-F377 HydrophobicContact CD2-CD2 4.15Å; L355-F377 HydrophobicContact CD2-CG 3.72Å; L355-F377 HydrophobicContact CG-CG 4.44Å
356	Q	98.4	Very high	90.5	Very high	70 Å²	70	69 Å²	69	33%	0.327	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	132.4	172.4	-167.4	172.4	9.1	0	0	110.9	N337 T339 R340 L342	N337-Q356 HydrophobicContact CB-CB 4.46Å; N337-Q356 HydrophobicContact CB-CG 4.22Å; N337-Q356 WeakPolarHBondContact O-CA 3.42Å; T339-Q356 WeakPolarHBondContact O-CG 3.45Å; T339-Q356 PolarHBondContact O-NE2 2.84Å; R340-Q356 PolarHBondContact O-NE2 3.42Å; L342-Q356 PolarHBondContact O-NE2 3.01Å
357	I	98.3	Very high	90.4	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	32%	0.323	C	S	.	.			trans	-116.3	97.2	174.3	-64.4	170.6	0	0	0	106.4	V336 N337 V338 T339 L355 I359 L367 H370 A374	V336-I357 HydrophobicContact CG1-CD1 3.86Å; N337-I357 PolarHBondContact O-N 3.37Å; V338-I357 CarbonylContact C-O 3.55Å; V338-I357 HydrophobicContact CG1-CB 4.25Å; V338-I357 HydrophobicContact CG1-CG2 4.14Å; T339-I357 PolarHBondContact N-O 3.3Å; L355-I357 HydrophobicContact CD1-CG1 4.44Å; L355-I357 HydrophobicContact CD2-CD1 4.33Å; L355-I357 HydrophobicContact CG-CD1 4.5Å; L355-I357 HydrophobicContact CG-CG1 4.24Å; I357-I359 VanDerWaalsContact C-N 3.26Å; I357-I359 HydrophobicContact CG2-CB 4.33Å; I357-I359 HydrophobicContact CG2-CG1 3.73Å; I357-I359 PolarHBondContact O-N 3.45Å; I357-L367 HydrophobicContact CG2-CD1 3.81Å; I357-H370 HydrophobicContact CD1-CB 4.17Å; I357-H370 HydrophobicContact CG1-CB 4.38Å; I357-H370 HydrophobicContact CG2-CB 3.78Å; I357-A374 HydrophobicContact CD1-CB 3.85Å
358	P	96.6	Very high	90.6	Very high	57 Å²	57	62.5 Å²	62.5	37%	0.37	31%	0.308	S	S	.	.			trans	-78.9	72.8	-166.7	32.1	-36.5	0	0	0	112	R340	R340-P358 HydrophobicContact CB-CB 4.32Å; R340-P358 HydrophobicContact CG-CB 4.3Å; R340-P358 PolarHBondContact NH1-O 2.82Å; R340-P358 PolarHBondContact NH2-O 3.33Å; R340-P358 VanDerWaalsContact NH2-O 3.1Å
359	I	92.1	Very high	90.7	Very high	10 Å²	10	56.7 Å²	56.7	5%	0.051	29%	0.292	C	S	.	.			trans	-121.3	138.6	-174.3	-70.9	-70.2	0	0	0	110.5	I357 Q365 L367 R398 F435	I357-I359 VanDerWaalsContact C-N 3.26Å; I357-I359 HydrophobicContact CG2-CB 4.33Å; I357-I359 HydrophobicContact CG2-CG1 3.73Å; I357-I359 PolarHBondContact O-N 3.45Å; I359-Q365 HydrophobicContact CD1-CB 4.21Å; I359-Q365 HydrophobicContact CG2-CB 3.92Å; I359-Q365 HydrophobicContact CG2-CG 4.37Å; I359-L367 HydrophobicContact CB-CD1 4.34Å; I359-L367 HydrophobicContact CG1-CD1 4.11Å; I359-L367 HydrophobicContact CG2-CB 4.34Å; I359-L367 HydrophobicContact CG2-CD1 4.2Å; I359-R398 HydrophobicContact CG2-CG 4.25Å; I359-R398 WeakPolarHBondContact O-CD 3.35Å; I359-R398 PolarHBondContact O-NH1 3Å; I359-F435 HydrophobicContact CG2-CE1 4.4Å; I359-F435 HydrophobicContact CG2-CZ 3.95Å
360	D	85.1	Confident	90.9	Very high	35 Å²	35	57.3 Å²	57.3	19%	0.187	29%	0.294	C	S	.	.			trans	-93.3	163.3	175.5	-59	-56.4	0	0	0	111.7	R340 N362 Q365	R340-D360 IonicContact CZ-OD2 3.09Å; R340-D360 IonicContact NE-OD1 2.67Å; R340-D360 IonicContact NE-OD2 2.65Å; R340-D360 PolarHBondContact NE-OD2 3.49Å; R340-D360 IonicContact NH2-OD2 2.71Å; R340-D360 PolarHBondContact NH2-OD2 3.16Å; D360-N362 WeakPolarHBondContact CB-ND2 3.32Å; D360-N362 PolarHBondContact O-N 3.4Å; D360-N362 VanDerWaalsContact O-N 3.13Å; D360-Q365 HydrophobicContact CB-CG 4.13Å; D360-Q365 WeakPolarHBondContact O-CG 3.46Å
361	D	84.2	Confident	91.1	Very high	38 Å²	38	49.1 Å²	49.1	20%	0.203	25%	0.25	C	S	.	.	S	Bend	trans	-86.4	28.5	-169.8	-127.7	-45	0	0	0	114.6	S397 R398 N432	D361-S397 WeakPolarHBondContact OD1-CB 3.14Å; D361-S397 PolarHBondContact OD1-OG 2.89Å; D361-R398 HydrophobicContact CB-CG 4.48Å; D361-R398 IonicContact OD1-NE 2.79Å; D361-R398 IonicContact OD2-CZ 3.75Å; D361-R398 VanDerWaalsContact OD2-CZ 3.28Å; D361-R398 IonicContact OD2-NE 3.06Å; D361-R398 PolarHBondContact OD2-NE 3.34Å; D361-R398 IonicContact OD2-NH2 3.82Å; D361-R398 PolarHBondContact OD2-NH2 3.31Å; D361-N432 VanDerWaalsContact C-ND2 3.27Å; D361-N432 PolarHBondContact O-ND2 3.3Å
362	N	74.5	Confident	91.2	Very high	45 Å²	45	45.9 Å²	45.9	24%	0.241	25%	0.25	C	C	.	.	S	Bend	trans	-123.9	168.3	-170.2	71.5	70.2	0	0	0	114	D360 S364 Q365	D360-N362 WeakPolarHBondContact CB-ND2 3.32Å; D360-N362 PolarHBondContact O-N 3.4Å; D360-N362 VanDerWaalsContact O-N 3.13Å; N362-S364 PolarHBondContact O-N 2.86Å; N362-S364 VanDerWaalsContact O-N 3.14Å; N362-S364 WeakPolarHBondContact OD1-CB 3.28Å; N362-S364 PolarHBondContact OD1-N 3.11Å; N362-S364 PolarHBondContact OD1-OG 2.96Å; N362-Q365 PolarHBondContact O-N 3.43Å
363	W	68.2	Low	91.2	Very high	129 Å²	129	49.9 Å²	49.9	49%	0.489	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.7	-174.6	59	-97.2	0	0	0	115.8	Q365 D434	W363-Q365 PolarHBondContact O-N 3.13Å; W363-D434 VanDerWaalsContact CA-CG 3.48Å; W363-D434 WeakPolarHBondContact CA-OD2 3.36Å; W363-D434 HydrophobicContact CB-CB 4.43Å; W363-D434 VanDerWaalsContact CB-CG 3.45Å; W363-D434 WeakPolarHBondContact CB-OD2 3.37Å
364	S	70.9	Confident	91.2	Very high	65 Å²	65	45.6 Å²	45.6	46%	0.455	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-6.1	-175.8	71.9	0	0	0	0	114.2	N362	N362-S364 PolarHBondContact O-N 2.86Å; N362-S364 VanDerWaalsContact O-N 3.14Å; N362-S364 WeakPolarHBondContact OD1-CB 3.28Å; N362-S364 PolarHBondContact OD1-N 3.11Å; N362-S364 PolarHBondContact OD1-OG 2.96Å
365	Q	83.6	Confident	91.2	Very high	30 Å²	30	44.5 Å²	44.5	14%	0.14	25%	0.245	C	C	.	.			trans	-104	124.3	-163.2	-57.6	-69.6	-76.5	0	0	112.2	I359 D360 N362 W363 L367 F435 Q438	I359-Q365 HydrophobicContact CD1-CB 4.21Å; I359-Q365 HydrophobicContact CG2-CB 3.92Å; I359-Q365 HydrophobicContact CG2-CG 4.37Å; D360-Q365 HydrophobicContact CB-CG 4.13Å; D360-Q365 WeakPolarHBondContact O-CG 3.46Å; N362-Q365 PolarHBondContact O-N 3.43Å; W363-Q365 PolarHBondContact O-N 3.13Å; Q365-L367 PolarHBondContact O-N 3.09Å; Q365-F435 HydrophobicContact CB-CE1 4.19Å; Q365-F435 HydrophobicContact CB-CZ 4.37Å; Q365-Q438 PolarHBondContact O-NE2 2.97Å
366	N	90.5	Very high	91.2	Very high	93 Å²	93	50.1 Å²	50.1	50%	0.497	27%	0.271	S	S	.	.			trans	-88.8	91.8	172.3	-175.4	-7.3	0	0	0	110.3	A368 A369	N366-A368 PolarHBondContact OD1-N 3.06Å; N366-A369 PolarHBondContact OD1-N 3.2Å
367	L	95.2	Very high	91.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.259	C	S	.	.			trans	-79.4	-28	174.9	-176.3	53.7	0	0	0	111.9	V338 I357 I359 Q365 A369 H370 F371 R398 T401 V402 F435	V338-L367 HydrophobicContact CG1-CD1 3.72Å; V338-L367 HydrophobicContact CG1-CD2 4.35Å; I357-L367 HydrophobicContact CG2-CD1 3.81Å; I359-L367 HydrophobicContact CB-CD1 4.34Å; I359-L367 HydrophobicContact CG1-CD1 4.11Å; I359-L367 HydrophobicContact CG2-CB 4.34Å; I359-L367 HydrophobicContact CG2-CD1 4.2Å; Q365-L367 PolarHBondContact O-N 3.09Å; L367-A369 VanDerWaalsContact C-N 3.28Å; L367-A369 PolarHBondContact O-N 3.4Å; L367-H370 PolarHBondContact O-N 3.48Å; L367-F371 HydrophobicContact CG-CE1 4.09Å; L367-R398 HydrophobicContact CD2-CG 4.41Å; L367-T401 HydrophobicContact CD2-CG2 3.95Å; L367-V402 HydrophobicContact CD1-CG2 4.02Å; L367-V402 HydrophobicContact CD2-CG2 4.27Å; L367-V402 HydrophobicContact CG-CG2 4.3Å; L367-F435 HydrophobicContact CB-CD1 3.82Å; L367-F435 HydrophobicContact CB-CE1 3.57Å; L367-F435 HydrophobicContact CB-CZ 4.29Å; L367-F435 HydrophobicContact CD2-CD1 4.13Å; L367-F435 HydrophobicContact CD2-CD2 4.26Å; L367-F435 HydrophobicContact CD2-CE1 4.02Å; L367-F435 HydrophobicContact CD2-CE2 4.18Å; L367-F435 HydrophobicContact CD2-CG 4.27Å; L367-F435 HydrophobicContact CD2-CZ 4.06Å; L367-F435 HydrophobicContact CG-CE1 4.47Å
368	A	95.4	Very high	91.2	Very high	26 Å²	26	47.6 Å²	47.6	22%	0.215	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-60.1	-33.6	178.1	0	0	0	0	0	114	N366 H370 F371 Q438	N366-A368 PolarHBondContact OD1-N 3.06Å; A368-H370 PolarHBondContact O-N 3.31Å; A368-H370 VanDerWaalsContact O-N 3.1Å; A368-F371 HydrophobicContact CB-CD2 3.91Å; A368-F371 HydrophobicContact CB-CE2 3.65Å; A368-F371 HydrophobicContact CB-CZ 4.1Å; A368-F371 WeakPolarHBondContact O-CB 3.45Å; A368-F371 PolarHBondContact O-N 3.39Å; A368-Q438 HydrophobicContact CB-CB 4.01Å; A368-Q438 HydrophobicContact CB-CG 4.2Å
369	A	96.3	Very high	91.3	Very high	65 Å²	65	47.4 Å²	47.4	54%	0.537	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-55.3	-26	173	0	0	0	0	0	113.4	N366 L367	N366-A369 PolarHBondContact OD1-N 3.2Å; L367-A369 VanDerWaalsContact C-N 3.28Å; L367-A369 PolarHBondContact O-N 3.4Å
370	H	97.9	Very high	91.6	Very high	49 Å²	49	48.9 Å²	48.9	23%	0.227	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-94.9	-6.3	179.3	-61.5	-79.9	0	0	0	114	I357 L367 A368 Q373 A374	I357-H370 HydrophobicContact CD1-CB 4.17Å; I357-H370 HydrophobicContact CG1-CB 4.38Å; I357-H370 HydrophobicContact CG2-CB 3.78Å; L367-H370 PolarHBondContact O-N 3.48Å; A368-H370 PolarHBondContact O-N 3.31Å; A368-H370 VanDerWaalsContact O-N 3.1Å; H370-Q373 PolarHBondContact O-N 2.87Å; H370-A374 PolarHBondContact O-N 3.14Å
371	F	97.9	Very high	92.2	Very high	1 Å²	1	47.2 Å²	47.2	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-55.8	-45.8	-179.1	-66	-18.3	0	0	0	113.2	L367 A368 Q373 A374 I375 T401 A405 L439 F442	L367-F371 HydrophobicContact CG-CE1 4.09Å; A368-F371 HydrophobicContact CB-CD2 3.91Å; A368-F371 HydrophobicContact CB-CE2 3.65Å; A368-F371 HydrophobicContact CB-CZ 4.1Å; A368-F371 WeakPolarHBondContact O-CB 3.45Å; A368-F371 PolarHBondContact O-N 3.39Å; F371-Q373 VanDerWaalsContact C-N 3.32Å; F371-Q373 PolarHBondContact O-N 3.14Å; F371-A374 PolarHBondContact O-N 3.45Å; F371-I375 HydrophobicContact CB-CD1 4.25Å; F371-I375 WeakPolarHBondContact O-CB 3.5Å; F371-I375 WeakPolarHBondContact O-CD1 3.26Å; F371-I375 WeakPolarHBondContact O-CG1 3.41Å; F371-I375 PolarHBondContact O-N 2.62Å; F371-T401 HydrophobicContact CE1-CG2 4.02Å; F371-T401 HydrophobicContact CZ-CG2 3.84Å; F371-A405 HydrophobicContact CB-CB 4.45Å; F371-A405 HydrophobicContact CD1-CB 3.76Å; F371-A405 HydrophobicContact CD2-CB 3.7Å; F371-A405 HydrophobicContact CE1-CB 3.8Å; F371-A405 HydrophobicContact CE2-CB 3.76Å; F371-A405 HydrophobicContact CG-CB 3.72Å; F371-A405 HydrophobicContact CZ-CB 3.81Å; F371-L439 HydrophobicContact CE2-CD2 4.01Å; F371-L439 HydrophobicContact CZ-CD2 3.86Å; F371-L439 HydrophobicContact CZ-CG 4.36Å; F371-F442 HydrophobicContact CB-CE2 4.3Å; F371-F442 HydrophobicContact CD2-CB 4.15Å; F371-F442 HydrophobicContact CD2-CD1 4.05Å; F371-F442 AromaticContact CD2-CD2 3.7Å; F371-F442 HydrophobicContact CD2-CD2 3.7Å; F371-F442 HydrophobicContact CD2-CE1 4.37Å; F371-F442 HydrophobicContact CD2-CE2 4.03Å; F371-F442 AromaticContact CD2-CG 3.69Å; F371-F442 HydrophobicContact CD2-CG 3.69Å; F371-F442 HydrophobicContact CD2-CZ 4.35Å; F371-F442 HydrophobicContact CE2-CB 3.95Å; F371-F442 HydrophobicContact CE2-CD1 4.26Å; F371-F442 HydrophobicContact CE2-CD2 4.37Å; F371-F442 AromaticContact CE2-CG 3.95Å; F371-F442 HydrophobicContact CE2-CG 3.95Å
372	P	96.9	Very high	92.9	Very high	89 Å²	89	47.8 Å²	47.8	58%	0.578	25%	0.252	S	S	*	.	H	α-helix	trans	-61.1	-38.9	-179.7	-23.6	35.2	0	0	0	113.3	H376	P372-H376 WeakPolarHBondContact O-CB 3.31Å; P372-H376 PolarHBondContact O-N 3.43Å; P372-H376 VanDerWaalsContact O-N 3.14Å
373	Q	98.1	Very high	94	Very high	103 Å²	103	50.1 Å²	50.1	48%	0.481	27%	0.272	S	S	.	.	H	α-helix	trans	-67.8	-44.5	177.6	-173.4	-177.2	13.7	0	0	111.3	L355 H370 F371 F377	L355-Q373 HydrophobicContact CD1-CG 4.16Å; L355-Q373 HydrophobicContact CD2-CG 4.26Å; H370-Q373 PolarHBondContact O-N 2.87Å; F371-Q373 VanDerWaalsContact C-N 3.32Å; F371-Q373 PolarHBondContact O-N 3.14Å; Q373-F377 WeakPolarHBondContact O-CB 3.26Å; Q373-F377 PolarHBondContact O-N 3.04Å
374	A	98.6	Very high	95.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-43.4	178.1	0	0	0	0	0	112.2	I357 H370 F371 F377 I378 V402	I357-A374 HydrophobicContact CD1-CB 3.85Å; H370-A374 PolarHBondContact O-N 3.14Å; F371-A374 PolarHBondContact O-N 3.45Å; A374-F377 PolarHBondContact O-N 2.79Å; A374-I378 WeakPolarHBondContact O-CD1 3.4Å; A374-I378 VanDerWaalsContact O-CG1 3.26Å; A374-I378 WeakPolarHBondContact O-CG1 3.34Å; A374-I378 PolarHBondContact O-N 3.17Å; A374-V402 HydrophobicContact CB-CG1 3.63Å
375	I	98.4	Very high	96.7	Very high	12 Å²	12	53.3 Å²	53.3	6%	0.062	28%	0.281	C	S	.	.	H	α-helix	trans	-59.8	-51.2	178.3	-70.3	162	0	0	0	110.4	F371 F377 I378 D379 Y406 H409 F442	F371-I375 HydrophobicContact CB-CD1 4.25Å; F371-I375 WeakPolarHBondContact O-CB 3.5Å; F371-I375 WeakPolarHBondContact O-CD1 3.26Å; F371-I375 WeakPolarHBondContact O-CG1 3.41Å; F371-I375 PolarHBondContact O-N 2.62Å; I375-F377 VanDerWaalsContact C-N 3.31Å; I375-F377 PolarHBondContact O-N 2.72Å; I375-I378 PolarHBondContact O-N 2.69Å; I375-D379 PolarHBondContact O-N 3.11Å; I375-Y406 HydrophobicContact CB-CD2 4.23Å; I375-Y406 HydrophobicContact CG1-CD2 4.06Å; I375-Y406 HydrophobicContact CG2-CD2 4.08Å; I375-Y406 HydrophobicContact CG2-CE2 4.28Å; I375-H409 HydrophobicContact CD1-CB 3.83Å; I375-F442 HydrophobicContact CD1-CZ 3.89Å
376	H	98.3	Very high	97.3	Very high	136 Å²	136	52.8 Å²	52.8	63%	0.63	28%	0.28	S	S	*	.	H	α-helix	trans	-58.4	-41.7	179.3	-176.9	72.1	0	0	0	112.7	P372 D379 E380	P372-H376 WeakPolarHBondContact O-CB 3.31Å; P372-H376 PolarHBondContact O-N 3.43Å; P372-H376 VanDerWaalsContact O-N 3.14Å; H376-D379 PolarHBondContact O-N 2.91Å; H376-E380 WeakPolarHBondContact O-CB 3.44Å; H376-E380 PolarHBondContact O-N 3.11Å
377	F	98.7	Very high	97.7	Very high	16 Å²	16	48.4 Å²	48.4	7%	0.07	26%	0.257	C	S	.	.	H	α-helix	trans	-68.2	-36.8	178.4	-173	-90.7	0	0	0	113	Y334 V336 K353 Y354 L355 Q373 A374 I375 A381	Y334-F377 HydrophobicContact CD1-CD1 4.08Å; Y334-F377 HydrophobicContact CD1-CD2 4.41Å; Y334-F377 AromaticContact CD1-CE1 3.67Å; Y334-F377 HydrophobicContact CD1-CE1 3.67Å; Y334-F377 HydrophobicContact CD1-CE2 4.03Å; Y334-F377 HydrophobicContact CD1-CG 4.45Å; Y334-F377 AromaticContact CD1-CZ 3.65Å; Y334-F377 HydrophobicContact CD1-CZ 3.65Å; Y334-F377 HydrophobicContact CE1-CE2 4.43Å; Y334-F377 HydrophobicContact CE1-CZ 4.45Å; Y334-F377 HydrophobicContact CG-CE1 4.28Å; Y334-F377 HydrophobicContact CG-CZ 4.39Å; V336-F377 HydrophobicContact CG2-CD1 3.49Å; V336-F377 VanDerWaalsContact CG2-CD1 3.49Å; V336-F377 HydrophobicContact CG2-CE1 3.71Å; K353-F377 HydrophobicContact CB-CZ 4.31Å; K353-F377 HydrophobicContact CD-CE2 3.77Å; K353-F377 HydrophobicContact CD-CZ 4.33Å; K353-F377 HydrophobicContact CG-CE2 3.91Å; K353-F377 HydrophobicContact CG-CZ 4.15Å; Y354-F377 VanDerWaalsContact C-CZ 3.5Å; L355-F377 HydrophobicContact CB-CD1 3.92Å; L355-F377 HydrophobicContact CB-CD2 3.75Å; L355-F377 HydrophobicContact CB-CE1 3.79Å; L355-F377 HydrophobicContact CB-CE2 3.62Å; L355-F377 HydrophobicContact CB-CG 3.88Å; L355-F377 HydrophobicContact CB-CZ 3.64Å; L355-F377 HydrophobicContact CD2-CB 3.62Å; L355-F377 HydrophobicContact CD2-CD1 4.11Å; L355-F377 HydrophobicContact CD2-CD2 4.15Å; L355-F377 HydrophobicContact CD2-CG 3.72Å; L355-F377 HydrophobicContact CG-CG 4.44Å; Q373-F377 WeakPolarHBondContact O-CB 3.26Å; Q373-F377 PolarHBondContact O-N 3.04Å; A374-F377 PolarHBondContact O-N 2.79Å; I375-F377 VanDerWaalsContact C-N 3.31Å; I375-F377 PolarHBondContact O-N 2.72Å; F377-A381 PolarHBondContact O-N 3.04Å
378	I	98.7	Very high	97.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67.1	-43.8	173.9	-68.8	164.6	0	0	0	110.3	L313 V336 A374 I375 E380 A381 R382 V388 V390 V402 Y406	L313-I378 HydrophobicContact CD1-CG2 4.09Å; V336-I378 HydrophobicContact CG2-CG1 4.39Å; A374-I378 WeakPolarHBondContact O-CD1 3.4Å; A374-I378 VanDerWaalsContact O-CG1 3.26Å; A374-I378 WeakPolarHBondContact O-CG1 3.34Å; A374-I378 PolarHBondContact O-N 3.17Å; I375-I378 PolarHBondContact O-N 2.69Å; I378-E380 VanDerWaalsContact C-N 3.35Å; I378-E380 PolarHBondContact O-N 2.84Å; I378-A381 WeakPolarHBondContact O-CB 3.28Å; I378-A381 PolarHBondContact O-N 3.07Å; I378-R382 HydrophobicContact CG2-CG 4.29Å; I378-R382 VanDerWaalsContact O-CG 3.3Å; I378-R382 WeakPolarHBondContact O-CG 3.42Å; I378-R382 PolarHBondContact O-N 2.8Å; I378-V388 HydrophobicContact CB-CG1 4.44Å; I378-V388 HydrophobicContact CG1-CG1 4.41Å; I378-V388 HydrophobicContact CG1-CG2 4.15Å; I378-V388 HydrophobicContact CG2-CG1 3.97Å; I378-V390 HydrophobicContact CD1-CG2 3.87Å; I378-V390 HydrophobicContact CG1-CG2 4.29Å; I378-V402 HydrophobicContact CD1-CG1 4.29Å; I378-Y406 HydrophobicContact CB-CD2 3.92Å; I378-Y406 HydrophobicContact CB-CE2 3.81Å; I378-Y406 HydrophobicContact CD1-CD2 4.09Å; I378-Y406 HydrophobicContact CD1-CG 4.08Å; I378-Y406 HydrophobicContact CG2-CD1 3.99Å; I378-Y406 HydrophobicContact CG2-CD2 3.68Å; I378-Y406 HydrophobicContact CG2-CE1 3.69Å; I378-Y406 HydrophobicContact CG2-CE2 3.36Å; I378-Y406 HydrophobicContact CG2-CG 3.98Å
379	D	98.2	Very high	98	Very high	54 Å²	54	47.1 Å²	47.1	29%	0.289	25%	0.246	S	C	.	.	H	α-helix	trans	-65.6	-34.8	176.7	-74.9	-34.7	0	0	0	112.7	I375 H376 A381 R382 S383 Y406	I375-D379 PolarHBondContact O-N 3.11Å; H376-D379 PolarHBondContact O-N 2.91Å; D379-A381 VanDerWaalsContact C-N 3.31Å; D379-A381 PolarHBondContact O-N 3.18Å; D379-R382 PolarHBondContact O-N 2.58Å; D379-S383 VanDerWaalsContact O-CB 3.22Å; D379-S383 WeakPolarHBondContact O-CB 3.49Å; D379-S383 PolarHBondContact O-N 3.03Å; D379-S383 PolarHBondContact O-OG 2.96Å; D379-Y406 VanDerWaalsContact OD1-CE2 3.27Å; D379-Y406 WeakPolarHBondContact OD1-CE2 3.3Å; D379-Y406 VanDerWaalsContact OD1-CZ 3.31Å; D379-Y406 PolarHBondContact OD1-OH 3Å
380	E	98.4	Very high	98.1	Very high	41 Å²	41	44 Å²	44	19%	0.192	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-38.4	172.9	-162.9	-155.5	146.4	0	0	112.2	Y334 K353 H376 I378 S383 K384	Y334-E380 HydrophobicContact CE1-CB 4.15Å; Y334-E380 HydrophobicContact CE1-CG 4.15Å; Y334-E380 VanDerWaalsContact OH-CD 3.3Å; Y334-E380 PolarHBondContact OH-OE1 2.87Å; K353-E380 IonicContact NZ-OE1 2.77Å; K353-E380 PolarHBondContact NZ-OE1 3.39Å; K353-E380 IonicContact NZ-OE2 3.01Å; K353-E380 PolarHBondContact NZ-OE2 3.39Å; H376-E380 WeakPolarHBondContact O-CB 3.44Å; H376-E380 PolarHBondContact O-N 3.11Å; I378-E380 VanDerWaalsContact C-N 3.35Å; I378-E380 PolarHBondContact O-N 2.84Å; E380-S383 PolarHBondContact O-OG 2.71Å; E380-K384 WeakPolarHBondContact O-CD 3.36Å; E380-K384 VanDerWaalsContact O-CG 3.31Å; E380-K384 WeakPolarHBondContact O-CG 3.46Å; E380-K384 IonicContact OE1-NZ 2.76Å; E380-K384 PolarHBondContact OE1-NZ 2.78Å
381	A	98.4	Very high	98.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-70.5	-50.7	176.3	0	0	0	0	0	112	Y334 F377 I378 D379 K384 K385 C386 V388	Y334-A381 HydrophobicContact CD1-CB 3.66Å; Y334-A381 HydrophobicContact CD2-CB 3.6Å; Y334-A381 HydrophobicContact CE1-CB 4.2Å; Y334-A381 HydrophobicContact CE2-CB 4.17Å; Y334-A381 HydrophobicContact CG-CB 3.35Å; F377-A381 PolarHBondContact O-N 3.04Å; I378-A381 WeakPolarHBondContact O-CB 3.28Å; I378-A381 PolarHBondContact O-N 3.07Å; D379-A381 VanDerWaalsContact C-N 3.31Å; D379-A381 PolarHBondContact O-N 3.18Å; A381-K384 CarbonylContact O-C 3.53Å; A381-K384 PolarHBondContact O-N 3.17Å; A381-K385 PolarHBondContact O-N 3.27Å; A381-C386 CarbonylContact C-O 3.59Å; A381-C386 PolarHBondContact O-N 3.34Å; A381-C386 VanDerWaalsContact O-N 3.07Å; A381-V388 HydrophobicContact CB-CB 3.64Å; A381-V388 HydrophobicContact CB-CG1 3.87Å; A381-V388 HydrophobicContact CB-CG2 4.49Å
382	R	98	Very high	98.1	Very high	50 Å²	50	42 Å²	42	19%	0.189	21%	0.211	C	C	.	.	H	α-helix	trans	-70.2	-35.9	-172.5	-64.3	-176.7	73	-123.8	-6.2	112.3	P311 F312 I378 D379 K384 K385 V388 Y406	P311-R382 PolarHBondContact O-NE 3.35Å; P311-R382 PolarHBondContact O-NH2 2.97Å; F312-R382 HydrophobicContact CB-CG 4.12Å; I378-R382 HydrophobicContact CG2-CG 4.29Å; I378-R382 VanDerWaalsContact O-CG 3.3Å; I378-R382 WeakPolarHBondContact O-CG 3.42Å; I378-R382 PolarHBondContact O-N 2.8Å; D379-R382 PolarHBondContact O-N 2.58Å; R382-K384 PolarHBondContact O-N 3.44Å; R382-K385 PolarHBondContact O-N 3.04Å; R382-V388 HydrophobicContact CG-CG1 4.11Å; R382-Y406 WeakPolarHBondContact CD-OH 3.23Å; R382-Y406 PolarHBondContact NH1-OH 3.18Å
383	S	97.8	Very high	97.8	Very high	93 Å²	93	42.5 Å²	42.5	65%	0.65	21%	0.209	S	C	*	.	H	α-helix	trans	-61.1	-32.8	172.6	55.9	0	0	0	0	112.7	D379 E380 K385	D379-S383 VanDerWaalsContact O-CB 3.22Å; D379-S383 WeakPolarHBondContact O-CB 3.49Å; D379-S383 PolarHBondContact O-N 3.03Å; D379-S383 PolarHBondContact O-OG 2.96Å; E380-S383 PolarHBondContact O-OG 2.71Å; S383-K385 VanDerWaalsContact C-N 3.28Å; S383-K385 PolarHBondContact O-N 3.12Å
384	K	97.9	Very high	97.3	Very high	113 Å²	113	40 Å²	40	49%	0.491	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	3.3	173.9	-61.8	175.9	-164.9	178.2	0	113.8	Y334 E380 A381 R382 C386	Y334-K384 PolarHBondContact OH-NZ 3.44Å; E380-K384 WeakPolarHBondContact O-CD 3.36Å; E380-K384 VanDerWaalsContact O-CG 3.31Å; E380-K384 WeakPolarHBondContact O-CG 3.46Å; E380-K384 IonicContact OE1-NZ 2.76Å; E380-K384 PolarHBondContact OE1-NZ 2.78Å; A381-K384 CarbonylContact O-C 3.53Å; A381-K384 PolarHBondContact O-N 3.17Å; R382-K384 PolarHBondContact O-N 3.44Å; K384-C386 PolarHBondContact O-N 3.23Å
385	K	97.4	Very high	97	Very high	149 Å²	149	40 Å²	40	65%	0.648	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	33.6	-173.9	-57.2	-179.9	-177.2	177.4	0	112.8	F312 N331 A381 R382 S383	F312-K385 HydrophobicContact CE1-CB 3.98Å; F312-K385 WeakPolarHBondContact CE1-O 3.26Å; F312-K385 HydrophobicContact CE2-CB 4.16Å; F312-K385 HydrophobicContact CE2-CG 4.16Å; F312-K385 HydrophobicContact CZ-CB 3.73Å; F312-K385 HydrophobicContact CZ-CG 4.07Å; N331-K385 PolarHBondContact ND2-O 2.81Å; A381-K385 PolarHBondContact O-N 3.27Å; R382-K385 PolarHBondContact O-N 3.04Å; S383-K385 VanDerWaalsContact C-N 3.28Å; S383-K385 PolarHBondContact O-N 3.12Å
386	C	97	Very high	96.5	Very high	19 Å²	19	42.2 Å²	42.2	13%	0.128	22%	0.217	C	C	.	.			trans	-104.4	141.5	173.8	-63.8	0	0	0	0	109.6	K333 Y334 A381 K384	K333-C386 HydrophobicContact CB-CB 4.23Å; K333-C386 HydrophobicContact CD-CB 4.39Å; Y334-C386 HydrophobicContact CD2-CB 4.36Å; A381-C386 CarbonylContact C-O 3.59Å; A381-C386 PolarHBondContact O-N 3.34Å; A381-C386 VanDerWaalsContact O-N 3.07Å; K384-C386 PolarHBondContact O-N 3.23Å
387	G	98.4	Very high	96.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	139.4	176.3	0	0	0	0	0	111.3	F312 N331 I332 K333 Y334	F312-G387 WeakPolarHBondContact O-CA 3.47Å; N331-G387 PolarHBondContact O-N 3.2Å; I332-G387 WeakPolarHBondContact CA-O 3.44Å; K333-G387 PolarHBondContact N-O 3.26Å; Y334-G387 PolarHBondContact N-O 2.88Å
388	V	98.8	Very high	96.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128	167.1	51.1	0	0	0	0	110.6	F312 L313 Y314 Y334 V336 I378 A381 R382	F312-V388 WeakPolarHBondContact O-CG1 3.37Å; F312-V388 PolarHBondContact O-N 3.34Å; L313-V388 HydrophobicContact CD1-CG1 3.94Å; Y314-V388 PolarHBondContact N-O 2.9Å; Y334-V388 CarbonylContact O-C 3.13Å; Y334-V388 VanDerWaalsContact O-CA 3.24Å; Y334-V388 WeakPolarHBondContact O-CA 3.47Å; V336-V388 HydrophobicContact CG2-CG2 4.05Å; I378-V388 HydrophobicContact CB-CG1 4.44Å; I378-V388 HydrophobicContact CG1-CG1 4.41Å; I378-V388 HydrophobicContact CG1-CG2 4.15Å; I378-V388 HydrophobicContact CG2-CG1 3.97Å; A381-V388 HydrophobicContact CB-CB 3.64Å; A381-V388 HydrophobicContact CB-CG1 3.87Å; A381-V388 HydrophobicContact CB-CG2 4.49Å; R382-V388 HydrophobicContact CG-CG1 4.11Å
389	L	98.7	Very high	96.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	114.9	174.9	176.6	62.2	0	0	0	110.2	P306 Y314 N320 A321 L327 I332 Y334 I335 V336 H391	P306-L389 HydrophobicContact CB-CD1 3.72Å; Y314-L389 WeakPolarHBondContact O-CA 3.44Å; N320-L389 HydrophobicContact CB-CD2 4.3Å; A321-L389 HydrophobicContact CB-CD2 3.94Å; L327-L389 HydrophobicContact CD2-CD2 4.03Å; I332-L389 HydrophobicContact CD1-CB 4.26Å; I332-L389 HydrophobicContact CG2-CB 3.77Å; Y334-L389 PolarHBondContact O-N 3.24Å; I335-L389 WeakPolarHBondContact CA-O 3.5Å; V336-L389 PolarHBondContact N-O 2.87Å; L389-H391 HydrophobicContact CG-CB 4.37Å
390	V	98.8	Very high	96.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	116.3	168.8	-170.1	0	0	0	0	108.1	L313 Y314 G316 V336 V338 I378 V402	L313-V390 HydrophobicContact CD1-CG2 3.82Å; Y314-V390 PolarHBondContact O-N 3.1Å; G316-V390 PolarHBondContact N-O 2.95Å; V336-V390 HydrophobicContact CB-CB 4.47Å; V336-V390 HydrophobicContact CB-CG1 4.25Å; V336-V390 HydrophobicContact CB-CG2 4.28Å; V336-V390 HydrophobicContact CG1-CG1 4.41Å; V336-V390 HydrophobicContact CG2-CG2 4.34Å; V338-V390 HydrophobicContact CG2-CG1 4.1Å; I378-V390 HydrophobicContact CD1-CG2 3.87Å; I378-V390 HydrophobicContact CG1-CG2 4.29Å; V390-V402 HydrophobicContact CG1-CB 4.07Å; V390-V402 HydrophobicContact CG1-CG1 3.98Å
391	H	98.4	Very high	96	Very high	5 Å²	5	31.8 Å²	31.8	2%	0.023	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	159.7	-178.5	82.8	99.8	0	0	0	113	G316 A321 V336 N337 V338 L389 S399	G316-H391 WeakPolarHBondContact O-CA 3.39Å; A321-H391 HydrophobicContact CB-CB 4.44Å; V336-H391 PolarHBondContact O-CD2 3.36Å; V336-H391 PolarHBondContact O-N 2.76Å; N337-H391 WeakPolarHBondContact CA-NE2 3.49Å; N337-H391 WeakPolarHBondContact CB-NE2 3.5Å; V338-H391 PolarHBondContact N-O 3.38Å; L389-H391 HydrophobicContact CG-CB 4.37Å; H391-S399 VanDerWaalsContact C-CB 3.48Å
392	C	96.1	Very high	96.1	Very high	1 Å²	1	32 Å²	32	1%	0.007	17%	0.168	C	C	.	.			trans	-133.8	-154.2	160.9	70.9	0	0	0	0	107.8	N317 A318 V338 T339 G395 R398	N317-C392 CarbonylContact C-O 3.27Å; A318-C392 PolarHBondContact N-O 3.45Å; V338-C392 HydrophobicContact CB-CB 4.47Å; V338-C392 WeakPolarHBondContact O-CB 3.39Å; T339-C392 HydrophobicContact CG2-CB 3.95Å; C392-G395 PolarHBondContact SG-N 3.08Å; C392-G395 VanDerWaalsContact SG-N 3.39Å; C392-R398 HydrophobicContact CB-CB 3.74Å
393	L	91.6	Very high	96.1	Very high	101 Å²	101	29.6 Å²	29.6	53%	0.529	16%	0.159	S	C	.	.	S	Bend	trans	-60.9	-62.3	174.9	-180	60.8	0	0	0	112.3	N317 A318 L342	N317-L393 WeakPolarHBondContact CB-O 3.23Å; A318-L393 HydrophobicContact CB-CD1 4.29Å; A318-L393 PolarHBondContact N-O 2.85Å; L342-L393 HydrophobicContact CD1-CB 4.36Å; L342-L393 HydrophobicContact CD1-CD1 4.15Å; L342-L393 HydrophobicContact CD2-CD1 4.35Å
394	A	87.7	Confident	96.1	Very high	51 Å²	51	25.1 Å²	25.1	42%	0.421	13%	0.128	S	C	.	.	S	Bend	trans	-100.8	-12.2	-173	0	0	0	0	0	114.7	I396	A394-I396 VanDerWaalsContact C-N 3.33Å; A394-I396 HydrophobicContact CB-CB 4.45Å; A394-I396 HydrophobicContact CB-CD1 4.02Å; A394-I396 HydrophobicContact CB-CG1 4.18Å
395	G	92.3	Very high	96.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.105	C	C	.	.	S	Bend	trans	70.9	23.3	-174.5	0	0	0	0	0	114.8	G316 C392 K426	G316-G395 WeakPolarHBondContact O-CA 3.3Å; C392-G395 PolarHBondContact SG-N 3.08Å; C392-G395 VanDerWaalsContact SG-N 3.39Å; G395-K426 WeakPolarHBondContact O-CE 3.29Å
396	I	88	Confident	96.2	Very high	58 Å²	58	12.7 Å²	12.7	30%	0.297	7%	0.074	S	C	.	.	S	Bend	trans	-108.6	-31.3	-171.5	-68.6	173.7	0	0	0	113.3	A394 V400 S430	A394-I396 VanDerWaalsContact C-N 3.33Å; A394-I396 HydrophobicContact CB-CB 4.45Å; A394-I396 HydrophobicContact CB-CD1 4.02Å; A394-I396 HydrophobicContact CB-CG1 4.18Å; I396-V400 VanDerWaalsContact C-CG2 3.46Å; I396-V400 VanDerWaalsContact O-CG2 3.26Å; I396-V400 WeakPolarHBondContact O-CG2 3.45Å; I396-S430 CarbonylContact O-C 3.56Å; I396-S430 PolarHBondContact O-N 2.79Å
397	S	91.2	Very high	96.2	Very high	8 Å²	8	11.8 Å²	11.8	6%	0.056	7%	0.068	C	C	.	.	S	Bend	trans	-130.1	-79.6	-169.6	170.4	0	0	0	0	113.8	D361 S399 V400 T401 P431 N432	D361-S397 WeakPolarHBondContact OD1-CB 3.14Å; D361-S397 PolarHBondContact OD1-OG 2.89Å; S397-S399 PolarHBondContact O-N 2.68Å; S397-V400 WeakPolarHBondContact O-CB 3.42Å; S397-V400 PolarHBondContact O-N 2.62Å; S397-T401 PolarHBondContact O-N 3.17Å; S397-T401 PolarHBondContact O-OG1 2.83Å; S397-P431 WeakPolarHBondContact OG-CA 3.24Å; S397-N432 PolarHBondContact OG-N 3.08Å; S397-N432 VanDerWaalsContact OG-N 3.13Å
398	R	96.9	Very high	96.2	Very high	20 Å²	20	11.8 Å²	11.8	8%	0.075	7%	0.068	C	C	.	.	H	α-helix	trans	-48.9	-54.4	-178.6	-82.8	172.4	-69.6	-177.8	-8	114.8	V338 I359 D361 L367 C392 T401 V402 F435	V338-R398 HydrophobicContact CB-CB 4.12Å; V338-R398 HydrophobicContact CG1-CB 3.76Å; V338-R398 HydrophobicContact CG1-CG 4.31Å; V338-R398 VanDerWaalsContact O-CD 3.3Å; V338-R398 WeakPolarHBondContact O-CD 3.45Å; I359-R398 HydrophobicContact CG2-CG 4.25Å; I359-R398 WeakPolarHBondContact O-CD 3.35Å; I359-R398 PolarHBondContact O-NH1 3Å; D361-R398 HydrophobicContact CB-CG 4.48Å; D361-R398 IonicContact OD1-NE 2.79Å; D361-R398 IonicContact OD2-CZ 3.75Å; D361-R398 VanDerWaalsContact OD2-CZ 3.28Å; D361-R398 IonicContact OD2-NE 3.06Å; D361-R398 PolarHBondContact OD2-NE 3.34Å; D361-R398 IonicContact OD2-NH2 3.82Å; D361-R398 PolarHBondContact OD2-NH2 3.31Å; L367-R398 HydrophobicContact CD2-CG 4.41Å; C392-R398 HydrophobicContact CB-CB 3.74Å; R398-T401 WeakPolarHBondContact O-CB 3.08Å; R398-T401 PolarHBondContact O-N 2.92Å; R398-V402 PolarHBondContact O-N 2.86Å; R398-F435 HydrophobicContact CB-CE2 4.5Å; R398-F435 HydrophobicContact CG-CE2 3.51Å; R398-F435 HydrophobicContact CG-CZ 3.91Å
399	S	98.1	Very high	96	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-65.9	-39.8	179.6	50.9	0	0	0	0	113.1	L315 H391 S397 T401 V402 T403	L315-S399 WeakPolarHBondContact CD1-OG 3.45Å; H391-S399 VanDerWaalsContact C-CB 3.48Å; S397-S399 PolarHBondContact O-N 2.68Å; S399-T401 VanDerWaalsContact C-N 3.27Å; S399-T401 PolarHBondContact O-N 2.9Å; S399-V402 PolarHBondContact O-N 2.89Å; S399-T403 PolarHBondContact O-N 2.86Å; S399-T403 PolarHBondContact O-OG1 3.22Å; S399-T403 VanDerWaalsContact O-OG1 3.11Å
400	V	97.5	Very high	95.8	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-57.1	-43.4	174.6	179.9	0	0	0	0	110.8	L315 I396 S397 V402 T403 V404 V422 I429 P431	L315-V400 HydrophobicContact CD1-CG2 4.24Å; L315-V400 HydrophobicContact CD2-CG2 4.13Å; I396-V400 VanDerWaalsContact C-CG2 3.46Å; I396-V400 VanDerWaalsContact O-CG2 3.26Å; I396-V400 WeakPolarHBondContact O-CG2 3.45Å; S397-V400 WeakPolarHBondContact O-CB 3.42Å; S397-V400 PolarHBondContact O-N 2.62Å; V400-V402 VanDerWaalsContact C-N 3.34Å; V400-V402 PolarHBondContact O-N 2.83Å; V400-T403 PolarHBondContact O-N 2.95Å; V400-V404 HydrophobicContact CG1-CG2 4.15Å; V400-V404 WeakPolarHBondContact O-CG2 3.5Å; V400-V404 PolarHBondContact O-N 2.78Å; V400-V422 HydrophobicContact CG1-CG1 4.37Å; V400-I429 HydrophobicContact CB-CG2 4.36Å; V400-I429 HydrophobicContact CG1-CB 3.88Å; V400-I429 HydrophobicContact CG1-CD1 3.8Å; V400-I429 HydrophobicContact CG1-CG1 4.42Å; V400-I429 HydrophobicContact CG1-CG2 3.95Å; V400-I429 HydrophobicContact CG2-CB 3.9Å; V400-I429 HydrophobicContact CG2-CG2 3.43Å; V400-I429 VanDerWaalsContact CG2-CG2 3.43Å; V400-P431 HydrophobicContact CB-CG 4.1Å; V400-P431 HydrophobicContact CG1-CG 3.73Å
401	T	97.8	Very high	95.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.8	-46.2	179.8	-50.8	0	0	0	0	110.9	L367 F371 S397 R398 S399 V404 A405 F435 L439	L367-T401 HydrophobicContact CD2-CG2 3.95Å; F371-T401 HydrophobicContact CE1-CG2 4.02Å; F371-T401 HydrophobicContact CZ-CG2 3.84Å; S397-T401 PolarHBondContact O-N 3.17Å; S397-T401 PolarHBondContact O-OG1 2.83Å; R398-T401 WeakPolarHBondContact O-CB 3.08Å; R398-T401 PolarHBondContact O-N 2.92Å; S399-T401 VanDerWaalsContact C-N 3.27Å; S399-T401 PolarHBondContact O-N 2.9Å; T401-V404 PolarHBondContact O-N 2.95Å; T401-A405 WeakPolarHBondContact O-CB 3.48Å; T401-A405 PolarHBondContact O-N 2.93Å; T401-F435 HydrophobicContact CG2-CB 3.74Å; T401-F435 HydrophobicContact CG2-CG 4.22Å; T401-L439 HydrophobicContact CG2-CD1 3.85Å; T401-L439 HydrophobicContact CG2-CD2 4.27Å; T401-L439 HydrophobicContact CG2-CG 3.89Å
402	V	98.7	Very high	95.4	Very high	3 Å²	3	24 Å²	24	2%	0.018	14%	0.138	C	C	.	.	H	α-helix	trans	-63.9	-42.6	175.6	174.3	0	0	0	0	111.6	V338 L367 A374 I378 V390 R398 S399 V400 A405 Y406	V338-V402 HydrophobicContact CG1-CG2 4.22Å; V338-V402 HydrophobicContact CG2-CG2 3.97Å; L367-V402 HydrophobicContact CD1-CG2 4.02Å; L367-V402 HydrophobicContact CD2-CG2 4.27Å; L367-V402 HydrophobicContact CG-CG2 4.3Å; A374-V402 HydrophobicContact CB-CG1 3.63Å; I378-V402 HydrophobicContact CD1-CG1 4.29Å; V390-V402 HydrophobicContact CG1-CB 4.07Å; V390-V402 HydrophobicContact CG1-CG1 3.98Å; R398-V402 PolarHBondContact O-N 2.86Å; S399-V402 PolarHBondContact O-N 2.89Å; V400-V402 VanDerWaalsContact C-N 3.34Å; V400-V402 PolarHBondContact O-N 2.83Å; V402-A405 PolarHBondContact O-N 2.84Å; V402-Y406 WeakPolarHBondContact O-CB 3.38Å; V402-Y406 PolarHBondContact O-N 2.91Å
403	T	98.7	Very high	95.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-42.9	176	-59.3	0	0	0	0	112.3	I309 L313 S399 V400 Y406 L407 V422	I309-T403 HydrophobicContact CG1-CG2 4.25Å; I309-T403 HydrophobicContact CG2-CG2 4.1Å; L313-T403 HydrophobicContact CD2-CG2 4.29Å; S399-T403 PolarHBondContact O-N 2.86Å; S399-T403 PolarHBondContact O-OG1 3.22Å; S399-T403 VanDerWaalsContact O-OG1 3.11Å; V400-T403 PolarHBondContact O-N 2.95Å; T403-Y406 PolarHBondContact O-N 2.81Å; T403-L407 HydrophobicContact CG2-CD1 4.17Å; T403-L407 VanDerWaalsContact O-CG 3.29Å; T403-L407 WeakPolarHBondContact O-CG 3.35Å; T403-L407 PolarHBondContact O-N 2.86Å; T403-V422 HydrophobicContact CG2-CG2 3.9Å
404	V	98.2	Very high	95.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.5	-44.6	178.6	172.8	0	0	0	0	110.8	V400 T401 Y406 L407 M408 L415 A418 V422 L439	V400-V404 HydrophobicContact CG1-CG2 4.15Å; V400-V404 WeakPolarHBondContact O-CG2 3.5Å; V400-V404 PolarHBondContact O-N 2.78Å; T401-V404 PolarHBondContact O-N 2.95Å; V404-Y406 VanDerWaalsContact C-N 3.29Å; V404-Y406 PolarHBondContact O-N 2.93Å; V404-L407 PolarHBondContact O-N 3.15Å; V404-M408 HydrophobicContact CG1-CG 4.42Å; V404-M408 HydrophobicContact CG1-SD 3.84Å; V404-M408 VanDerWaalsContact O-CG 3.26Å; V404-M408 WeakPolarHBondContact O-CG 3.46Å; V404-M408 PolarHBondContact O-N 2.92Å; V404-L415 HydrophobicContact CG1-CD1 3.71Å; V404-A418 HydrophobicContact CG1-CB 3.97Å; V404-V422 HydrophobicContact CG2-CB 4.45Å; V404-V422 HydrophobicContact CG2-CG2 3.91Å; V404-L439 HydrophobicContact CB-CD1 4.16Å; V404-L439 HydrophobicContact CB-CD2 4.46Å; V404-L439 HydrophobicContact CG1-CD1 3.9Å; V404-L439 HydrophobicContact CG1-CD2 4.19Å
405	A	98.3	Very high	95.6	Very high	1 Å²	1	21 Å²	21	1%	0.008	12%	0.117	C	C	.	.	H	α-helix	trans	-57.2	-42.4	173.4	0	0	0	0	0	112.2	F371 T401 V402 M408 H409 L439 F442	F371-A405 HydrophobicContact CB-CB 4.45Å; F371-A405 HydrophobicContact CD1-CB 3.76Å; F371-A405 HydrophobicContact CD2-CB 3.7Å; F371-A405 HydrophobicContact CE1-CB 3.8Å; F371-A405 HydrophobicContact CE2-CB 3.76Å; F371-A405 HydrophobicContact CG-CB 3.72Å; F371-A405 HydrophobicContact CZ-CB 3.81Å; T401-A405 WeakPolarHBondContact O-CB 3.48Å; T401-A405 PolarHBondContact O-N 2.93Å; V402-A405 PolarHBondContact O-N 2.84Å; A405-M408 PolarHBondContact O-N 2.81Å; A405-H409 WeakPolarHBondContact O-CB 3.37Å; A405-H409 PolarHBondContact O-N 3.18Å; A405-L439 HydrophobicContact CB-CD2 3.75Å; A405-F442 HydrophobicContact CB-CD1 4.17Å; A405-F442 HydrophobicContact CB-CE1 3.98Å; A405-F442 WeakPolarHBondContact O-CE1 3.08Å
406	Y	98.4	Very high	95.5	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62	-45.3	175.9	178.2	-97.9	0	0	0	112.7	I310 L313 I375 I378 D379 R382 V402 T403 V404 H409 T410	I310-Y406 HydrophobicContact CD1-CE1 4.17Å; L313-Y406 HydrophobicContact CD2-CD1 3.52Å; L313-Y406 HydrophobicContact CD2-CE1 3.82Å; I375-Y406 HydrophobicContact CB-CD2 4.23Å; I375-Y406 HydrophobicContact CG1-CD2 4.06Å; I375-Y406 HydrophobicContact CG2-CD2 4.08Å; I375-Y406 HydrophobicContact CG2-CE2 4.28Å; I378-Y406 HydrophobicContact CB-CD2 3.92Å; I378-Y406 HydrophobicContact CB-CE2 3.81Å; I378-Y406 HydrophobicContact CD1-CD2 4.09Å; I378-Y406 HydrophobicContact CD1-CG 4.08Å; I378-Y406 HydrophobicContact CG2-CD1 3.99Å; I378-Y406 HydrophobicContact CG2-CD2 3.68Å; I378-Y406 HydrophobicContact CG2-CE1 3.69Å; I378-Y406 HydrophobicContact CG2-CE2 3.36Å; I378-Y406 HydrophobicContact CG2-CG 3.98Å; D379-Y406 VanDerWaalsContact OD1-CE2 3.27Å; D379-Y406 WeakPolarHBondContact OD1-CE2 3.3Å; D379-Y406 VanDerWaalsContact OD1-CZ 3.31Å; D379-Y406 PolarHBondContact OD1-OH 3Å; R382-Y406 WeakPolarHBondContact CD-OH 3.23Å; R382-Y406 PolarHBondContact NH1-OH 3.18Å; V402-Y406 WeakPolarHBondContact O-CB 3.38Å; V402-Y406 PolarHBondContact O-N 2.91Å; T403-Y406 PolarHBondContact O-N 2.81Å; V404-Y406 VanDerWaalsContact C-N 3.29Å; V404-Y406 PolarHBondContact O-N 2.93Å; Y406-H409 PolarHBondContact O-N 3.36Å; Y406-T410 HydrophobicContact CE2-CG2 4.36Å; Y406-T410 VanDerWaalsContact CE2-OG1 3.27Å; Y406-T410 WeakPolarHBondContact CE2-OG1 3.29Å; Y406-T410 PolarHBondContact O-N 2.99Å
407	L	97.9	Very high	95.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63.4	-42.6	177.8	-69.5	166.2	0	0	0	112.2	I309 I310 T403 V404 H409 L411 L413 A418 L421 V422	I309-L407 HydrophobicContact CG2-CD1 4Å; I310-L407 HydrophobicContact CD1-CD2 3.9Å; I310-L407 HydrophobicContact CG1-CD2 4.45Å; I310-L407 HydrophobicContact CG2-CD2 4.11Å; T403-L407 HydrophobicContact CG2-CD1 4.17Å; T403-L407 VanDerWaalsContact O-CG 3.29Å; T403-L407 WeakPolarHBondContact O-CG 3.35Å; T403-L407 PolarHBondContact O-N 2.86Å; V404-L407 PolarHBondContact O-N 3.15Å; L407-H409 VanDerWaalsContact C-N 3.3Å; L407-H409 PolarHBondContact O-N 3.45Å; L407-L411 HydrophobicContact CD2-CD1 3.64Å; L407-L411 HydrophobicContact CD2-CG 4.32Å; L407-L411 WeakPolarHBondContact O-CA 3.41Å; L407-L411 WeakPolarHBondContact O-CB 3.5Å; L407-L411 PolarHBondContact O-N 2.84Å; L407-L413 HydrophobicContact CB-CD1 4.47Å; L407-A418 HydrophobicContact CB-CB 3.85Å; L407-L421 HydrophobicContact CD1-CD2 3.9Å; L407-L421 HydrophobicContact CD2-CD2 4.26Å; L407-V422 HydrophobicContact CD1-CG2 3.36Å
408	M	97	Very high	96	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.5	-40	175.4	-66.5	162.5	67.2	0	0	112	V404 A405 A412 L413 L415 A418 L439 F442 E443	V404-M408 HydrophobicContact CG1-CG 4.42Å; V404-M408 HydrophobicContact CG1-SD 3.84Å; V404-M408 VanDerWaalsContact O-CG 3.26Å; V404-M408 WeakPolarHBondContact O-CG 3.46Å; V404-M408 PolarHBondContact O-N 2.92Å; A405-M408 PolarHBondContact O-N 2.81Å; M408-A412 WeakPolarHBondContact O-CA 3.35Å; M408-A412 PolarHBondContact O-N 3.17Å; M408-L413 WeakPolarHBondContact CA-O 2.98Å; M408-L415 HydrophobicContact CE-CB 4Å; M408-L415 HydrophobicContact CE-CD1 4.5Å; M408-L415 HydrophobicContact SD-CB 4.24Å; M408-L415 HydrophobicContact SD-CD1 3.9Å; M408-A418 HydrophobicContact CG-CB 3.54Å; M408-L439 HydrophobicContact SD-CD2 3.96Å; M408-F442 HydrophobicContact CB-CE1 4.49Å; M408-F442 HydrophobicContact CE-CD1 4.1Å; M408-F442 HydrophobicContact SD-CD1 4.49Å; M408-E443 HydrophobicContact CE-CB 3.48Å; M408-E443 VanDerWaalsContact CE-CB 3.48Å; M408-E443 HydrophobicContact CE-CG 3.99Å
409	H	95.9	Very high	95.9	Very high	97 Å²	97	24.9 Å²	24.9	45%	0.449	14%	0.135	S	C	.	.	H	α-helix	trans	-73.4	-59.7	179.2	-171.5	87.4	0	0	0	112.2	I375 A405 Y406 L407 F442	I375-H409 HydrophobicContact CD1-CB 3.83Å; A405-H409 WeakPolarHBondContact O-CB 3.37Å; A405-H409 PolarHBondContact O-N 3.18Å; Y406-H409 PolarHBondContact O-N 3.36Å; L407-H409 VanDerWaalsContact C-N 3.3Å; L407-H409 PolarHBondContact O-N 3.45Å; H409-F442 HydrophobicContact CB-CE1 4.44Å; H409-F442 HydrophobicContact CB-CZ 4.27Å
410	T	94.8	Very high	95.6	Very high	51 Å²	51	28.2 Å²	28.2	31%	0.313	15%	0.154	S	C	.	.	H	α-helix	trans	-86.6	-26.7	-165.4	-54.6	0	0	0	0	113.4	Y406	Y406-T410 HydrophobicContact CE2-CG2 4.36Å; Y406-T410 VanDerWaalsContact CE2-OG1 3.27Å; Y406-T410 WeakPolarHBondContact CE2-OG1 3.29Å; Y406-T410 PolarHBondContact O-N 2.99Å
411	L	94.6	Very high	95.5	Very high	73 Å²	73	30.1 Å²	30.1	38%	0.382	16%	0.164	S	C	.	.	S	Bend	trans	-100.4	3.6	172.2	-57.3	-172.8	0	0	0	113.2	I310 L407 L413	I310-L411 HydrophobicContact CD1-CD1 4.06Å; I310-L411 HydrophobicContact CD1-CG 4.48Å; I310-L411 HydrophobicContact CG2-CD1 4.15Å; L407-L411 HydrophobicContact CD2-CD1 3.64Å; L407-L411 HydrophobicContact CD2-CG 4.32Å; L407-L411 WeakPolarHBondContact O-CA 3.41Å; L407-L411 WeakPolarHBondContact O-CB 3.5Å; L407-L411 PolarHBondContact O-N 2.84Å; L411-L413 HydrophobicContact CB-CD1 4.22Å; L411-L413 HydrophobicContact CB-CG 3.97Å; L411-L413 PolarHBondContact O-N 3.41Å
412	A	93.9	Very high	95.5	Very high	41 Å²	41	30.1 Å²	30.1	34%	0.339	16%	0.164	S	C	.	.			trans	55.8	37	177.2	0	0	0	0	0	113.4	M408 R450	M408-A412 WeakPolarHBondContact O-CA 3.35Å; M408-A412 PolarHBondContact O-N 3.17Å; A412-R450 PolarHBondContact O-NH1 2.65Å; A412-R450 PolarHBondContact O-NH2 2.84Å
413	L	94	Very high	95.1	Very high	35 Å²	35	32.3 Å²	32.3	18%	0.183	17%	0.173	C	C	.	.			trans	-87	155.9	177.2	-62.4	-179.4	0	0	0	111.9	L407 M408 L411 E417 A418 L421	L407-L413 HydrophobicContact CB-CD1 4.47Å; M408-L413 WeakPolarHBondContact CA-O 2.98Å; L411-L413 HydrophobicContact CB-CD1 4.22Å; L411-L413 HydrophobicContact CB-CG 3.97Å; L411-L413 PolarHBondContact O-N 3.41Å; L413-E417 HydrophobicContact CB-CB 4.07Å; L413-E417 HydrophobicContact CD1-CB 4.48Å; L413-E417 HydrophobicContact CD2-CB 4.16Å; L413-E417 HydrophobicContact CG-CB 4.46Å; L413-A418 HydrophobicContact CB-CB 4.05Å; L413-A418 HydrophobicContact CD1-CB 4.28Å; L413-L421 HydrophobicContact CD1-CD1 4.32Å
414	T	92.6	Very high	94.9	Very high	52 Å²	52	39.1 Å²	39.1	32%	0.319	20%	0.204	S	C	.	.			trans	-68	166.2	160.7	58.2	0	0	0	0	111.2	D416 E417 A418 E443	T414-D416 VanDerWaalsContact C-N 3.27Å; T414-D416 PolarHBondContact O-N 3.42Å; T414-E417 WeakPolarHBondContact CB-OE2 3.35Å; T414-E417 WeakPolarHBondContact CG2-OE2 3.24Å; T414-E417 PolarHBondContact N-OE2 3.43Å; T414-E417 PolarHBondContact O-N 2.99Å; T414-E417 WeakPolarHBondContact OG1-CB 3.48Å; T414-E417 VanDerWaalsContact OG1-CD 3.23Å; T414-E417 VanDerWaalsContact OG1-CG 3.23Å; T414-E417 WeakPolarHBondContact OG1-CG 3.45Å; T414-E417 PolarHBondContact OG1-N 2.69Å; T414-E417 PolarHBondContact OG1-OE2 2.79Å; T414-A418 WeakPolarHBondContact O-CB 3.24Å; T414-A418 PolarHBondContact O-N 3.28Å; T414-E443 VanDerWaalsContact CA-OE1 3.23Å; T414-E443 WeakPolarHBondContact CA-OE1 3.36Å; T414-E443 VanDerWaalsContact CB-OE1 3.24Å; T414-E443 WeakPolarHBondContact CB-OE1 3.36Å
415	L	93.3	Very high	94.6	Very high	3 Å²	3	43 Å²	43	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-57.9	-40.6	171.3	175.7	54.5	0	0	0	111.5	L86 V404 M408 Y419 L439 V440 E443	L86-L415 HydrophobicContact CD2-CD2 3.96Å; L86-L415 HydrophobicContact CD2-CG 4.25Å; V404-L415 HydrophobicContact CG1-CD1 3.71Å; M408-L415 HydrophobicContact CE-CB 4Å; M408-L415 HydrophobicContact CE-CD1 4.5Å; M408-L415 HydrophobicContact SD-CB 4.24Å; M408-L415 HydrophobicContact SD-CD1 3.9Å; L415-Y419 WeakPolarHBondContact O-CB 3.35Å; L415-Y419 PolarHBondContact O-N 3.29Å; L415-L439 HydrophobicContact CD1-CB 3.76Å; L415-L439 HydrophobicContact CD1-CD1 4Å; L415-L439 HydrophobicContact CD1-CG 4.38Å; L415-L439 HydrophobicContact CD2-CB 4.16Å; L415-V440 HydrophobicContact CD2-CB 4.4Å; L415-V440 HydrophobicContact CD2-CG2 3.49Å; L415-V440 VanDerWaalsContact CD2-CG2 3.49Å; L415-E443 PolarHBondContact N-OE1 3.26Å
416	D	90.6	Very high	94.2	Very high	63 Å²	63	44.5 Å²	44.5	34%	0.337	23%	0.229	S	C	.	.	H	α-helix	trans	-63.8	-51.3	179.4	-79.5	17.1	0	0	0	111.2	L86 T414 Y419 D420	L86-D416 WeakPolarHBondContact CD1-OD1 3.43Å; L86-D416 WeakPolarHBondContact CD2-OD1 3.34Å; T414-D416 VanDerWaalsContact C-N 3.27Å; T414-D416 PolarHBondContact O-N 3.42Å; D416-Y419 PolarHBondContact O-N 3.11Å; D416-D420 WeakPolarHBondContact O-CB 3.29Å; D416-D420 PolarHBondContact O-N 3.08Å
417	E	93.3	Very high	93.5	Very high	102 Å²	102	48 Å²	48	48%	0.477	25%	0.251	S	S	.	.	H	α-helix	trans	-63.9	-45.1	179.5	-67.8	161.9	133.1	0	0	112.1	L413 T414 L421	L413-E417 HydrophobicContact CB-CB 4.07Å; L413-E417 HydrophobicContact CD1-CB 4.48Å; L413-E417 HydrophobicContact CD2-CB 4.16Å; L413-E417 HydrophobicContact CG-CB 4.46Å; T414-E417 WeakPolarHBondContact CB-OE2 3.35Å; T414-E417 WeakPolarHBondContact CG2-OE2 3.24Å; T414-E417 PolarHBondContact N-OE2 3.43Å; T414-E417 PolarHBondContact O-N 2.99Å; T414-E417 WeakPolarHBondContact OG1-CB 3.48Å; T414-E417 VanDerWaalsContact OG1-CD 3.23Å; T414-E417 VanDerWaalsContact OG1-CG 3.23Å; T414-E417 WeakPolarHBondContact OG1-CG 3.45Å; T414-E417 PolarHBondContact OG1-N 2.69Å; T414-E417 PolarHBondContact OG1-OE2 2.79Å; E417-L421 VanDerWaalsContact O-CB 3.3Å; E417-L421 WeakPolarHBondContact O-CB 3.08Å; E417-L421 PolarHBondContact O-N 2.83Å
418	A	96.2	Very high	92.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.9	-41.1	178.2	0	0	0	0	0	111.9	V404 L407 M408 L413 T414 V422	V404-A418 HydrophobicContact CG1-CB 3.97Å; L407-A418 HydrophobicContact CB-CB 3.85Å; M408-A418 HydrophobicContact CG-CB 3.54Å; L413-A418 HydrophobicContact CB-CB 4.05Å; L413-A418 HydrophobicContact CD1-CB 4.28Å; T414-A418 WeakPolarHBondContact O-CB 3.24Å; T414-A418 PolarHBondContact O-N 3.28Å; A418-V422 WeakPolarHBondContact O-CG2 3.47Å; A418-V422 PolarHBondContact O-N 3.2Å
419	Y	93.7	Very high	92.2	Very high	1 Å²	1	51.3 Å²	51.3	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-65.9	-49.9	176.7	-169.8	-70.9	0	0	0	111.2	R90 L415 D416 L421 V422 K423 I429 P431 L436	R90-Y419 PolarHBondContact NH2-OH 2.83Å; L415-Y419 WeakPolarHBondContact O-CB 3.35Å; L415-Y419 PolarHBondContact O-N 3.29Å; D416-Y419 PolarHBondContact O-N 3.11Å; Y419-L421 VanDerWaalsContact C-N 3.29Å; Y419-L421 PolarHBondContact O-N 2.87Å; Y419-V422 PolarHBondContact O-N 3.28Å; Y419-V422 VanDerWaalsContact O-N 3.14Å; Y419-K423 HydrophobicContact CD1-CB 4.21Å; Y419-K423 HydrophobicContact CE1-CB 4.07Å; Y419-K423 HydrophobicContact CE1-CD 4.03Å; Y419-K423 HydrophobicContact CE1-CG 4.26Å; Y419-K423 WeakPolarHBondContact O-CB 3.34Å; Y419-K423 PolarHBondContact O-N 3.41Å; Y419-I429 HydrophobicContact CD1-CD1 4.11Å; Y419-I429 HydrophobicContact CE1-CD1 3.52Å; Y419-I429 HydrophobicContact CE1-CG1 4Å; Y419-I429 HydrophobicContact CE2-CD1 4.16Å; Y419-I429 PolarHBondContact OH-O 2.82Å; Y419-P431 HydrophobicContact CE2-CG 4.03Å; Y419-L436 HydrophobicContact CD2-CD2 4.27Å; Y419-L436 HydrophobicContact CE2-CD2 4.03Å
420	D	93.3	Very high	91.6	Very high	71 Å²	71	47.7 Å²	47.7	38%	0.38	26%	0.255	S	S	.	.	H	α-helix	trans	-68.3	-29.3	-176	-81.6	-5	0	0	0	111.7	D416 K423 Q424	D416-D420 WeakPolarHBondContact O-CB 3.29Å; D416-D420 PolarHBondContact O-N 3.08Å; D420-K423 PolarHBondContact O-N 3.17Å; D420-Q424 VanDerWaalsContact O-CG 3.24Å; D420-Q424 WeakPolarHBondContact O-CG 3.45Å; D420-Q424 PolarHBondContact O-N 2.89Å; D420-Q424 PolarHBondContact O-NE2 3.44Å
421	L	95.4	Very high	91.2	Very high	40 Å²	40	45.4 Å²	45.4	21%	0.209	24%	0.241	C	C	.	.	H	α-helix	trans	-60	-47	168.9	-173.4	150.3	0	0	0	111.7	I309 I310 L407 L413 E417 Y419 K423 H425	I309-L421 HydrophobicContact CG2-CD2 3.58Å; I310-L421 HydrophobicContact CG2-CD2 4.35Å; L407-L421 HydrophobicContact CD1-CD2 3.9Å; L407-L421 HydrophobicContact CD2-CD2 4.26Å; L413-L421 HydrophobicContact CD1-CD1 4.32Å; E417-L421 VanDerWaalsContact O-CB 3.3Å; E417-L421 WeakPolarHBondContact O-CB 3.08Å; E417-L421 PolarHBondContact O-N 2.83Å; Y419-L421 VanDerWaalsContact C-N 3.29Å; Y419-L421 PolarHBondContact O-N 2.87Å; L421-K423 VanDerWaalsContact C-N 3.35Å; L421-H425 PolarHBondContact O-ND1 3.03Å
422	V	96.1	Very high	90.5	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.8	-35.2	175.8	-171.8	0	0	0	0	111	I309 L315 V400 T403 V404 L407 A418 Y419 Q424 H425 K426 I429	I309-V422 HydrophobicContact CD1-CG1 4.07Å; I309-V422 HydrophobicContact CG2-CG2 4.01Å; L315-V422 HydrophobicContact CD2-CG1 3.53Å; V400-V422 HydrophobicContact CG1-CG1 4.37Å; T403-V422 HydrophobicContact CG2-CG2 3.9Å; V404-V422 HydrophobicContact CG2-CB 4.45Å; V404-V422 HydrophobicContact CG2-CG2 3.91Å; L407-V422 HydrophobicContact CD1-CG2 3.36Å; A418-V422 WeakPolarHBondContact O-CG2 3.47Å; A418-V422 PolarHBondContact O-N 3.2Å; Y419-V422 PolarHBondContact O-N 3.28Å; Y419-V422 VanDerWaalsContact O-N 3.14Å; V422-Q424 PolarHBondContact O-N 2.71Å; V422-H425 PolarHBondContact O-N 3.02Å; V422-K426 PolarHBondContact O-N 2.88Å; V422-I429 HydrophobicContact CB-CD1 3.86Å; V422-I429 HydrophobicContact CG1-CD1 3.84Å; V422-I429 HydrophobicContact CG1-CG2 4.1Å
423	K	91	Very high	89.5	Confident	48 Å²	48	42.6 Å²	42.6	21%	0.209	22%	0.218	C	C	.	.	H	α-helix	trans	-64.6	-36.2	178.8	-166.6	62	159.5	177.4	0	112.6	Y419 D420 L421 K426 P427 I429	Y419-K423 HydrophobicContact CD1-CB 4.21Å; Y419-K423 HydrophobicContact CE1-CB 4.07Å; Y419-K423 HydrophobicContact CE1-CD 4.03Å; Y419-K423 HydrophobicContact CE1-CG 4.26Å; Y419-K423 WeakPolarHBondContact O-CB 3.34Å; Y419-K423 PolarHBondContact O-N 3.41Å; D420-K423 PolarHBondContact O-N 3.17Å; L421-K423 VanDerWaalsContact C-N 3.35Å; K423-K426 CarbonylContact O-C 3.53Å; K423-K426 VanDerWaalsContact O-C 3.27Å; K423-P427 VanDerWaalsContact CE-O 3.32Å; K423-P427 WeakPolarHBondContact CE-O 3.29Å; K423-P427 PolarHBondContact NZ-O 3.3Å; K423-P427 WeakPolarHBondContact O-CA 3.37Å; K423-I429 HydrophobicContact CB-CD1 4.08Å; K423-I429 HydrophobicContact CB-CG1 4.36Å; K423-I429 HydrophobicContact CD-CD1 4.15Å; K423-I429 HydrophobicContact CD-CG1 3.52Å; K423-I429 PolarHBondContact NZ-O 2.78Å
424	Q	93.7	Very high	88.8	Confident	143 Å²	143	43 Å²	43	67%	0.668	22%	0.221	S	C	*	.	H	α-helix	trans	-63.2	-45.7	175	-74.4	165.5	47.3	0	0	111.8	D420 V422	D420-Q424 VanDerWaalsContact O-CG 3.24Å; D420-Q424 WeakPolarHBondContact O-CG 3.45Å; D420-Q424 PolarHBondContact O-N 2.89Å; D420-Q424 PolarHBondContact O-NE2 3.44Å; V422-Q424 PolarHBondContact O-N 2.71Å
425	H	92.9	Very high	88.6	Confident	83 Å²	83	40.6 Å²	40.6	38%	0.384	21%	0.205	S	C	.	.	H	α-helix	trans	-74.2	-33.4	178.5	-66.1	85.8	0	0	0	112.5	V307 E308 I309 L421 V422	V307-H425 HydrophobicContact CG1-CB 3.76Å; V307-H425 WeakPolarHBondContact CG1-O 3.18Å; E308-H425 PolarHBondContact O-CD2 3.49Å; E308-H425 VanDerWaalsContact O-CD2 3.29Å; I309-H425 HydrophobicContact CD1-CB 3.69Å; L421-H425 PolarHBondContact O-ND1 3.03Å; V422-H425 PolarHBondContact O-N 3.02Å
426	K	88.7	Confident	88.3	Confident	32 Å²	32	41 Å²	41	14%	0.139	21%	0.207	C	C	.	.			trans	-135.8	87.2	-177.5	-171.4	169.4	175.2	53.2	0	111.6	V307 L315 G395 V422 K423 N428 I429	V307-K426 HydrophobicContact CG2-CB 4.46Å; V307-K426 HydrophobicContact CG2-CD 4.24Å; V307-K426 HydrophobicContact CG2-CG 4.48Å; L315-K426 HydrophobicContact CD2-CD 3.8Å; L315-K426 HydrophobicContact CG-CD 4.16Å; G395-K426 WeakPolarHBondContact O-CE 3.29Å; V422-K426 PolarHBondContact O-N 2.88Å; K423-K426 CarbonylContact O-C 3.53Å; K423-K426 VanDerWaalsContact O-C 3.27Å; K426-N428 WeakPolarHBondContact CE-OD1 3.49Å; K426-N428 WeakPolarHBondContact CG-OD1 3.38Å; K426-N428 PolarHBondContact NZ-OD1 3.25Å; K426-N428 PolarHBondContact O-N 3.18Å; K426-I429 HydrophobicContact CB-CG2 3.91Å; K426-I429 HydrophobicContact CD-CG2 3.84Å; K426-I429 HydrophobicContact CG-CG2 3.75Å; K426-I429 WeakPolarHBondContact O-CG2 3.45Å; K426-I429 PolarHBondContact O-N 3.33Å
427	P	84.5	Confident	87.9	Confident	72 Å²	72	39.6 Å²	39.6	47%	0.468	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-24.1	-175.5	-29.7	37.1	0	0	0	115.5	K423	K423-P427 VanDerWaalsContact CE-O 3.32Å; K423-P427 WeakPolarHBondContact CE-O 3.29Å; K423-P427 PolarHBondContact NZ-O 3.3Å; K423-P427 WeakPolarHBondContact O-CA 3.37Å
428	N	81.1	Confident	87.8	Confident	70 Å²	70	36.3 Å²	36.3	37%	0.374	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	10.2	-178.1	84.7	-40.1	0	0	0	115.7	K426	K426-N428 WeakPolarHBondContact CE-OD1 3.49Å; K426-N428 WeakPolarHBondContact CG-OD1 3.38Å; K426-N428 PolarHBondContact NZ-OD1 3.25Å; K426-N428 PolarHBondContact O-N 3.18Å
429	I	86.6	Confident	87.7	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	19%	0.193	C	C	.	.			trans	-65.6	140.6	173.6	64.4	165.9	0	0	0	112.9	L315 V400 Y419 V422 K423 K426	L315-I429 HydrophobicContact CD2-CG2 4.38Å; V400-I429 HydrophobicContact CB-CG2 4.36Å; V400-I429 HydrophobicContact CG1-CB 3.88Å; V400-I429 HydrophobicContact CG1-CD1 3.8Å; V400-I429 HydrophobicContact CG1-CG1 4.42Å; V400-I429 HydrophobicContact CG1-CG2 3.95Å; V400-I429 HydrophobicContact CG2-CB 3.9Å; V400-I429 HydrophobicContact CG2-CG2 3.43Å; V400-I429 VanDerWaalsContact CG2-CG2 3.43Å; Y419-I429 HydrophobicContact CD1-CD1 4.11Å; Y419-I429 HydrophobicContact CE1-CD1 3.52Å; Y419-I429 HydrophobicContact CE1-CG1 4Å; Y419-I429 HydrophobicContact CE2-CD1 4.16Å; Y419-I429 PolarHBondContact OH-O 2.82Å; V422-I429 HydrophobicContact CB-CD1 3.86Å; V422-I429 HydrophobicContact CG1-CD1 3.84Å; V422-I429 HydrophobicContact CG1-CG2 4.1Å; K423-I429 HydrophobicContact CB-CD1 4.08Å; K423-I429 HydrophobicContact CB-CG1 4.36Å; K423-I429 HydrophobicContact CD-CD1 4.15Å; K423-I429 HydrophobicContact CD-CG1 3.52Å; K423-I429 PolarHBondContact NZ-O 2.78Å; K426-I429 HydrophobicContact CB-CG2 3.91Å; K426-I429 HydrophobicContact CD-CG2 3.84Å; K426-I429 HydrophobicContact CG-CG2 3.75Å; K426-I429 WeakPolarHBondContact O-CG2 3.45Å; K426-I429 PolarHBondContact O-N 3.33Å
430	S	83.4	Confident	87.5	Confident	21 Å²	21	38.7 Å²	38.7	15%	0.147	21%	0.208	C	C	.	.			trans	-161.9	87.2	170.8	-173.3	0	0	0	0	110.7	S100 I396	S100-S430 WeakPolarHBondContact CB-OG 3.39Å; S100-S430 PolarHBondContact OG-OG 3.09Å; I396-S430 CarbonylContact O-C 3.56Å; I396-S430 PolarHBondContact O-N 2.79Å
431	P	86.7	Confident	87.3	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.013	21%	0.207	C	C	.	.			trans	-47.9	148.6	161.1	-26.8	36.8	0	0	0	112.6	S397 V400 Y419 F435 L436	S397-P431 WeakPolarHBondContact OG-CA 3.24Å; V400-P431 HydrophobicContact CB-CG 4.1Å; V400-P431 HydrophobicContact CG1-CG 3.73Å; Y419-P431 HydrophobicContact CE2-CG 4.03Å; P431-F435 HydrophobicContact CB-CB 4.41Å; P431-L436 HydrophobicContact CB-CD2 3.8Å; P431-L436 HydrophobicContact CB-CG 3.97Å; P431-L436 HydrophobicContact CG-CD2 4.06Å
432	N	79.9	Confident	87.2	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.016	20%	0.204	C	C	.	.			trans	-67.8	164.7	169.8	76.7	29.8	0	0	0	111	D361 S397 D434 F435 L436	D361-N432 VanDerWaalsContact C-ND2 3.27Å; D361-N432 PolarHBondContact O-ND2 3.3Å; S397-N432 PolarHBondContact OG-N 3.08Å; S397-N432 VanDerWaalsContact OG-N 3.13Å; N432-D434 PolarHBondContact O-N 3.06Å; N432-D434 PolarHBondContact OD1-N 3.02Å; N432-F435 HydrophobicContact CB-CD2 4.48Å; N432-F435 VanDerWaalsContact CG-CD2 3.43Å; N432-F435 VanDerWaalsContact ND2-CD2 3.34Å; N432-F435 WeakPolarHBondContact ND2-CD2 3.46Å; N432-F435 WeakPolarHBondContact ND2-CE2 3.49Å; N432-F435 PolarHBondContact O-N 3.11Å; N432-F435 WeakPolarHBondContact OD1-CB 3.26Å; N432-F435 VanDerWaalsContact OD1-CD2 3.29Å; N432-F435 WeakPolarHBondContact OD1-CD2 3.27Å; N432-F435 WeakPolarHBondContact OD1-CG 3.47Å; N432-F435 PolarHBondContact OD1-N 3.06Å; N432-L436 WeakPolarHBondContact O-CG 3.37Å; N432-L436 PolarHBondContact O-N 3.32Å; N432-L436 VanDerWaalsContact O-N 3.13Å
433	F	73	Confident	87.1	Confident	53 Å²	53	40.9 Å²	40.9	23%	0.232	21%	0.214	C	C	.	.	H	α-helix	trans	-57.2	-47.8	-174.2	-176.9	-102.3	0	0	0	113.3	V82 P84 L87 V101 F435 L436 G437	V82-F433 WeakPolarHBondContact O-CZ 3.39Å; P84-F433 HydrophobicContact CG-CZ 4.49Å; L87-F433 HydrophobicContact CD1-CD2 3.99Å; L87-F433 HydrophobicContact CD1-CE2 3.82Å; V101-F433 HydrophobicContact CG1-CD2 4.12Å; V101-F433 HydrophobicContact CG1-CE2 4.49Å; V101-F433 VanDerWaalsContact O-CB 3.3Å; V101-F433 WeakPolarHBondContact O-CB 3.38Å; V101-F433 WeakPolarHBondContact O-CD2 3.37Å; V101-F433 WeakPolarHBondContact O-CG 3.41Å; F433-F435 VanDerWaalsContact C-N 3.32Å; F433-F435 PolarHBondContact O-N 3.17Å; F433-L436 CarbonylContact O-C 3.37Å; F433-L436 WeakPolarHBondContact O-CA 2.99Å; F433-L436 WeakPolarHBondContact O-CB 3.47Å; F433-L436 PolarHBondContact O-N 3.17Å; F433-G437 PolarHBondContact O-N 3.2Å
434	D	78.8	Confident	87.1	Confident	44 Å²	44	46.1 Å²	46.1	24%	0.235	23%	0.232	C	C	.	.	H	α-helix	trans	-69.1	-32.9	-173.7	-50.8	-92.9	0	0	0	111.5	W363 N432 G437 Q438	W363-D434 VanDerWaalsContact CA-CG 3.48Å; W363-D434 WeakPolarHBondContact CA-OD2 3.36Å; W363-D434 HydrophobicContact CB-CB 4.43Å; W363-D434 VanDerWaalsContact CB-CG 3.45Å; W363-D434 WeakPolarHBondContact CB-OD2 3.37Å; N432-D434 PolarHBondContact O-N 3.06Å; N432-D434 PolarHBondContact OD1-N 3.02Å; D434-G437 PolarHBondContact O-N 2.82Å; D434-Q438 WeakPolarHBondContact O-CB 3.36Å; D434-Q438 WeakPolarHBondContact O-CG 3.46Å; D434-Q438 PolarHBondContact O-N 3.09Å; D434-Q438 PolarHBondContact O-NE2 3.13Å
435	F	89.3	Confident	86.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-68.4	-33.4	169.2	-67.2	-19.4	0	0	0	112.9	I359 Q365 L367 R398 T401 P431 N432 F433 L439	I359-F435 HydrophobicContact CG2-CE1 4.4Å; I359-F435 HydrophobicContact CG2-CZ 3.95Å; Q365-F435 HydrophobicContact CB-CE1 4.19Å; Q365-F435 HydrophobicContact CB-CZ 4.37Å; L367-F435 HydrophobicContact CB-CD1 3.82Å; L367-F435 HydrophobicContact CB-CE1 3.57Å; L367-F435 HydrophobicContact CB-CZ 4.29Å; L367-F435 HydrophobicContact CD2-CD1 4.13Å; L367-F435 HydrophobicContact CD2-CD2 4.26Å; L367-F435 HydrophobicContact CD2-CE1 4.02Å; L367-F435 HydrophobicContact CD2-CE2 4.18Å; L367-F435 HydrophobicContact CD2-CG 4.27Å; L367-F435 HydrophobicContact CD2-CZ 4.06Å; L367-F435 HydrophobicContact CG-CE1 4.47Å; R398-F435 HydrophobicContact CB-CE2 4.5Å; R398-F435 HydrophobicContact CG-CE2 3.51Å; R398-F435 HydrophobicContact CG-CZ 3.91Å; T401-F435 HydrophobicContact CG2-CB 3.74Å; T401-F435 HydrophobicContact CG2-CG 4.22Å; P431-F435 HydrophobicContact CB-CB 4.41Å; N432-F435 HydrophobicContact CB-CD2 4.48Å; N432-F435 VanDerWaalsContact CG-CD2 3.43Å; N432-F435 VanDerWaalsContact ND2-CD2 3.34Å; N432-F435 WeakPolarHBondContact ND2-CD2 3.46Å; N432-F435 WeakPolarHBondContact ND2-CE2 3.49Å; N432-F435 PolarHBondContact O-N 3.11Å; N432-F435 WeakPolarHBondContact OD1-CB 3.26Å; N432-F435 VanDerWaalsContact OD1-CD2 3.29Å; N432-F435 WeakPolarHBondContact OD1-CD2 3.27Å; N432-F435 WeakPolarHBondContact OD1-CG 3.47Å; N432-F435 PolarHBondContact OD1-N 3.06Å; F433-F435 VanDerWaalsContact C-N 3.32Å; F433-F435 PolarHBondContact O-N 3.17Å; F435-L439 WeakPolarHBondContact O-CG 3.21Å; F435-L439 PolarHBondContact O-N 3.34Å
436	L	87.3	Confident	86.3	Confident	11 Å²	11	41.5 Å²	41.5	6%	0.058	21%	0.212	C	C	.	.	H	α-helix	trans	-69.6	-39.5	170.9	-64.7	174.5	0	0	0	111.6	L87 Y419 P431 N432 F433 Q438 L439 V440	L87-L436 HydrophobicContact CD1-CB 4.44Å; L87-L436 HydrophobicContact CD1-CD1 4.11Å; L87-L436 HydrophobicContact CD2-CD1 3.73Å; L87-L436 HydrophobicContact CG-CD1 4.47Å; Y419-L436 HydrophobicContact CD2-CD2 4.27Å; Y419-L436 HydrophobicContact CE2-CD2 4.03Å; P431-L436 HydrophobicContact CB-CD2 3.8Å; P431-L436 HydrophobicContact CB-CG 3.97Å; P431-L436 HydrophobicContact CG-CD2 4.06Å; N432-L436 WeakPolarHBondContact O-CG 3.37Å; N432-L436 PolarHBondContact O-N 3.32Å; N432-L436 VanDerWaalsContact O-N 3.13Å; F433-L436 CarbonylContact O-C 3.37Å; F433-L436 WeakPolarHBondContact O-CA 2.99Å; F433-L436 WeakPolarHBondContact O-CB 3.47Å; F433-L436 PolarHBondContact O-N 3.17Å; L436-Q438 VanDerWaalsContact C-N 3.35Å; L436-L439 HydrophobicContact CD2-CD1 4.33Å; L436-L439 PolarHBondContact O-N 3.08Å; L436-V440 WeakPolarHBondContact O-CG2 3.38Å; L436-V440 PolarHBondContact O-N 2.85Å
437	G	81.2	Confident	85.7	Confident	34 Å²	34	42.6 Å²	42.6	35%	0.351	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-41.7	172.3	0	0	0	0	0	112.6	F433 D434 L439 V440 E441	F433-G437 PolarHBondContact O-N 3.2Å; D434-G437 PolarHBondContact O-N 2.82Å; G437-L439 VanDerWaalsContact C-N 3.34Å; G437-L439 PolarHBondContact O-N 3.43Å; G437-V440 PolarHBondContact O-N 3.33Å; G437-E441 PolarHBondContact O-N 3.15Å
438	Q	91.5	Very high	85	Confident	33 Å²	33	42 Å²	42	15%	0.154	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-36.8	173.1	-79.4	169.9	54	0	0	112.8	Q365 A368 D434 L436 F442	Q365-Q438 PolarHBondContact O-NE2 2.97Å; A368-Q438 HydrophobicContact CB-CB 4.01Å; A368-Q438 HydrophobicContact CB-CG 4.2Å; D434-Q438 WeakPolarHBondContact O-CB 3.36Å; D434-Q438 WeakPolarHBondContact O-CG 3.46Å; D434-Q438 PolarHBondContact O-N 3.09Å; D434-Q438 PolarHBondContact O-NE2 3.13Å; L436-Q438 VanDerWaalsContact C-N 3.35Å; Q438-F442 WeakPolarHBondContact O-CB 3.38Å; Q438-F442 PolarHBondContact O-N 2.65Å
439	L	93.5	Very high	84.7	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-69.3	-39.2	172.8	-76.1	169.9	0	0	0	112.8	F371 T401 V404 A405 M408 L415 F435 L436 G437 E441 F442 E443	F371-L439 HydrophobicContact CE2-CD2 4.01Å; F371-L439 HydrophobicContact CZ-CD2 3.86Å; F371-L439 HydrophobicContact CZ-CG 4.36Å; T401-L439 HydrophobicContact CG2-CD1 3.85Å; T401-L439 HydrophobicContact CG2-CD2 4.27Å; T401-L439 HydrophobicContact CG2-CG 3.89Å; V404-L439 HydrophobicContact CB-CD1 4.16Å; V404-L439 HydrophobicContact CB-CD2 4.46Å; V404-L439 HydrophobicContact CG1-CD1 3.9Å; V404-L439 HydrophobicContact CG1-CD2 4.19Å; A405-L439 HydrophobicContact CB-CD2 3.75Å; M408-L439 HydrophobicContact SD-CD2 3.96Å; L415-L439 HydrophobicContact CD1-CB 3.76Å; L415-L439 HydrophobicContact CD1-CD1 4Å; L415-L439 HydrophobicContact CD1-CG 4.38Å; L415-L439 HydrophobicContact CD2-CB 4.16Å; F435-L439 WeakPolarHBondContact O-CG 3.21Å; F435-L439 PolarHBondContact O-N 3.34Å; L436-L439 HydrophobicContact CD2-CD1 4.33Å; L436-L439 PolarHBondContact O-N 3.08Å; G437-L439 VanDerWaalsContact C-N 3.34Å; G437-L439 PolarHBondContact O-N 3.43Å; L439-E441 VanDerWaalsContact C-N 3.34Å; L439-E441 PolarHBondContact O-N 3.34Å; L439-F442 PolarHBondContact O-N 2.94Å; L439-E443 PolarHBondContact O-N 3.47Å
440	V	89.5	Confident	84.2	Confident	52 Å²	52	46.3 Å²	46.3	32%	0.315	25%	0.245	S	C	.	.	H	α-helix	trans	-60.7	-43.8	173.8	170.1	0	0	0	0	110.8	L415 L436 G437 E443 R444	L415-V440 HydrophobicContact CD2-CB 4.4Å; L415-V440 HydrophobicContact CD2-CG2 3.49Å; L415-V440 VanDerWaalsContact CD2-CG2 3.49Å; L436-V440 WeakPolarHBondContact O-CG2 3.38Å; L436-V440 PolarHBondContact O-N 2.85Å; G437-V440 PolarHBondContact O-N 3.33Å; V440-E443 WeakPolarHBondContact O-CB 3.44Å; V440-E443 PolarHBondContact O-N 2.99Å; V440-R444 WeakPolarHBondContact O-CG 3.32Å; V440-R444 PolarHBondContact O-N 2.87Å
441	E	89.2	Confident	83.7	Confident	80 Å²	80	50.6 Å²	50.6	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-70.1	-34.3	177.5	-165.9	56.5	-144.7	0	0	112	G437 L439 R444 H445	G437-E441 PolarHBondContact O-N 3.15Å; L439-E441 VanDerWaalsContact C-N 3.34Å; L439-E441 PolarHBondContact O-N 3.34Å; E441-R444 PolarHBondContact O-N 3.48Å; E441-R444 IonicContact OE1-CZ 2.93Å; E441-R444 IonicContact OE1-NH1 2.63Å; E441-R444 PolarHBondContact OE1-NH1 3.39Å; E441-R444 WeakPolarHBondContact OE2-CD 3.44Å; E441-R444 IonicContact OE2-CZ 3.98Å; E441-R444 IonicContact OE2-NE 3.86Å; E441-R444 IonicContact OE2-NH1 3.94Å; E441-R444 PolarHBondContact OE2-NH1 3.3Å; E441-H445 PolarHBondContact O-N 2.85Å; E441-H445 PolarHBondContact O-ND1 2.87Å; E441-H445 IonicContact OE1-CE1 3.71Å; E441-H445 PolarHBondContact OE1-CE1 3.24Å; E441-H445 IonicContact OE1-ND1 3.4Å
442	F	94.4	Very high	82.6	Confident	33 Å²	33	53.6 Å²	53.6	15%	0.145	30%	0.297	C	S	.	.	H	α-helix	trans	-64.5	-37.7	172.7	-177.2	-111.6	0	0	0	112.8	F371 I375 A405 M408 H409 Q438 L439 R444 H445 T446	F371-F442 HydrophobicContact CB-CE2 4.3Å; F371-F442 HydrophobicContact CD2-CB 4.15Å; F371-F442 HydrophobicContact CD2-CD1 4.05Å; F371-F442 AromaticContact CD2-CD2 3.7Å; F371-F442 HydrophobicContact CD2-CD2 3.7Å; F371-F442 HydrophobicContact CD2-CE1 4.37Å; F371-F442 HydrophobicContact CD2-CE2 4.03Å; F371-F442 AromaticContact CD2-CG 3.69Å; F371-F442 HydrophobicContact CD2-CG 3.69Å; F371-F442 HydrophobicContact CD2-CZ 4.35Å; F371-F442 HydrophobicContact CE2-CB 3.95Å; F371-F442 HydrophobicContact CE2-CD1 4.26Å; F371-F442 HydrophobicContact CE2-CD2 4.37Å; F371-F442 AromaticContact CE2-CG 3.95Å; F371-F442 HydrophobicContact CE2-CG 3.95Å; I375-F442 HydrophobicContact CD1-CZ 3.89Å; A405-F442 HydrophobicContact CB-CD1 4.17Å; A405-F442 HydrophobicContact CB-CE1 3.98Å; A405-F442 WeakPolarHBondContact O-CE1 3.08Å; M408-F442 HydrophobicContact CB-CE1 4.49Å; M408-F442 HydrophobicContact CE-CD1 4.1Å; M408-F442 HydrophobicContact SD-CD1 4.49Å; H409-F442 HydrophobicContact CB-CE1 4.44Å; H409-F442 HydrophobicContact CB-CZ 4.27Å; Q438-F442 WeakPolarHBondContact O-CB 3.38Å; Q438-F442 PolarHBondContact O-N 2.65Å; L439-F442 PolarHBondContact O-N 2.94Å; F442-R444 VanDerWaalsContact C-N 3.3Å; F442-R444 PolarHBondContact O-N 3.24Å; F442-H445 PolarHBondContact O-N 3.04Å; F442-H445 VanDerWaalsContact O-N 3.13Å; F442-T446 HydrophobicContact CD1-CG2 4Å; F442-T446 HydrophobicContact CD2-CG2 4.4Å; F442-T446 HydrophobicContact CE1-CG2 3.53Å; F442-T446 HydrophobicContact CE2-CG2 3.99Å; F442-T446 HydrophobicContact CG-CG2 4.42Å; F442-T446 HydrophobicContact CZ-CG2 3.53Å; F442-T446 PolarHBondContact O-N 3.04Å
443	E	93.6	Very high	81.7	Confident	44 Å²	44	63.4 Å²	63.4	21%	0.206	33%	0.334	C	S	.	.	H	α-helix	trans	-56.7	-43.1	174.9	-171	172	-142.5	0	0	112	M408 T414 L415 L439 V440 H445 T446 V447	M408-E443 HydrophobicContact CE-CB 3.48Å; M408-E443 VanDerWaalsContact CE-CB 3.48Å; M408-E443 HydrophobicContact CE-CG 3.99Å; T414-E443 VanDerWaalsContact CA-OE1 3.23Å; T414-E443 WeakPolarHBondContact CA-OE1 3.36Å; T414-E443 VanDerWaalsContact CB-OE1 3.24Å; T414-E443 WeakPolarHBondContact CB-OE1 3.36Å; L415-E443 PolarHBondContact N-OE1 3.26Å; L439-E443 PolarHBondContact O-N 3.47Å; V440-E443 WeakPolarHBondContact O-CB 3.44Å; V440-E443 PolarHBondContact O-N 2.99Å; E443-H445 VanDerWaalsContact C-N 3.25Å; E443-H445 PolarHBondContact O-N 3.44Å; E443-T446 PolarHBondContact O-N 3.23Å; E443-T446 PolarHBondContact O-OG1 3.32Å; E443-T446 VanDerWaalsContact O-OG1 3.12Å; E443-V447 HydrophobicContact CG-CG2 4.25Å; E443-V447 WeakPolarHBondContact O-CB 3.43Å; E443-V447 VanDerWaalsContact O-CG2 3.32Å; E443-V447 WeakPolarHBondContact O-CG2 3.45Å; E443-V447 PolarHBondContact O-N 3.47Å
444	R	90.1	Very high	80.7	Confident	157 Å²	157	64.1 Å²	64.1	59%	0.592	35%	0.35	S	S	*	.	H	α-helix	trans	-60.7	-38.5	178.7	-60	170.2	80.1	-159.6	2.1	111.1	V440 E441 F442 A448	V440-R444 WeakPolarHBondContact O-CG 3.32Å; V440-R444 PolarHBondContact O-N 2.87Å; E441-R444 PolarHBondContact O-N 3.48Å; E441-R444 IonicContact OE1-CZ 2.93Å; E441-R444 IonicContact OE1-NH1 2.63Å; E441-R444 PolarHBondContact OE1-NH1 3.39Å; E441-R444 WeakPolarHBondContact OE2-CD 3.44Å; E441-R444 IonicContact OE2-CZ 3.98Å; E441-R444 IonicContact OE2-NE 3.86Å; E441-R444 IonicContact OE2-NH1 3.94Å; E441-R444 PolarHBondContact OE2-NH1 3.3Å; F442-R444 VanDerWaalsContact C-N 3.3Å; F442-R444 PolarHBondContact O-N 3.24Å; R444-A448 VanDerWaalsContact O-CB 3.26Å; R444-A448 WeakPolarHBondContact O-CB 3.34Å; R444-A448 PolarHBondContact O-N 3.47Å
445	H	87.1	Confident	78.9	Confident	118 Å²	118	69 Å²	69	55%	0.546	38%	0.375	S	S	.	.	H	α-helix	trans	-73.1	-40.6	177.1	-69.3	80.1	0	0	0	112.7	E441 F442 E443 A449	E441-H445 PolarHBondContact O-N 2.85Å; E441-H445 PolarHBondContact O-ND1 2.87Å; E441-H445 IonicContact OE1-CE1 3.71Å; E441-H445 PolarHBondContact OE1-CE1 3.24Å; E441-H445 IonicContact OE1-ND1 3.4Å; F442-H445 PolarHBondContact O-N 3.04Å; F442-H445 VanDerWaalsContact O-N 3.13Å; E443-H445 VanDerWaalsContact C-N 3.25Å; E443-H445 PolarHBondContact O-N 3.44Å; H445-A449 WeakPolarHBondContact O-CB 3.39Å; H445-A449 PolarHBondContact O-N 2.94Å
446	T	82.7	Confident	76.6	Confident	12 Å²	12	74.1 Å²	74.1	7%	0.074	41%	0.409	C	S	.	.	H	α-helix	trans	-70.4	-37.9	177.6	59.1	0	0	0	0	112.3	F442 E443 A449 R450	F442-T446 HydrophobicContact CD1-CG2 4Å; F442-T446 HydrophobicContact CD2-CG2 4.4Å; F442-T446 HydrophobicContact CE1-CG2 3.53Å; F442-T446 HydrophobicContact CE2-CG2 3.99Å; F442-T446 HydrophobicContact CG-CG2 4.42Å; F442-T446 HydrophobicContact CZ-CG2 3.53Å; F442-T446 PolarHBondContact O-N 3.04Å; E443-T446 PolarHBondContact O-N 3.23Å; E443-T446 PolarHBondContact O-OG1 3.32Å; E443-T446 VanDerWaalsContact O-OG1 3.12Å; T446-A449 PolarHBondContact O-N 2.73Å; T446-R450 VanDerWaalsContact O-CD 3.32Å; T446-R450 WeakPolarHBondContact O-CD 3.43Å; T446-R450 VanDerWaalsContact O-CG 3.22Å; T446-R450 WeakPolarHBondContact O-CG 3.44Å; T446-R450 PolarHBondContact O-N 2.67Å
447	V	75.5	Confident	74.4	Confident	55 Å²	55	82.4 Å²	82.4	33%	0.333	45%	0.447	S	S	.	.	H	α-helix	trans	-65.1	-44.5	173.2	172.9	0	0	0	0	111.1	E443 A449 R450 N451	E443-V447 HydrophobicContact CG-CG2 4.25Å; E443-V447 WeakPolarHBondContact O-CB 3.43Å; E443-V447 VanDerWaalsContact O-CG2 3.32Å; E443-V447 WeakPolarHBondContact O-CG2 3.45Å; E443-V447 PolarHBondContact O-N 3.47Å; V447-A449 PolarHBondContact O-N 3.36Å; V447-R450 PolarHBondContact O-N 3.21Å; V447-N451 PolarHBondContact O-N 2.98Å
448	A	70.6	Confident	72.4	Confident	59 Å²	59	89.6 Å²	89.6	49%	0.488	47%	0.472	S	S	.	.	H	α-helix	trans	-59.5	-44	174.9	0	0	0	0	0	112.2	R444 R450 N451 G452	R444-A448 VanDerWaalsContact O-CB 3.26Å; R444-A448 WeakPolarHBondContact O-CB 3.34Å; R444-A448 PolarHBondContact O-N 3.47Å; A448-R450 VanDerWaalsContact C-N 3.31Å; A448-R450 PolarHBondContact O-N 3.47Å; A448-N451 PolarHBondContact O-N 3.46Å; A448-G452 PolarHBondContact O-N 3.24Å
449	A	74.9	Confident	69.7	Low	56 Å²	56	97.8 Å²	97.8	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-65.6	-29.8	177.6	0	0	0	0	0	113.6	H445 T446 V447 R453	H445-A449 WeakPolarHBondContact O-CB 3.39Å; H445-A449 PolarHBondContact O-N 2.94Å; T446-A449 PolarHBondContact O-N 2.73Å; V447-A449 PolarHBondContact O-N 3.36Å; A449-R453 WeakPolarHBondContact O-CG 3.28Å; A449-R453 PolarHBondContact O-N 3.37Å
450	R	75.9	Confident	66.9	Low	106 Å²	106	101.7 Å²	101.7	40%	0.4	55%	0.551	S	S	.	*	H	α-helix	trans	-72.2	-47.9	173.8	-72	159.7	66.8	169.5	11	111.3	A412 T446 V447 A448 G452 R453 A454	A412-R450 PolarHBondContact O-NH1 2.65Å; A412-R450 PolarHBondContact O-NH2 2.84Å; T446-R450 VanDerWaalsContact O-CD 3.32Å; T446-R450 WeakPolarHBondContact O-CD 3.43Å; T446-R450 VanDerWaalsContact O-CG 3.22Å; T446-R450 WeakPolarHBondContact O-CG 3.44Å; T446-R450 PolarHBondContact O-N 2.67Å; V447-R450 PolarHBondContact O-N 3.21Å; A448-R450 VanDerWaalsContact C-N 3.31Å; A448-R450 PolarHBondContact O-N 3.47Å; R450-G452 PolarHBondContact O-N 3.26Å; R450-R453 PolarHBondContact O-N 3.45Å; R450-R453 VanDerWaalsContact O-N 3.16Å; R450-A454 PolarHBondContact O-N 3.19Å
451	N	72.6	Confident	64.2	Low	111 Å²	111	102.7 Å²	102.7	59%	0.594	57%	0.571	S	S	*	*	H	α-helix	trans	-64.4	-40.2	178.7	-66.1	-3.9	0	0	0	111.5	V447 A448 R453 A454	V447-N451 PolarHBondContact O-N 2.98Å; A448-N451 PolarHBondContact O-N 3.46Å; N451-R453 PolarHBondContact O-N 3.18Å; N451-A454 WeakPolarHBondContact O-CB 3.49Å; N451-A454 PolarHBondContact O-N 3.5Å; N451-A454 VanDerWaalsContact O-N 3.08Å
452	G	65	Low	61.6	Low	64 Å²	64	106.2 Å²	106.2	66%	0.66	59%	0.593	S	S	*	*	H	α-helix	trans	-65.2	-22.4	175.2	0	0	0	0	0	114.5	A448 R450	A448-G452 PolarHBondContact O-N 3.24Å; R450-G452 PolarHBondContact O-N 3.26Å
453	R	59.9	Low	59.1	Low	209 Å²	209	113.9 Å²	113.9	79%	0.789	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-8.4	172.9	-77.5	179.1	173.2	173.6	-0.7	113.9	A449 R450 N451	A449-R453 WeakPolarHBondContact O-CG 3.28Å; A449-R453 PolarHBondContact O-N 3.37Å; R450-R453 PolarHBondContact O-N 3.45Å; R450-R453 VanDerWaalsContact O-N 3.16Å; N451-R453 PolarHBondContact O-N 3.18Å
454	A	52.3	Low	56.5	Low	69 Å²	69	117.8 Å²	117.8	57%	0.57	66%	0.658	S	S	*	*	S	Bend	trans	-81	-18.7	-176.2	0	0	0	0	0	114.1	R450 N451 P456	R450-A454 PolarHBondContact O-N 3.19Å; N451-A454 WeakPolarHBondContact O-CB 3.49Å; N451-A454 PolarHBondContact O-N 3.5Å; N451-A454 VanDerWaalsContact O-N 3.08Å; A454-P456 VanDerWaalsContact C-CD 3.43Å; A454-P456 WeakPolarHBondContact O-CD 3.43Å
455	N	41.5	Very low	54.2	Low	145 Å²	145	114.4 Å²	114.4	78%	0.775	67%	0.672	S	S	*	*			trans	-116.4	67.9	-179.5	-68.1	10.5	0	0	0	114.5
456	P	39.8	Very low	52	Low	108 Å²	108	118.5 Å²	118.5	70%	0.701	69%	0.689	S	S	*	*			trans	-84.4	-14.2	167.4	-10.1	29	0	0	0	114.5	A454	A454-P456 VanDerWaalsContact C-CD 3.43Å; A454-P456 WeakPolarHBondContact O-CD 3.43Å
457	E	42.4	Very low	50	Low	185 Å²	185	126.4 Å²	126.4	86%	0.864	73%	0.725	S	S	*	*	S	Bend	trans	-121.1	53.6	-160.9	-60.8	-167.8	151.1	0	0	114.9
458	E	38.9	Very low	48.6	Very low	186 Å²	186	130.2 Å²	130.2	87%	0.869	75%	0.748	S	S	*	*	S	Bend	trans	-144.9	29.2	169.4	-141.2	173.8	-138.7	0	0	116
459	Q	35.1	Very low	47.3	Very low	205 Å²	205	131.5 Å²	131.5	96%	0.958	76%	0.759	S	S	*	*	S	Bend	trans	-136.5	69.6	167.4	-68.9	-166.5	4.4	0	0	111.7
460	G	33.3	Very low	46.2	Very low	82 Å²	82	133.4 Å²	133.4	85%	0.845	77%	0.774	S	S	*	*	S	Bend	trans	-171.7	74	-177.4	0	0	0	0	0	116.4
461	G	33.5	Very low	44.9	Very low	73 Å²	73	133.2 Å²	133.2	75%	0.753	79%	0.787	S	S	*	*			trans	102.6	107.2	156.8	0	0	0	0	0	117.4
462	N	35	Very low	43.6	Very low	154 Å²	154	134.3 Å²	134.3	82%	0.824	80%	0.798	S	S	*	*			trans	-164.7	100.8	140.5	-109	-32.3	0	0	0	111.2
463	M	41.3	Very low	42.7	Very low	193 Å²	193	136.4 Å²	136.4	95%	0.951	80%	0.799	S	S	*	*			trans	-145	81.7	162.7	-82.8	-159.6	178.8	0	0	110
464	T	38.2	Very low	41.8	Very low	127 Å²	127	132.5 Å²	132.5	78%	0.779	80%	0.799	S	S	*	*			trans	-128.7	71.4	168.3	40.1	0	0	0	0	109.2
465	G	41.8	Very low	41.8	Very low	86 Å²	86	133.6 Å²	133.6	89%	0.887	81%	0.808	S	S	*	*			trans	-59.2	135.9	172.4	0	0	0	0	0	111.2
466	K	42.5	Very low	42.1	Very low	204 Å²	204	132.3 Å²	132.3	89%	0.887	81%	0.808	S	S	*	*			trans	-102.5	169.2	-178.9	-159.2	176.7	-178.5	-176.5	0	109.7
467	E	40.9	Very low	42.3	Very low	177 Å²	177	132.6 Å²	132.6	83%	0.827	81%	0.808	S	S	*	*			trans	102.8	84.6	155.9	-149.6	152.6	-174.4	0	0	119.8
468	V	44.3	Very low	42.2	Very low	135 Å²	135	130.1 Å²	130.1	82%	0.818	81%	0.805	S	S	*	*				54.3	122.4	119.6	-178.2	0	0	0	0	121.8
469	A	44.4	Very low	42.3	Very low	87 Å²	87	125.8 Å²	125.8	72%	0.719	80%	0.802	S	S	*	*			trans	71.5	93.8	148.6	0	0	0	0	0	122.7
470	A	51.1	Low	42.7	Very low	96 Å²	96	121.5 Å²	121.5	79%	0.793	79%	0.789	S	S	*	*				43.2	163.8	105.4	0	0	0	0	0	122.1
471	P	49.7	Very low	43.1	Very low	102 Å²	102	126.2 Å²	126.2	66%	0.662	79%	0.789	S	S	*	*			cis	-141.3	147	2.7	39.3	-19.5	0	0	0	118.8
472	T	45.3	Very low	43.5	Very low	133 Å²	133	128 Å²	128	82%	0.816	78%	0.781	S	S	*	*			trans	62.4	169.3	146.5	53.2	0	0	0	0	120.7
473	P	45.5	Very low	43.7	Very low	108 Å²	108	130 Å²	130	70%	0.701	78%	0.777	S	S	*	*			cis	-131.6	178	0.5	30.5	-7.3	0	0	0	118.2
474	T	41.9	Very low	43.9	Very low	127 Å²	127	127.6 Å²	127.6	78%	0.779	76%	0.764	S	S	*	*			trans	67.5	88.5	149.2	42.1	0	0	0	0	123.6
475	A	52.1	Low	44.1	Very low	93 Å²	93	129.1 Å²	129.1	77%	0.769	77%	0.766	S	S	*	*				62.1	170.4	101.2	0	0	0	0	0	121.4
476	P	47.7	Very low	43.9	Very low	118 Å²	118	128.3 Å²	128.3	77%	0.766	76%	0.757	S	S	*	*				-138.5	-161.5	-109.7	37.7	-14	0	0	0	115.5
477	T	42.5	Very low	44	Very low	114 Å²	114	122.3 Å²	122.3	70%	0.699	75%	0.746	S	S	*	*				145.1	112.7	128.6	-56.3	0	0	0	0	116.6
478	T	40.7	Very low	43.9	Very low	132 Å²	132	123.2 Å²	123.2	81%	0.81	75%	0.748	S	S	*	*			trans	41.1	138	152.6	64.7	0	0	0	0	125.5
479	A	41.5	Very low	43.8	Very low	96 Å²	96	124.6 Å²	124.6	79%	0.793	75%	0.745	S	S	*	*				145.1	148.5	127.5	0	0	0	0	0	111.3
480	V	43.1	Very low	43.6	Very low	115 Å²	115	129.1 Å²	129.1	70%	0.697	75%	0.751	S	S	*	*			cis	165.7	145.6	-26.6	141.5	0	0	0	0	105.3
481	E	41.4	Very low	43	Very low	181 Å²	181	129.8 Å²	129.8	85%	0.846	75%	0.749	S	S	*	*			trans	69.9	149.7	167.3	-82	163.2	-169.5	0	0	119.5
482	D	42	Very low	42.5	Very low	109 Å²	109	128.6 Å²	128.6	58%	0.583	75%	0.748	S	S	*	*			cis	-162.7	169.3	-15.1	-163.6	4.7	0	0	0	110.5
483	R	40.4	Very low	42.1	Very low	196 Å²	196	130.6 Å²	130.6	74%	0.74	75%	0.753	S	S	*	*			trans	67.7	152.1	154.4	-80.1	168.7	-144.3	-144.9	1.5	120.7
484	Q	44.7	Very low	42	Very low	143 Å²	143	130.2 Å²	130.2	67%	0.668	76%	0.759	S	S	*	*			cis	-168.5	160.6	-17.6	-133.2	177.8	-39.2	0	0	111.7
485	I	42.8	Very low	41.9	Very low	159 Å²	159	131.3 Å²	131.3	82%	0.815	77%	0.765	S	S	*	*			trans	70.4	138	157.6	-58.9	156.4	0	0	0	116.6
486	G	38.4	Very low	41.6	Very low	69 Å²	69	129.7 Å²	129.7	71%	0.711	76%	0.757	S	S	*	*			cis	-171.5	-176.2	3	0	0	0	0	0	115.2
487	A	42.7	Very low	41.4	Very low	79 Å²	79	130.1 Å²	130.1	65%	0.653	76%	0.758	S	S	*	*			trans	-73.7	171.9	-166.1	0	0	0	0	0	115.7
488	F	39.9	Very low	41.4	Very low	196 Å²	196	130 Å²	130	86%	0.86	76%	0.761	S	S	*	*				-158.6	176.3	65.6	-98.8	-83.2	0	0	0	117.2
489	H	42.1	Very low	42.2	Very low	164 Å²	164	133.3 Å²	133.3	76%	0.759	79%	0.79	S	S	*	*			trans	-66.6	163.5	-168.1	-71.4	-128.9	0	0	0	116
490	H	39.8	Very low	42.2	Very low	182 Å²	182	135.2 Å²	135.2	84%	0.843	79%	0.79	S	S	*	*			cis	91.9	120.5	27.4	-120.7	-68.6	0	0	0	117.1
491	S	39.5	Very low	42.2	Very low	109 Å²	109	136.2 Å²	136.2	76%	0.762	80%	0.795	S	S	*	*			trans	126	127.6	163.4	-154.5	0	0	0	0	111.8
492	A	38.9	Very low	42.2	Very low	77 Å²	77	133.7 Å²	133.7	64%	0.636	79%	0.792	S	S	*	*			cis	97.7	123.9	16.2	0	0	0	0	0	116.7
493	L	36.6	Very low	42.2	Very low	175 Å²	175	135.2 Å²	135.2	92%	0.916	80%	0.804	S	S	*	*			trans	57.9	121.2	153.5	-69.2	162.9	0	0	0	122
494	A	43.1	Very low	42.4	Very low	101 Å²	101	131.4 Å²	131.4	84%	0.835	81%	0.808	S	S	*	*				-165.7	155.7	130	0	0	0	0	0	111.5
495	V	40	Very low	42.2	Very low	150 Å²	150	130.6 Å²	130.6	91%	0.909	82%	0.818	S	S	*	*			trans	-140.6	139.6	173.6	174	0	0	0	0	109.5
496	G	45	Very low	42.2	Very low	58 Å²	58	128.6 Å²	128.6	60%	0.598	82%	0.818	S	S	*	*			trans	172.8	110.7	169.7	0	0	0	0	0	109.8
497	T	45.3	Very low	42.4	Very low	128 Å²	128	133.2 Å²	133.2	79%	0.785	83%	0.826	S	S	*	*				78.9	116	68.2	60.1	0	0	0	0	115.2
498	S	42.2	Very low	42.4	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	84%	0.84	S	S	*	*			trans	55.4	112.1	153.8	60.9	0	0	0	0	120.4
499	S	56.8	Low	42.7	Very low	202 Å²	202	132.4 Å²	132.4	100%	1.413	84%	0.839	S	S	*	*				-140.6	0	108.9	-67.8	0	0	0	0	108.8

Retrieved 499 of 499 residues in 1173.2 ms (Link to these results)

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