A0A3Q0KSE3_SCHMA Loading...

Mic1 domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KSE3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 643 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	83.9	Confident	84.7	Confident	100 Å²	100	88.5 Å²	88.5	49%	0.493	51%	0.506	S	S	.	.				0	130.3	0	-170.9	169.3	67.7	0	0	110.8	R17 I18 V24	M1-R17 WeakPolarHBondContact O-CA 3.47Å; M1-I18 HydrophobicContact CB-CG1 4.16Å; M1-I18 HydrophobicContact CE-CD1 3.47Å; M1-I18 VanDerWaalsContact CE-CD1 3.47Å; M1-I18 HydrophobicContact CE-CG1 3.93Å; M1-I18 PolarHBondContact N-O 3.04Å; M1-I18 PolarHBondContact O-N 3.45Å; M1-V24 HydrophobicContact CE-CG2 3.84Å
2	G	87.8	Confident	84.6	Confident	61 Å²	61	84.9 Å²	84.9	63%	0.629	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	137.4	174.8	0	0	0	0	0	111.3
3	V	90.1	Very high	84.6	Confident	27 Å²	27	84.5 Å²	84.5	16%	0.164	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.7	-178.7	-175.8	0	0	0	0	108.8	V5 F16 I18	V3-V5 HydrophobicContact CG1-CG2 3.91Å; V3-F16 HydrophobicContact CB-CD2 4.13Å; V3-F16 HydrophobicContact CB-CE2 3.75Å; V3-F16 HydrophobicContact CB-CZ 3.96Å; V3-F16 HydrophobicContact CG1-CE1 4.32Å; V3-F16 HydrophobicContact CG1-CE2 3.96Å; V3-F16 HydrophobicContact CG1-CZ 3.71Å; V3-F16 HydrophobicContact CG2-CE2 4.11Å; V3-F16 PolarHBondContact N-O 3.3Å; V3-F16 PolarHBondContact O-N 2.82Å; V3-F16 VanDerWaalsContact O-N 3.11Å; V3-I18 HydrophobicContact CG2-CD1 3.77Å; V3-I18 HydrophobicContact CG2-CG1 3.79Å; V3-I18 HydrophobicContact CG2-CG2 4.39Å
4	N	90	Very high	84.8	Confident	87 Å²	87	78.9 Å²	78.9	47%	0.465	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	118.9	173.2	-172.2	-40	0	0	0	108	K6 L14 N15	N4-K6 WeakPolarHBondContact OD1-CE 3.29Å; N4-K6 WeakPolarHBondContact OD1-CG 3.37Å; N4-L14 WeakPolarHBondContact CA-O 3.37Å; N4-N15 VanDerWaalsContact CG-OD1 3.23Å; N4-N15 PolarHBondContact ND2-OD1 3.28Å
5	V	90.3	Very high	85.1	Confident	38 Å²	38	80.9 Å²	80.9	23%	0.23	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	128.7	179.8	-173.3	0	0	0	0	107.6	V3 V13 L14 F16 F29	V3-V5 HydrophobicContact CG1-CG2 3.91Å; V5-V13 WeakPolarHBondContact O-CA 3.29Å; V5-L14 HydrophobicContact CB-CB 4.09Å; V5-L14 HydrophobicContact CG2-CB 4.47Å; V5-L14 PolarHBondContact N-O 3.47Å; V5-L14 PolarHBondContact O-N 3.06Å; V5-F16 HydrophobicContact CG2-CE1 3.59Å; V5-F16 HydrophobicContact CG2-CZ 3.86Å; V5-F29 HydrophobicContact CG1-CE2 4.22Å; V5-F29 HydrophobicContact CG2-CE2 3.99Å
6	K	88.2	Confident	85.4	Confident	153 Å²	153	76.7 Å²	76.7	67%	0.665	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	142.7	177.8	-59.3	-178.3	-178.2	176.7	0	109	N4 L12	N4-K6 WeakPolarHBondContact OD1-CE 3.29Å; N4-K6 WeakPolarHBondContact OD1-CG 3.37Å; K6-L12 WeakPolarHBondContact CA-O 3.38Å
7	S	85.2	Confident	85.5	Confident	48 Å²	48	84.8 Å²	84.8	34%	0.336	46%	0.457	S	S	.	.			trans	-95.6	146.3	168.2	176.5	0	0	0	0	110.3	V9 N10 L12	S7-V9 PolarHBondContact OG-N 3.44Å; S7-N10 VanDerWaalsContact CB-O 3.31Å; S7-N10 WeakPolarHBondContact CB-O 3.1Å; S7-N10 PolarHBondContact OG-N 3.5Å; S7-N10 VanDerWaalsContact OG-N 3.17Å; S7-L12 PolarHBondContact N-O 3.27Å; S7-L12 VanDerWaalsContact N-O 3.17Å
8	V	79.5	Confident	85.6	Confident	62 Å²	62	80.5 Å²	80.5	38%	0.376	43%	0.434	S	S	.	.	S	Bend	trans	-82.5	-22.8	174.1	-174.2	0	0	0	0	110.9	V306 L317	V8-V306 HydrophobicContact CG2-CG1 4.37Å; V8-L317 HydrophobicContact CG1-CB 4.05Å; V8-L317 HydrophobicContact CG1-CD1 4.43Å
9	V	77.6	Confident	85.6	Confident	119 Å²	119	81.5 Å²	81.5	72%	0.721	44%	0.439	S	S	*	.	S	Bend	trans	-100.9	-35.3	-173.3	-171.9	0	0	0	0	111.7	S7	S7-V9 PolarHBondContact OG-N 3.44Å
10	N	80	Confident	85.6	Confident	107 Å²	107	83.8 Å²	83.8	57%	0.572	45%	0.451	S	S	*	.	S	Bend	trans	-121.2	155.5	-175.7	-60.2	-9.3	0	0	0	110.1	S7 L12	S7-N10 VanDerWaalsContact CB-O 3.31Å; S7-N10 WeakPolarHBondContact CB-O 3.1Å; S7-N10 PolarHBondContact OG-N 3.5Å; S7-N10 VanDerWaalsContact OG-N 3.17Å; N10-L12 HydrophobicContact CB-CB 4.47Å; N10-L12 PolarHBondContact O-N 3.35Å
11	D	79.3	Confident	85.6	Confident	171 Å²	171	85.2 Å²	85.2	91%	0.914	46%	0.455	S	S	*	.			trans	-71.5	23.4	173.7	-64	-37.9	0	0	0	113.8	V13	D11-V13 PolarHBondContact O-N 3.43Å
12	L	82.6	Confident	85.7	Confident	46 Å²	46	82.5 Å²	82.5	24%	0.241	45%	0.452	C	S	.	.			trans	-69.7	116.1	177.6	-175.9	72.2	0	0	0	109.4	K6 S7 N10 L14	K6-L12 WeakPolarHBondContact CA-O 3.38Å; S7-L12 PolarHBondContact N-O 3.27Å; S7-L12 VanDerWaalsContact N-O 3.17Å; N10-L12 HydrophobicContact CB-CB 4.47Å; N10-L12 PolarHBondContact O-N 3.35Å; L12-L14 HydrophobicContact CD1-CD2 4Å; L12-L14 HydrophobicContact CD1-CG 4.24Å; L12-L14 HydrophobicContact CD2-CD1 4.33Å; L12-L14 HydrophobicContact CD2-CG 4.43Å; L12-L14 HydrophobicContact CG-CD2 4.49Å; L12-L14 HydrophobicContact CG-CG 4.19Å
13	V	85.1	Confident	85.8	Confident	80 Å²	80	86.6 Å²	86.6	49%	0.485	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	116.4	169.8	-176.6	0	0	0	0	108.5	V5 D11	V5-V13 WeakPolarHBondContact O-CA 3.29Å; D11-V13 PolarHBondContact O-N 3.43Å
14	L	87.2	Confident	85.9	Confident	5 Å²	5	87.5 Å²	87.5	3%	0.026	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.7	174.3	-55.1	172.6	0	0	0	109.2	N4 V5 L12 F16 F29 N53	N4-L14 WeakPolarHBondContact CA-O 3.37Å; V5-L14 HydrophobicContact CB-CB 4.09Å; V5-L14 HydrophobicContact CG2-CB 4.47Å; V5-L14 PolarHBondContact N-O 3.47Å; V5-L14 PolarHBondContact O-N 3.06Å; L12-L14 HydrophobicContact CD1-CD2 4Å; L12-L14 HydrophobicContact CD1-CG 4.24Å; L12-L14 HydrophobicContact CD2-CD1 4.33Å; L12-L14 HydrophobicContact CD2-CG 4.43Å; L12-L14 HydrophobicContact CG-CD2 4.49Å; L12-L14 HydrophobicContact CG-CG 4.19Å; L14-F16 HydrophobicContact CB-CD1 4.05Å; L14-F16 HydrophobicContact CB-CE1 4.01Å; L14-F29 HydrophobicContact CD1-CE2 4.42Å; L14-F29 HydrophobicContact CD1-CZ 4.03Å; L14-N53 HydrophobicContact CD2-CB 3.46Å; L14-N53 VanDerWaalsContact CD2-CB 3.46Å
15	N	89.4	Confident	86.1	Confident	109 Å²	109	86.6 Å²	86.6	58%	0.583	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	116.6	174	-65.5	-65.3	0	0	0	108.6	N4	N4-N15 VanDerWaalsContact CG-OD1 3.23Å; N4-N15 PolarHBondContact ND2-OD1 3.28Å
16	F	89.8	Confident	86.4	Confident	14 Å²	14	86.1 Å²	86.1	6%	0.061	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	170.2	179.3	55.6	-89.2	0	0	0	110.9	V3 V5 L14 I18 F29 L36 F50 P55	V3-F16 HydrophobicContact CB-CD2 4.13Å; V3-F16 HydrophobicContact CB-CE2 3.75Å; V3-F16 HydrophobicContact CB-CZ 3.96Å; V3-F16 HydrophobicContact CG1-CE1 4.32Å; V3-F16 HydrophobicContact CG1-CE2 3.96Å; V3-F16 HydrophobicContact CG1-CZ 3.71Å; V3-F16 HydrophobicContact CG2-CE2 4.11Å; V3-F16 PolarHBondContact N-O 3.3Å; V3-F16 PolarHBondContact O-N 2.82Å; V3-F16 VanDerWaalsContact O-N 3.11Å; V5-F16 HydrophobicContact CG2-CE1 3.59Å; V5-F16 HydrophobicContact CG2-CZ 3.86Å; L14-F16 HydrophobicContact CB-CD1 4.05Å; L14-F16 HydrophobicContact CB-CE1 4.01Å; F16-I18 HydrophobicContact CD2-CG2 3.75Å; F16-I18 HydrophobicContact CE2-CG2 3.68Å; F16-F29 HydrophobicContact CE1-CE2 4.47Å; F16-F29 AromaticContact CE1-CZ 3.97Å; F16-F29 HydrophobicContact CE1-CZ 3.97Å; F16-F29 HydrophobicContact CZ-CE2 4.31Å; F16-F29 AromaticContact CZ-CZ 3.92Å; F16-F29 HydrophobicContact CZ-CZ 3.92Å; F16-L36 HydrophobicContact CE2-CD2 3.59Å; F16-L36 HydrophobicContact CZ-CD2 3.73Å; F16-F50 AromaticContact CD1-CE1 3.73Å; F16-F50 HydrophobicContact CD1-CE1 3.73Å; F16-F50 AromaticContact CD1-CZ 3.78Å; F16-F50 HydrophobicContact CD1-CZ 3.78Å; F16-F50 AromaticContact CD2-CZ 3.88Å; F16-F50 HydrophobicContact CD2-CZ 3.88Å; F16-F50 AromaticContact CE1-CE1 3.95Å; F16-F50 HydrophobicContact CE1-CE1 3.95Å; F16-F50 AromaticContact CE1-CZ 3.73Å; F16-F50 HydrophobicContact CE1-CZ 3.73Å; F16-F50 AromaticContact CE2-CZ 3.83Å; F16-F50 HydrophobicContact CE2-CZ 3.83Å; F16-F50 HydrophobicContact CG-CE1 4.05Å; F16-F50 AromaticContact CG-CZ 3.86Å; F16-F50 HydrophobicContact CG-CZ 3.86Å; F16-F50 HydrophobicContact CZ-CE1 4.44Å; F16-F50 AromaticContact CZ-CZ 3.77Å; F16-F50 HydrophobicContact CZ-CZ 3.77Å; F16-P55 HydrophobicContact CB-CG 4.01Å
17	R	86.9	Confident	86.7	Confident	214 Å²	214	82.5 Å²	82.5	81%	0.808	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.5	139.8	174.1	-68.8	-175.9	173.4	-171.1	-1.3	108.9	M1	M1-R17 WeakPolarHBondContact O-CA 3.47Å
18	I	87.6	Confident	87.1	Confident	8 Å²	8	83.7 Å²	83.7	4%	0.041	44%	0.44	C	S	.	.			trans	-117.7	156	170.3	61.7	176.7	0	0	0	109.6	M1 V3 F16 I38 L48	M1-I18 HydrophobicContact CB-CG1 4.16Å; M1-I18 HydrophobicContact CE-CD1 3.47Å; M1-I18 VanDerWaalsContact CE-CD1 3.47Å; M1-I18 HydrophobicContact CE-CG1 3.93Å; M1-I18 PolarHBondContact N-O 3.04Å; M1-I18 PolarHBondContact O-N 3.45Å; V3-I18 HydrophobicContact CG2-CD1 3.77Å; V3-I18 HydrophobicContact CG2-CG1 3.79Å; V3-I18 HydrophobicContact CG2-CG2 4.39Å; F16-I18 HydrophobicContact CD2-CG2 3.75Å; F16-I18 HydrophobicContact CE2-CG2 3.68Å; I18-I38 HydrophobicContact CD1-CD1 3.93Å; I18-I38 HydrophobicContact CG2-CD1 4.19Å; I18-L48 HydrophobicContact CG2-CD2 4.06Å
19	D	85	Confident	87.8	Confident	99 Å²	99	82.6 Å²	82.6	53%	0.529	43%	0.43	S	S	.	.			trans	-62.2	138.9	176.3	-66.9	-21.7	0	0	0	110.5	Q21 R40	D19-Q21 HydrophobicContact CB-CG 4.18Å; D19-Q21 PolarHBondContact O-N 3.39Å; D19-R40 PolarHBondContact O-NH2 3.24Å
20	D	85.5	Confident	88.6	Confident	127 Å²	127	77 Å²	77	68%	0.679	40%	0.396	S	S	*	.			trans	-85.6	97.6	176.4	-170.7	2.6	0	0	0	109
21	Q	86.3	Confident	89	Confident	114 Å²	114	76.8 Å²	76.8	53%	0.533	39%	0.392	S	S	.	.			trans	-121.8	30.7	-178.6	-61.9	-167.1	-1.4	0	0	111.6	D19	D19-Q21 HydrophobicContact CB-CG 4.18Å; D19-Q21 PolarHBondContact O-N 3.39Å
22	G	85.9	Confident	89.5	Confident	43 Å²	43	71 Å²	71	44%	0.443	36%	0.361	S	S	.	.	S	Bend	trans	97.8	-167.3	-179.6	0	0	0	0	0	114
23	E	90.6	Very high	89.8	Confident	148 Å²	148	71.8 Å²	71.8	69%	0.692	37%	0.366	S	S	*	.			trans	-62.8	140	-173.6	-173.2	175.5	-168.5	0	0	112.3	R40	E23-R40 WeakPolarHBondContact O-CA 3.38Å
24	V	92.6	Very high	90.1	Very high	45 Å²	45	73 Å²	73	27%	0.273	36%	0.364	S	S	.	.			trans	-100	113.7	174.9	177.2	0	0	0	0	108.7	M1 I27 I38 R40	M1-V24 HydrophobicContact CE-CG2 3.84Å; V24-I27 HydrophobicContact CG1-CB 4.09Å; V24-I38 HydrophobicContact CG1-CG2 3.87Å; V24-I38 HydrophobicContact CG2-CG2 4.01Å; V24-R40 HydrophobicContact CG2-CG 4.42Å
25	L	94.3	Very high	90.4	Very high	69 Å²	69	72.7 Å²	72.7	36%	0.361	36%	0.363	S	S	.	.	S	Bend	trans	-82.4	-37	179.5	-58.3	175.7	0	0	0	112.1	Q39	L25-Q39 HydrophobicContact CB-CG 4.35Å; L25-Q39 WeakPolarHBondContact CB-O 3.49Å; L25-Q39 HydrophobicContact CD1-CG 4.43Å; L25-Q39 PolarHBondContact N-O 2.86Å
26	S	94.8	Very high	90.7	Very high	27 Å²	27	67.5 Å²	67.5	19%	0.189	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	142.1	179.8	171.2	0	0	0	0	110.1	Q39	S26-Q39 PolarHBondContact N-O 3Å; S26-Q39 PolarHBondContact O-N 3.18Å
27	I	94.8	Very high	90.9	Very high	78 Å²	78	66.9 Å²	66.9	40%	0.4	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	127	179	-172.9	165.4	0	0	0	109.1	V24 L36 G37 I38	V24-I27 HydrophobicContact CG1-CB 4.09Å; I27-L36 HydrophobicContact CD1-CD1 4.05Å; I27-L36 HydrophobicContact CD1-CD2 4.28Å; I27-L36 HydrophobicContact CG1-CD1 3.57Å; I27-L36 HydrophobicContact CG1-CG 4.33Å; I27-G37 WeakPolarHBondContact CA-O 3.42Å; I27-I38 HydrophobicContact CD1-CG1 4.35Å; I27-I38 HydrophobicContact CG1-CG1 4.3Å
28	K	95.3	Very high	91.4	Very high	73 Å²	73	56.7 Å²	56.7	32%	0.317	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	131	-175.6	-59.8	-177.6	-177.2	176.9	0	111.8	G37 F74 W76	K28-G37 PolarHBondContact N-O 3.2Å; K28-G37 PolarHBondContact O-N 2.98Å; K28-F74 HydrophobicContact CB-CE2 3.84Å; K28-F74 HydrophobicContact CB-CZ 3.96Å; K28-F74 HydrophobicContact CD-CE2 4.16Å; K28-F74 HydrophobicContact CD-CZ 4.27Å; K28-F74 HydrophobicContact CG-CE2 4.25Å; K28-F74 HydrophobicContact CG-CZ 4.09Å; K28-F74 PolarHBondContact NZ-O 3.36Å; K28-W76 PolarHBondContact O-NE1 3.29Å
29	F	93.7	Very high	91.7	Very high	39 Å²	39	56.7 Å²	56.7	17%	0.171	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	151.9	166.5	-82.4	-81.1	0	0	0	111.6	V5 L14 F16 N33 I35 L36 F50 W76	V5-F29 HydrophobicContact CG1-CE2 4.22Å; V5-F29 HydrophobicContact CG2-CE2 3.99Å; L14-F29 HydrophobicContact CD1-CE2 4.42Å; L14-F29 HydrophobicContact CD1-CZ 4.03Å; F16-F29 HydrophobicContact CE1-CE2 4.47Å; F16-F29 AromaticContact CE1-CZ 3.97Å; F16-F29 HydrophobicContact CE1-CZ 3.97Å; F16-F29 HydrophobicContact CZ-CE2 4.31Å; F16-F29 AromaticContact CZ-CZ 3.92Å; F16-F29 HydrophobicContact CZ-CZ 3.92Å; F29-N33 WeakPolarHBondContact CB-OD1 3.05Å; F29-N33 HydrophobicContact CD1-CB 4.26Å; F29-I35 CarbonylContact C-O 3.55Å; F29-I35 WeakPolarHBondContact CA-O 3.33Å; F29-L36 HydrophobicContact CD1-CB 4.11Å; F29-L36 HydrophobicContact CD1-CD1 4.17Å; F29-L36 HydrophobicContact CD2-CD1 3.76Å; F29-L36 HydrophobicContact CE1-CB 3.81Å; F29-L36 HydrophobicContact CE1-CD1 4.08Å; F29-L36 HydrophobicContact CE1-CG 4.4Å; F29-L36 HydrophobicContact CE2-CD1 3.62Å; F29-L36 HydrophobicContact CG-CD1 4.03Å; F29-L36 HydrophobicContact CZ-CB 4.18Å; F29-L36 HydrophobicContact CZ-CD1 3.8Å; F29-L36 HydrophobicContact CZ-CD2 4.22Å; F29-L36 HydrophobicContact CZ-CG 4.3Å; F29-F50 HydrophobicContact CE1-CD1 4.42Å; F29-F50 AromaticContact CE1-CD2 3.85Å; F29-F50 HydrophobicContact CE1-CD2 3.85Å; F29-F50 HydrophobicContact CE1-CE1 4.33Å; F29-F50 AromaticContact CE1-CE2 3.75Å; F29-F50 HydrophobicContact CE1-CE2 3.75Å; F29-F50 HydrophobicContact CE1-CG 4.2Å; F29-F50 AromaticContact CE1-CZ 4Å; F29-F50 HydrophobicContact CE1-CZ 4Å; F29-F50 HydrophobicContact CZ-CE1 4.29Å; F29-F50 HydrophobicContact CZ-CE2 4.06Å; F29-F50 AromaticContact CZ-CZ 3.91Å; F29-F50 HydrophobicContact CZ-CZ 3.91Å; F29-W76 VanDerWaalsContact C-CD1 3.5Å; F29-W76 PolarHBondContact O-NE1 3.1Å
30	S	93.9	Very high	92	Very high	1 Å²	1	53 Å²	53	1%	0.007	27%	0.272	C	S	.	.			trans	-60.9	159.1	160.6	63.2	0	0	0	0	110.4	N32 N33 K34 I35 N79	S30-N32 PolarHBondContact O-N 3.29Å; S30-N32 VanDerWaalsContact O-N 3.07Å; S30-N32 PolarHBondContact OG-OD1 3.21Å; S30-N33 PolarHBondContact O-N 2.95Å; S30-K34 PolarHBondContact OG-N 2.96Å; S30-I35 PolarHBondContact N-O 3.34Å; S30-I35 PolarHBondContact OG-N 3.44Å; S30-I35 PolarHBondContact OG-O 2.89Å; S30-N79 WeakPolarHBondContact CB-O 3.27Å
31	E	88.6	Confident	92.3	Very high	103 Å²	103	49.8 Å²	49.8	48%	0.481	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-32.9	-175.1	-66.8	173.2	174.9	0	0	113.7	H122	E31-H122 IonicContact OE1-CE1 3.55Å
32	N	89.1	Confident	92.7	Very high	49 Å²	49	49.1 Å²	49.1	26%	0.262	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	9.6	176.8	63.8	4.9	0	0	0	114.9	S30 K34 N79	S30-N32 PolarHBondContact O-N 3.29Å; S30-N32 VanDerWaalsContact O-N 3.07Å; S30-N32 PolarHBondContact OG-OD1 3.21Å; N32-K34 HydrophobicContact CB-CG 4.36Å; N32-K34 PolarHBondContact O-N 2.94Å; N32-K34 VanDerWaalsContact O-N 3.16Å; N32-K34 WeakPolarHBondContact OD1-CB 3.41Å; N32-K34 PolarHBondContact OD1-N 3.1Å; N32-K34 VanDerWaalsContact OD1-N 3.14Å; N32-N79 VanDerWaalsContact CB-OD1 3.25Å; N32-N79 WeakPolarHBondContact CB-OD1 3.37Å; N32-N79 VanDerWaalsContact CG-OD1 3.28Å; N32-N79 PolarHBondContact N-OD1 3.21Å; N32-N79 PolarHBondContact ND2-OD1 3.24Å
33	N	88.9	Confident	93	Very high	63 Å²	63	53.7 Å²	53.7	34%	0.337	26%	0.258	S	S	.	.	S	Bend	trans	56.8	23.1	-177	-59.2	-42.9	0	0	0	115.4	F29 S30	F29-N33 WeakPolarHBondContact CB-OD1 3.05Å; F29-N33 HydrophobicContact CD1-CB 4.26Å; S30-N33 PolarHBondContact O-N 2.95Å
34	K	91.5	Very high	93.2	Very high	104 Å²	104	47.3 Å²	47.3	45%	0.452	23%	0.23	S	C	.	.	S	Bend	trans	-90.9	-20.1	179.9	-66.3	-166	-178.9	-174.8	0	114.4	S30 N32 F50	S30-K34 PolarHBondContact OG-N 2.96Å; N32-K34 HydrophobicContact CB-CG 4.36Å; N32-K34 PolarHBondContact O-N 2.94Å; N32-K34 VanDerWaalsContact O-N 3.16Å; N32-K34 WeakPolarHBondContact OD1-CB 3.41Å; N32-K34 PolarHBondContact OD1-N 3.1Å; N32-K34 VanDerWaalsContact OD1-N 3.14Å; K34-F50 PolarHBondContact O-N 3.37Å
35	I	94.1	Very high	93.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	127.8	-179.1	-46.7	177.2	0	0	0	108.4	F29 S30 F47 W76 Y80 A95 P97	F29-I35 CarbonylContact C-O 3.55Å; F29-I35 WeakPolarHBondContact CA-O 3.33Å; S30-I35 PolarHBondContact N-O 3.34Å; S30-I35 PolarHBondContact OG-N 3.44Å; S30-I35 PolarHBondContact OG-O 2.89Å; I35-F47 HydrophobicContact CG2-CB 4.38Å; I35-F47 HydrophobicContact CG2-CD1 3.96Å; I35-W76 HydrophobicContact CB-CH2 3.73Å; I35-W76 HydrophobicContact CB-CZ2 3.93Å; I35-W76 HydrophobicContact CD1-CH2 4.01Å; I35-W76 HydrophobicContact CD1-CZ3 4.37Å; I35-W76 HydrophobicContact CG1-CH2 4.45Å; I35-W76 HydrophobicContact CG2-CH2 3.67Å; I35-W76 HydrophobicContact CG2-CZ2 3.84Å; I35-Y80 HydrophobicContact CD1-CD1 3.8Å; I35-Y80 HydrophobicContact CD1-CE1 4.24Å; I35-A95 HydrophobicContact CD1-CB 3.73Å; I35-P97 HydrophobicContact CD1-CG 3.8Å; I35-P97 HydrophobicContact CG1-CG 4.43Å
36	L	95	Very high	93.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	120.8	174.1	179.9	61.9	0	0	0	109.1	F16 I27 F29 I38 F47 L48 F50	F16-L36 HydrophobicContact CE2-CD2 3.59Å; F16-L36 HydrophobicContact CZ-CD2 3.73Å; I27-L36 HydrophobicContact CD1-CD1 4.05Å; I27-L36 HydrophobicContact CD1-CD2 4.28Å; I27-L36 HydrophobicContact CG1-CD1 3.57Å; I27-L36 HydrophobicContact CG1-CG 4.33Å; F29-L36 HydrophobicContact CD1-CB 4.11Å; F29-L36 HydrophobicContact CD1-CD1 4.17Å; F29-L36 HydrophobicContact CD2-CD1 3.76Å; F29-L36 HydrophobicContact CE1-CB 3.81Å; F29-L36 HydrophobicContact CE1-CD1 4.08Å; F29-L36 HydrophobicContact CE1-CG 4.4Å; F29-L36 HydrophobicContact CE2-CD1 3.62Å; F29-L36 HydrophobicContact CG-CD1 4.03Å; F29-L36 HydrophobicContact CZ-CB 4.18Å; F29-L36 HydrophobicContact CZ-CD1 3.8Å; F29-L36 HydrophobicContact CZ-CD2 4.22Å; F29-L36 HydrophobicContact CZ-CG 4.3Å; L36-I38 HydrophobicContact CD2-CD1 4Å; L36-I38 HydrophobicContact CD2-CG1 4.15Å; L36-I38 HydrophobicContact CG-CD1 4.29Å; L36-I38 HydrophobicContact CG-CG1 3.92Å; L36-F47 CarbonylContact O-C 3.55Å; L36-F47 VanDerWaalsContact O-CA 3.27Å; L36-F47 WeakPolarHBondContact O-CA 3.31Å; L36-L48 HydrophobicContact CB-CB 4.33Å; L36-L48 PolarHBondContact N-O 3.4Å; L36-L48 PolarHBondContact O-N 2.56Å; L36-F50 HydrophobicContact CB-CD2 4.22Å; L36-F50 HydrophobicContact CB-CE2 3.68Å; L36-F50 HydrophobicContact CD2-CE2 3.99Å; L36-F50 HydrophobicContact CD2-CZ 4.28Å; L36-F50 HydrophobicContact CG-CE2 4.5Å
37	G	95.6	Very high	93.4	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.8	168.3	0	0	0	0	0	110.9	I27 K28 D46	I27-G37 WeakPolarHBondContact CA-O 3.42Å; K28-G37 PolarHBondContact N-O 3.2Å; K28-G37 PolarHBondContact O-N 2.98Å; G37-D46 CarbonylContact C-O 3.59Å; G37-D46 WeakPolarHBondContact CA-O 3.47Å
38	I	95.5	Very high	93.4	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	113.3	-178.4	-48.2	172.3	0	0	0	108.1	I18 V24 I27 L36 R40 D46	I18-I38 HydrophobicContact CD1-CD1 3.93Å; I18-I38 HydrophobicContact CG2-CD1 4.19Å; V24-I38 HydrophobicContact CG1-CG2 3.87Å; V24-I38 HydrophobicContact CG2-CG2 4.01Å; I27-I38 HydrophobicContact CD1-CG1 4.35Å; I27-I38 HydrophobicContact CG1-CG1 4.3Å; L36-I38 HydrophobicContact CD2-CD1 4Å; L36-I38 HydrophobicContact CD2-CG1 4.15Å; L36-I38 HydrophobicContact CG-CD1 4.29Å; L36-I38 HydrophobicContact CG-CG1 3.92Å; I38-R40 HydrophobicContact CG2-CG 4.04Å; I38-D46 HydrophobicContact CB-CB 4.42Å; I38-D46 PolarHBondContact N-O 3.41Å; I38-D46 PolarHBondContact O-N 2.95Å
39	Q	95.5	Very high	93.3	Very high	8 Å²	8	35 Å²	35	4%	0.037	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	112.1	173.9	-178.3	-178.4	-2.3	0	0	109.1	L25 S26 T41 V45 L71 F74	L25-Q39 HydrophobicContact CB-CG 4.35Å; L25-Q39 WeakPolarHBondContact CB-O 3.49Å; L25-Q39 HydrophobicContact CD1-CG 4.43Å; L25-Q39 PolarHBondContact N-O 2.86Å; S26-Q39 PolarHBondContact N-O 3Å; S26-Q39 PolarHBondContact O-N 3.18Å; Q39-T41 WeakPolarHBondContact CG-O 3.41Å; Q39-T41 PolarHBondContact NE2-O 3.46Å; Q39-V45 HydrophobicContact CB-CG2 4.41Å; Q39-L71 HydrophobicContact CG-CD2 4.12Å; Q39-L71 PolarHBondContact NE2-O 2.93Å; Q39-F74 HydrophobicContact CB-CD1 4.18Å; Q39-F74 HydrophobicContact CB-CE1 3.8Å
40	R	90.7	Very high	93.1	Very high	21 Å²	21	33.7 Å²	33.7	8%	0.079	16%	0.159	C	C	.	.			trans	-104.9	-22.5	174.5	-64.1	-176.3	175.1	100.4	-10.8	113.1	D19 E23 V24 I38 D46 Q59	D19-R40 PolarHBondContact O-NH2 3.24Å; E23-R40 WeakPolarHBondContact O-CA 3.38Å; V24-R40 HydrophobicContact CG2-CG 4.42Å; I38-R40 HydrophobicContact CG2-CG 4.04Å; R40-D46 IonicContact CZ-OD2 3.69Å; R40-D46 IonicContact NH1-OD2 3.74Å; R40-D46 PolarHBondContact NH1-OD2 3.43Å; R40-Q59 VanDerWaalsContact NH1-NE2 3.1Å
41	T	92.3	Very high	92.7	Very high	61 Å²	61	40.8 Å²	40.8	37%	0.374	19%	0.192	S	C	.	.	S	Bend	trans	-123.8	163.7	179.2	78.3	0	0	0	0	110.4	Q39 R43 S44	Q39-T41 WeakPolarHBondContact CG-O 3.41Å; Q39-T41 PolarHBondContact NE2-O 3.46Å; T41-R43 PolarHBondContact O-N 3.08Å; T41-R43 PolarHBondContact OG1-N 3.38Å; T41-R43 VanDerWaalsContact OG1-N 3.14Å; T41-S44 PolarHBondContact OG1-N 3.37Å; T41-S44 PolarHBondContact OG1-OG 3.34Å
42	H	93.2	Very high	92.3	Very high	100 Å²	100	40.7 Å²	40.7	46%	0.463	21%	0.209	S	C	.	.	S	Bend	trans	-80.9	22.1	169.9	-63.5	-80.6	0	0	0	113.2	L70 L71	H42-L70 HydrophobicContact CB-CD1 3.33Å; H42-L70 HydrophobicContact CB-CG 4.03Å; H42-L71 WeakPolarHBondContact O-CB 3.22Å; H42-L71 PolarHBondContact O-N 3.06Å
43	R	93.3	Very high	91.9	Very high	139 Å²	139	42.6 Å²	42.6	53%	0.525	22%	0.219	S	C	.	.	S	Bend	trans	-139.8	-20	-178.7	-68	-170.1	179.4	-170.4	-2.3	114.4	T41 E63 C64 K67	T41-R43 PolarHBondContact O-N 3.08Å; T41-R43 PolarHBondContact OG1-N 3.38Å; T41-R43 VanDerWaalsContact OG1-N 3.14Å; R43-E63 CarbonylContact O-C 3.48Å; R43-E63 WeakPolarHBondContact O-CA 3.45Å; R43-C64 PolarHBondContact O-N 3.31Å; R43-C64 PolarHBondContact O-SG 3.12Å; R43-K67 PolarHBondContact NH1-O 3.47Å; R43-K67 PolarHBondContact NH2-O 3.48Å
44	S	94.2	Very high	91.5	Very high	14 Å²	14	43.4 Å²	43.4	10%	0.098	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	153.9	-176.7	64.3	0	0	0	0	112.2	T41 Q62	T41-S44 PolarHBondContact OG1-N 3.37Å; T41-S44 PolarHBondContact OG1-OG 3.34Å; S44-Q62 VanDerWaalsContact CA-O 3.25Å; S44-Q62 WeakPolarHBondContact CA-O 3.26Å
45	V	96.3	Very high	91	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.7	169.4	-174.2	0	0	0	0	107.9	Q39 F47 Q62 L71 F74 F84	Q39-V45 HydrophobicContact CB-CG2 4.41Å; V45-F47 HydrophobicContact CB-CE2 3.81Å; V45-F47 HydrophobicContact CB-CZ 4.03Å; V45-F47 HydrophobicContact CG1-CD2 4.49Å; V45-F47 HydrophobicContact CG1-CE1 4.35Å; V45-F47 HydrophobicContact CG1-CE2 3.85Å; V45-F47 HydrophobicContact CG1-CZ 3.78Å; V45-F47 WeakPolarHBondContact O-CD2 3.15Å; V45-F47 VanDerWaalsContact O-CE2 3.26Å; V45-F47 WeakPolarHBondContact O-CE2 3.28Å; V45-Q62 PolarHBondContact N-O 3.27Å; V45-Q62 PolarHBondContact O-N 3.01Å; V45-L71 HydrophobicContact CG2-CD2 3.38Å; V45-F74 HydrophobicContact CG1-CD1 4.11Å; V45-F74 HydrophobicContact CG1-CD2 4.49Å; V45-F74 HydrophobicContact CG1-CE1 3.96Å; V45-F74 HydrophobicContact CG1-CE2 4.33Å; V45-F74 HydrophobicContact CG1-CG 4.38Å; V45-F74 HydrophobicContact CG1-CZ 4.08Å; V45-F74 HydrophobicContact CG2-CB 4.39Å; V45-F74 HydrophobicContact CG2-CD1 3.8Å; V45-F74 HydrophobicContact CG2-CE1 4.36Å; V45-F74 HydrophobicContact CG2-CG 4.15Å; V45-F84 HydrophobicContact CB-CE1 4.14Å; V45-F84 HydrophobicContact CB-CE2 4.36Å; V45-F84 HydrophobicContact CB-CZ 3.63Å; V45-F84 HydrophobicContact CG2-CE1 3.81Å; V45-F84 HydrophobicContact CG2-CE2 4.01Å; V45-F84 HydrophobicContact CG2-CZ 3.53Å
46	D	95	Very high	89.8	Confident	9 Å²	9	42.2 Å²	42.2	5%	0.048	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	144.4	173.2	-58.6	-38.8	0	0	0	110.1	G37 I38 R40 Q59 Y60 S61	G37-D46 CarbonylContact C-O 3.59Å; G37-D46 WeakPolarHBondContact CA-O 3.47Å; I38-D46 HydrophobicContact CB-CB 4.42Å; I38-D46 PolarHBondContact N-O 3.41Å; I38-D46 PolarHBondContact O-N 2.95Å; R40-D46 IonicContact CZ-OD2 3.69Å; R40-D46 IonicContact NH1-OD2 3.74Å; R40-D46 PolarHBondContact NH1-OD2 3.43Å; D46-Q59 HydrophobicContact CB-CG 3.99Å; D46-Q59 PolarHBondContact OD2-NE2 3.48Å; D46-Y60 CarbonylContact C-O 3.53Å; D46-Y60 WeakPolarHBondContact CA-O 3.47Å; D46-S61 WeakPolarHBondContact OD1-CB 3.1Å; D46-S61 PolarHBondContact OD1-OG 2.57Å
47	F	95.3	Very high	88.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	139.4	-177.8	-64.8	-93.2	0	0	0	110.3	I35 L36 V45 Q59 Y60 Q62 W76 V82 F84 L102	I35-F47 HydrophobicContact CG2-CB 4.38Å; I35-F47 HydrophobicContact CG2-CD1 3.96Å; L36-F47 CarbonylContact O-C 3.55Å; L36-F47 VanDerWaalsContact O-CA 3.27Å; L36-F47 WeakPolarHBondContact O-CA 3.31Å; V45-F47 HydrophobicContact CB-CE2 3.81Å; V45-F47 HydrophobicContact CB-CZ 4.03Å; V45-F47 HydrophobicContact CG1-CD2 4.49Å; V45-F47 HydrophobicContact CG1-CE1 4.35Å; V45-F47 HydrophobicContact CG1-CE2 3.85Å; V45-F47 HydrophobicContact CG1-CZ 3.78Å; V45-F47 WeakPolarHBondContact O-CD2 3.15Å; V45-F47 VanDerWaalsContact O-CE2 3.26Å; V45-F47 WeakPolarHBondContact O-CE2 3.28Å; F47-Q59 WeakPolarHBondContact O-CA 3.33Å; F47-Y60 HydrophobicContact CB-CD1 4.1Å; F47-Y60 HydrophobicContact CB-CD2 3.89Å; F47-Y60 HydrophobicContact CB-CE1 3.67Å; F47-Y60 HydrophobicContact CB-CE2 3.49Å; F47-Y60 VanDerWaalsContact CB-CE2 3.49Å; F47-Y60 HydrophobicContact CB-CG 4.2Å; F47-Y60 HydrophobicContact CD2-CD2 4.43Å; F47-Y60 HydrophobicContact CD2-CE2 4.29Å; F47-Y60 HydrophobicContact CG-CD2 4.48Å; F47-Y60 HydrophobicContact CG-CE2 4Å; F47-Y60 PolarHBondContact N-O 2.84Å; F47-Y60 WeakPolarHBondContact O-CD1 3.19Å; F47-Y60 PolarHBondContact O-N 2.91Å; F47-Q62 HydrophobicContact CE2-CB 3.97Å; F47-W76 HydrophobicContact CD1-CH2 4.15Å; F47-W76 HydrophobicContact CD1-CZ2 4.07Å; F47-W76 AromaticContact CE1-CH2 3.97Å; F47-W76 HydrophobicContact CE1-CH2 3.97Å; F47-W76 AromaticContact CE1-CZ2 3.87Å; F47-W76 HydrophobicContact CE1-CZ2 3.87Å; F47-V82 HydrophobicContact CE1-CG1 4.21Å; F47-V82 HydrophobicContact CZ-CG1 4.06Å; F47-F84 HydrophobicContact CE2-CZ 4.04Å; F47-F84 AromaticContact CZ-CE1 3.94Å; F47-F84 HydrophobicContact CZ-CE1 3.94Å; F47-F84 AromaticContact CZ-CZ 3.89Å; F47-F84 HydrophobicContact CZ-CZ 3.89Å; F47-L102 HydrophobicContact CD1-CD1 4.42Å; F47-L102 HydrophobicContact CD2-CD1 3.38Å; F47-L102 HydrophobicContact CD2-CD2 4.46Å; F47-L102 HydrophobicContact CE1-CD1 4.46Å; F47-L102 HydrophobicContact CE1-CD2 4.04Å; F47-L102 HydrophobicContact CE2-CD1 3.44Å; F47-L102 VanDerWaalsContact CE2-CD1 3.44Å; F47-L102 HydrophobicContact CE2-CD2 3.81Å; F47-L102 HydrophobicContact CE2-CG 4.31Å; F47-L102 HydrophobicContact CG-CD1 3.9Å; F47-L102 HydrophobicContact CZ-CD1 4.01Å; F47-L102 HydrophobicContact CZ-CD2 3.56Å; F47-L102 HydrophobicContact CZ-CG 4.46Å
48	L	93.6	Very high	88.1	Confident	13 Å²	13	51.6 Å²	51.6	7%	0.068	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	121.8	176.8	-172.7	66	0	0	0	109.2	I18 L36 F50 P55	I18-L48 HydrophobicContact CG2-CD2 4.06Å; L36-L48 HydrophobicContact CB-CB 4.33Å; L36-L48 PolarHBondContact N-O 3.4Å; L36-L48 PolarHBondContact O-N 2.56Å; L48-F50 HydrophobicContact CB-CE2 4.47Å; L48-F50 HydrophobicContact CD2-CE2 4.02Å; L48-F50 HydrophobicContact CD2-CZ 4.42Å; L48-F50 HydrophobicContact CG-CE2 4.16Å; L48-P55 HydrophobicContact CD1-CB 4.23Å; L48-P55 HydrophobicContact CD2-CB 3.57Å; L48-P55 HydrophobicContact CG-CB 3.92Å
49	N	93.3	Very high	87.8	Confident	11 Å²	11	53.6 Å²	53.6	6%	0.059	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	143.6	178.9	-68.1	-40.7	0	0	0	110.4	P55 G56 Y60 P97 N100	N49-P55 CarbonylContact O-C 3.6Å; N49-P55 WeakPolarHBondContact O-CA 3.49Å; N49-G56 PolarHBondContact O-N 3.36Å; N49-Y60 VanDerWaalsContact ND2-CE1 3.34Å; N49-Y60 WeakPolarHBondContact ND2-CE1 3.47Å; N49-Y60 PolarHBondContact OD1-OH 2.81Å; N49-Y60 VanDerWaalsContact OD1-OH 3.14Å; N49-P97 WeakPolarHBondContact ND2-CA 3.36Å; N49-P97 PolarHBondContact ND2-O 2.88Å; N49-N100 PolarHBondContact ND2-OD1 2.94Å
50	F	90.7	Very high	87.7	Confident	12 Å²	12	54.1 Å²	54.1	5%	0.053	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.6	177.9	-82.6	-109.4	0	0	0	110.1	F16 F29 K34 L36 L48 C54 P55	F16-F50 AromaticContact CD1-CE1 3.73Å; F16-F50 HydrophobicContact CD1-CE1 3.73Å; F16-F50 AromaticContact CD1-CZ 3.78Å; F16-F50 HydrophobicContact CD1-CZ 3.78Å; F16-F50 AromaticContact CD2-CZ 3.88Å; F16-F50 HydrophobicContact CD2-CZ 3.88Å; F16-F50 AromaticContact CE1-CE1 3.95Å; F16-F50 HydrophobicContact CE1-CE1 3.95Å; F16-F50 AromaticContact CE1-CZ 3.73Å; F16-F50 HydrophobicContact CE1-CZ 3.73Å; F16-F50 AromaticContact CE2-CZ 3.83Å; F16-F50 HydrophobicContact CE2-CZ 3.83Å; F16-F50 HydrophobicContact CG-CE1 4.05Å; F16-F50 AromaticContact CG-CZ 3.86Å; F16-F50 HydrophobicContact CG-CZ 3.86Å; F16-F50 HydrophobicContact CZ-CE1 4.44Å; F16-F50 AromaticContact CZ-CZ 3.77Å; F16-F50 HydrophobicContact CZ-CZ 3.77Å; F29-F50 HydrophobicContact CE1-CD1 4.42Å; F29-F50 AromaticContact CE1-CD2 3.85Å; F29-F50 HydrophobicContact CE1-CD2 3.85Å; F29-F50 HydrophobicContact CE1-CE1 4.33Å; F29-F50 AromaticContact CE1-CE2 3.75Å; F29-F50 HydrophobicContact CE1-CE2 3.75Å; F29-F50 HydrophobicContact CE1-CG 4.2Å; F29-F50 AromaticContact CE1-CZ 4Å; F29-F50 HydrophobicContact CE1-CZ 4Å; F29-F50 HydrophobicContact CZ-CE1 4.29Å; F29-F50 HydrophobicContact CZ-CE2 4.06Å; F29-F50 AromaticContact CZ-CZ 3.91Å; F29-F50 HydrophobicContact CZ-CZ 3.91Å; K34-F50 PolarHBondContact O-N 3.37Å; L36-F50 HydrophobicContact CB-CD2 4.22Å; L36-F50 HydrophobicContact CB-CE2 3.68Å; L36-F50 HydrophobicContact CD2-CE2 3.99Å; L36-F50 HydrophobicContact CD2-CZ 4.28Å; L36-F50 HydrophobicContact CG-CE2 4.5Å; L48-F50 HydrophobicContact CB-CE2 4.47Å; L48-F50 HydrophobicContact CD2-CE2 4.02Å; L48-F50 HydrophobicContact CD2-CZ 4.42Å; L48-F50 HydrophobicContact CG-CE2 4.16Å; F50-C54 VanDerWaalsContact CA-O 3.31Å; F50-C54 WeakPolarHBondContact CA-O 3.48Å; F50-P55 HydrophobicContact CE1-CB 4.44Å; F50-P55 HydrophobicContact CE2-CB 4.4Å; F50-P55 HydrophobicContact CZ-CB 4.19Å
51	Q	85.1	Confident	87.8	Confident	150 Å²	150	56.2 Å²	56.2	70%	0.701	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.4	169	-75.7	-175.6	-10.2	0	0	108.3	N53 C54	Q51-N53 VanDerWaalsContact C-N 3.27Å; Q51-N53 PolarHBondContact O-N 3.49Å; Q51-C54 PolarHBondContact N-O 3.36Å; Q51-C54 PolarHBondContact O-N 3.3Å; Q51-C54 VanDerWaalsContact O-O 3.1Å
52	A	81.3	Confident	88	Confident	100 Å²	100	55.2 Å²	55.2	83%	0.826	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	46.7	-178	0	0	0	0	0	113.2	C54	A52-C54 PolarHBondContact O-N 3.46Å; A52-C54 VanDerWaalsContact O-N 3.11Å
53	N	79.3	Confident	88	Confident	89 Å²	89	56.6 Å²	56.6	48%	0.476	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	8.2	178.7	-66.3	-14.9	0	0	0	116.1	L14 Q51	L14-N53 HydrophobicContact CD2-CB 3.46Å; L14-N53 VanDerWaalsContact CD2-CB 3.46Å; Q51-N53 VanDerWaalsContact C-N 3.27Å; Q51-N53 PolarHBondContact O-N 3.49Å
54	C	80.6	Confident	88.1	Confident	80 Å²	80	50.5 Å²	50.5	54%	0.541	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	144.4	172.6	-69.9	0	0	0	0	109.9	F50 Q51 A52 G56	F50-C54 VanDerWaalsContact CA-O 3.31Å; F50-C54 WeakPolarHBondContact CA-O 3.48Å; Q51-C54 PolarHBondContact N-O 3.36Å; Q51-C54 PolarHBondContact O-N 3.3Å; Q51-C54 VanDerWaalsContact O-O 3.1Å; A52-C54 PolarHBondContact O-N 3.46Å; A52-C54 VanDerWaalsContact O-N 3.11Å; C54-G56 PolarHBondContact O-N 3.06Å; C54-G56 VanDerWaalsContact O-N 3.09Å
55	P	81.9	Confident	87.9	Confident	53 Å²	53	55.5 Å²	55.5	34%	0.344	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	115.3	172.1	27.8	-34.1	0	0	0	108.9	F16 L48 N49 F50	F16-P55 HydrophobicContact CB-CG 4.01Å; L48-P55 HydrophobicContact CD1-CB 4.23Å; L48-P55 HydrophobicContact CD2-CB 3.57Å; L48-P55 HydrophobicContact CG-CB 3.92Å; N49-P55 CarbonylContact O-C 3.6Å; N49-P55 WeakPolarHBondContact O-CA 3.49Å; F50-P55 HydrophobicContact CE1-CB 4.44Å; F50-P55 HydrophobicContact CE2-CB 4.4Å; F50-P55 HydrophobicContact CZ-CB 4.19Å
56	G	68.7	Low	87.6	Confident	26 Å²	26	58 Å²	58	27%	0.268	34%	0.339	S	S	.	.			trans	-109.2	113.6	178.7	0	0	0	0	0	110	N49 C54	N49-G56 PolarHBondContact O-N 3.36Å; C54-G56 PolarHBondContact O-N 3.06Å; C54-G56 VanDerWaalsContact O-N 3.09Å
57	G	71.8	Confident	87.2	Confident	61 Å²	61	65.9 Å²	65.9	63%	0.629	37%	0.373	S	S	*	.	S	Bend	trans	105.5	-175.5	170.7	0	0	0	0	0	115.7
58	L	82.6	Confident	86.9	Confident	137 Å²	137	69.6 Å²	69.6	72%	0.717	40%	0.398	S	S	*	.			trans	-76.1	139.4	178.1	-86.5	116.1	0	0	0	111.1
59	Q	88.8	Confident	86.9	Confident	42 Å²	42	69 Å²	69	20%	0.196	40%	0.395	C	S	.	.			trans	-63.8	134.5	165.7	-169.5	-176	-68.9	0	0	109	R40 D46 F47	R40-Q59 VanDerWaalsContact NH1-NE2 3.1Å; D46-Q59 HydrophobicContact CB-CG 3.99Å; D46-Q59 PolarHBondContact OD2-NE2 3.48Å; F47-Q59 WeakPolarHBondContact O-CA 3.33Å
60	Y	93.6	Very high	87	Confident	19 Å²	19	71.9 Å²	71.9	8%	0.075	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	145.7	176.9	57	-77.7	0	0	0	110.1	D46 F47 N49 N100 L102	D46-Y60 CarbonylContact C-O 3.53Å; D46-Y60 WeakPolarHBondContact CA-O 3.47Å; F47-Y60 HydrophobicContact CB-CD1 4.1Å; F47-Y60 HydrophobicContact CB-CD2 3.89Å; F47-Y60 HydrophobicContact CB-CE1 3.67Å; F47-Y60 HydrophobicContact CB-CE2 3.49Å; F47-Y60 VanDerWaalsContact CB-CE2 3.49Å; F47-Y60 HydrophobicContact CB-CG 4.2Å; F47-Y60 HydrophobicContact CD2-CD2 4.43Å; F47-Y60 HydrophobicContact CD2-CE2 4.29Å; F47-Y60 HydrophobicContact CG-CD2 4.48Å; F47-Y60 HydrophobicContact CG-CE2 4Å; F47-Y60 PolarHBondContact N-O 2.84Å; F47-Y60 WeakPolarHBondContact O-CD1 3.19Å; F47-Y60 PolarHBondContact O-N 2.91Å; N49-Y60 VanDerWaalsContact ND2-CE1 3.34Å; N49-Y60 WeakPolarHBondContact ND2-CE1 3.47Å; N49-Y60 PolarHBondContact OD1-OH 2.81Å; N49-Y60 VanDerWaalsContact OD1-OH 3.14Å; Y60-N100 WeakPolarHBondContact CB-O 3.34Å; Y60-N100 HydrophobicContact CD1-CB 3.64Å; Y60-N100 WeakPolarHBondContact CD2-O 3.47Å; Y60-N100 HydrophobicContact CE1-CB 4.12Å; Y60-N100 VanDerWaalsContact CG-C 3.49Å; Y60-N100 HydrophobicContact CG-CB 3.94Å; Y60-L102 HydrophobicContact CD2-CD1 3.8Å; Y60-L102 HydrophobicContact CE2-CD1 3.43Å; Y60-L102 VanDerWaalsContact CE2-CD1 3.43Å; Y60-L102 HydrophobicContact CE2-CG 4.46Å
61	S	93.3	Very high	87.3	Confident	65 Å²	65	71.3 Å²	71.3	46%	0.455	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142.7	-174.6	-157.1	0	0	0	0	111.2	D46	D46-S61 WeakPolarHBondContact OD1-CB 3.1Å; D46-S61 PolarHBondContact OD1-OG 2.57Å
62	Q	95.7	Very high	87.7	Confident	40 Å²	40	67 Å²	67	19%	0.187	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	115.3	170.6	179.1	62.5	59	0	0	109.1	S44 V45 F47 F84 Y93 L102	S44-Q62 VanDerWaalsContact CA-O 3.25Å; S44-Q62 WeakPolarHBondContact CA-O 3.26Å; V45-Q62 PolarHBondContact N-O 3.27Å; V45-Q62 PolarHBondContact O-N 3.01Å; F47-Q62 HydrophobicContact CE2-CB 3.97Å; Q62-F84 HydrophobicContact CB-CE2 4.25Å; Q62-F84 HydrophobicContact CB-CZ 4.19Å; Q62-F84 HydrophobicContact CG-CE2 3.86Å; Q62-F84 HydrophobicContact CG-CZ 4.11Å; Q62-Y93 HydrophobicContact CG-CD1 4.17Å; Q62-Y93 HydrophobicContact CG-CE1 3.82Å; Q62-Y93 HydrophobicContact CG-CE2 4.35Å; Q62-L102 HydrophobicContact CB-CB 4.48Å; Q62-L102 HydrophobicContact CB-CD1 3.89Å; Q62-L102 HydrophobicContact CG-CB 4.28Å
63	E	94.8	Very high	88.4	Confident	129 Å²	129	62.5 Å²	62.5	60%	0.603	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	150.7	170.2	-62.6	-172.9	169.5	0	0	110.7	R43	R43-E63 CarbonylContact O-C 3.48Å; R43-E63 WeakPolarHBondContact O-CA 3.45Å
64	C	93.5	Very high	89.3	Confident	10 Å²	10	58.2 Å²	58.2	7%	0.068	33%	0.33	C	S	.	.			trans	-57	143.7	169.7	-61.8	0	0	0	0	109.6	R43 N66 A69 T86	R43-C64 PolarHBondContact O-N 3.31Å; R43-C64 PolarHBondContact O-SG 3.12Å; C64-N66 VanDerWaalsContact C-N 3.28Å; C64-N66 PolarHBondContact O-N 2.89Å; C64-A69 HydrophobicContact CB-CB 4.48Å; C64-T86 HydrophobicContact CB-CG2 4.34Å
65	K	91.9	Very high	90	Very high	119 Å²	119	54.7 Å²	54.7	52%	0.517	31%	0.306	S	S	.	.	S	Bend	trans	-58.6	-40.4	-176.8	178.8	-172.7	177.3	-175.1	0	112.6	E91 L104	K65-E91 WeakPolarHBondContact CB-OE1 3.48Å; K65-E91 PolarHBondContact N-OE1 2.76Å; K65-E91 PolarHBondContact N-OE2 3.27Å; K65-L104 HydrophobicContact CD-CD2 3.85Å
66	N	88.9	Confident	90.7	Very high	54 Å²	54	52.9 Å²	52.9	29%	0.289	29%	0.292	S	S	.	.	S	Bend	trans	-92.9	127.3	177	-74.4	4.9	0	0	0	110.5	C64 S68 A69 E88 Q89	C64-N66 VanDerWaalsContact C-N 3.28Å; C64-N66 PolarHBondContact O-N 2.89Å; N66-S68 PolarHBondContact O-N 3.1Å; N66-A69 HydrophobicContact CB-CB 3.86Å; N66-A69 WeakPolarHBondContact O-CB 3.38Å; N66-A69 PolarHBondContact O-N 3.3Å; N66-A69 VanDerWaalsContact O-N 3.14Å; N66-E88 PolarHBondContact ND2-OE2 2.93Å; N66-Q89 VanDerWaalsContact CG-NE2 3.26Å; N66-Q89 PolarHBondContact OD1-NE2 3.32Å
67	K	86.5	Confident	91.9	Very high	174 Å²	174	51.8 Å²	51.8	76%	0.757	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.1	178.9	-64.9	-173.7	178.6	-175.9	0	113.9	R43	R43-K67 PolarHBondContact NH1-O 3.47Å; R43-K67 PolarHBondContact NH2-O 3.48Å
68	S	90.1	Very high	92.8	Very high	77 Å²	77	50.3 Å²	50.3	54%	0.538	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-20.7	176	53.1	0	0	0	0	113.3	N66 E88	N66-S68 PolarHBondContact O-N 3.1Å; S68-E88 WeakPolarHBondContact CB-OE1 3.47Å; S68-E88 PolarHBondContact OG-OE1 3.33Å; S68-E88 PolarHBondContact OG-OE2 3.19Å
69	A	92.4	Very high	93.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.242	C	C	.	.			trans	-70.2	142.5	-173	0	0	0	0	0	111.8	C64 N66 T86 N87 E88	C64-A69 HydrophobicContact CB-CB 4.48Å; N66-A69 HydrophobicContact CB-CB 3.86Å; N66-A69 WeakPolarHBondContact O-CB 3.38Å; N66-A69 PolarHBondContact O-N 3.3Å; N66-A69 VanDerWaalsContact O-N 3.14Å; A69-T86 HydrophobicContact CB-CG2 4.38Å; A69-N87 WeakPolarHBondContact CA-OD1 3.39Å; A69-E88 HydrophobicContact CB-CB 4.4Å; A69-E88 HydrophobicContact CB-CG 4.47Å
70	L	95.4	Very high	93.6	Very high	73 Å²	73	48.8 Å²	48.8	38%	0.382	25%	0.249	S	C	.	.			trans	-102.8	120.9	173.9	-169.4	82.8	0	0	0	108.5	H42 L72 T86 N87	H42-L70 HydrophobicContact CB-CD1 3.33Å; H42-L70 HydrophobicContact CB-CG 4.03Å; L70-L72 HydrophobicContact CD2-CD2 4.34Å; L70-L72 PolarHBondContact O-N 3.2Å; L70-T86 CarbonylContact O-C 3.53Å; L70-T86 WeakPolarHBondContact O-CA 3.19Å; L70-T86 WeakPolarHBondContact O-CB 3.48Å; L70-N87 HydrophobicContact CB-CB 4.4Å; L70-N87 PolarHBondContact N-OD1 2.91Å; L70-N87 PolarHBondContact O-N 3.21Å; L70-N87 PolarHBondContact O-OD1 3.21Å
71	L	96.3	Very high	93.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	110.1	173.4	-174.5	64.3	0	0	0	109.9	Q39 H42 V45 G73 F84 T86	Q39-L71 HydrophobicContact CG-CD2 4.12Å; Q39-L71 PolarHBondContact NE2-O 2.93Å; H42-L71 WeakPolarHBondContact O-CB 3.22Å; H42-L71 PolarHBondContact O-N 3.06Å; V45-L71 HydrophobicContact CG2-CD2 3.38Å; L71-G73 WeakPolarHBondContact CD1-O 3.09Å; L71-F84 HydrophobicContact CD1-CB 3.77Å; L71-F84 HydrophobicContact CD1-CD2 4.13Å; L71-F84 HydrophobicContact CD1-CG 3.97Å; L71-T86 HydrophobicContact CD1-CG2 4.21Å
72	L	95.3	Very high	93.8	Very high	58 Å²	58	45.4 Å²	45.4	30%	0.304	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	-32.3	174.4	-57.8	177.2	0	0	0	111	L70 V85 T112 F115	L70-L72 HydrophobicContact CD2-CD2 4.34Å; L70-L72 PolarHBondContact O-N 3.2Å; L72-V85 WeakPolarHBondContact CB-O 3.37Å; L72-V85 HydrophobicContact CD1-CG1 4.4Å; L72-V85 PolarHBondContact N-O 3.46Å; L72-T112 HydrophobicContact CD1-CG2 3.7Å; L72-F115 HydrophobicContact CB-CD1 4.27Å; L72-F115 HydrophobicContact CB-CE1 4.21Å
73	G	95.9	Very high	93.9	Very high	6 Å²	6	43.6 Å²	43.6	6%	0.062	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.6	177.5	173.3	0	0	0	0	0	112	L71 V85	L71-G73 WeakPolarHBondContact CD1-O 3.09Å; G73-V85 PolarHBondContact N-O 3.24Å; G73-V85 PolarHBondContact O-N 3.21Å
74	F	97	Very high	94	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	151.7	176.6	72.1	-81.6	0	0	0	111.3	K28 Q39 V45 V82 L83 F84	K28-F74 HydrophobicContact CB-CE2 3.84Å; K28-F74 HydrophobicContact CB-CZ 3.96Å; K28-F74 HydrophobicContact CD-CE2 4.16Å; K28-F74 HydrophobicContact CD-CZ 4.27Å; K28-F74 HydrophobicContact CG-CE2 4.25Å; K28-F74 HydrophobicContact CG-CZ 4.09Å; K28-F74 PolarHBondContact NZ-O 3.36Å; Q39-F74 HydrophobicContact CB-CD1 4.18Å; Q39-F74 HydrophobicContact CB-CE1 3.8Å; V45-F74 HydrophobicContact CG1-CD1 4.11Å; V45-F74 HydrophobicContact CG1-CD2 4.49Å; V45-F74 HydrophobicContact CG1-CE1 3.96Å; V45-F74 HydrophobicContact CG1-CE2 4.33Å; V45-F74 HydrophobicContact CG1-CG 4.38Å; V45-F74 HydrophobicContact CG1-CZ 4.08Å; V45-F74 HydrophobicContact CG2-CB 4.39Å; V45-F74 HydrophobicContact CG2-CD1 3.8Å; V45-F74 HydrophobicContact CG2-CE1 4.36Å; V45-F74 HydrophobicContact CG2-CG 4.15Å; F74-V82 HydrophobicContact CB-CG2 4.13Å; F74-V82 HydrophobicContact CD2-CG2 3.74Å; F74-V82 HydrophobicContact CG-CG2 4.4Å; F74-L83 CarbonylContact C-O 3.44Å; F74-L83 WeakPolarHBondContact CA-O 3.36Å; F74-F84 HydrophobicContact CB-CD1 3.7Å; F74-F84 HydrophobicContact CB-CE1 3.99Å
75	V	96.4	Very high	94.2	Very high	5 Å²	5	37 Å²	37	3%	0.03	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	142.2	176.4	-63.7	0	0	0	0	110.4	V82 L83 F115 W117	V75-V82 CarbonylContact O-C 3.53Å; V75-V82 WeakPolarHBondContact O-CA 3.47Å; V75-V82 WeakPolarHBondContact O-CG2 3.49Å; V75-L83 HydrophobicContact CG2-CB 3.87Å; V75-L83 HydrophobicContact CG2-CD2 4.1Å; V75-L83 HydrophobicContact CG2-CG 4.46Å; V75-L83 PolarHBondContact N-O 2.91Å; V75-L83 PolarHBondContact O-N 3.07Å; V75-F115 HydrophobicContact CG1-CE2 3.92Å; V75-F115 HydrophobicContact CG1-CZ 4.49Å; V75-W117 HydrophobicContact CB-CD2 4.18Å; V75-W117 HydrophobicContact CB-CG 4.09Å; V75-W117 HydrophobicContact CG1-CB 3.96Å; V75-W117 HydrophobicContact CG1-CD2 4.33Å; V75-W117 HydrophobicContact CG1-CG 3.76Å; V75-W117 HydrophobicContact CG2-CD2 3.9Å; V75-W117 HydrophobicContact CG2-CE3 4.15Å; V75-W117 HydrophobicContact CG2-CG 4.21Å
76	W	95.4	Very high	94.4	Very high	15 Å²	15	31.3 Å²	31.3	6%	0.057	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	125.6	169.2	-70.4	101.8	0	0	0	108.5	K28 F29 I35 F47 V82 A95	K28-W76 PolarHBondContact O-NE1 3.29Å; F29-W76 VanDerWaalsContact C-CD1 3.5Å; F29-W76 PolarHBondContact O-NE1 3.1Å; I35-W76 HydrophobicContact CB-CH2 3.73Å; I35-W76 HydrophobicContact CB-CZ2 3.93Å; I35-W76 HydrophobicContact CD1-CH2 4.01Å; I35-W76 HydrophobicContact CD1-CZ3 4.37Å; I35-W76 HydrophobicContact CG1-CH2 4.45Å; I35-W76 HydrophobicContact CG2-CH2 3.67Å; I35-W76 HydrophobicContact CG2-CZ2 3.84Å; F47-W76 HydrophobicContact CD1-CH2 4.15Å; F47-W76 HydrophobicContact CD1-CZ2 4.07Å; F47-W76 AromaticContact CE1-CH2 3.97Å; F47-W76 HydrophobicContact CE1-CH2 3.97Å; F47-W76 AromaticContact CE1-CZ2 3.87Å; F47-W76 HydrophobicContact CE1-CZ2 3.87Å; W76-V82 HydrophobicContact CD2-CB 4.35Å; W76-V82 HydrophobicContact CD2-CG2 4.48Å; W76-V82 HydrophobicContact CE3-CB 4.04Å; W76-V82 HydrophobicContact CH2-CB 4.5Å; W76-V82 HydrophobicContact CZ3-CB 4.11Å; W76-A95 HydrophobicContact CH2-CB 4.35Å; W76-A95 HydrophobicContact CZ3-CB 4.38Å
77	C	93.5	Very high	94.7	Very high	4 Å²	4	31.2 Å²	31.2	3%	0.027	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	-18.8	176.7	-58.2	0	0	0	0	111.9	E81 L83 W117 H122 L138	C77-E81 PolarHBondContact N-O 3.08Å; C77-L83 VanDerWaalsContact SG-CB 3.55Å; C77-W117 HydrophobicContact CB-CH2 4.41Å; C77-H122 PolarHBondContact O-CE1 3.3Å; C77-H122 PolarHBondContact O-ND1 3.21Å; C77-L138 HydrophobicContact CB-CB 4.39Å
78	S	92.1	Very high	95.2	Very high	29 Å²	29	25.4 Å²	25.4	20%	0.203	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	-177.4	170.1	71.5	0	0	0	0	109.2	Y80 E81	S78-Y80 PolarHBondContact O-N 2.93Å; S78-Y80 VanDerWaalsContact O-N 3.07Å; S78-Y80 PolarHBondContact OG-N 3.43Å; S78-E81 PolarHBondContact N-O 2.95Å; S78-E81 VanDerWaalsContact OG-CB 3.32Å; S78-E81 WeakPolarHBondContact OG-CB 3.34Å; S78-E81 PolarHBondContact OG-N 3.12Å; S78-E81 VanDerWaalsContact OG-N 3.13Å
79	N	92.5	Very high	95.4	Very high	61 Å²	61	22.2 Å²	22.2	33%	0.326	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-30.7	174	-72.2	-42.9	0	0	0	115.5	S30 N32	S30-N79 WeakPolarHBondContact CB-O 3.27Å; N32-N79 VanDerWaalsContact CB-OD1 3.25Å; N32-N79 WeakPolarHBondContact CB-OD1 3.37Å; N32-N79 VanDerWaalsContact CG-OD1 3.28Å; N32-N79 PolarHBondContact N-OD1 3.21Å; N32-N79 PolarHBondContact ND2-OD1 3.24Å
80	Y	94.7	Very high	95.6	Very high	87 Å²	87	22.2 Å²	22.2	34%	0.341	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-134.7	10.9	-175	-57.6	-74.3	0	0	0	113.1	I35 S78 Q94 A95 P97	I35-Y80 HydrophobicContact CD1-CD1 3.8Å; I35-Y80 HydrophobicContact CD1-CE1 4.24Å; S78-Y80 PolarHBondContact O-N 2.93Å; S78-Y80 VanDerWaalsContact O-N 3.07Å; S78-Y80 PolarHBondContact OG-N 3.43Å; Y80-Q94 CarbonylContact O-C 3.6Å; Y80-Q94 WeakPolarHBondContact O-CA 2.95Å; Y80-A95 PolarHBondContact O-N 3.34Å; Y80-P97 HydrophobicContact CD1-CG 4.03Å; Y80-P97 HydrophobicContact CE1-CG 3.91Å
81	E	95.2	Very high	95.6	Very high	13 Å²	13	18.8 Å²	18.8	6%	0.061	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.8	175.2	-67.6	-166.1	131.1	0	0	111.6	C77 S78 L92 Y93 N105 P141 G142	C77-E81 PolarHBondContact N-O 3.08Å; S78-E81 PolarHBondContact N-O 2.95Å; S78-E81 VanDerWaalsContact OG-CB 3.32Å; S78-E81 WeakPolarHBondContact OG-CB 3.34Å; S78-E81 PolarHBondContact OG-N 3.12Å; S78-E81 VanDerWaalsContact OG-N 3.13Å; E81-L92 HydrophobicContact CB-CD1 4.42Å; E81-Y93 VanDerWaalsContact CA-O 3.32Å; E81-Y93 WeakPolarHBondContact CA-O 3.46Å; E81-N105 PolarHBondContact OE1-ND2 3.19Å; E81-P141 WeakPolarHBondContact OE2-CA 3.33Å; E81-G142 VanDerWaalsContact CD-N 3.27Å; E81-G142 WeakPolarHBondContact OE1-CA 3.29Å; E81-G142 PolarHBondContact OE1-N 3.16Å; E81-G142 PolarHBondContact OE2-N 3.4Å
82	V	96.6	Very high	95.7	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	130.4	-179.4	65.9	0	0	0	0	109.3	F47 F74 V75 W76 F84 Y93 L102	F47-V82 HydrophobicContact CE1-CG1 4.21Å; F47-V82 HydrophobicContact CZ-CG1 4.06Å; F74-V82 HydrophobicContact CB-CG2 4.13Å; F74-V82 HydrophobicContact CD2-CG2 3.74Å; F74-V82 HydrophobicContact CG-CG2 4.4Å; V75-V82 CarbonylContact O-C 3.53Å; V75-V82 WeakPolarHBondContact O-CA 3.47Å; V75-V82 WeakPolarHBondContact O-CG2 3.49Å; W76-V82 HydrophobicContact CD2-CB 4.35Å; W76-V82 HydrophobicContact CD2-CG2 4.48Å; W76-V82 HydrophobicContact CE3-CB 4.04Å; W76-V82 HydrophobicContact CH2-CB 4.5Å; W76-V82 HydrophobicContact CZ3-CB 4.11Å; V82-F84 HydrophobicContact CG1-CD1 4.44Å; V82-F84 HydrophobicContact CG1-CE1 3.96Å; V82-F84 HydrophobicContact CG2-CD1 4.11Å; V82-F84 HydrophobicContact CG2-CE1 3.89Å; V82-Y93 PolarHBondContact N-O 3.04Å; V82-Y93 PolarHBondContact O-N 2.84Å; V82-L102 HydrophobicContact CG1-CD2 3.46Å; V82-L102 VanDerWaalsContact CG1-CD2 3.46Å
83	L	97.3	Very high	95.7	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.005	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122.6	174.1	178	71.7	0	0	0	109	F74 V75 C77 V85 L90 L92 L138 I144	F74-L83 CarbonylContact C-O 3.44Å; F74-L83 WeakPolarHBondContact CA-O 3.36Å; V75-L83 HydrophobicContact CG2-CB 3.87Å; V75-L83 HydrophobicContact CG2-CD2 4.1Å; V75-L83 HydrophobicContact CG2-CG 4.46Å; V75-L83 PolarHBondContact N-O 2.91Å; V75-L83 PolarHBondContact O-N 3.07Å; C77-L83 VanDerWaalsContact SG-CB 3.55Å; L83-V85 HydrophobicContact CD2-CG2 4.06Å; L83-V85 HydrophobicContact CG-CG2 4.2Å; L83-L90 HydrophobicContact CD1-CB 4.23Å; L83-L92 HydrophobicContact CB-CD1 4.26Å; L83-L92 HydrophobicContact CD1-CB 4.37Å; L83-L92 HydrophobicContact CD1-CD1 4.41Å; L83-L138 HydrophobicContact CB-CD2 4.36Å; L83-L138 HydrophobicContact CD1-CD2 4.01Å; L83-L138 HydrophobicContact CD2-CD1 4.17Å; L83-L138 HydrophobicContact CD2-CD2 3.87Å; L83-L138 HydrophobicContact CG-CD2 4.31Å; L83-I144 HydrophobicContact CD1-CD1 4.25Å
84	F	97.2	Very high	95.7	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125	167.4	-72.7	13.3	0	0	0	108.6	V45 F47 Q62 L71 F74 V82 E91 Y93	V45-F84 HydrophobicContact CB-CE1 4.14Å; V45-F84 HydrophobicContact CB-CE2 4.36Å; V45-F84 HydrophobicContact CB-CZ 3.63Å; V45-F84 HydrophobicContact CG2-CE1 3.81Å; V45-F84 HydrophobicContact CG2-CE2 4.01Å; V45-F84 HydrophobicContact CG2-CZ 3.53Å; F47-F84 HydrophobicContact CE2-CZ 4.04Å; F47-F84 AromaticContact CZ-CE1 3.94Å; F47-F84 HydrophobicContact CZ-CE1 3.94Å; F47-F84 AromaticContact CZ-CZ 3.89Å; F47-F84 HydrophobicContact CZ-CZ 3.89Å; Q62-F84 HydrophobicContact CB-CE2 4.25Å; Q62-F84 HydrophobicContact CB-CZ 4.19Å; Q62-F84 HydrophobicContact CG-CE2 3.86Å; Q62-F84 HydrophobicContact CG-CZ 4.11Å; L71-F84 HydrophobicContact CD1-CB 3.77Å; L71-F84 HydrophobicContact CD1-CD2 4.13Å; L71-F84 HydrophobicContact CD1-CG 3.97Å; F74-F84 HydrophobicContact CB-CD1 3.7Å; F74-F84 HydrophobicContact CB-CE1 3.99Å; V82-F84 HydrophobicContact CG1-CD1 4.44Å; V82-F84 HydrophobicContact CG1-CE1 3.96Å; V82-F84 HydrophobicContact CG2-CD1 4.11Å; V82-F84 HydrophobicContact CG2-CE1 3.89Å; F84-E91 HydrophobicContact CB-CB 4.18Å; F84-E91 PolarHBondContact N-O 2.85Å; F84-E91 PolarHBondContact O-N 3.19Å; F84-Y93 HydrophobicContact CB-CE2 4.41Å; F84-Y93 HydrophobicContact CD1-CD2 4.34Å; F84-Y93 HydrophobicContact CD2-CD2 4.17Å; F84-Y93 AromaticContact CD2-CE2 3.75Å; F84-Y93 HydrophobicContact CD2-CE2 3.75Å; F84-Y93 HydrophobicContact CE2-CD2 4.42Å; F84-Y93 HydrophobicContact CE2-CE2 4.13Å; F84-Y93 HydrophobicContact CG-CD2 4.12Å; F84-Y93 HydrophobicContact CG-CE2 4.06Å
85	V	97.1	Very high	95.6	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	107.5	175.4	-175.6	0	0	0	0	107.3	L72 G73 L83 L90 T112 F115	L72-V85 WeakPolarHBondContact CB-O 3.37Å; L72-V85 HydrophobicContact CD1-CG1 4.4Å; L72-V85 PolarHBondContact N-O 3.46Å; G73-V85 PolarHBondContact N-O 3.24Å; G73-V85 PolarHBondContact O-N 3.21Å; L83-V85 HydrophobicContact CD2-CG2 4.06Å; L83-V85 HydrophobicContact CG-CG2 4.2Å; V85-L90 HydrophobicContact CB-CD2 4.14Å; V85-L90 HydrophobicContact CG1-CD2 3.73Å; V85-L90 HydrophobicContact CG2-CD2 4.02Å; V85-T112 HydrophobicContact CG1-CG2 4.06Å; V85-F115 HydrophobicContact CB-CD1 3.88Å; V85-F115 HydrophobicContact CB-CE1 4.04Å; V85-F115 HydrophobicContact CB-CG 4.16Å; V85-F115 HydrophobicContact CB-CZ 4.44Å; V85-F115 HydrophobicContact CG1-CB 3.96Å; V85-F115 HydrophobicContact CG1-CD1 3.61Å; V85-F115 HydrophobicContact CG1-CE1 4.26Å; V85-F115 HydrophobicContact CG1-CG 3.8Å; V85-F115 HydrophobicContact CG2-CD1 4.25Å; V85-F115 HydrophobicContact CG2-CD2 4.03Å; V85-F115 HydrophobicContact CG2-CE1 4.38Å; V85-F115 HydrophobicContact CG2-CE2 4.16Å; V85-F115 HydrophobicContact CG2-CG 4.07Å; V85-F115 HydrophobicContact CG2-CZ 4.34Å
86	T	96.9	Very high	95.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	168.6	177	76.1	0	0	0	0	110.7	C64 A69 L70 L71 E88 Q89 T112	C64-T86 HydrophobicContact CB-CG2 4.34Å; A69-T86 HydrophobicContact CB-CG2 4.38Å; L70-T86 CarbonylContact O-C 3.53Å; L70-T86 WeakPolarHBondContact O-CA 3.19Å; L70-T86 WeakPolarHBondContact O-CB 3.48Å; L71-T86 HydrophobicContact CD1-CG2 4.21Å; T86-E88 PolarHBondContact O-N 3.42Å; T86-E88 PolarHBondContact OG1-N 2.63Å; T86-Q89 WeakPolarHBondContact CB-O 3.35Å; T86-Q89 PolarHBondContact N-O 3.42Å; T86-Q89 PolarHBondContact OG1-N 3.25Å; T86-Q89 PolarHBondContact OG1-O 3.16Å; T86-T112 WeakPolarHBondContact O-CB 3.45Å
87	N	95.9	Very high	95.3	Very high	52 Å²	52	22.7 Å²	22.7	28%	0.278	12%	0.115	S	C	.	.	S	Bend	trans	-67.1	-16.6	174	68.5	-31.4	0	0	0	114.4	A69 L70 N111 T112	A69-N87 WeakPolarHBondContact CA-OD1 3.39Å; L70-N87 HydrophobicContact CB-CB 4.4Å; L70-N87 PolarHBondContact N-OD1 2.91Å; L70-N87 PolarHBondContact O-N 3.21Å; L70-N87 PolarHBondContact O-OD1 3.21Å; N87-N111 CarbonylContact O-C 3.58Å; N87-N111 VanDerWaalsContact O-CA 3.28Å; N87-N111 WeakPolarHBondContact O-CA 3.38Å; N87-T112 VanDerWaalsContact CA-O 3.29Å; N87-T112 WeakPolarHBondContact CA-O 3.43Å; N87-T112 PolarHBondContact O-N 2.75Å
88	E	95.1	Very high	95.2	Very high	52 Å²	52	31.7 Å²	31.7	24%	0.243	16%	0.157	C	C	.	.	S	Bend	trans	-113.8	-25.9	-176.2	-69.1	178	-170.4	0	0	113.6	N66 S68 A69 T86 L110	N66-E88 PolarHBondContact ND2-OE2 2.93Å; S68-E88 WeakPolarHBondContact CB-OE1 3.47Å; S68-E88 PolarHBondContact OG-OE1 3.33Å; S68-E88 PolarHBondContact OG-OE2 3.19Å; A69-E88 HydrophobicContact CB-CB 4.4Å; A69-E88 HydrophobicContact CB-CG 4.47Å; T86-E88 PolarHBondContact O-N 3.42Å; T86-E88 PolarHBondContact OG1-N 2.63Å; E88-L110 CarbonylContact C-O 3.56Å; E88-L110 CarbonylContact O-C 3.28Å; E88-L110 VanDerWaalsContact O-C 3.28Å; E88-L110 PolarHBondContact O-N 3.08Å; E88-L110 VanDerWaalsContact O-O 3.07Å
89	Q	94.8	Very high	95.1	Very high	11 Å²	11	37.3 Å²	37.3	5%	0.051	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	158	-173.8	58.7	-166.4	-0.7	0	0	113.9	N66 T86 E91 C107 L108 L110	N66-Q89 VanDerWaalsContact CG-NE2 3.26Å; N66-Q89 PolarHBondContact OD1-NE2 3.32Å; T86-Q89 WeakPolarHBondContact CB-O 3.35Å; T86-Q89 PolarHBondContact N-O 3.42Å; T86-Q89 PolarHBondContact OG1-N 3.25Å; T86-Q89 PolarHBondContact OG1-O 3.16Å; Q89-E91 HydrophobicContact CG-CG 3.81Å; Q89-E91 WeakPolarHBondContact CG-OE1 3.19Å; Q89-E91 PolarHBondContact NE2-OE1 2.91Å; Q89-C107 PolarHBondContact OE1-SG 2.95Å; Q89-L108 CarbonylContact C-O 3.01Å; Q89-L108 VanDerWaalsContact CA-O 3.29Å; Q89-L108 WeakPolarHBondContact CA-O 3.43Å; Q89-L108 WeakPolarHBondContact CB-O 3.3Å; Q89-L110 PolarHBondContact N-O 2.84Å
90	L	96.7	Very high	95.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.2	166.2	-59.4	-176.2	0	0	0	109.3	L83 V85 C107 L108 L110 T126 F136 I144	L83-L90 HydrophobicContact CD1-CB 4.23Å; V85-L90 HydrophobicContact CB-CD2 4.14Å; V85-L90 HydrophobicContact CG1-CD2 3.73Å; V85-L90 HydrophobicContact CG2-CD2 4.02Å; L90-C107 CarbonylContact O-C 3.5Å; L90-C107 WeakPolarHBondContact O-CA 3.43Å; L90-L108 HydrophobicContact CB-CB 4.34Å; L90-L108 HydrophobicContact CD1-CD2 4.44Å; L90-L108 PolarHBondContact N-O 2.97Å; L90-L108 PolarHBondContact O-N 2.99Å; L90-L110 HydrophobicContact CD1-CD2 4.21Å; L90-L110 HydrophobicContact CG-CD2 4.35Å; L90-T126 HydrophobicContact CD2-CG2 4.26Å; L90-F136 HydrophobicContact CD1-CD1 4.47Å; L90-F136 HydrophobicContact CD1-CD2 3.63Å; L90-F136 HydrophobicContact CD1-CE1 4.48Å; L90-F136 HydrophobicContact CD1-CE2 3.61Å; L90-F136 HydrophobicContact CD1-CG 4.08Å; L90-F136 HydrophobicContact CD1-CZ 4.07Å; L90-I144 HydrophobicContact CB-CD1 4.36Å
91	E	96.4	Very high	95.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	113.8	-177.1	-48.6	174.1	172.9	0	0	109.2	K65 F84 Q89 Y93 L104	K65-E91 WeakPolarHBondContact CB-OE1 3.48Å; K65-E91 PolarHBondContact N-OE1 2.76Å; K65-E91 PolarHBondContact N-OE2 3.27Å; F84-E91 HydrophobicContact CB-CB 4.18Å; F84-E91 PolarHBondContact N-O 2.85Å; F84-E91 PolarHBondContact O-N 3.19Å; Q89-E91 HydrophobicContact CG-CG 3.81Å; Q89-E91 WeakPolarHBondContact CG-OE1 3.19Å; Q89-E91 PolarHBondContact NE2-OE1 2.91Å; E91-Y93 HydrophobicContact CB-CD2 4.08Å; E91-Y93 HydrophobicContact CB-CE2 3.44Å; E91-Y93 VanDerWaalsContact CB-CE2 3.44Å; E91-Y93 HydrophobicContact CG-CE2 4.42Å; E91-Y93 VanDerWaalsContact OE2-CE2 3.32Å; E91-Y93 WeakPolarHBondContact OE2-CE2 3.3Å; E91-Y93 PolarHBondContact OE2-OH 3.2Å; E91-L104 HydrophobicContact CB-CD1 3.94Å
92	L	96.9	Very high	95.1	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	115.9	177.9	-175.5	66.9	0	0	0	109.7	E81 L83 N105 S106 L138 G142 I144	E81-L92 HydrophobicContact CB-CD1 4.42Å; L83-L92 HydrophobicContact CB-CD1 4.26Å; L83-L92 HydrophobicContact CD1-CB 4.37Å; L83-L92 HydrophobicContact CD1-CD1 4.41Å; L92-N105 PolarHBondContact O-N 3.13Å; L92-S106 WeakPolarHBondContact CB-OG 3.21Å; L92-S106 PolarHBondContact N-O 2.94Å; L92-S106 PolarHBondContact O-N 3.44Å; L92-L138 HydrophobicContact CD1-CD2 4.05Å; L92-G142 VanDerWaalsContact CD2-C 3.44Å; L92-I144 HydrophobicContact CB-CD1 4.17Å; L92-I144 HydrophobicContact CB-CG1 4.41Å; L92-I144 HydrophobicContact CD2-CG1 4.26Å
93	Y	96.9	Very high	95.1	Very high	5 Å²	5	43.4 Å²	43.4	2%	0.02	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	144.3	-179.7	-69.9	-89.3	0	0	0	111.7	Q62 E81 V82 F84 E91 L102 R103 L104	Q62-Y93 HydrophobicContact CG-CD1 4.17Å; Q62-Y93 HydrophobicContact CG-CE1 3.82Å; Q62-Y93 HydrophobicContact CG-CE2 4.35Å; E81-Y93 VanDerWaalsContact CA-O 3.32Å; E81-Y93 WeakPolarHBondContact CA-O 3.46Å; V82-Y93 PolarHBondContact N-O 3.04Å; V82-Y93 PolarHBondContact O-N 2.84Å; F84-Y93 HydrophobicContact CB-CE2 4.41Å; F84-Y93 HydrophobicContact CD1-CD2 4.34Å; F84-Y93 HydrophobicContact CD2-CD2 4.17Å; F84-Y93 AromaticContact CD2-CE2 3.75Å; F84-Y93 HydrophobicContact CD2-CE2 3.75Å; F84-Y93 HydrophobicContact CE2-CD2 4.42Å; F84-Y93 HydrophobicContact CE2-CE2 4.13Å; F84-Y93 HydrophobicContact CG-CD2 4.12Å; F84-Y93 HydrophobicContact CG-CE2 4.06Å; E91-Y93 HydrophobicContact CB-CD2 4.08Å; E91-Y93 HydrophobicContact CB-CE2 3.44Å; E91-Y93 VanDerWaalsContact CB-CE2 3.44Å; E91-Y93 HydrophobicContact CG-CE2 4.42Å; E91-Y93 VanDerWaalsContact OE2-CE2 3.32Å; E91-Y93 WeakPolarHBondContact OE2-CE2 3.3Å; E91-Y93 PolarHBondContact OE2-OH 3.2Å; Y93-L102 HydrophobicContact CD1-CB 3.99Å; Y93-L102 HydrophobicContact CG-CB 4.42Å; Y93-L102 HydrophobicContact CG-CD2 4.28Å; Y93-R103 CarbonylContact C-O 3.6Å; Y93-R103 WeakPolarHBondContact CA-O 3.41Å; Y93-L104 HydrophobicContact CD1-CB 3.98Å; Y93-L104 HydrophobicContact CD1-CD1 4.13Å; Y93-L104 HydrophobicContact CD2-CD1 4.29Å; Y93-L104 HydrophobicContact CE1-CB 3.73Å; Y93-L104 HydrophobicContact CE1-CD1 3.83Å; Y93-L104 HydrophobicContact CE1-CG 4.33Å; Y93-L104 HydrophobicContact CE2-CD1 4Å; Y93-L104 HydrophobicContact CG-CD1 4.35Å
94	Q	96.2	Very high	95	Very high	63 Å²	63	46.2 Å²	46.2	29%	0.294	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.3	167.4	-177.8	172.9	20.1	0	0	109.7	Y80 L96 L102 R103 N105	Y80-Q94 CarbonylContact O-C 3.6Å; Y80-Q94 WeakPolarHBondContact O-CA 2.95Å; Q94-L96 HydrophobicContact CG-CD2 4.35Å; Q94-L102 CarbonylContact O-C 3.52Å; Q94-L102 WeakPolarHBondContact O-CA 3.44Å; Q94-R103 PolarHBondContact N-O 3.35Å; Q94-R103 PolarHBondContact O-N 2.85Å; Q94-N105 WeakPolarHBondContact CB-ND2 3.49Å; Q94-N105 PolarHBondContact OE1-ND2 2.86Å
95	A	95	Very high	94.8	Very high	2 Å²	2	48.5 Å²	48.5	2%	0.017	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	131.5	173.3	0	0	0	0	0	110.5	I35 W76 Y80 P97 L102	I35-A95 HydrophobicContact CD1-CB 3.73Å; W76-A95 HydrophobicContact CH2-CB 4.35Å; W76-A95 HydrophobicContact CZ3-CB 4.38Å; Y80-A95 PolarHBondContact O-N 3.34Å; A95-P97 WeakPolarHBondContact O-CD 3.28Å; A95-L102 HydrophobicContact CB-CG 4.44Å
96	L	94.7	Very high	94.6	Very high	52 Å²	52	50 Å²	50	27%	0.272	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	86.9	176.8	-60.6	173.9	0	0	0	108.7	Q94 E98 K99 N100 T101 R103	Q94-L96 HydrophobicContact CG-CD2 4.35Å; L96-E98 VanDerWaalsContact C-N 3.27Å; L96-E98 PolarHBondContact O-N 2.92Å; L96-K99 HydrophobicContact CB-CB 4.39Å; L96-K99 HydrophobicContact CD1-CD 4.5Å; L96-K99 PolarHBondContact O-N 3.25Å; L96-N100 PolarHBondContact O-N 3.31Å; L96-N100 VanDerWaalsContact O-N 3.1Å; L96-T101 PolarHBondContact N-O 3.48Å; L96-T101 PolarHBondContact O-N 3.36Å; L96-R103 HydrophobicContact CD1-CB 4.2Å
97	P	90.7	Very high	94.5	Very high	42 Å²	42	51.9 Å²	51.9	27%	0.273	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-57.2	-37.7	-174.1	-27.9	36.1	0	0	0	113.7	I35 N49 Y80 A95 K99 N100	I35-P97 HydrophobicContact CD1-CG 3.8Å; I35-P97 HydrophobicContact CG1-CG 4.43Å; N49-P97 WeakPolarHBondContact ND2-CA 3.36Å; N49-P97 PolarHBondContact ND2-O 2.88Å; Y80-P97 HydrophobicContact CD1-CG 4.03Å; Y80-P97 HydrophobicContact CE1-CG 3.91Å; A95-P97 WeakPolarHBondContact O-CD 3.28Å; P97-K99 PolarHBondContact O-N 3.22Å; P97-N100 PolarHBondContact O-N 3.03Å; P97-N100 PolarHBondContact O-OD1 3.01Å
98	E	89.7	Confident	94.4	Very high	193 Å²	193	50.6 Å²	50.6	90%	0.902	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-60.9	-29.4	179.5	-62.1	177.6	179.2	0	0	113.1	L96	L96-E98 VanDerWaalsContact C-N 3.27Å; L96-E98 PolarHBondContact O-N 2.92Å
99	K	91.1	Very high	94.4	Very high	148 Å²	148	52.8 Å²	52.8	64%	0.643	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-103.9	-3.3	-178.4	-63.4	-175.1	-179.2	179.9	0	112.8	L96 P97 T101	L96-K99 HydrophobicContact CB-CB 4.39Å; L96-K99 HydrophobicContact CD1-CD 4.5Å; L96-K99 PolarHBondContact O-N 3.25Å; P97-K99 PolarHBondContact O-N 3.22Å; K99-T101 WeakPolarHBondContact CB-OG1 3.49Å; K99-T101 PolarHBondContact O-N 3.48Å
100	N	92.6	Very high	94.4	Very high	52 Å²	52	53.5 Å²	53.5	28%	0.278	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	46	45.8	-170.8	-60.3	-48	0	0	0	112.3	N49 Y60 L96 P97	N49-N100 PolarHBondContact ND2-OD1 2.94Å; Y60-N100 WeakPolarHBondContact CB-O 3.34Å; Y60-N100 HydrophobicContact CD1-CB 3.64Å; Y60-N100 WeakPolarHBondContact CD2-O 3.47Å; Y60-N100 HydrophobicContact CE1-CB 4.12Å; Y60-N100 VanDerWaalsContact CG-C 3.49Å; Y60-N100 HydrophobicContact CG-CB 3.94Å; L96-N100 PolarHBondContact O-N 3.31Å; L96-N100 VanDerWaalsContact O-N 3.1Å; P97-N100 PolarHBondContact O-N 3.03Å; P97-N100 PolarHBondContact O-OD1 3.01Å
101	T	94.4	Very high	94.3	Very high	66 Å²	66	58.4 Å²	58.4	41%	0.405	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	161.2	180	47.8	0	0	0	0	111	L96 K99	L96-T101 PolarHBondContact N-O 3.48Å; L96-T101 PolarHBondContact O-N 3.36Å; K99-T101 WeakPolarHBondContact CB-OG1 3.49Å; K99-T101 PolarHBondContact O-N 3.48Å
102	L	96	Very high	94.2	Very high	18 Å²	18	58.7 Å²	58.7	9%	0.094	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	143.4	168.5	-72.3	92.7	0	0	0	109.9	F47 Y60 Q62 V82 Y93 Q94 A95	F47-L102 HydrophobicContact CD1-CD1 4.42Å; F47-L102 HydrophobicContact CD2-CD1 3.38Å; F47-L102 HydrophobicContact CD2-CD2 4.46Å; F47-L102 HydrophobicContact CE1-CD1 4.46Å; F47-L102 HydrophobicContact CE1-CD2 4.04Å; F47-L102 HydrophobicContact CE2-CD1 3.44Å; F47-L102 VanDerWaalsContact CE2-CD1 3.44Å; F47-L102 HydrophobicContact CE2-CD2 3.81Å; F47-L102 HydrophobicContact CE2-CG 4.31Å; F47-L102 HydrophobicContact CG-CD1 3.9Å; F47-L102 HydrophobicContact CZ-CD1 4.01Å; F47-L102 HydrophobicContact CZ-CD2 3.56Å; F47-L102 HydrophobicContact CZ-CG 4.46Å; Y60-L102 HydrophobicContact CD2-CD1 3.8Å; Y60-L102 HydrophobicContact CE2-CD1 3.43Å; Y60-L102 VanDerWaalsContact CE2-CD1 3.43Å; Y60-L102 HydrophobicContact CE2-CG 4.46Å; Q62-L102 HydrophobicContact CB-CB 4.48Å; Q62-L102 HydrophobicContact CB-CD1 3.89Å; Q62-L102 HydrophobicContact CG-CB 4.28Å; V82-L102 HydrophobicContact CG1-CD2 3.46Å; V82-L102 VanDerWaalsContact CG1-CD2 3.46Å; Y93-L102 HydrophobicContact CD1-CB 3.99Å; Y93-L102 HydrophobicContact CG-CB 4.42Å; Y93-L102 HydrophobicContact CG-CD2 4.28Å; Q94-L102 CarbonylContact O-C 3.52Å; Q94-L102 WeakPolarHBondContact O-CA 3.44Å; A95-L102 HydrophobicContact CB-CG 4.44Å
103	R	95.3	Very high	94.1	Very high	153 Å²	153	61.6 Å²	61.6	58%	0.577	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.1	173.3	173.8	-176.5	152.3	-178	-5	108.9	Y93 Q94 L96 N105	Y93-R103 CarbonylContact C-O 3.6Å; Y93-R103 WeakPolarHBondContact CA-O 3.41Å; Q94-R103 PolarHBondContact N-O 3.35Å; Q94-R103 PolarHBondContact O-N 2.85Å; L96-R103 HydrophobicContact CD1-CB 4.2Å; R103-N105 PolarHBondContact NE-OD1 3.28Å; R103-N105 PolarHBondContact O-N 3.34Å
104	L	95.4	Very high	94	Very high	60 Å²	60	62.7 Å²	62.7	31%	0.314	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	119.5	172.7	-176.9	67.1	0	0	0	109.9	K65 E91 Y93 S106 C107	K65-L104 HydrophobicContact CD-CD2 3.85Å; E91-L104 HydrophobicContact CB-CD1 3.94Å; Y93-L104 HydrophobicContact CD1-CB 3.98Å; Y93-L104 HydrophobicContact CD1-CD1 4.13Å; Y93-L104 HydrophobicContact CD2-CD1 4.29Å; Y93-L104 HydrophobicContact CE1-CB 3.73Å; Y93-L104 HydrophobicContact CE1-CD1 3.83Å; Y93-L104 HydrophobicContact CE1-CG 4.33Å; Y93-L104 HydrophobicContact CE2-CD1 4Å; Y93-L104 HydrophobicContact CG-CD1 4.35Å; L104-S106 WeakPolarHBondContact CD1-O 3.42Å; L104-C107 HydrophobicContact CD2-CB 4.31Å
105	N	93.7	Very high	94	Very high	48 Å²	48	61.1 Å²	61.1	26%	0.257	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-48.3	179.8	-82.1	-5.1	0	0	0	112	E81 L92 Q94 R103	E81-N105 PolarHBondContact OE1-ND2 3.19Å; L92-N105 PolarHBondContact O-N 3.13Å; Q94-N105 WeakPolarHBondContact CB-ND2 3.49Å; Q94-N105 PolarHBondContact OE1-ND2 2.86Å; R103-N105 PolarHBondContact NE-OD1 3.28Å; R103-N105 PolarHBondContact O-N 3.34Å
106	S	93.3	Very high	94.1	Very high	30 Å²	30	62.2 Å²	62.2	21%	0.21	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	152	177.4	63.8	0	0	0	0	111.2	L92 L104	L92-S106 WeakPolarHBondContact CB-OG 3.21Å; L92-S106 PolarHBondContact N-O 2.94Å; L92-S106 PolarHBondContact O-N 3.44Å; L104-S106 WeakPolarHBondContact CD1-O 3.42Å
107	C	93.3	Very high	94.1	Very high	41 Å²	41	62.1 Å²	62.1	28%	0.277	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	123.9	-177	-175.1	0	0	0	0	107.8	Q89 L90 L104	Q89-C107 PolarHBondContact OE1-SG 2.95Å; L90-C107 CarbonylContact O-C 3.5Å; L90-C107 WeakPolarHBondContact O-CA 3.43Å; L104-C107 HydrophobicContact CD2-CB 4.31Å
108	L	94.9	Very high	94.3	Very high	24 Å²	24	60.7 Å²	60.7	13%	0.126	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	110.4	-179.1	175	63.4	0	0	0	109.9	Q89 L90 L110 F136 I144 K146	Q89-L108 CarbonylContact C-O 3.01Å; Q89-L108 VanDerWaalsContact CA-O 3.29Å; Q89-L108 WeakPolarHBondContact CA-O 3.43Å; Q89-L108 WeakPolarHBondContact CB-O 3.3Å; L90-L108 HydrophobicContact CB-CB 4.34Å; L90-L108 HydrophobicContact CD1-CD2 4.44Å; L90-L108 PolarHBondContact N-O 2.97Å; L90-L108 PolarHBondContact O-N 2.99Å; L108-L110 PolarHBondContact O-N 3Å; L108-F136 HydrophobicContact CD2-CD1 4.01Å; L108-F136 HydrophobicContact CD2-CE1 3.4Å; L108-F136 VanDerWaalsContact CD2-CE1 3.4Å; L108-F136 HydrophobicContact CD2-CZ 3.96Å; L108-I144 HydrophobicContact CD2-CG2 4.46Å; L108-K146 VanDerWaalsContact CD1-NZ 3.26Å; L108-K146 HydrophobicContact CD2-CD 4.49Å; L108-K146 HydrophobicContact CD2-CG 4.41Å
109	P	94.9	Very high	94.4	Very high	99 Å²	99	54.9 Å²	54.9	64%	0.643	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.2	125.5	172.9	-22.7	33.8	0	0	0	111.1
110	L	93.6	Very high	94.4	Very high	25 Å²	25	54.2 Å²	54.2	13%	0.131	29%	0.288	C	S	.	.			trans	-163.6	119.7	-179.2	-176	71.4	0	0	0	110.8	E88 Q89 L90 L108 T112 T126 F136	E88-L110 CarbonylContact C-O 3.56Å; E88-L110 CarbonylContact O-C 3.28Å; E88-L110 VanDerWaalsContact O-C 3.28Å; E88-L110 PolarHBondContact O-N 3.08Å; E88-L110 VanDerWaalsContact O-O 3.07Å; Q89-L110 PolarHBondContact N-O 2.84Å; L90-L110 HydrophobicContact CD1-CD2 4.21Å; L90-L110 HydrophobicContact CG-CD2 4.35Å; L108-L110 PolarHBondContact O-N 3Å; L110-T112 PolarHBondContact O-N 2.98Å; L110-T112 VanDerWaalsContact O-N 3.13Å; L110-T112 PolarHBondContact O-OG1 3.41Å; L110-T126 HydrophobicContact CD2-CG2 4.25Å; L110-T126 VanDerWaalsContact CD2-OG1 3.26Å; L110-T126 WeakPolarHBondContact CD2-OG1 3.3Å; L110-F136 HydrophobicContact CD2-CE2 3.46Å; L110-F136 VanDerWaalsContact CD2-CE2 3.46Å; L110-F136 HydrophobicContact CD2-CZ 3.47Å; L110-F136 VanDerWaalsContact CD2-CZ 3.47Å
111	N	94.8	Very high	94.3	Very high	104 Å²	104	53.3 Å²	53.3	56%	0.556	28%	0.284	S	S	*	.			trans	-70.5	109.9	173.8	-68.9	-15.3	0	0	0	109.9	N87 D128 P129	N87-N111 CarbonylContact O-C 3.58Å; N87-N111 VanDerWaalsContact O-CA 3.28Å; N87-N111 WeakPolarHBondContact O-CA 3.38Å; N111-D128 WeakPolarHBondContact O-CA 3.24Å; N111-D128 WeakPolarHBondContact O-CB 3.33Å; N111-P129 HydrophobicContact CB-CG 4.32Å
112	T	95.6	Very high	94.3	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.031	27%	0.274	C	S	.	.			trans	-116.1	131	-175	-53.6	0	0	0	0	110.8	L72 V85 T86 N87 L110 W114 T126 S127	L72-T112 HydrophobicContact CD1-CG2 3.7Å; V85-T112 HydrophobicContact CG1-CG2 4.06Å; T86-T112 WeakPolarHBondContact O-CB 3.45Å; N87-T112 VanDerWaalsContact CA-O 3.29Å; N87-T112 WeakPolarHBondContact CA-O 3.43Å; N87-T112 PolarHBondContact O-N 2.75Å; L110-T112 PolarHBondContact O-N 2.98Å; L110-T112 VanDerWaalsContact O-N 3.13Å; L110-T112 PolarHBondContact O-OG1 3.41Å; T112-W114 WeakPolarHBondContact CG2-O 3.31Å; T112-T126 HydrophobicContact CG2-CG2 4.01Å; T112-S127 CarbonylContact C-O 3.55Å; T112-S127 WeakPolarHBondContact CA-O 3.41Å
113	C	94.5	Very high	94.3	Very high	64 Å²	64	51.7 Å²	51.7	43%	0.432	27%	0.271	S	S	.	.	S	Bend	trans	-94.7	-41.2	172.2	-64.9	0	0	0	0	111.7	S127	C113-S127 PolarHBondContact N-O 3.06Å
114	W	95	Very high	94.3	Very high	28 Å²	28	44.4 Å²	44.4	11%	0.106	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	165.4	177.8	56.5	-98.9	0	0	0	110.6	T112 L116 T126 S127 L133 Q167 C170 F181	T112-W114 WeakPolarHBondContact CG2-O 3.31Å; W114-L116 HydrophobicContact CE3-CG 4.25Å; W114-L116 HydrophobicContact CZ3-CD1 3.9Å; W114-L116 HydrophobicContact CZ3-CG 3.82Å; W114-T126 WeakPolarHBondContact O-CA 3.43Å; W114-S127 VanDerWaalsContact NE1-CB 3.3Å; W114-S127 PolarHBondContact NE1-OG 2.93Å; W114-S127 PolarHBondContact O-N 2.97Å; W114-L133 HydrophobicContact CH2-CD2 3.37Å; W114-L133 HydrophobicContact CZ2-CD2 3.6Å; W114-L133 HydrophobicContact CZ3-CD2 4.24Å; W114-Q167 HydrophobicContact CB-CB 4.18Å; W114-Q167 VanDerWaalsContact CB-CD 3.43Å; W114-Q167 HydrophobicContact CB-CG 3.96Å; W114-Q167 VanDerWaalsContact CB-OE1 3.28Å; W114-Q167 HydrophobicContact CD2-CB 3.91Å; W114-Q167 HydrophobicContact CD2-CG 3.85Å; W114-Q167 HydrophobicContact CE3-CB 4.43Å; W114-Q167 HydrophobicContact CE3-CG 3.92Å; W114-Q167 HydrophobicContact CG-CB 3.81Å; W114-Q167 HydrophobicContact CG-CG 3.91Å; W114-C170 HydrophobicContact CH2-CB 4.39Å; W114-F181 HydrophobicContact CH2-CE2 4.42Å
115	F	96.1	Very high	94.4	Very high	29 Å²	29	41.6 Å²	41.6	13%	0.127	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	161.6	177.4	75.7	-79.4	0	0	0	113.2	L72 V75 V85 W117 I125 T126 Q167	L72-F115 HydrophobicContact CB-CD1 4.27Å; L72-F115 HydrophobicContact CB-CE1 4.21Å; V75-F115 HydrophobicContact CG1-CE2 3.92Å; V75-F115 HydrophobicContact CG1-CZ 4.49Å; V85-F115 HydrophobicContact CB-CD1 3.88Å; V85-F115 HydrophobicContact CB-CE1 4.04Å; V85-F115 HydrophobicContact CB-CG 4.16Å; V85-F115 HydrophobicContact CB-CZ 4.44Å; V85-F115 HydrophobicContact CG1-CB 3.96Å; V85-F115 HydrophobicContact CG1-CD1 3.61Å; V85-F115 HydrophobicContact CG1-CE1 4.26Å; V85-F115 HydrophobicContact CG1-CG 3.8Å; V85-F115 HydrophobicContact CG2-CD1 4.25Å; V85-F115 HydrophobicContact CG2-CD2 4.03Å; V85-F115 HydrophobicContact CG2-CE1 4.38Å; V85-F115 HydrophobicContact CG2-CE2 4.16Å; V85-F115 HydrophobicContact CG2-CG 4.07Å; V85-F115 HydrophobicContact CG2-CZ 4.34Å; F115-W117 HydrophobicContact CE2-CB 4.46Å; F115-I125 CarbonylContact C-O 3.58Å; F115-I125 WeakPolarHBondContact CA-O 3.37Å; F115-I125 WeakPolarHBondContact CB-O 3.35Å; F115-T126 HydrophobicContact CB-CG2 4.02Å; F115-Q167 PolarHBondContact O-NE2 3.34Å
116	L	96.4	Very high	94.5	Very high	25 Å²	25	39.3 Å²	39.3	13%	0.131	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	145	170.2	-63.6	172.9	0	0	0	108.6	W114 C124 I125 C170 L172 F181	W114-L116 HydrophobicContact CE3-CG 4.25Å; W114-L116 HydrophobicContact CZ3-CD1 3.9Å; W114-L116 HydrophobicContact CZ3-CG 3.82Å; L116-C124 WeakPolarHBondContact O-CA 3.3Å; L116-I125 HydrophobicContact CB-CB 4.47Å; L116-I125 PolarHBondContact N-O 3.45Å; L116-I125 PolarHBondContact O-N 2.97Å; L116-C170 HydrophobicContact CD1-CB 3.92Å; L116-L172 HydrophobicContact CB-CD1 3.85Å; L116-L172 HydrophobicContact CB-CG 4.02Å; L116-L172 HydrophobicContact CD1-CG 4.34Å; L116-F181 HydrophobicContact CD1-CD2 4.13Å; L116-F181 HydrophobicContact CD1-CE2 3.81Å
117	W	95.4	Very high	94.6	Very high	51 Å²	51	38 Å²	38	19%	0.193	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.3	-179.2	173.4	-111.8	0	0	0	109.8	V75 C77 F115 H122 C124 L138	V75-W117 HydrophobicContact CB-CD2 4.18Å; V75-W117 HydrophobicContact CB-CG 4.09Å; V75-W117 HydrophobicContact CG1-CB 3.96Å; V75-W117 HydrophobicContact CG1-CD2 4.33Å; V75-W117 HydrophobicContact CG1-CG 3.76Å; V75-W117 HydrophobicContact CG2-CD2 3.9Å; V75-W117 HydrophobicContact CG2-CE3 4.15Å; V75-W117 HydrophobicContact CG2-CG 4.21Å; C77-W117 HydrophobicContact CB-CH2 4.41Å; F115-W117 HydrophobicContact CE2-CB 4.46Å; W117-H122 VanDerWaalsContact CH2-CA 3.44Å; W117-H122 HydrophobicContact CH2-CB 3.83Å; W117-H122 HydrophobicContact CZ2-CB 4.47Å; W117-C124 HydrophobicContact CE3-CB 3.87Å; W117-C124 HydrophobicContact CZ3-CB 4.14Å; W117-L138 HydrophobicContact CH2-CB 4.46Å; W117-L138 HydrophobicContact CH2-CD1 4.45Å; W117-L138 HydrophobicContact CZ3-CD1 3.83Å
118	N	94.8	Very high	94.6	Very high	11 Å²	11	37.1 Å²	37.1	6%	0.059	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.5	165.5	-178.4	-73.9	0	0	0	108.8	E120 T121 H122 I123 L172 L179	N118-E120 PolarHBondContact OD1-N 3.31Å; N118-T121 PolarHBondContact OD1-N 3.1Å; N118-T121 PolarHBondContact OD1-OG1 2.88Å; N118-H122 WeakPolarHBondContact O-CA 3.24Å; N118-H122 PolarHBondContact O-N 3.11Å; N118-H122 VanDerWaalsContact O-N 3.16Å; N118-I123 PolarHBondContact N-O 3.47Å; N118-I123 PolarHBondContact O-N 2.94Å; N118-L172 HydrophobicContact CB-CB 4.2Å; N118-L172 HydrophobicContact CB-CD1 3.89Å; N118-L179 HydrophobicContact CB-CD1 3.96Å
119	P	90.8	Very high	94.4	Very high	71 Å²	71	40.1 Å²	40.1	46%	0.461	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-33.2	-177.8	27.5	-33.3	0	0	0	113.2
120	E	90.8	Very high	94.1	Very high	135 Å²	135	41.6 Å²	41.6	63%	0.631	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-40.5	-174.9	-65.9	170.1	-177.1	0	0	112.3	N118 L174	N118-E120 PolarHBondContact OD1-N 3.31Å; E120-L174 VanDerWaalsContact OE2-CD2 3.25Å; E120-L174 WeakPolarHBondContact OE2-CD2 3.44Å
121	T	92.3	Very high	93.8	Very high	33 Å²	33	45.4 Å²	45.4	20%	0.202	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-3.7	179.9	67.1	0	0	0	0	113.3	N118 I123 L174 L179	N118-T121 PolarHBondContact OD1-N 3.1Å; N118-T121 PolarHBondContact OD1-OG1 2.88Å; T121-I123 PolarHBondContact O-N 3.21Å; T121-L174 HydrophobicContact CG2-CD1 3.8Å; T121-L179 HydrophobicContact CG2-CB 4.31Å; T121-L179 HydrophobicContact CG2-CD1 4.22Å
122	H	94	Very high	93.6	Very high	41 Å²	41	44.2 Å²	44.2	19%	0.19	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	42.1	-171.8	-58.9	-94.6	0	0	0	113.2	E31 C77 W117 N118 L138	E31-H122 IonicContact OE1-CE1 3.55Å; C77-H122 PolarHBondContact O-CE1 3.3Å; C77-H122 PolarHBondContact O-ND1 3.21Å; W117-H122 VanDerWaalsContact CH2-CA 3.44Å; W117-H122 HydrophobicContact CH2-CB 3.83Å; W117-H122 HydrophobicContact CZ2-CB 4.47Å; N118-H122 WeakPolarHBondContact O-CA 3.24Å; N118-H122 PolarHBondContact O-N 3.11Å; N118-H122 VanDerWaalsContact O-N 3.16Å; H122-L138 PolarHBondContact O-N 3.15Å
123	I	95.1	Very high	93.6	Very high	9 Å²	9	44 Å²	44	5%	0.046	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.5	179.4	-73.3	171.6	0	0	0	109.9	N118 T121 I125 M135 F136 Q137 L179 I206	N118-I123 PolarHBondContact N-O 3.47Å; N118-I123 PolarHBondContact O-N 2.94Å; T121-I123 PolarHBondContact O-N 3.21Å; I123-I125 HydrophobicContact CG2-CG1 4.46Å; I123-M135 HydrophobicContact CD1-SD 4.45Å; I123-M135 HydrophobicContact CG2-CG 3.71Å; I123-M135 HydrophobicContact CG2-SD 3.9Å; I123-F136 WeakPolarHBondContact CA-O 3.43Å; I123-Q137 HydrophobicContact CG1-CB 4.45Å; I123-Q137 HydrophobicContact CG1-CG 4.23Å; I123-L179 HydrophobicContact CB-CD2 3.85Å; I123-L179 HydrophobicContact CD1-CD2 3.53Å; I123-L179 HydrophobicContact CG1-CD2 4.23Å; I123-L179 HydrophobicContact CG2-CD2 3.9Å; I123-I206 HydrophobicContact CD1-CD1 4.42Å
124	C	96.2	Very high	93.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.8	173.2	-174.1	0	0	0	0	109.6	L116 W117 M135 F136 L138	L116-C124 WeakPolarHBondContact O-CA 3.3Å; W117-C124 HydrophobicContact CE3-CB 3.87Å; W117-C124 HydrophobicContact CZ3-CB 4.14Å; C124-M135 CarbonylContact O-C 3.5Å; C124-F136 HydrophobicContact CB-CB 4.44Å; C124-F136 PolarHBondContact N-O 2.98Å; C124-F136 PolarHBondContact O-N 3.37Å; C124-L138 HydrophobicContact CB-CD1 4.02Å
125	I	96.3	Very high	93.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	134.3	168.4	-63.6	-171.7	0	0	0	108.4	F115 L116 I123 L133 H134 M135 F150 L172 F181 L204	F115-I125 CarbonylContact C-O 3.58Å; F115-I125 WeakPolarHBondContact CA-O 3.37Å; F115-I125 WeakPolarHBondContact CB-O 3.35Å; L116-I125 HydrophobicContact CB-CB 4.47Å; L116-I125 PolarHBondContact N-O 3.45Å; L116-I125 PolarHBondContact O-N 2.97Å; I123-I125 HydrophobicContact CG2-CG1 4.46Å; I125-L133 HydrophobicContact CG2-CB 4.12Å; I125-L133 HydrophobicContact CG2-CD2 4.27Å; I125-H134 WeakPolarHBondContact CA-O 3.49Å; I125-M135 HydrophobicContact CG1-CG 4.48Å; I125-F150 HydrophobicContact CD1-CZ 4.15Å; I125-L172 HydrophobicContact CD1-CD2 3.69Å; I125-L172 HydrophobicContact CG1-CD1 4.5Å; I125-L172 HydrophobicContact CG1-CD2 4.39Å; I125-F181 HydrophobicContact CD1-CB 4.2Å; I125-F181 HydrophobicContact CD1-CD2 3.96Å; I125-F181 HydrophobicContact CD1-CG 4.31Å; I125-L204 HydrophobicContact CD1-CD1 3.65Å; I125-L204 HydrophobicContact CD1-CD2 4.21Å
126	T	96.2	Very high	93.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	148.7	174.5	61.1	0	0	0	0	109.9	L90 L110 T112 W114 F115 L133 H134 F136	L90-T126 HydrophobicContact CD2-CG2 4.26Å; L110-T126 HydrophobicContact CD2-CG2 4.25Å; L110-T126 VanDerWaalsContact CD2-OG1 3.26Å; L110-T126 WeakPolarHBondContact CD2-OG1 3.3Å; T112-T126 HydrophobicContact CG2-CG2 4.01Å; W114-T126 WeakPolarHBondContact O-CA 3.43Å; F115-T126 HydrophobicContact CB-CG2 4.02Å; T126-L133 CarbonylContact O-C 3.56Å; T126-L133 VanDerWaalsContact O-CA 3.26Å; T126-L133 WeakPolarHBondContact O-CA 3.5Å; T126-H134 PolarHBondContact N-O 2.88Å; T126-H134 PolarHBondContact O-N 3.43Å; T126-H134 PolarHBondContact OG1-O 3.49Å; T126-F136 HydrophobicContact CG2-CD2 4.31Å; T126-F136 HydrophobicContact CG2-CE2 4.08Å; T126-F136 WeakPolarHBondContact OG1-CE2 3.14Å
127	S	95.6	Very high	93.5	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.028	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	138.5	170.9	-178.1	0	0	0	0	110.6	T112 C113 W114 K132	T112-S127 CarbonylContact C-O 3.55Å; T112-S127 WeakPolarHBondContact CA-O 3.41Å; C113-S127 PolarHBondContact N-O 3.06Å; W114-S127 VanDerWaalsContact NE1-CB 3.3Å; W114-S127 PolarHBondContact NE1-OG 2.93Å; W114-S127 PolarHBondContact O-N 2.97Å; S127-K132 WeakPolarHBondContact CA-O 3.25Å
128	D	93.6	Very high	93.5	Very high	21 Å²	21	38.4 Å²	38.4	11%	0.112	19%	0.194	C	C	.	.			trans	-90.8	174	170.1	79.4	2.4	0	0	0	112	N111 E130 K131 K132 H134	N111-D128 WeakPolarHBondContact O-CA 3.24Å; N111-D128 WeakPolarHBondContact O-CB 3.33Å; D128-E130 PolarHBondContact O-N 3.43Å; D128-E130 VanDerWaalsContact OD1-CA 3.29Å; D128-E130 WeakPolarHBondContact OD1-CA 3.24Å; D128-E130 WeakPolarHBondContact OD1-CB 3.36Å; D128-E130 PolarHBondContact OD1-N 3Å; D128-K131 PolarHBondContact O-N 2.75Å; D128-K131 PolarHBondContact OD1-N 3.35Å; D128-K132 PolarHBondContact N-O 2.92Å; D128-K132 PolarHBondContact OD1-N 3.07Å; D128-H134 IonicContact OD2-NE2 2.63Å
129	P	90.1	Very high	93.2	Very high	87 Å²	87	45.1 Å²	45.1	57%	0.565	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-23.5	175.9	-23.3	34.7	0	0	0	114.3	N111 K131	N111-P129 HydrophobicContact CB-CG 4.32Å; P129-K131 PolarHBondContact O-N 3.3Å
130	E	88.4	Confident	93	Very high	131 Å²	131	45.8 Å²	45.8	61%	0.612	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	5	174.1	-61.9	-176.6	-177.4	0	0	112.3	D128 K132	D128-E130 PolarHBondContact O-N 3.43Å; D128-E130 VanDerWaalsContact OD1-CA 3.29Å; D128-E130 WeakPolarHBondContact OD1-CA 3.24Å; D128-E130 WeakPolarHBondContact OD1-CB 3.36Å; D128-E130 PolarHBondContact OD1-N 3Å; E130-K132 PolarHBondContact O-N 3.17Å; E130-K132 WeakPolarHBondContact OE2-CE 3.38Å; E130-K132 IonicContact OE2-NZ 2.66Å; E130-K132 PolarHBondContact OE2-NZ 3.32Å
131	K	87.2	Confident	92.8	Very high	105 Å²	105	43.8 Å²	43.8	46%	0.457	23%	0.225	S	C	.	.			trans	63.1	26.8	-179.9	-50.4	173.5	178	174.6	0	113.2	D128 P129 S152 S164	D128-K131 PolarHBondContact O-N 2.75Å; D128-K131 PolarHBondContact OD1-N 3.35Å; P129-K131 PolarHBondContact O-N 3.3Å; K131-S152 WeakPolarHBondContact O-CB 3.4Å; K131-S152 PolarHBondContact O-N 3.5Å; K131-S164 VanDerWaalsContact CD-CB 3.42Å; K131-S164 WeakPolarHBondContact CE-OG 3.09Å; K131-S164 VanDerWaalsContact NZ-CB 3.26Å; K131-S164 PolarHBondContact NZ-OG 2.93Å
132	K	92	Very high	92.7	Very high	78 Å²	78	43.2 Å²	43.2	34%	0.339	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	138.5	165.3	-62.8	166.7	179.6	157.8	0	108.8	S127 D128 E130 L151	S127-K132 WeakPolarHBondContact CA-O 3.25Å; D128-K132 PolarHBondContact N-O 2.92Å; D128-K132 PolarHBondContact OD1-N 3.07Å; E130-K132 PolarHBondContact O-N 3.17Å; E130-K132 WeakPolarHBondContact OE2-CE 3.38Å; E130-K132 IonicContact OE2-NZ 2.66Å; E130-K132 PolarHBondContact OE2-NZ 3.32Å; K132-L151 HydrophobicContact CG-CD2 4.13Å
133	L	94.9	Very high	92.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.4	177.2	-59.3	179.6	0	0	0	109.1	W114 I125 T126 K149 F150 F181	W114-L133 HydrophobicContact CH2-CD2 3.37Å; W114-L133 HydrophobicContact CZ2-CD2 3.6Å; W114-L133 HydrophobicContact CZ3-CD2 4.24Å; I125-L133 HydrophobicContact CG2-CB 4.12Å; I125-L133 HydrophobicContact CG2-CD2 4.27Å; T126-L133 CarbonylContact O-C 3.56Å; T126-L133 VanDerWaalsContact O-CA 3.26Å; T126-L133 WeakPolarHBondContact O-CA 3.5Å; L133-K149 CarbonylContact O-C 3.55Å; L133-K149 VanDerWaalsContact O-CA 3.29Å; L133-K149 WeakPolarHBondContact O-CA 3.47Å; L133-F150 HydrophobicContact CB-CD1 3.84Å; L133-F150 HydrophobicContact CB-CD2 4.17Å; L133-F150 HydrophobicContact CB-CE1 3.51Å; L133-F150 HydrophobicContact CB-CE2 3.88Å; L133-F150 HydrophobicContact CB-CG 4.18Å; L133-F150 HydrophobicContact CB-CZ 3.55Å; L133-F150 HydrophobicContact CD1-CD2 4.09Å; L133-F150 HydrophobicContact CD1-CE1 4.45Å; L133-F150 HydrophobicContact CD1-CE2 3.4Å; L133-F150 HydrophobicContact CD1-CZ 3.62Å; L133-F150 HydrophobicContact CG-CE2 4.21Å; L133-F150 HydrophobicContact CG-CZ 4.22Å; L133-F150 PolarHBondContact N-O 3.27Å; L133-F150 WeakPolarHBondContact O-CD1 3.5Å; L133-F150 PolarHBondContact O-N 2.86Å; L133-F181 HydrophobicContact CD1-CD1 4.35Å; L133-F181 HydrophobicContact CD1-CE1 3.54Å; L133-F181 HydrophobicContact CD1-CE2 4.12Å; L133-F181 HydrophobicContact CD1-CZ 3.41Å; L133-F181 VanDerWaalsContact CD1-CZ 3.41Å
134	H	94.8	Very high	92.5	Very high	16 Å²	16	45.4 Å²	45.4	7%	0.074	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	126	177.6	-56.4	-101	0	0	0	109.1	I125 T126 D128 F136 K149	I125-H134 WeakPolarHBondContact CA-O 3.49Å; T126-H134 PolarHBondContact N-O 2.88Å; T126-H134 PolarHBondContact O-N 3.43Å; T126-H134 PolarHBondContact OG1-O 3.49Å; D128-H134 IonicContact OD2-NE2 2.63Å; H134-F136 HydrophobicContact CB-CE2 3.65Å; H134-F136 HydrophobicContact CB-CZ 3.68Å; H134-K149 WeakPolarHBondContact ND1-CD 3.44Å
135	M	95.4	Very high	92.4	Very high	1 Å²	1	48 Å²	48	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	138.7	175.5	-171	169.7	63.1	0	0	111.2	I123 C124 I125 G147 P148 L204 K205 I206	I123-M135 HydrophobicContact CD1-SD 4.45Å; I123-M135 HydrophobicContact CG2-CG 3.71Å; I123-M135 HydrophobicContact CG2-SD 3.9Å; C124-M135 CarbonylContact O-C 3.5Å; I125-M135 HydrophobicContact CG1-CG 4.48Å; M135-G147 WeakPolarHBondContact O-CA 3.11Å; M135-G147 PolarHBondContact O-N 2.66Å; M135-P148 VanDerWaalsContact CE-CD 3.48Å; M135-P148 HydrophobicContact CE-CG 3.67Å; M135-P148 PolarHBondContact N-O 3.35Å; M135-L204 HydrophobicContact SD-CB 4.06Å; M135-L204 HydrophobicContact SD-CD1 4.46Å; M135-L204 HydrophobicContact SD-CD2 4.28Å; M135-K205 WeakPolarHBondContact CE-O 3.35Å; M135-I206 HydrophobicContact CE-CB 4.42Å; M135-I206 HydrophobicContact CE-CG1 3.64Å
136	F	95.4	Very high	92.3	Very high	8 Å²	8	54.4 Å²	54.4	4%	0.035	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	143.3	174.6	-55.1	-76.1	0	0	0	110.4	L90 L108 L110 I123 C124 T126 H134 L138 I144 T145 K146	L90-F136 HydrophobicContact CD1-CD1 4.47Å; L90-F136 HydrophobicContact CD1-CD2 3.63Å; L90-F136 HydrophobicContact CD1-CE1 4.48Å; L90-F136 HydrophobicContact CD1-CE2 3.61Å; L90-F136 HydrophobicContact CD1-CG 4.08Å; L90-F136 HydrophobicContact CD1-CZ 4.07Å; L108-F136 HydrophobicContact CD2-CD1 4.01Å; L108-F136 HydrophobicContact CD2-CE1 3.4Å; L108-F136 VanDerWaalsContact CD2-CE1 3.4Å; L108-F136 HydrophobicContact CD2-CZ 3.96Å; L110-F136 HydrophobicContact CD2-CE2 3.46Å; L110-F136 VanDerWaalsContact CD2-CE2 3.46Å; L110-F136 HydrophobicContact CD2-CZ 3.47Å; L110-F136 VanDerWaalsContact CD2-CZ 3.47Å; I123-F136 WeakPolarHBondContact CA-O 3.43Å; C124-F136 HydrophobicContact CB-CB 4.44Å; C124-F136 PolarHBondContact N-O 2.98Å; C124-F136 PolarHBondContact O-N 3.37Å; T126-F136 HydrophobicContact CG2-CD2 4.31Å; T126-F136 HydrophobicContact CG2-CE2 4.08Å; T126-F136 WeakPolarHBondContact OG1-CE2 3.14Å; H134-F136 HydrophobicContact CB-CE2 3.65Å; H134-F136 HydrophobicContact CB-CZ 3.68Å; F136-L138 HydrophobicContact CB-CD1 4.37Å; F136-I144 HydrophobicContact CB-CG2 4.03Å; F136-I144 HydrophobicContact CD1-CG2 3.91Å; F136-I144 HydrophobicContact CG-CG2 4.21Å; F136-T145 CarbonylContact C-O 3.51Å; F136-T145 WeakPolarHBondContact CA-O 3.44Å; F136-K146 HydrophobicContact CD1-CG 4.16Å; F136-K146 HydrophobicContact CE1-CG 4Å
137	Q	94.9	Very high	92.1	Very high	47 Å²	47	55.3 Å²	55.3	22%	0.22	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.9	174.1	-167.8	-177.3	43	0	0	110.7	I123 K139 T145 I206	I123-Q137 HydrophobicContact CG1-CB 4.45Å; I123-Q137 HydrophobicContact CG1-CG 4.23Å; Q137-K139 HydrophobicContact CG-CB 4.06Å; Q137-T145 PolarHBondContact N-O 3.4Å; Q137-T145 PolarHBondContact O-N 3.17Å; Q137-I206 HydrophobicContact CB-CD1 3.34Å; Q137-I206 HydrophobicContact CB-CG1 4.43Å; Q137-I206 HydrophobicContact CG-CD1 3.59Å
138	L	94.1	Very high	91.9	Very high	9 Å²	9	56.8 Å²	56.8	5%	0.047	30%	0.303	C	S	.	.			trans	-122.1	45.3	-177.5	-60.8	99.7	0	0	0	110.8	C77 L83 L92 W117 H122 C124 F136 I144	C77-L138 HydrophobicContact CB-CB 4.39Å; L83-L138 HydrophobicContact CB-CD2 4.36Å; L83-L138 HydrophobicContact CD1-CD2 4.01Å; L83-L138 HydrophobicContact CD2-CD1 4.17Å; L83-L138 HydrophobicContact CD2-CD2 3.87Å; L83-L138 HydrophobicContact CG-CD2 4.31Å; L92-L138 HydrophobicContact CD1-CD2 4.05Å; W117-L138 HydrophobicContact CH2-CB 4.46Å; W117-L138 HydrophobicContact CH2-CD1 4.45Å; W117-L138 HydrophobicContact CZ3-CD1 3.83Å; H122-L138 PolarHBondContact O-N 3.15Å; C124-L138 HydrophobicContact CB-CD1 4.02Å; F136-L138 HydrophobicContact CB-CD1 4.37Å; L138-I144 HydrophobicContact CD2-CG1 4.04Å
139	K	88.1	Confident	91.8	Very high	151 Å²	151	63 Å²	63	66%	0.657	33%	0.329	S	S	*	.			trans	-79.2	-36.2	179.8	-172.3	176.1	-178.2	176.8	0	112.4	Q137	Q137-K139 HydrophobicContact CG-CB 4.06Å
140	T	88.3	Confident	91.9	Very high	86 Å²	86	60.2 Å²	60.2	53%	0.528	31%	0.308	S	S	.	.	S	Bend	trans	-92.7	124.1	178.8	-53.6	0	0	0	0	109.2	G142 T143	T140-G142 PolarHBondContact O-N 2.91Å; T140-T143 PolarHBondContact O-N 2.97Å
141	P	86.8	Confident	92	Very high	93 Å²	93	60.1 Å²	60.1	60%	0.604	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	139.5	179.4	-28	34.7	0	0	0	112.9	E81 T143	E81-P141 WeakPolarHBondContact OE2-CA 3.33Å; P141-T143 PolarHBondContact O-N 3.16Å
142	G	88.3	Confident	91.9	Very high	20 Å²	20	55.9 Å²	55.9	21%	0.206	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	-5.5	178.1	0	0	0	0	0	115.7	E81 L92 T140	E81-G142 VanDerWaalsContact CD-N 3.27Å; E81-G142 WeakPolarHBondContact OE1-CA 3.29Å; E81-G142 PolarHBondContact OE1-N 3.16Å; E81-G142 PolarHBondContact OE2-N 3.4Å; L92-G142 VanDerWaalsContact CD2-C 3.44Å; T140-G142 PolarHBondContact O-N 2.91Å
143	T	91.4	Very high	91.6	Very high	71 Å²	71	52.8 Å²	52.8	44%	0.436	28%	0.282	S	S	.	.			trans	-120.6	134.3	-171.7	-49.7	0	0	0	0	112	T140 P141	T140-T143 PolarHBondContact O-N 2.97Å; P141-T143 PolarHBondContact O-N 3.16Å
144	I	94.3	Very high	91.2	Very high	26 Å²	26	55.8 Å²	55.8	13%	0.133	30%	0.301	C	S	.	.			trans	-105.7	106.1	171.2	-55.6	174.2	0	0	0	108.2	L83 L90 L92 L108 F136 L138	L83-I144 HydrophobicContact CD1-CD1 4.25Å; L90-I144 HydrophobicContact CB-CD1 4.36Å; L92-I144 HydrophobicContact CB-CD1 4.17Å; L92-I144 HydrophobicContact CB-CG1 4.41Å; L92-I144 HydrophobicContact CD2-CG1 4.26Å; L108-I144 HydrophobicContact CD2-CG2 4.46Å; F136-I144 HydrophobicContact CB-CG2 4.03Å; F136-I144 HydrophobicContact CD1-CG2 3.91Å; F136-I144 HydrophobicContact CG-CG2 4.21Å; L138-I144 HydrophobicContact CD2-CG1 4.04Å
145	T	94.1	Very high	90.8	Very high	55 Å²	55	55.6 Å²	55.6	34%	0.337	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	125	176.2	-54.5	0	0	0	0	109.6	F136 Q137	F136-T145 CarbonylContact C-O 3.51Å; F136-T145 WeakPolarHBondContact CA-O 3.44Å; Q137-T145 PolarHBondContact N-O 3.4Å; Q137-T145 PolarHBondContact O-N 3.17Å
146	K	93.7	Very high	90.2	Very high	134 Å²	134	57.3 Å²	57.3	58%	0.583	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	126.8	177.7	-60.5	-175.5	-179.1	173.6	0	110.1	L108 F136	L108-K146 VanDerWaalsContact CD1-NZ 3.26Å; L108-K146 HydrophobicContact CD2-CD 4.49Å; L108-K146 HydrophobicContact CD2-CG 4.41Å; F136-K146 HydrophobicContact CD1-CG 4.16Å; F136-K146 HydrophobicContact CE1-CG 4Å
147	G	92.3	Very high	89.2	Confident	18 Å²	18	57.9 Å²	57.9	19%	0.186	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-168.9	171.1	0	0	0	0	0	112.8	M135	M135-G147 WeakPolarHBondContact O-CA 3.11Å; M135-G147 PolarHBondContact O-N 2.66Å
148	P	92.6	Very high	88.1	Confident	35 Å²	35	60.3 Å²	60.3	23%	0.227	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	155.7	175.2	23.6	-35.8	0	0	0	112.9	M135 I206 I210	M135-P148 VanDerWaalsContact CE-CD 3.48Å; M135-P148 HydrophobicContact CE-CG 3.67Å; M135-P148 PolarHBondContact N-O 3.35Å; P148-I206 VanDerWaalsContact CD-O 3.28Å; P148-I206 WeakPolarHBondContact CD-O 3.24Å; P148-I210 HydrophobicContact CB-CD1 4.38Å; P148-I210 HydrophobicContact CG-CD1 3.9Å; P148-I210 HydrophobicContact CG-CG1 4.13Å
149	K	91.6	Very high	87	Confident	152 Å²	152	66.9 Å²	66.9	66%	0.661	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	139.6	170.9	-54.7	177.3	-175.8	178.9	0	108.3	L133 H134	L133-K149 CarbonylContact O-C 3.55Å; L133-K149 VanDerWaalsContact O-CA 3.29Å; L133-K149 WeakPolarHBondContact O-CA 3.47Å; H134-K149 WeakPolarHBondContact ND1-CD 3.44Å
150	F	92.2	Very high	86.2	Confident	29 Å²	29	62.1 Å²	62.1	13%	0.127	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	153	-177	62.5	-71.5	0	0	0	110.5	I125 L133 F181 L204 I210	I125-F150 HydrophobicContact CD1-CZ 4.15Å; L133-F150 HydrophobicContact CB-CD1 3.84Å; L133-F150 HydrophobicContact CB-CD2 4.17Å; L133-F150 HydrophobicContact CB-CE1 3.51Å; L133-F150 HydrophobicContact CB-CE2 3.88Å; L133-F150 HydrophobicContact CB-CG 4.18Å; L133-F150 HydrophobicContact CB-CZ 3.55Å; L133-F150 HydrophobicContact CD1-CD2 4.09Å; L133-F150 HydrophobicContact CD1-CE1 4.45Å; L133-F150 HydrophobicContact CD1-CE2 3.4Å; L133-F150 HydrophobicContact CD1-CZ 3.62Å; L133-F150 HydrophobicContact CG-CE2 4.21Å; L133-F150 HydrophobicContact CG-CZ 4.22Å; L133-F150 PolarHBondContact N-O 3.27Å; L133-F150 WeakPolarHBondContact O-CD1 3.5Å; L133-F150 PolarHBondContact O-N 2.86Å; F150-F181 AromaticContact CE2-CD1 3.85Å; F150-F181 HydrophobicContact CE2-CD1 3.85Å; F150-F181 HydrophobicContact CE2-CE1 4.09Å; F150-F181 HydrophobicContact CE2-CG 4.47Å; F150-F181 HydrophobicContact CZ-CD1 4.24Å; F150-F181 HydrophobicContact CZ-CG 4.42Å; F150-L204 HydrophobicContact CZ-CD2 4.24Å; F150-I210 HydrophobicContact CB-CD1 4.17Å; F150-I210 HydrophobicContact CD1-CD1 3.05Å; F150-I210 HydrophobicContact CD1-CG1 4.41Å; F150-I210 HydrophobicContact CD2-CD1 4.18Å; F150-I210 HydrophobicContact CD2-CG2 4.12Å; F150-I210 HydrophobicContact CE1-CD1 3.24Å; F150-I210 HydrophobicContact CE2-CD1 4.3Å; F150-I210 HydrophobicContact CE2-CG2 4.26Å; F150-I210 HydrophobicContact CG-CB 4.45Å; F150-I210 HydrophobicContact CG-CD1 3.56Å; F150-I210 HydrophobicContact CG-CG2 4.39Å; F150-I210 HydrophobicContact CZ-CD1 3.87Å
151	L	88.9	Confident	85.6	Confident	129 Å²	129	63.4 Å²	63.4	68%	0.675	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	139.1	178.1	-78.7	150.8	0	0	0	110	K132	K132-L151 HydrophobicContact CG-CD2 4.13Å
152	S	85.6	Confident	85.3	Confident	15 Å²	15	63.6 Å²	63.6	11%	0.105	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-59.3	130.2	170.5	-175	0	0	0	0	109.3	K131	K131-S152 WeakPolarHBondContact O-CB 3.4Å; K131-S152 PolarHBondContact O-N 3.5Å
153	P	86.7	Confident	85	Confident	13 Å²	13	66.2 Å²	66.2	8%	0.084	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-57.3	149.1	177.4	-23.6	33.3	0	0	0	111.9	I165 F181 T183 Y202	P153-I165 HydrophobicContact CB-CD1 3.91Å; P153-I165 VanDerWaalsContact O-CD1 3.25Å; P153-I165 WeakPolarHBondContact O-CD1 3.46Å; P153-I165 VanDerWaalsContact O-CG1 3.26Å; P153-I165 WeakPolarHBondContact O-CG1 3.2Å; P153-F181 HydrophobicContact CG-CE1 4.08Å; P153-T183 HydrophobicContact CG-CG2 4.19Å; P153-Y202 HydrophobicContact CB-CE2 4.16Å; P153-Y202 WeakPolarHBondContact CB-OH 3.35Å; P153-Y202 HydrophobicContact CG-CD2 4.25Å; P153-Y202 HydrophobicContact CG-CE1 4.18Å; P153-Y202 HydrophobicContact CG-CE2 3.48Å; P153-Y202 VanDerWaalsContact CG-CE2 3.48Å; P153-Y202 VanDerWaalsContact CG-CZ 3.44Å; P153-Y202 WeakPolarHBondContact CG-OH 3.43Å
154	T	86.5	Confident	84.6	Confident	64 Å²	64	65.1 Å²	65.1	39%	0.393	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	148.9	175	55.2	0	0	0	0	111.2	T163 R185	T154-T163 WeakPolarHBondContact CA-O 3.47Å; T154-R185 WeakPolarHBondContact O-CD 3.31Å
155	S	85.2	Confident	84.1	Confident	12 Å²	12	64.5 Å²	64.5	8%	0.084	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	143	169.6	-175.8	0	0	0	0	109	T162 T163 Y186	S155-T162 CarbonylContact O-C 3.5Å; S155-T162 WeakPolarHBondContact O-CA 3.23Å; S155-T163 PolarHBondContact N-O 3.2Å; S155-T163 PolarHBondContact O-N 3.02Å; S155-T163 PolarHBondContact O-OG1 3.36Å; S155-Y186 PolarHBondContact OG-N 2.98Å
156	V	82.3	Confident	83.8	Confident	37 Å²	37	67 Å²	67	22%	0.224	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	125.7	173.9	-175.1	0	0	0	0	108.6	Y186 L195	V156-Y186 PolarHBondContact N-O 3.16Å; V156-Y186 WeakPolarHBondContact O-CB 3.47Å; V156-L195 HydrophobicContact CB-CD2 3.65Å; V156-L195 HydrophobicContact CG1-CD2 3.65Å
157	G	76.2	Confident	83.6	Confident	20 Å²	20	64.9 Å²	64.9	21%	0.206	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-82.3	167.2	174.7	0	0	0	0	0	112.4	N159 G160 D161 L195	G157-N159 PolarHBondContact O-N 3.4Å; G157-N159 VanDerWaalsContact O-N 3.13Å; G157-G160 PolarHBondContact O-N 2.79Å; G157-D161 PolarHBondContact N-O 3.43Å; G157-L195 WeakPolarHBondContact O-CD1 3.48Å
158	A	70.7	Confident	83.5	Confident	97 Å²	97	71.2 Å²	71.2	80%	0.802	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-31.3	-177.7	0	0	0	0	0	113.8	G160	A158-G160 VanDerWaalsContact C-N 3.34Å
159	N	70.3	Confident	83.4	Confident	148 Å²	148	72.5 Å²	72.5	79%	0.791	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	1.9	179.9	-62.1	-10	0	0	0	113.6	G157	G157-N159 PolarHBondContact O-N 3.4Å; G157-N159 VanDerWaalsContact O-N 3.13Å
160	G	71.7	Confident	83.6	Confident	51 Å²	51	65.7 Å²	65.7	53%	0.526	38%	0.381	S	S	.	.	S	Bend	trans	90	-8.9	-174.8	0	0	0	0	0	114.8	G157 A158	G157-G160 PolarHBondContact O-N 2.79Å; A158-G160 VanDerWaalsContact C-N 3.34Å
161	D	76.4	Confident	83.7	Confident	112 Å²	112	65.6 Å²	65.6	60%	0.599	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-69.4	143.5	176.4	-63.7	-34.2	0	0	0	111.9	G157	G157-D161 PolarHBondContact N-O 3.43Å
162	T	80.1	Confident	84.1	Confident	98 Å²	98	60.2 Å²	60.2	60%	0.601	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	118.8	176.8	54.7	0	0	0	0	111.2	S155	S155-T162 CarbonylContact O-C 3.5Å; S155-T162 WeakPolarHBondContact O-CA 3.23Å
163	T	82.3	Confident	84.6	Confident	75 Å²	75	59.7 Å²	59.7	46%	0.46	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	142	174.7	59.1	0	0	0	0	110.8	T154 S155	T154-T163 WeakPolarHBondContact CA-O 3.47Å; S155-T163 PolarHBondContact N-O 3.2Å; S155-T163 PolarHBondContact O-N 3.02Å; S155-T163 PolarHBondContact O-OG1 3.36Å
164	S	82.8	Confident	85	Confident	47 Å²	47	60.8 Å²	60.8	33%	0.329	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	147.4	171.8	55.8	0	0	0	0	112	K131	K131-S164 VanDerWaalsContact CD-CB 3.42Å; K131-S164 WeakPolarHBondContact CE-OG 3.09Å; K131-S164 VanDerWaalsContact NZ-CB 3.26Å; K131-S164 PolarHBondContact NZ-OG 2.93Å
165	I	83.7	Confident	85.3	Confident	13 Å²	13	57.8 Å²	57.8	7%	0.067	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-82.7	132.9	178.9	-58.2	172.7	0	0	0	110	P153 H169 T183 R185	P153-I165 HydrophobicContact CB-CD1 3.91Å; P153-I165 VanDerWaalsContact O-CD1 3.25Å; P153-I165 WeakPolarHBondContact O-CD1 3.46Å; P153-I165 VanDerWaalsContact O-CG1 3.26Å; P153-I165 WeakPolarHBondContact O-CG1 3.2Å; I165-H169 HydrophobicContact CG2-CB 3.62Å; I165-T183 HydrophobicContact CD1-CG2 4.19Å; I165-R185 HydrophobicContact CD1-CB 3.83Å; I165-R185 HydrophobicContact CD1-CG 4.41Å; I165-R185 HydrophobicContact CG1-CB 4.49Å
166	E	87	Confident	85.6	Confident	107 Å²	107	58.4 Å²	58.4	50%	0.5	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-77.7	154.9	174.8	-64.5	179.9	-176.1	0	0	111.9	K168 H169	E166-K168 HydrophobicContact CB-CG 4.33Å; E166-K168 PolarHBondContact O-N 3.29Å; E166-K168 VanDerWaalsContact O-N 3.14Å; E166-K168 WeakPolarHBondContact OE2-CD 3.49Å; E166-K168 WeakPolarHBondContact OE2-CE 3.5Å; E166-K168 IonicContact OE2-NZ 2.79Å; E166-K168 PolarHBondContact OE2-NZ 3.06Å; E166-H169 PolarHBondContact O-N 3.36Å
167	Q	90.4	Very high	85.9	Confident	90 Å²	90	60.7 Å²	60.7	42%	0.421	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-52.2	-39.5	-179.8	-175.8	-170.6	3.3	0	0	113.2	W114 F115 H169 C170	W114-Q167 HydrophobicContact CB-CB 4.18Å; W114-Q167 VanDerWaalsContact CB-CD 3.43Å; W114-Q167 HydrophobicContact CB-CG 3.96Å; W114-Q167 VanDerWaalsContact CB-OE1 3.28Å; W114-Q167 HydrophobicContact CD2-CB 3.91Å; W114-Q167 HydrophobicContact CD2-CG 3.85Å; W114-Q167 HydrophobicContact CE3-CB 4.43Å; W114-Q167 HydrophobicContact CE3-CG 3.92Å; W114-Q167 HydrophobicContact CG-CB 3.81Å; W114-Q167 HydrophobicContact CG-CG 3.91Å; F115-Q167 PolarHBondContact O-NE2 3.34Å; Q167-H169 PolarHBondContact O-N 3.33Å; Q167-C170 PolarHBondContact O-N 3.01Å
168	K	89.5	Confident	86.6	Confident	151 Å²	151	61.7 Å²	61.7	66%	0.657	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-62	-13.2	-178.8	76.1	-168.7	-172.6	-151.3	0	114.2	E166	E166-K168 HydrophobicContact CB-CG 4.33Å; E166-K168 PolarHBondContact O-N 3.29Å; E166-K168 VanDerWaalsContact O-N 3.14Å; E166-K168 WeakPolarHBondContact OE2-CD 3.49Å; E166-K168 WeakPolarHBondContact OE2-CE 3.5Å; E166-K168 IonicContact OE2-NZ 2.79Å; E166-K168 PolarHBondContact OE2-NZ 3.06Å
169	H	91.6	Very high	87.8	Confident	63 Å²	63	57.5 Å²	57.5	29%	0.292	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-106	5.5	178	-62.4	-44.4	0	0	0	112.8	I165 E166 Q167 T183 I184	I165-H169 HydrophobicContact CG2-CB 3.62Å; E166-H169 PolarHBondContact O-N 3.36Å; Q167-H169 PolarHBondContact O-N 3.33Å; H169-T183 WeakPolarHBondContact O-CA 3.5Å; H169-I184 HydrophobicContact CB-CB 4.18Å; H169-I184 HydrophobicContact CB-CD1 4.37Å; H169-I184 HydrophobicContact CB-CG1 4.48Å; H169-I184 PolarHBondContact O-N 3.48Å
170	C	94.8	Very high	89	Confident	9 Å²	9	50.9 Å²	50.9	6%	0.061	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	138.5	179.7	-60	0	0	0	0	109.9	W114 L116 Q167 F181 C182	W114-C170 HydrophobicContact CH2-CB 4.39Å; L116-C170 HydrophobicContact CD1-CB 3.92Å; Q167-C170 PolarHBondContact O-N 3.01Å; C170-F181 HydrophobicContact CB-CE2 3.84Å; C170-F181 HydrophobicContact CB-CZ 4.1Å; C170-C182 VanDerWaalsContact CA-O 3.31Å; C170-C182 WeakPolarHBondContact CA-O 3.41Å
171	F	95.8	Very high	90.2	Very high	27 Å²	27	48.4 Å²	48.4	12%	0.118	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	163.8	173.6	58.1	-86.1	0	0	0	110.9	T173 C182 I199 F226 F233 L303	F171-T173 HydrophobicContact CE2-CG2 4.48Å; F171-C182 HydrophobicContact CD1-CB 4.06Å; F171-C182 HydrophobicContact CD2-CB 3.67Å; F171-C182 HydrophobicContact CE1-CB 3.72Å; F171-C182 HydrophobicContact CE2-CB 3.3Å; F171-C182 HydrophobicContact CG-CB 4.04Å; F171-C182 HydrophobicContact CZ-CB 3.33Å; F171-C182 PolarHBondContact N-O 2.97Å; F171-C182 PolarHBondContact O-N 2.82Å; F171-I199 HydrophobicContact CE1-CG2 4.48Å; F171-I199 HydrophobicContact CZ-CG2 4.1Å; F171-F226 HydrophobicContact CD1-CD2 4.31Å; F171-F226 HydrophobicContact CD1-CE2 4.35Å; F171-F226 AromaticContact CE1-CD2 3.72Å; F171-F226 HydrophobicContact CE1-CD2 3.72Å; F171-F226 AromaticContact CE1-CE2 3.67Å; F171-F226 HydrophobicContact CE1-CE2 3.67Å; F171-F226 HydrophobicContact CE1-CZ 4.46Å; F171-F226 AromaticContact CZ-CD2 3.97Å; F171-F226 HydrophobicContact CZ-CD2 3.97Å; F171-F226 HydrophobicContact CZ-CE2 4.24Å; F171-F226 HydrophobicContact CZ-CG 4.38Å; F171-F233 AromaticContact CE2-CE2 3.91Å; F171-F233 HydrophobicContact CE2-CE2 3.91Å; F171-F233 HydrophobicContact CE2-CZ 4.46Å; F171-F233 AromaticContact CZ-CE2 3.87Å; F171-F233 HydrophobicContact CZ-CE2 3.87Å; F171-F233 AromaticContact CZ-CZ 3.96Å; F171-F233 HydrophobicContact CZ-CZ 3.96Å; F171-L303 HydrophobicContact CD2-CD1 4.12Å; F171-L303 HydrophobicContact CD2-CD2 3.81Å; F171-L303 HydrophobicContact CE2-CD1 4.06Å; F171-L303 HydrophobicContact CE2-CD2 4.43Å
172	L	96.5	Very high	91.2	Very high	15 Å²	15	43.1 Å²	43.1	8%	0.079	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	136.7	173.3	-70.5	176.6	0	0	0	108.8	L116 N118 I125 Y180 F181 L204 L303	L116-L172 HydrophobicContact CB-CD1 3.85Å; L116-L172 HydrophobicContact CB-CG 4.02Å; L116-L172 HydrophobicContact CD1-CG 4.34Å; N118-L172 HydrophobicContact CB-CB 4.2Å; N118-L172 HydrophobicContact CB-CD1 3.89Å; I125-L172 HydrophobicContact CD1-CD2 3.69Å; I125-L172 HydrophobicContact CG1-CD1 4.5Å; I125-L172 HydrophobicContact CG1-CD2 4.39Å; L172-Y180 WeakPolarHBondContact CA-O 3.43Å; L172-F181 HydrophobicContact CD2-CB 4.23Å; L172-F181 HydrophobicContact CD2-CD2 4.28Å; L172-L204 HydrophobicContact CD2-CD1 3.54Å; L172-L303 WeakPolarHBondContact O-CD2 3.33Å
173	T	95.7	Very high	91.9	Very high	4 Å²	4	38.4 Å²	38.4	3%	0.025	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	143.6	175.5	-167.6	0	0	0	0	111.1	F171 L175 Y180 C182 F201 V228	F171-T173 HydrophobicContact CE2-CG2 4.48Å; T173-L175 HydrophobicContact CG2-CD1 4.25Å; T173-L175 HydrophobicContact CG2-CG 4.33Å; T173-Y180 PolarHBondContact N-O 2.84Å; T173-Y180 PolarHBondContact O-N 3.38Å; T173-C182 WeakPolarHBondContact CG2-SG 3.43Å; T173-F201 HydrophobicContact CG2-CD1 4.27Å; T173-F201 HydrophobicContact CG2-CE1 3.94Å; T173-V228 WeakPolarHBondContact OG1-CG2 3.47Å
174	L	94.8	Very high	92.4	Very high	37 Å²	37	35.7 Å²	35.7	19%	0.194	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.1	166.9	-161.5	75.4	0	0	0	107.9	E120 T121 D178 L179	E120-L174 VanDerWaalsContact OE2-CD2 3.25Å; E120-L174 WeakPolarHBondContact OE2-CD2 3.44Å; T121-L174 HydrophobicContact CG2-CD1 3.8Å; L174-D178 WeakPolarHBondContact CA-O 3.46Å; L174-L179 HydrophobicContact CD1-CB 4.21Å; L174-L179 HydrophobicContact CD1-CD1 4.42Å
175	L	93.6	Very high	92.8	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	124.9	172.3	-72.4	171.9	0	0	0	107.4	T173 D177 D178 Y180 F201 V228 F233 I248	T173-L175 HydrophobicContact CG2-CD1 4.25Å; T173-L175 HydrophobicContact CG2-CG 4.33Å; L175-D177 PolarHBondContact O-N 3.18Å; L175-D178 PolarHBondContact N-O 3.48Å; L175-D178 PolarHBondContact O-N 3.44Å; L175-D178 VanDerWaalsContact O-N 3.13Å; L175-Y180 HydrophobicContact CB-CD2 4.27Å; L175-Y180 HydrophobicContact CB-CE2 3.98Å; L175-F201 HydrophobicContact CD1-CD1 4.27Å; L175-F201 HydrophobicContact CD1-CE1 3.67Å; L175-V228 HydrophobicContact CD2-CG1 3.56Å; L175-V228 HydrophobicContact CD2-CG2 4.45Å; L175-F233 HydrophobicContact CD1-CB 4.31Å; L175-I248 HydrophobicContact CB-CD1 3.61Å; L175-I248 HydrophobicContact CB-CG1 4.35Å; L175-I248 HydrophobicContact CD1-CD1 3.81Å; L175-I248 HydrophobicContact CD1-CG1 4.27Å; L175-I248 HydrophobicContact CD1-CG2 4.21Å; L175-I248 HydrophobicContact CG-CD1 4.35Å
176	Y	90.8	Very high	93	Very high	25 Å²	25	37.8 Å²	37.8	10%	0.098	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	45.8	-178.2	-61.1	-75.8	0	0	0	112.5	D178 N231 D247 I248 A249 H341 R342 L442	Y176-D178 PolarHBondContact O-N 3.1Å; Y176-N231 HydrophobicContact CD1-CB 3.88Å; Y176-N231 HydrophobicContact CD2-CB 4.07Å; Y176-N231 HydrophobicContact CE1-CB 3.59Å; Y176-N231 HydrophobicContact CE2-CB 3.8Å; Y176-N231 HydrophobicContact CG-CB 4.13Å; Y176-N231 PolarHBondContact N-OD1 3.44Å; Y176-D247 VanDerWaalsContact CE2-OD1 3.3Å; Y176-D247 WeakPolarHBondContact CE2-OD1 3.43Å; Y176-D247 PolarHBondContact OH-OD1 3.42Å; Y176-D247 PolarHBondContact OH-OD2 3.46Å; Y176-I248 HydrophobicContact CD2-CD1 4.07Å; Y176-I248 HydrophobicContact CD2-CG1 3.69Å; Y176-I248 HydrophobicContact CE2-CG1 3.78Å; Y176-A249 HydrophobicContact CD2-CB 4.2Å; Y176-A249 HydrophobicContact CE1-CB 4.14Å; Y176-A249 HydrophobicContact CE2-CB 3.55Å; Y176-A249 VanDerWaalsContact CZ-CB 3.5Å; Y176-H341 HydrophobicContact CE1-CB 4.09Å; Y176-R342 PolarHBondContact OH-NH1 3.33Å; Y176-L442 HydrophobicContact CD1-CD2 3.97Å
177	D	88.6	Confident	92.8	Very high	85 Å²	85	33.7 Å²	33.7	46%	0.455	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	-1.3	-179.7	-54.5	-46.1	0	0	0	116.4	L175	L175-D177 PolarHBondContact O-N 3.18Å
178	D	92.4	Very high	92.4	Very high	42 Å²	42	35.9 Å²	35.9	23%	0.225	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	133.7	171.1	-81.3	-40.2	0	0	0	110.5	L174 L175 Y176 Y180	L174-D178 WeakPolarHBondContact CA-O 3.46Å; L175-D178 PolarHBondContact N-O 3.48Å; L175-D178 PolarHBondContact O-N 3.44Å; L175-D178 VanDerWaalsContact O-N 3.13Å; Y176-D178 PolarHBondContact O-N 3.1Å; D178-Y180 HydrophobicContact CB-CD2 4.49Å; D178-Y180 HydrophobicContact CB-CE2 3.62Å; D178-Y180 VanDerWaalsContact O-CD2 3.25Å; D178-Y180 WeakPolarHBondContact O-CD2 3.18Å; D178-Y180 VanDerWaalsContact O-CE2 3.29Å; D178-Y180 WeakPolarHBondContact O-CE2 3.42Å
179	L	95.2	Very high	91.9	Very high	8 Å²	8	29.7 Å²	29.7	4%	0.042	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132.5	174.8	-174.3	74.6	0	0	0	110.3	N118 T121 I123 L174 L204	N118-L179 HydrophobicContact CB-CD1 3.96Å; T121-L179 HydrophobicContact CG2-CB 4.31Å; T121-L179 HydrophobicContact CG2-CD1 4.22Å; I123-L179 HydrophobicContact CB-CD2 3.85Å; I123-L179 HydrophobicContact CD1-CD2 3.53Å; I123-L179 HydrophobicContact CG1-CD2 4.23Å; I123-L179 HydrophobicContact CG2-CD2 3.9Å; L174-L179 HydrophobicContact CD1-CB 4.21Å; L174-L179 HydrophobicContact CD1-CD1 4.42Å; L179-L204 HydrophobicContact CB-CB 4.41Å; L179-L204 HydrophobicContact CD2-CB 4.14Å; L179-L204 HydrophobicContact CD2-CD1 3.65Å; L179-L204 HydrophobicContact CG-CB 4.35Å; L179-L204 HydrophobicContact CG-CD1 3.94Å; L179-L204 WeakPolarHBondContact O-CB 3.26Å; L179-L204 PolarHBondContact O-N 3.24Å
180	Y	96.4	Very high	90.8	Very high	9 Å²	9	35.5 Å²	35.5	4%	0.035	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	137.7	177.1	-58.8	-89.7	0	0	0	112	L172 T173 L175 D178 F201 Y202 T203 A213 H214 I248	L172-Y180 WeakPolarHBondContact CA-O 3.43Å; T173-Y180 PolarHBondContact N-O 2.84Å; T173-Y180 PolarHBondContact O-N 3.38Å; L175-Y180 HydrophobicContact CB-CD2 4.27Å; L175-Y180 HydrophobicContact CB-CE2 3.98Å; D178-Y180 HydrophobicContact CB-CD2 4.49Å; D178-Y180 HydrophobicContact CB-CE2 3.62Å; D178-Y180 VanDerWaalsContact O-CD2 3.25Å; D178-Y180 WeakPolarHBondContact O-CD2 3.18Å; D178-Y180 VanDerWaalsContact O-CE2 3.29Å; D178-Y180 WeakPolarHBondContact O-CE2 3.42Å; Y180-F201 HydrophobicContact CD1-CB 3.83Å; Y180-F201 HydrophobicContact CD1-CD1 4.37Å; Y180-F201 HydrophobicContact CD2-CD1 4.48Å; Y180-F201 HydrophobicContact CE1-CB 4.48Å; Y180-F201 HydrophobicContact CG-CB 4.27Å; Y180-F201 HydrophobicContact CG-CD1 4.04Å; Y180-Y202 CarbonylContact C-O 3.56Å; Y180-Y202 VanDerWaalsContact CA-O 3.26Å; Y180-Y202 WeakPolarHBondContact CA-O 3.49Å; Y180-T203 WeakPolarHBondContact CE1-OG1 3.22Å; Y180-A213 HydrophobicContact CE1-CB 4.33Å; Y180-H214 AromaticContact CE1-CD2 3.6Å; Y180-H214 AromaticContact CE1-NE2 3.87Å; Y180-H214 AromaticContact CZ-CD2 3.97Å; Y180-H214 AromaticContact CZ-NE2 3.93Å; Y180-H214 PolarHBondContact OH-NE2 2.89Å; Y180-I248 HydrophobicContact CE2-CD1 3.92Å
181	F	96.6	Very high	89.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	118.2	158.8	173.9	-112.4	0	0	0	108.6	W114 L116 I125 L133 F150 P153 C170 L172 T183 Y202 L204	W114-F181 HydrophobicContact CH2-CE2 4.42Å; L116-F181 HydrophobicContact CD1-CD2 4.13Å; L116-F181 HydrophobicContact CD1-CE2 3.81Å; I125-F181 HydrophobicContact CD1-CB 4.2Å; I125-F181 HydrophobicContact CD1-CD2 3.96Å; I125-F181 HydrophobicContact CD1-CG 4.31Å; L133-F181 HydrophobicContact CD1-CD1 4.35Å; L133-F181 HydrophobicContact CD1-CE1 3.54Å; L133-F181 HydrophobicContact CD1-CE2 4.12Å; L133-F181 HydrophobicContact CD1-CZ 3.41Å; L133-F181 VanDerWaalsContact CD1-CZ 3.41Å; F150-F181 AromaticContact CE2-CD1 3.85Å; F150-F181 HydrophobicContact CE2-CD1 3.85Å; F150-F181 HydrophobicContact CE2-CE1 4.09Å; F150-F181 HydrophobicContact CE2-CG 4.47Å; F150-F181 HydrophobicContact CZ-CD1 4.24Å; F150-F181 HydrophobicContact CZ-CG 4.42Å; P153-F181 HydrophobicContact CG-CE1 4.08Å; C170-F181 HydrophobicContact CB-CE2 3.84Å; C170-F181 HydrophobicContact CB-CZ 4.1Å; L172-F181 HydrophobicContact CD2-CB 4.23Å; L172-F181 HydrophobicContact CD2-CD2 4.28Å; F181-T183 HydrophobicContact CD1-CG2 3.98Å; F181-T183 HydrophobicContact CE1-CG2 3.22Å; F181-T183 HydrophobicContact CE2-CG2 4.24Å; F181-T183 HydrophobicContact CZ-CG2 3.37Å; F181-Y202 AromaticContact CD1-CD2 3.99Å; F181-Y202 HydrophobicContact CD1-CD2 3.99Å; F181-Y202 HydrophobicContact CD1-CG 4.38Å; F181-Y202 PolarHBondContact N-O 3.19Å; F181-Y202 WeakPolarHBondContact O-CD2 3.44Å; F181-Y202 PolarHBondContact O-N 3.42Å; F181-L204 HydrophobicContact CB-CD1 3.86Å; F181-L204 HydrophobicContact CB-CD2 3.85Å; F181-L204 HydrophobicContact CB-CG 3.96Å
182	C	96.8	Very high	88.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	136.3	-176.6	-64.6	0	0	0	0	110.7	C170 F171 T173 I199 S200 F201	C170-C182 VanDerWaalsContact CA-O 3.31Å; C170-C182 WeakPolarHBondContact CA-O 3.41Å; F171-C182 HydrophobicContact CD1-CB 4.06Å; F171-C182 HydrophobicContact CD2-CB 3.67Å; F171-C182 HydrophobicContact CE1-CB 3.72Å; F171-C182 HydrophobicContact CE2-CB 3.3Å; F171-C182 HydrophobicContact CG-CB 4.04Å; F171-C182 HydrophobicContact CZ-CB 3.33Å; F171-C182 PolarHBondContact N-O 2.97Å; F171-C182 PolarHBondContact O-N 2.82Å; T173-C182 WeakPolarHBondContact CG2-SG 3.43Å; C182-I199 HydrophobicContact CB-CG2 4.31Å; C182-S200 VanDerWaalsContact CA-O 3.26Å; C182-S200 WeakPolarHBondContact CA-O 3.19Å; C182-F201 WeakPolarHBondContact SG-CD1 3.33Å; C182-F201 WeakPolarHBondContact SG-CE1 3.48Å
183	T	95	Very high	86.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	137.6	173.5	64.2	0	0	0	0	112	P153 I165 H169 F181 I199 S200	P153-T183 HydrophobicContact CG-CG2 4.19Å; I165-T183 HydrophobicContact CD1-CG2 4.19Å; H169-T183 WeakPolarHBondContact O-CA 3.5Å; F181-T183 HydrophobicContact CD1-CG2 3.98Å; F181-T183 HydrophobicContact CE1-CG2 3.22Å; F181-T183 HydrophobicContact CE2-CG2 4.24Å; F181-T183 HydrophobicContact CZ-CG2 3.37Å; T183-I199 WeakPolarHBondContact O-CA 3.43Å; T183-S200 PolarHBondContact N-O 3.3Å; T183-S200 PolarHBondContact O-N 2.95Å
184	I	93.3	Very high	85.8	Confident	17 Å²	17	60.2 Å²	60.2	9%	0.087	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	122	170.3	-45.7	167	0	0	0	108	H169 R197 F226	H169-I184 HydrophobicContact CB-CB 4.18Å; H169-I184 HydrophobicContact CB-CD1 4.37Å; H169-I184 HydrophobicContact CB-CG1 4.48Å; H169-I184 PolarHBondContact O-N 3.48Å; I184-R197 HydrophobicContact CG2-CG 4.39Å; I184-F226 HydrophobicContact CD1-CE2 3.58Å; I184-F226 HydrophobicContact CD1-CZ 3.54Å; I184-F226 HydrophobicContact CG1-CE2 4.04Å; I184-F226 HydrophobicContact CG1-CZ 3.85Å
185	R	90.2	Very high	85.2	Confident	33 Å²	33	60.5 Å²	60.5	13%	0.125	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	158.8	179.3	59.4	177.2	-174.2	118.8	8.5	113.1	T154 I165 V187 T198 S200	T154-R185 WeakPolarHBondContact O-CD 3.31Å; I165-R185 HydrophobicContact CD1-CB 3.83Å; I165-R185 HydrophobicContact CD1-CG 4.41Å; I165-R185 HydrophobicContact CG1-CB 4.49Å; R185-V187 HydrophobicContact CG-CG2 3.88Å; R185-V187 VanDerWaalsContact CZ-CG2 3.45Å; R185-T198 PolarHBondContact N-O 3.24Å; R185-T198 PolarHBondContact O-N 3.08Å; R185-T198 VanDerWaalsContact O-O 3.14Å; R185-T198 PolarHBondContact O-OG1 3.29Å; R185-S200 PolarHBondContact NE-OG 3.12Å; R185-S200 PolarHBondContact NH2-OG 2.92Å
186	Y	87.3	Confident	84.9	Confident	71 Å²	71	61.7 Å²	61.7	28%	0.278	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	132.3	168.9	-68.5	-85.9	0	0	0	109.9	S155 V156 L195 T196 R197 Q221	S155-Y186 PolarHBondContact OG-N 2.98Å; V156-Y186 PolarHBondContact N-O 3.16Å; V156-Y186 WeakPolarHBondContact O-CB 3.47Å; Y186-L195 HydrophobicContact CD1-CB 4.24Å; Y186-T196 WeakPolarHBondContact CA-O 3.27Å; Y186-R197 HydrophobicContact CD1-CB 3.93Å; Y186-R197 HydrophobicContact CD1-CG 4.24Å; Y186-R197 HydrophobicContact CE1-CB 3.6Å; Y186-R197 HydrophobicContact CE1-CG 3.81Å; Y186-R197 HydrophobicContact CE2-CG 4.42Å; Y186-Q221 PolarHBondContact OH-OE1 3.18Å
187	V	83.5	Confident	84.9	Confident	22 Å²	22	61.6 Å²	61.6	13%	0.133	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	139.5	-178.4	-170.1	0	0	0	0	108.4	R185 L189 T196 T198	R185-V187 HydrophobicContact CG-CG2 3.88Å; R185-V187 VanDerWaalsContact CZ-CG2 3.45Å; V187-L189 PolarHBondContact O-N 2.9Å; V187-T196 PolarHBondContact N-O 3.14Å; V187-T196 PolarHBondContact O-N 3.06Å; V187-T198 HydrophobicContact CB-CG2 4.27Å; V187-T198 HydrophobicContact CG2-CG2 4.22Å; V187-T198 VanDerWaalsContact CG2-OG1 3.29Å; V187-T198 WeakPolarHBondContact CG2-OG1 3.29Å
188	K	81.3	Confident	85.1	Confident	136 Å²	136	57.6 Å²	57.6	59%	0.591	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	109.1	170	-164.4	170.3	-173.1	172.8	0	108.3	L195	K188-L195 HydrophobicContact CB-CD2 4.28Å
189	L	79.3	Confident	85.2	Confident	20 Å²	20	55.6 Å²	55.6	11%	0.105	26%	0.261	C	S	.	.			trans	-78.4	153.1	178.7	-64.8	172	0	0	0	110.3	V187 N191 E192 T196 L215 L217	V187-L189 PolarHBondContact O-N 2.9Å; L189-N191 PolarHBondContact O-N 3.43Å; L189-E192 PolarHBondContact O-N 3.18Å; L189-T196 HydrophobicContact CD1-CG2 3.71Å; L189-L215 HydrophobicContact CD2-CD2 4.43Å; L189-L217 HydrophobicContact CD1-CD2 3.59Å; L189-L217 HydrophobicContact CD2-CD2 4.33Å
190	Y	69.4	Low	85.2	Confident	185 Å²	185	55.2 Å²	55.2	73%	0.725	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	129	175.4	-70.6	-84.5	0	0	0	109.3	E192	Y190-E192 VanDerWaalsContact C-N 3.33Å; Y190-E192 PolarHBondContact O-N 3.4Å
191	N	64.7	Low	85.2	Confident	171 Å²	171	54.8 Å²	54.8	91%	0.914	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	4.3	179.9	-51.4	-25.5	0	0	0	117	L189	L189-N191 PolarHBondContact O-N 3.43Å
192	E	67.8	Low	85.1	Confident	95 Å²	95	56.3 Å²	56.3	44%	0.444	26%	0.263	S	S	.	.			trans	-108.3	128.5	173.8	-67.8	-174.9	165.1	0	0	111.1	L189 Y190 N194 T196	L189-E192 PolarHBondContact O-N 3.18Å; Y190-E192 VanDerWaalsContact C-N 3.33Å; Y190-E192 PolarHBondContact O-N 3.4Å; E192-N194 VanDerWaalsContact C-N 3.29Å; E192-T196 PolarHBondContact OE2-OG1 3.37Å
193	Q	67.9	Low	85	Confident	181 Å²	181	57.5 Å²	57.5	85%	0.846	27%	0.271	S	S	*	.	S	Bend	trans	-71.3	-30	174	-69.1	-159.1	-1.9	0	0	111.7
194	N	76.6	Confident	84.9	Confident	128 Å²	128	57.9 Å²	57.9	68%	0.684	27%	0.272	S	S	*	.	S	Bend	trans	-87.1	150.6	-175.9	-67.2	-20.2	0	0	0	111.8	E192 T196	E192-N194 VanDerWaalsContact C-N 3.29Å; N194-T196 PolarHBondContact O-N 3.1Å
195	L	83.2	Confident	84.7	Confident	42 Å²	42	60.4 Å²	60.4	22%	0.22	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123	172.9	-74.7	162.3	0	0	0	109.7	V156 G157 Y186 K188	V156-L195 HydrophobicContact CB-CD2 3.65Å; V156-L195 HydrophobicContact CG1-CD2 3.65Å; G157-L195 WeakPolarHBondContact O-CD1 3.48Å; Y186-L195 HydrophobicContact CD1-CB 4.24Å; K188-L195 HydrophobicContact CB-CD2 4.28Å
196	T	86	Confident	84.5	Confident	25 Å²	25	61 Å²	61	15%	0.153	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	133.8	177.7	-60.6	0	0	0	0	108.7	Y186 V187 L189 E192 N194 T198 L217	Y186-T196 WeakPolarHBondContact CA-O 3.27Å; V187-T196 PolarHBondContact N-O 3.14Å; V187-T196 PolarHBondContact O-N 3.06Å; L189-T196 HydrophobicContact CD1-CG2 3.71Å; E192-T196 PolarHBondContact OE2-OG1 3.37Å; N194-T196 PolarHBondContact O-N 3.1Å; T196-T198 HydrophobicContact CG2-CG2 4.28Å; T196-L217 HydrophobicContact CG2-CD2 4.14Å
197	R	90.9	Very high	84.4	Confident	24 Å²	24	66.4 Å²	66.4	9%	0.091	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	129.4	177.2	-163.7	-177.8	175.5	-153.1	10.1	108.7	I184 Y186 L218 G222	I184-R197 HydrophobicContact CG2-CG 4.39Å; Y186-R197 HydrophobicContact CD1-CB 3.93Å; Y186-R197 HydrophobicContact CD1-CG 4.24Å; Y186-R197 HydrophobicContact CE1-CB 3.6Å; Y186-R197 HydrophobicContact CE1-CG 3.81Å; Y186-R197 HydrophobicContact CE2-CG 4.42Å; R197-L218 HydrophobicContact CB-CB 4.38Å; R197-L218 HydrophobicContact CG-CD1 4.1Å; R197-L218 WeakPolarHBondContact O-CB 3.47Å; R197-L218 PolarHBondContact O-N 3.13Å; R197-G222 PolarHBondContact NH1-O 3.24Å; R197-G222 PolarHBondContact NH2-O 3.49Å
198	T	92.9	Very high	84.5	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	159.7	-171.2	70.6	0	0	0	0	110.8	R185 V187 T196 L215 V216 L217	R185-T198 PolarHBondContact N-O 3.24Å; R185-T198 PolarHBondContact O-N 3.08Å; R185-T198 VanDerWaalsContact O-O 3.14Å; R185-T198 PolarHBondContact O-OG1 3.29Å; V187-T198 HydrophobicContact CB-CG2 4.27Å; V187-T198 HydrophobicContact CG2-CG2 4.22Å; V187-T198 VanDerWaalsContact CG2-OG1 3.29Å; V187-T198 WeakPolarHBondContact CG2-OG1 3.29Å; T196-T198 HydrophobicContact CG2-CG2 4.28Å; T198-L215 HydrophobicContact CG2-CD2 3.74Å; T198-L215 HydrophobicContact CG2-CG 4.28Å; T198-V216 CarbonylContact C-O 3.57Å; T198-V216 WeakPolarHBondContact CA-O 3.42Å; T198-L217 HydrophobicContact CG2-CD2 3.9Å
199	I	95	Very high	84.7	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	118.1	167.1	-55.5	170.5	0	0	0	107.2	F171 C182 T183 F201 L215 V216 L218 F226 F233 V235	F171-I199 HydrophobicContact CE1-CG2 4.48Å; F171-I199 HydrophobicContact CZ-CG2 4.1Å; C182-I199 HydrophobicContact CB-CG2 4.31Å; T183-I199 WeakPolarHBondContact O-CA 3.43Å; I199-F201 HydrophobicContact CB-CE2 4.04Å; I199-F201 HydrophobicContact CG2-CD2 4.15Å; I199-F201 HydrophobicContact CG2-CE2 3.52Å; I199-F201 HydrophobicContact CG2-CZ 4.09Å; I199-L215 WeakPolarHBondContact O-CA 3.1Å; I199-V216 HydrophobicContact CB-CB 4.21Å; I199-V216 PolarHBondContact N-O 3.46Å; I199-V216 PolarHBondContact O-N 3.45Å; I199-L218 HydrophobicContact CD1-CD1 4.12Å; I199-L218 HydrophobicContact CD1-CD2 3.8Å; I199-L218 HydrophobicContact CD1-CG 4.32Å; I199-L218 HydrophobicContact CG1-CD1 4.02Å; I199-L218 HydrophobicContact CG1-CD2 4.19Å; I199-L218 HydrophobicContact CG1-CG 4.23Å; I199-F226 HydrophobicContact CD1-CD1 4.06Å; I199-F226 HydrophobicContact CD1-CE1 3.37Å; I199-F226 HydrophobicContact CD1-CZ 3.77Å; I199-F233 HydrophobicContact CD1-CE1 3.59Å; I199-F233 HydrophobicContact CD1-CZ 3.68Å; I199-F233 HydrophobicContact CG2-CZ 4.44Å; I199-V235 HydrophobicContact CD1-CG2 4.22Å
200	S	95	Very high	85.2	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.5	-178.4	-67.4	0	0	0	0	109.9	C182 T183 R185	C182-S200 VanDerWaalsContact CA-O 3.26Å; C182-S200 WeakPolarHBondContact CA-O 3.19Å; T183-S200 PolarHBondContact N-O 3.3Å; T183-S200 PolarHBondContact O-N 2.95Å; R185-S200 PolarHBondContact NE-OG 3.12Å; R185-S200 PolarHBondContact NH2-OG 2.92Å
201	F	95.9	Very high	86.2	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	111.2	-179.6	-68.7	-113.4	0	0	0	109	T173 L175 Y180 C182 I199 A213 H214 V216 F233	T173-F201 HydrophobicContact CG2-CD1 4.27Å; T173-F201 HydrophobicContact CG2-CE1 3.94Å; L175-F201 HydrophobicContact CD1-CD1 4.27Å; L175-F201 HydrophobicContact CD1-CE1 3.67Å; Y180-F201 HydrophobicContact CD1-CB 3.83Å; Y180-F201 HydrophobicContact CD1-CD1 4.37Å; Y180-F201 HydrophobicContact CD2-CD1 4.48Å; Y180-F201 HydrophobicContact CE1-CB 4.48Å; Y180-F201 HydrophobicContact CG-CB 4.27Å; Y180-F201 HydrophobicContact CG-CD1 4.04Å; C182-F201 WeakPolarHBondContact SG-CD1 3.33Å; C182-F201 WeakPolarHBondContact SG-CE1 3.48Å; I199-F201 HydrophobicContact CB-CE2 4.04Å; I199-F201 HydrophobicContact CG2-CD2 4.15Å; I199-F201 HydrophobicContact CG2-CE2 3.52Å; I199-F201 HydrophobicContact CG2-CZ 4.09Å; F201-A213 PolarHBondContact O-N 3.37Å; F201-H214 HydrophobicContact CB-CB 3.93Å; F201-H214 HydrophobicContact CD2-CB 4.33Å; F201-H214 HydrophobicContact CG-CB 4.25Å; F201-H214 PolarHBondContact N-O 3.42Å; F201-H214 PolarHBondContact O-N 3.44Å; F201-V216 HydrophobicContact CD2-CG2 4.21Å; F201-V216 HydrophobicContact CE2-CB 4.08Å; F201-V216 HydrophobicContact CE2-CG2 3.51Å; F201-V216 HydrophobicContact CZ-CG2 4.18Å; F201-F233 HydrophobicContact CE1-CD2 4.34Å; F201-F233 AromaticContact CZ-CD1 4Å; F201-F233 HydrophobicContact CZ-CD1 4Å; F201-F233 AromaticContact CZ-CD2 3.96Å; F201-F233 HydrophobicContact CZ-CD2 3.96Å; F201-F233 HydrophobicContact CZ-CE1 4.1Å; F201-F233 HydrophobicContact CZ-CE2 4.08Å; F201-F233 AromaticContact CZ-CG 3.93Å; F201-F233 HydrophobicContact CZ-CG 3.93Å; F201-F233 HydrophobicContact CZ-CZ 4.15Å
202	Y	95.5	Very high	87.6	Confident	32 Å²	32	56.5 Å²	56.5	13%	0.125	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.7	176.2	-64	-96	0	0	0	108.9	P153 Y180 F181 L204 I210 A211 L212	P153-Y202 HydrophobicContact CB-CE2 4.16Å; P153-Y202 WeakPolarHBondContact CB-OH 3.35Å; P153-Y202 HydrophobicContact CG-CD2 4.25Å; P153-Y202 HydrophobicContact CG-CE1 4.18Å; P153-Y202 HydrophobicContact CG-CE2 3.48Å; P153-Y202 VanDerWaalsContact CG-CE2 3.48Å; P153-Y202 VanDerWaalsContact CG-CZ 3.44Å; P153-Y202 WeakPolarHBondContact CG-OH 3.43Å; Y180-Y202 CarbonylContact C-O 3.56Å; Y180-Y202 VanDerWaalsContact CA-O 3.26Å; Y180-Y202 WeakPolarHBondContact CA-O 3.49Å; F181-Y202 AromaticContact CD1-CD2 3.99Å; F181-Y202 HydrophobicContact CD1-CD2 3.99Å; F181-Y202 HydrophobicContact CD1-CG 4.38Å; F181-Y202 PolarHBondContact N-O 3.19Å; F181-Y202 WeakPolarHBondContact O-CD2 3.44Å; F181-Y202 PolarHBondContact O-N 3.42Å; Y202-L204 PolarHBondContact O-N 3.05Å; Y202-I210 HydrophobicContact CD1-CG2 4.35Å; Y202-A211 CarbonylContact C-O 3.55Å; Y202-A211 VanDerWaalsContact CA-O 3.28Å; Y202-A211 WeakPolarHBondContact CA-O 3.35Å; Y202-L212 HydrophobicContact CD1-CB 3.95Å; Y202-L212 HydrophobicContact CD1-CD1 4.42Å; Y202-L212 HydrophobicContact CD2-CD1 4.38Å; Y202-L212 HydrophobicContact CE1-CB 3.7Å; Y202-L212 HydrophobicContact CE1-CD1 4.17Å; Y202-L212 HydrophobicContact CE1-CG 4.38Å; Y202-L212 HydrophobicContact CE2-CD1 4.1Å
203	T	94.6	Very high	88.7	Confident	26 Å²	26	53.1 Å²	53.1	16%	0.16	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	128.8	177.9	-59.4	0	0	0	0	109.6	Y180 K205 A211 A213	Y180-T203 WeakPolarHBondContact CE1-OG1 3.22Å; T203-K205 HydrophobicContact CG2-CD 4.32Å; T203-K205 HydrophobicContact CG2-CG 4.2Å; T203-A211 PolarHBondContact N-O 2.97Å; T203-A213 VanDerWaalsContact OG1-CB 3.3Å; T203-A213 WeakPolarHBondContact OG1-CB 3.41Å
204	L	92.9	Very high	90	Very high	7 Å²	7	45.4 Å²	45.4	4%	0.037	25%	0.247	C	C	.	.			trans	-106.8	114.6	179.1	-62.6	178.4	0	0	0	110.1	I125 M135 F150 L172 L179 F181 Y202 I210	I125-L204 HydrophobicContact CD1-CD1 3.65Å; I125-L204 HydrophobicContact CD1-CD2 4.21Å; M135-L204 HydrophobicContact SD-CB 4.06Å; M135-L204 HydrophobicContact SD-CD1 4.46Å; M135-L204 HydrophobicContact SD-CD2 4.28Å; F150-L204 HydrophobicContact CZ-CD2 4.24Å; L172-L204 HydrophobicContact CD2-CD1 3.54Å; L179-L204 HydrophobicContact CB-CB 4.41Å; L179-L204 HydrophobicContact CD2-CB 4.14Å; L179-L204 HydrophobicContact CD2-CD1 3.65Å; L179-L204 HydrophobicContact CG-CB 4.35Å; L179-L204 HydrophobicContact CG-CD1 3.94Å; L179-L204 WeakPolarHBondContact O-CB 3.26Å; L179-L204 PolarHBondContact O-N 3.24Å; F181-L204 HydrophobicContact CB-CD1 3.86Å; F181-L204 HydrophobicContact CB-CD2 3.85Å; F181-L204 HydrophobicContact CB-CG 3.96Å; Y202-L204 PolarHBondContact O-N 3.05Å; L204-I210 HydrophobicContact CD2-CD1 3.78Å; L204-I210 HydrophobicContact CD2-CG1 4.01Å; L204-I210 HydrophobicContact CD2-CG2 4.2Å
205	K	89.1	Confident	90.8	Very high	70 Å²	70	39.6 Å²	39.6	30%	0.304	22%	0.215	S	C	.	.			trans	-135.4	142.5	172.6	-72.3	-179.3	-175.4	-175.9	0	107.9	M135 T203 D208	M135-K205 WeakPolarHBondContact CE-O 3.35Å; T203-K205 HydrophobicContact CG2-CD 4.32Å; T203-K205 HydrophobicContact CG2-CG 4.2Å; K205-D208 HydrophobicContact CB-CB 3.8Å; K205-D208 HydrophobicContact CD-CB 4.2Å; K205-D208 WeakPolarHBondContact CD-OD2 3.47Å; K205-D208 VanDerWaalsContact O-O 3.13Å
206	I	86.4	Confident	91.3	Very high	45 Å²	45	37.6 Å²	37.6	23%	0.231	21%	0.205	C	C	.	.	S	Bend	trans	-73.4	-34.6	-174.5	-84.2	157.5	0	0	0	112.5	I123 M135 Q137 P148	I123-I206 HydrophobicContact CD1-CD1 4.42Å; M135-I206 HydrophobicContact CE-CB 4.42Å; M135-I206 HydrophobicContact CE-CG1 3.64Å; Q137-I206 HydrophobicContact CB-CD1 3.34Å; Q137-I206 HydrophobicContact CB-CG1 4.43Å; Q137-I206 HydrophobicContact CG-CD1 3.59Å; P148-I206 VanDerWaalsContact CD-O 3.28Å; P148-I206 WeakPolarHBondContact CD-O 3.24Å
207	E	85.5	Confident	91.6	Very high	185 Å²	185	38.1 Å²	38.1	86%	0.864	21%	0.207	S	C	*	.	S	Bend	trans	-95.4	-21.3	-176.6	-58.7	-173.9	172.7	0	0	112.2
208	D	83.9	Confident	91.6	Very high	82 Å²	82	37.5 Å²	37.5	44%	0.439	21%	0.205	S	C	.	.	S	Bend	trans	-101.3	154.2	-177.1	-65.4	-37.4	0	0	0	112.5	K205	K205-D208 HydrophobicContact CB-CB 3.8Å; K205-D208 HydrophobicContact CD-CB 4.2Å; K205-D208 WeakPolarHBondContact CD-OD2 3.47Å; K205-D208 VanDerWaalsContact O-O 3.13Å
209	P	85.4	Confident	91.1	Very high	113 Å²	113	40.2 Å²	40.2	73%	0.734	22%	0.22	S	C	*	.	P	Polyproline II helix	trans	-63.3	141.6	171.8	27.5	-35	0	0	0	111.2	A211	P209-A211 PolarHBondContact O-N 2.98Å
210	I	90.3	Very high	90.6	Very high	33 Å²	33	42.5 Å²	42.5	17%	0.169	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-72.7	121.9	175.7	-65.5	167.8	0	0	0	108.7	P148 F150 Y202 L204	P148-I210 HydrophobicContact CB-CD1 4.38Å; P148-I210 HydrophobicContact CG-CD1 3.9Å; P148-I210 HydrophobicContact CG-CG1 4.13Å; F150-I210 HydrophobicContact CB-CD1 4.17Å; F150-I210 HydrophobicContact CD1-CD1 3.05Å; F150-I210 HydrophobicContact CD1-CG1 4.41Å; F150-I210 HydrophobicContact CD2-CD1 4.18Å; F150-I210 HydrophobicContact CD2-CG2 4.12Å; F150-I210 HydrophobicContact CE1-CD1 3.24Å; F150-I210 HydrophobicContact CE2-CD1 4.3Å; F150-I210 HydrophobicContact CE2-CG2 4.26Å; F150-I210 HydrophobicContact CG-CB 4.45Å; F150-I210 HydrophobicContact CG-CD1 3.56Å; F150-I210 HydrophobicContact CG-CG2 4.39Å; F150-I210 HydrophobicContact CZ-CD1 3.87Å; Y202-I210 HydrophobicContact CD1-CG2 4.35Å; L204-I210 HydrophobicContact CD2-CD1 3.78Å; L204-I210 HydrophobicContact CD2-CG1 4.01Å; L204-I210 HydrophobicContact CD2-CG2 4.2Å
211	A	90.8	Very high	89.9	Confident	55 Å²	55	48.9 Å²	48.9	46%	0.455	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	144.4	-177.4	0	0	0	0	0	110.8	Y202 T203 P209 A213	Y202-A211 CarbonylContact C-O 3.55Å; Y202-A211 VanDerWaalsContact CA-O 3.28Å; Y202-A211 WeakPolarHBondContact CA-O 3.35Å; T203-A211 PolarHBondContact N-O 2.97Å; P209-A211 PolarHBondContact O-N 2.98Å; A211-A213 PolarHBondContact O-N 3.33Å
212	L	93.1	Very high	89.4	Confident	44 Å²	44	50 Å²	50	23%	0.23	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	109.8	170.2	177.4	57.3	0	0	0	108.8	Y202 H214 V257	Y202-L212 HydrophobicContact CD1-CB 3.95Å; Y202-L212 HydrophobicContact CD1-CD1 4.42Å; Y202-L212 HydrophobicContact CD2-CD1 4.38Å; Y202-L212 HydrophobicContact CE1-CB 3.7Å; Y202-L212 HydrophobicContact CE1-CD1 4.17Å; Y202-L212 HydrophobicContact CE1-CG 4.38Å; Y202-L212 HydrophobicContact CE2-CD1 4.1Å; L212-H214 WeakPolarHBondContact CD1-O 3.28Å; L212-V257 HydrophobicContact CB-CG2 4.39Å; L212-V257 HydrophobicContact CD1-CG1 4.43Å; L212-V257 HydrophobicContact CD2-CG1 4.3Å; L212-V257 HydrophobicContact CD2-CG2 3.83Å; L212-V257 HydrophobicContact CG-CG1 3.84Å; L212-V257 HydrophobicContact CG-CG2 3.82Å
213	A	92.5	Very high	89	Confident	24 Å²	24	52.9 Å²	52.9	20%	0.198	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-45.1	-176.2	0	0	0	0	0	112.2	Y180 F201 T203 A211 V257 I258	Y180-A213 HydrophobicContact CE1-CB 4.33Å; F201-A213 PolarHBondContact O-N 3.37Å; T203-A213 VanDerWaalsContact OG1-CB 3.3Å; T203-A213 WeakPolarHBondContact OG1-CB 3.41Å; A211-A213 PolarHBondContact O-N 3.33Å; A213-V257 WeakPolarHBondContact O-CG1 3.19Å; A213-I258 PolarHBondContact O-N 3.39Å; A213-I258 VanDerWaalsContact O-N 3.15Å
214	H	94.5	Very high	88.9	Confident	18 Å²	18	52.7 Å²	52.7	8%	0.083	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	147.2	-174.9	-47.1	-75.4	0	0	0	112.5	Y180 F201 L212 I258 H260	Y180-H214 AromaticContact CE1-CD2 3.6Å; Y180-H214 AromaticContact CE1-NE2 3.87Å; Y180-H214 AromaticContact CZ-CD2 3.97Å; Y180-H214 AromaticContact CZ-NE2 3.93Å; Y180-H214 PolarHBondContact OH-NE2 2.89Å; F201-H214 HydrophobicContact CB-CB 3.93Å; F201-H214 HydrophobicContact CD2-CB 4.33Å; F201-H214 HydrophobicContact CG-CB 4.25Å; F201-H214 PolarHBondContact N-O 3.42Å; F201-H214 PolarHBondContact O-N 3.44Å; L212-H214 WeakPolarHBondContact CD1-O 3.28Å; H214-I258 WeakPolarHBondContact CA-O 3.42Å; H214-H260 AromaticContact CG-NE2 3.7Å; H214-H260 AromaticContact ND1-NE2 3.2Å; H214-H260 PolarHBondContact ND1-NE2 3.02Å; H214-H260 VanDerWaalsContact ND1-NE2 3.2Å
215	L	94	Very high	89	Confident	6 Å²	6	53.6 Å²	53.6	3%	0.031	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	112	175.9	-171.5	147.8	0	0	0	109	L189 T198 I199 L217 V257 I258 H259 H260	L189-L215 HydrophobicContact CD2-CD2 4.43Å; T198-L215 HydrophobicContact CG2-CD2 3.74Å; T198-L215 HydrophobicContact CG2-CG 4.28Å; I199-L215 WeakPolarHBondContact O-CA 3.1Å; L215-L217 HydrophobicContact CD2-CD2 3.33Å; L215-L217 HydrophobicContact CD2-CG 4.1Å; L215-V257 HydrophobicContact CB-CG1 3.88Å; L215-I258 PolarHBondContact N-O 3.49Å; L215-H259 WeakPolarHBondContact O-CA 3.45Å; L215-H260 PolarHBondContact O-N 2.97Å
216	V	93.9	Very high	89.3	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	123.2	178.1	168.1	0	0	0	0	108.9	T198 I199 F201 L218 F246 H260	T198-V216 CarbonylContact C-O 3.57Å; T198-V216 WeakPolarHBondContact CA-O 3.42Å; I199-V216 HydrophobicContact CB-CB 4.21Å; I199-V216 PolarHBondContact N-O 3.46Å; I199-V216 PolarHBondContact O-N 3.45Å; F201-V216 HydrophobicContact CD2-CG2 4.21Å; F201-V216 HydrophobicContact CE2-CB 4.08Å; F201-V216 HydrophobicContact CE2-CG2 3.51Å; F201-V216 HydrophobicContact CZ-CG2 4.18Å; V216-L218 HydrophobicContact CG1-CD2 4.22Å; V216-F246 HydrophobicContact CG1-CD1 3.66Å; V216-F246 HydrophobicContact CG1-CD2 4.05Å; V216-F246 HydrophobicContact CG1-CE1 3.49Å; V216-F246 VanDerWaalsContact CG1-CE1 3.49Å; V216-F246 HydrophobicContact CG1-CE2 3.92Å; V216-F246 HydrophobicContact CG1-CG 3.93Å; V216-F246 HydrophobicContact CG1-CZ 3.63Å; V216-F246 HydrophobicContact CG2-CD1 4.4Å; V216-H260 HydrophobicContact CG2-CB 4.1Å
217	L	90.8	Very high	89.8	Confident	36 Å²	36	49.2 Å²	49.2	19%	0.188	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	126.3	179.5	-59.8	176.7	0	0	0	110.1	L189 T196 T198 L215 H260	L189-L217 HydrophobicContact CD1-CD2 3.59Å; L189-L217 HydrophobicContact CD2-CD2 4.33Å; T196-L217 HydrophobicContact CG2-CD2 4.14Å; T198-L217 HydrophobicContact CG2-CD2 3.9Å; L215-L217 HydrophobicContact CD2-CD2 3.33Å; L215-L217 HydrophobicContact CD2-CG 4.1Å; L217-H260 PolarHBondContact N-O 3.24Å
218	L	91.4	Very high	90.3	Very high	11 Å²	11	41.7 Å²	41.7	6%	0.058	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-95.9	131.6	176.9	-57.8	-173.1	0	0	0	110.6	R197 I199 V216 Y220 V235	R197-L218 HydrophobicContact CB-CB 4.38Å; R197-L218 HydrophobicContact CG-CD1 4.1Å; R197-L218 WeakPolarHBondContact O-CB 3.47Å; R197-L218 PolarHBondContact O-N 3.13Å; I199-L218 HydrophobicContact CD1-CD1 4.12Å; I199-L218 HydrophobicContact CD1-CD2 3.8Å; I199-L218 HydrophobicContact CD1-CG 4.32Å; I199-L218 HydrophobicContact CG1-CD1 4.02Å; I199-L218 HydrophobicContact CG1-CD2 4.19Å; I199-L218 HydrophobicContact CG1-CG 4.23Å; V216-L218 HydrophobicContact CG1-CD2 4.22Å; L218-Y220 VanDerWaalsContact C-N 3.34Å; L218-V235 HydrophobicContact CD2-CB 4.46Å; L218-V235 HydrophobicContact CD2-CG1 4.05Å; L218-V235 HydrophobicContact CD2-CG2 3.87Å
219	D	83	Confident	90.7	Very high	57 Å²	57	39 Å²	39	31%	0.305	23%	0.229	S	C	.	.	S	Bend	trans	-77.2	-21.1	-177.4	-62.4	-44.4	0	0	0	112.6	Y237 R265	D219-Y237 PolarHBondContact N-OH 2.7Å; D219-R265 IonicContact OD1-CZ 2.69Å; D219-R265 IonicContact OD1-NE 2.66Å; D219-R265 IonicContact OD1-NH2 3.68Å; D219-R265 PolarHBondContact OD1-NH2 3.02Å; D219-R265 IonicContact OD2-CZ 3.46Å; D219-R265 IonicContact OD2-NE 3.33Å; D219-R265 PolarHBondContact OD2-NE 3.23Å; D219-R265 IonicContact OD2-NH2 2.74Å; D219-R265 PolarHBondContact OD2-NH2 3.2Å
220	Y	84.7	Confident	91.1	Very high	48 Å²	48	35.6 Å²	35.6	19%	0.188	21%	0.205	C	C	.	.			trans	-127.1	144	-171.7	-56.5	-65.7	0	0	0	115.1	L218 Y237 R240 D266	L218-Y220 VanDerWaalsContact C-N 3.34Å; Y220-Y237 AromaticContact CD2-CD1 3.72Å; Y220-Y237 HydrophobicContact CD2-CD1 3.72Å; Y220-Y237 AromaticContact CD2-CD2 3.87Å; Y220-Y237 HydrophobicContact CD2-CD2 3.87Å; Y220-Y237 AromaticContact CD2-CE1 3.71Å; Y220-Y237 HydrophobicContact CD2-CE1 3.71Å; Y220-Y237 AromaticContact CD2-CE2 3.85Å; Y220-Y237 HydrophobicContact CD2-CE2 3.85Å; Y220-Y237 AromaticContact CD2-CG 3.8Å; Y220-Y237 HydrophobicContact CD2-CG 3.8Å; Y220-Y237 AromaticContact CD2-CZ 3.75Å; Y220-Y237 HydrophobicContact CE2-CD2 4.32Å; Y220-Y237 HydrophobicContact CE2-CE2 4.36Å; Y220-Y237 HydrophobicContact CG-CD1 4.2Å; Y220-Y237 HydrophobicContact CG-CE1 4.18Å; Y220-R240 PolarHBondContact OH-NH1 3.13Å; Y220-R240 PolarHBondContact OH-NH2 3.31Å; Y220-R240 VanDerWaalsContact OH-NH2 3.16Å; Y220-D266 VanDerWaalsContact CE2-OD1 3.31Å; Y220-D266 WeakPolarHBondContact CE2-OD1 3.48Å; Y220-D266 PolarHBondContact OH-OD1 2.95Å; Y220-D266 PolarHBondContact OH-OD2 3.24Å
221	Q	80.3	Confident	91.2	Very high	135 Å²	135	36.3 Å²	36.3	63%	0.631	21%	0.209	S	C	*	.	S	Bend	trans	-92.4	98.7	172.4	-59.4	-94.5	-17.9	0	0	107.4	Y186	Y186-Q221 PolarHBondContact OH-OE1 3.18Å
222	G	84.5	Confident	91.4	Very high	23 Å²	23	33.9 Å²	33.9	24%	0.237	19%	0.189	C	C	.	.	S	Bend	trans	176.7	174.3	-177.1	0	0	0	0	0	113.6	R197 V224	R197-G222 PolarHBondContact NH1-O 3.24Å; R197-G222 PolarHBondContact NH2-O 3.49Å; G222-V224 PolarHBondContact O-N 2.92Å
223	P	87.7	Confident	91.6	Very high	92 Å²	92	31.8 Å²	31.8	60%	0.597	18%	0.178	S	C	*	.			trans	-60.5	136.3	172.7	26	-32.2	0	0	0	109.9
224	V	92.7	Very high	91.8	Very high	23 Å²	23	31.7 Å²	31.7	14%	0.139	17%	0.173	C	C	.	.			trans	-132.7	148.3	179.6	-67.9	0	0	0	0	108.9	G222 F226 V235 H236 Y237	G222-V224 PolarHBondContact O-N 2.92Å; V224-F226 HydrophobicContact CB-CE1 4.11Å; V224-F226 HydrophobicContact CB-CZ 4.35Å; V224-F226 HydrophobicContact CG2-CE1 3.67Å; V224-F226 HydrophobicContact CG2-CE2 4.46Å; V224-F226 HydrophobicContact CG2-CZ 3.47Å; V224-F226 VanDerWaalsContact CG2-CZ 3.47Å; V224-V235 HydrophobicContact CB-CG1 4.05Å; V224-V235 HydrophobicContact CG1-CG1 3.97Å; V224-H236 WeakPolarHBondContact CA-O 3.37Å; V224-Y237 HydrophobicContact CG1-CD1 3.48Å; V224-Y237 VanDerWaalsContact CG1-CD1 3.48Å; V224-Y237 HydrophobicContact CG1-CE1 3.4Å; V224-Y237 VanDerWaalsContact CG1-CE1 3.4Å
225	S	94.1	Very high	91.8	Very high	25 Å²	25	30.8 Å²	30.8	18%	0.175	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	162.6	168.4	-48.6	0	0	0	0	109.1	H236	S225-H236 PolarHBondContact N-O 3.42Å; S225-H236 VanDerWaalsContact N-O 3.1Å; S225-H236 PolarHBondContact O-N 3.45Å
226	F	95.5	Very high	91.9	Very high	23 Å²	23	30.6 Å²	30.6	10%	0.101	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	148.9	-174.6	-46.2	-62	0	0	0	111	F171 I184 I199 V224 F233 M234 V235 H302 L303	F171-F226 HydrophobicContact CD1-CD2 4.31Å; F171-F226 HydrophobicContact CD1-CE2 4.35Å; F171-F226 AromaticContact CE1-CD2 3.72Å; F171-F226 HydrophobicContact CE1-CD2 3.72Å; F171-F226 AromaticContact CE1-CE2 3.67Å; F171-F226 HydrophobicContact CE1-CE2 3.67Å; F171-F226 HydrophobicContact CE1-CZ 4.46Å; F171-F226 AromaticContact CZ-CD2 3.97Å; F171-F226 HydrophobicContact CZ-CD2 3.97Å; F171-F226 HydrophobicContact CZ-CE2 4.24Å; F171-F226 HydrophobicContact CZ-CG 4.38Å; I184-F226 HydrophobicContact CD1-CE2 3.58Å; I184-F226 HydrophobicContact CD1-CZ 3.54Å; I184-F226 HydrophobicContact CG1-CE2 4.04Å; I184-F226 HydrophobicContact CG1-CZ 3.85Å; I199-F226 HydrophobicContact CD1-CD1 4.06Å; I199-F226 HydrophobicContact CD1-CE1 3.37Å; I199-F226 HydrophobicContact CD1-CZ 3.77Å; V224-F226 HydrophobicContact CB-CE1 4.11Å; V224-F226 HydrophobicContact CB-CZ 4.35Å; V224-F226 HydrophobicContact CG2-CE1 3.67Å; V224-F226 HydrophobicContact CG2-CE2 4.46Å; V224-F226 HydrophobicContact CG2-CZ 3.47Å; V224-F226 VanDerWaalsContact CG2-CZ 3.47Å; F226-F233 HydrophobicContact CB-CE2 4.04Å; F226-F233 HydrophobicContact CB-CZ 4.08Å; F226-F233 HydrophobicContact CD1-CE1 4.24Å; F226-F233 HydrophobicContact CD1-CE2 4.4Å; F226-F233 AromaticContact CD1-CZ 3.6Å; F226-F233 HydrophobicContact CD1-CZ 3.6Å; F226-F233 HydrophobicContact CE1-CZ 4.25Å; F226-F233 HydrophobicContact CG-CE2 4.27Å; F226-F233 AromaticContact CG-CZ 3.87Å; F226-F233 HydrophobicContact CG-CZ 3.87Å; F226-M234 VanDerWaalsContact CA-O 3.28Å; F226-M234 WeakPolarHBondContact CA-O 3.31Å; F226-V235 HydrophobicContact CD1-CB 4.48Å; F226-V235 HydrophobicContact CD1-CG1 4.3Å; F226-V235 HydrophobicContact CD1-CG2 4.08Å; F226-V235 HydrophobicContact CE1-CG1 4.08Å; F226-V235 HydrophobicContact CE1-CG2 4.24Å; F226-H302 CarbonylContact O-C 3.52Å; F226-L303 HydrophobicContact CB-CD1 3.77Å; F226-L303 WeakPolarHBondContact O-CA 3.31Å
227	S	96.7	Very high	91.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	154.7	163.3	63.1	0	0	0	0	110.5	M234 H236 L303	S227-M234 PolarHBondContact N-O 3.06Å; S227-M234 VanDerWaalsContact N-O 3.11Å; S227-M234 PolarHBondContact O-N 2.89Å; S227-M234 WeakPolarHBondContact OG-CB 3.36Å; S227-H236 WeakPolarHBondContact CB-NE2 3.33Å; S227-H236 PolarHBondContact OG-CE1 3.08Å; S227-H236 PolarHBondContact OG-NE2 3.47Å; S227-L303 CarbonylContact C-O 3.54Å; S227-L303 WeakPolarHBondContact CA-O 3.32Å
228	V	96	Very high	92	Very high	27 Å²	27	30.7 Å²	30.7	16%	0.164	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	117.8	178.1	173.7	0	0	0	0	107.4	T173 L175 L232 F233 L303	T173-V228 WeakPolarHBondContact OG1-CG2 3.47Å; L175-V228 HydrophobicContact CD2-CG1 3.56Å; L175-V228 HydrophobicContact CD2-CG2 4.45Å; V228-L232 VanDerWaalsContact CA-O 3.25Å; V228-L232 WeakPolarHBondContact CA-O 3.49Å; V228-F233 HydrophobicContact CG2-CD2 3.8Å; V228-F233 HydrophobicContact CG2-CE2 4.44Å; V228-L303 HydrophobicContact CG2-CD1 3.72Å; V228-L303 HydrophobicContact CG2-CG 4.06Å; V228-L303 PolarHBondContact N-O 2.57Å
229	L	94.2	Very high	91.9	Very high	25 Å²	25	34.6 Å²	34.6	13%	0.131	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	126.4	-174.3	-63.3	168.8	0	0	0	109.1	N231 L232 M234 L318 V320	L229-N231 PolarHBondContact O-N 3Å; L229-L232 PolarHBondContact N-O 3.21Å; L229-L232 VanDerWaalsContact N-O 3.09Å; L229-L232 VanDerWaalsContact O-CB 3.25Å; L229-L232 WeakPolarHBondContact O-CB 3.46Å; L229-L232 PolarHBondContact O-N 3.3Å; L229-M234 HydrophobicContact CB-CE 4.24Å; L229-M234 HydrophobicContact CD1-CE 4.07Å; L229-M234 HydrophobicContact CD1-SD 4.09Å; L229-L318 HydrophobicContact CD1-CB 3.52Å; L229-L318 WeakPolarHBondContact CD2-O 3.42Å; L229-V320 HydrophobicContact CB-CG2 3.72Å; L229-V320 HydrophobicContact CD1-CG2 4.27Å
230	D	91.9	Very high	92.4	Very high	43 Å²	43	38.2 Å²	38.2	23%	0.23	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	45.3	177.9	-159.1	11.8	0	0	0	112.5	L232 N322 R342 S343	D230-L232 PolarHBondContact O-N 3.1Å; D230-N322 PolarHBondContact OD2-ND2 3.27Å; D230-R342 PolarHBondContact O-NH1 3.35Å; D230-R342 WeakPolarHBondContact OD2-CB 3.49Å; D230-R342 WeakPolarHBondContact OD2-CD 3.33Å; D230-S343 VanDerWaalsContact CG-OG 3.27Å; D230-S343 WeakPolarHBondContact OD1-CB 3.13Å; D230-S343 PolarHBondContact OD1-N 2.95Å; D230-S343 PolarHBondContact OD1-OG 3.46Å; D230-S343 PolarHBondContact OD2-N 3.39Å; D230-S343 VanDerWaalsContact OD2-N 3.16Å; D230-S343 PolarHBondContact OD2-OG 3.49Å
231	N	93.6	Very high	92.8	Very high	48 Å²	48	41.4 Å²	41.4	26%	0.257	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	16.6	-174.6	-63.8	-48.6	0	0	0	116.3	Y176 L229	Y176-N231 HydrophobicContact CD1-CB 3.88Å; Y176-N231 HydrophobicContact CD2-CB 4.07Å; Y176-N231 HydrophobicContact CE1-CB 3.59Å; Y176-N231 HydrophobicContact CE2-CB 3.8Å; Y176-N231 HydrophobicContact CG-CB 4.13Å; Y176-N231 PolarHBondContact N-OD1 3.44Å; L229-N231 PolarHBondContact O-N 3Å
232	L	95.1	Very high	93.6	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.016	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.2	171.4	-64.2	171.9	0	0	0	111	V228 L229 D230 M234 V245 D247 I263 V320 F338 R342	V228-L232 VanDerWaalsContact CA-O 3.25Å; V228-L232 WeakPolarHBondContact CA-O 3.49Å; L229-L232 PolarHBondContact N-O 3.21Å; L229-L232 VanDerWaalsContact N-O 3.09Å; L229-L232 VanDerWaalsContact O-CB 3.25Å; L229-L232 WeakPolarHBondContact O-CB 3.46Å; L229-L232 PolarHBondContact O-N 3.3Å; D230-L232 PolarHBondContact O-N 3.1Å; L232-M234 HydrophobicContact CB-CE 4.16Å; L232-M234 HydrophobicContact CD1-CE 4.22Å; L232-V245 HydrophobicContact CB-CG1 4.06Å; L232-V245 HydrophobicContact CD1-CG1 4Å; L232-V245 HydrophobicContact CD2-CG1 4.03Å; L232-V245 HydrophobicContact CG-CG1 4.27Å; L232-D247 HydrophobicContact CD2-CB 3.84Å; L232-I263 HydrophobicContact CD2-CD1 4.03Å; L232-V320 HydrophobicContact CD1-CG1 4.3Å; L232-V320 HydrophobicContact CD1-CG2 4.46Å; L232-F338 HydrophobicContact CD1-CE2 3.84Å; L232-F338 HydrophobicContact CD1-CZ 3.87Å; L232-F338 HydrophobicContact CD2-CE2 3.79Å; L232-F338 HydrophobicContact CG-CE2 4.37Å; L232-R342 VanDerWaalsContact CD2-NH2 3.25Å
233	F	96.4	Very high	94.1	Very high	1 Å²	1	35.1 Å²	35.1	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	117.9	171.7	-177	-100.6	0	0	0	109.7	F171 L175 I199 F201 F226 V228 V235 F246 L303	F171-F233 AromaticContact CE2-CE2 3.91Å; F171-F233 HydrophobicContact CE2-CE2 3.91Å; F171-F233 HydrophobicContact CE2-CZ 4.46Å; F171-F233 AromaticContact CZ-CE2 3.87Å; F171-F233 HydrophobicContact CZ-CE2 3.87Å; F171-F233 AromaticContact CZ-CZ 3.96Å; F171-F233 HydrophobicContact CZ-CZ 3.96Å; L175-F233 HydrophobicContact CD1-CB 4.31Å; I199-F233 HydrophobicContact CD1-CE1 3.59Å; I199-F233 HydrophobicContact CD1-CZ 3.68Å; I199-F233 HydrophobicContact CG2-CZ 4.44Å; F201-F233 HydrophobicContact CE1-CD2 4.34Å; F201-F233 AromaticContact CZ-CD1 4Å; F201-F233 HydrophobicContact CZ-CD1 4Å; F201-F233 AromaticContact CZ-CD2 3.96Å; F201-F233 HydrophobicContact CZ-CD2 3.96Å; F201-F233 HydrophobicContact CZ-CE1 4.1Å; F201-F233 HydrophobicContact CZ-CE2 4.08Å; F201-F233 AromaticContact CZ-CG 3.93Å; F201-F233 HydrophobicContact CZ-CG 3.93Å; F201-F233 HydrophobicContact CZ-CZ 4.15Å; F226-F233 HydrophobicContact CB-CE2 4.04Å; F226-F233 HydrophobicContact CB-CZ 4.08Å; F226-F233 HydrophobicContact CD1-CE1 4.24Å; F226-F233 HydrophobicContact CD1-CE2 4.4Å; F226-F233 AromaticContact CD1-CZ 3.6Å; F226-F233 HydrophobicContact CD1-CZ 3.6Å; F226-F233 HydrophobicContact CE1-CZ 4.25Å; F226-F233 HydrophobicContact CG-CE2 4.27Å; F226-F233 AromaticContact CG-CZ 3.87Å; F226-F233 HydrophobicContact CG-CZ 3.87Å; V228-F233 HydrophobicContact CG2-CD2 3.8Å; V228-F233 HydrophobicContact CG2-CE2 4.44Å; F233-V235 HydrophobicContact CD1-CG2 4.14Å; F233-V235 HydrophobicContact CE1-CG2 3.55Å; F233-V235 HydrophobicContact CZ-CG2 4.35Å; F233-F246 HydrophobicContact CB-CB 4.4Å; F233-F246 HydrophobicContact CD1-CB 4.48Å; F233-F246 HydrophobicContact CD1-CD2 4.29Å; F233-F246 PolarHBondContact N-O 3.27Å; F233-F246 WeakPolarHBondContact O-CB 3.4Å; F233-F246 PolarHBondContact O-N 3.04Å; F233-L303 HydrophobicContact CE2-CD1 4.47Å
234	M	96.4	Very high	94.5	Very high	21 Å²	21	30.8 Å²	30.8	10%	0.103	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.2	-176.7	-58.9	-170.8	-174.7	0	0	111.1	F226 S227 L229 L232 T243 S244 V245 V320	F226-M234 VanDerWaalsContact CA-O 3.28Å; F226-M234 WeakPolarHBondContact CA-O 3.31Å; S227-M234 PolarHBondContact N-O 3.06Å; S227-M234 VanDerWaalsContact N-O 3.11Å; S227-M234 PolarHBondContact O-N 2.89Å; S227-M234 WeakPolarHBondContact OG-CB 3.36Å; L229-M234 HydrophobicContact CB-CE 4.24Å; L229-M234 HydrophobicContact CD1-CE 4.07Å; L229-M234 HydrophobicContact CD1-SD 4.09Å; L232-M234 HydrophobicContact CB-CE 4.16Å; L232-M234 HydrophobicContact CD1-CE 4.22Å; M234-T243 HydrophobicContact CB-CG2 3.84Å; M234-T243 HydrophobicContact CG-CG2 4.38Å; M234-T243 HydrophobicContact SD-CG2 4.35Å; M234-S244 WeakPolarHBondContact CA-O 3.32Å; M234-V245 HydrophobicContact CE-CG1 4.46Å; M234-V245 HydrophobicContact CG-CG1 4.36Å; M234-V245 HydrophobicContact CG-CG2 4.34Å; M234-V320 HydrophobicContact CE-CG2 3.69Å
235	V	96	Very high	94.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	116.3	174.8	-176.1	0	0	0	0	108.9	I199 L218 V224 F226 F233 Y237 T243 S244 F246	I199-V235 HydrophobicContact CD1-CG2 4.22Å; L218-V235 HydrophobicContact CD2-CB 4.46Å; L218-V235 HydrophobicContact CD2-CG1 4.05Å; L218-V235 HydrophobicContact CD2-CG2 3.87Å; V224-V235 HydrophobicContact CB-CG1 4.05Å; V224-V235 HydrophobicContact CG1-CG1 3.97Å; F226-V235 HydrophobicContact CD1-CB 4.48Å; F226-V235 HydrophobicContact CD1-CG1 4.3Å; F226-V235 HydrophobicContact CD1-CG2 4.08Å; F226-V235 HydrophobicContact CE1-CG1 4.08Å; F226-V235 HydrophobicContact CE1-CG2 4.24Å; F233-V235 HydrophobicContact CD1-CG2 4.14Å; F233-V235 HydrophobicContact CE1-CG2 3.55Å; F233-V235 HydrophobicContact CZ-CG2 4.35Å; V235-Y237 HydrophobicContact CB-CE2 4.23Å; V235-Y237 HydrophobicContact CG1-CD2 4.44Å; V235-Y237 HydrophobicContact CG1-CE1 3.97Å; V235-Y237 HydrophobicContact CG1-CE2 3.82Å; V235-T243 CarbonylContact O-C 3.59Å; V235-T243 VanDerWaalsContact O-CA 3.27Å; V235-T243 WeakPolarHBondContact O-CA 3.44Å; V235-S244 PolarHBondContact N-O 3.26Å; V235-S244 PolarHBondContact O-N 3.18Å; V235-F246 HydrophobicContact CB-CE2 4.23Å; V235-F246 HydrophobicContact CG2-CD2 4.07Å; V235-F246 HydrophobicContact CG2-CE2 3.67Å
236	H	95.5	Very high	94.6	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	122.2	179.4	-52.9	-74.6	0	0	0	110.4	V224 S225 S227 T243 Y295 I301	V224-H236 WeakPolarHBondContact CA-O 3.37Å; S225-H236 PolarHBondContact N-O 3.42Å; S225-H236 VanDerWaalsContact N-O 3.1Å; S225-H236 PolarHBondContact O-N 3.45Å; S227-H236 WeakPolarHBondContact CB-NE2 3.33Å; S227-H236 PolarHBondContact OG-CE1 3.08Å; S227-H236 PolarHBondContact OG-NE2 3.47Å; H236-T243 WeakPolarHBondContact ND1-CG2 3.43Å; H236-T243 PolarHBondContact ND1-OG1 3.28Å; H236-Y295 HydrophobicContact CB-CE1 4.33Å; H236-I301 HydrophobicContact CB-CD1 3.81Å
237	Y	94.4	Very high	94.6	Very high	3 Å²	3	28.2 Å²	28.2	1%	0.012	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	86.4	174.6	-58.9	-80.5	0	0	0	109	D219 Y220 V224 V235 S239 R240 K241 V242	D219-Y237 PolarHBondContact N-OH 2.7Å; Y220-Y237 AromaticContact CD2-CD1 3.72Å; Y220-Y237 HydrophobicContact CD2-CD1 3.72Å; Y220-Y237 AromaticContact CD2-CD2 3.87Å; Y220-Y237 HydrophobicContact CD2-CD2 3.87Å; Y220-Y237 AromaticContact CD2-CE1 3.71Å; Y220-Y237 HydrophobicContact CD2-CE1 3.71Å; Y220-Y237 AromaticContact CD2-CE2 3.85Å; Y220-Y237 HydrophobicContact CD2-CE2 3.85Å; Y220-Y237 AromaticContact CD2-CG 3.8Å; Y220-Y237 HydrophobicContact CD2-CG 3.8Å; Y220-Y237 AromaticContact CD2-CZ 3.75Å; Y220-Y237 HydrophobicContact CE2-CD2 4.32Å; Y220-Y237 HydrophobicContact CE2-CE2 4.36Å; Y220-Y237 HydrophobicContact CG-CD1 4.2Å; Y220-Y237 HydrophobicContact CG-CE1 4.18Å; V224-Y237 HydrophobicContact CG1-CD1 3.48Å; V224-Y237 VanDerWaalsContact CG1-CD1 3.48Å; V224-Y237 HydrophobicContact CG1-CE1 3.4Å; V224-Y237 VanDerWaalsContact CG1-CE1 3.4Å; V235-Y237 HydrophobicContact CB-CE2 4.23Å; V235-Y237 HydrophobicContact CG1-CD2 4.44Å; V235-Y237 HydrophobicContact CG1-CE1 3.97Å; V235-Y237 HydrophobicContact CG1-CE2 3.82Å; Y237-S239 VanDerWaalsContact C-N 3.3Å; Y237-S239 PolarHBondContact O-N 3.46Å; Y237-R240 CarbonylContact O-C 3.54Å; Y237-R240 PolarHBondContact O-N 3.5Å; Y237-K241 PolarHBondContact O-N 3.15Å; Y237-V242 HydrophobicContact CD2-CG2 4.2Å; Y237-V242 PolarHBondContact N-O 2.99Å; Y237-V242 PolarHBondContact O-N 3.02Å
238	Q	91.4	Very high	94.4	Very high	35 Å²	35	28.8 Å²	28.8	16%	0.164	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-56.6	-41.1	-174	-72.9	-179.2	-22.2	0	0	113	R240 K241 Y295 W299	Q238-R240 PolarHBondContact O-N 3.03Å; Q238-K241 PolarHBondContact O-N 3.17Å; Q238-K241 VanDerWaalsContact O-N 3.15Å; Q238-Y295 HydrophobicContact CG-CD1 4.46Å; Q238-W299 PolarHBondContact NE2-O 2.87Å
239	S	91	Very high	93.9	Very high	94 Å²	94	28.8 Å²	28.8	66%	0.657	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	-61.9	-27.6	178.6	56.8	0	0	0	0	113.8	Y237	Y237-S239 VanDerWaalsContact C-N 3.3Å; Y237-S239 PolarHBondContact O-N 3.46Å
240	R	92.6	Very high	93.3	Very high	133 Å²	133	29.1 Å²	29.1	50%	0.502	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-101	-7.1	178.5	-69.6	-169.9	67.8	130.9	-4.4	113.4	Y220 Y237 Q238 V242	Y220-R240 PolarHBondContact OH-NH1 3.13Å; Y220-R240 PolarHBondContact OH-NH2 3.31Å; Y220-R240 VanDerWaalsContact OH-NH2 3.16Å; Y237-R240 CarbonylContact O-C 3.54Å; Y237-R240 PolarHBondContact O-N 3.5Å; Q238-R240 PolarHBondContact O-N 3.03Å; R240-V242 VanDerWaalsContact C-N 3.27Å; R240-V242 HydrophobicContact CB-CG2 3.77Å; R240-V242 PolarHBondContact O-N 3.05Å
241	K	94	Very high	92.3	Very high	114 Å²	114	34.7 Å²	34.7	50%	0.496	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	38.8	-174.9	-50.7	-166.9	174.7	-168.9	0	113.7	Y237 Q238 Y295	Y237-K241 PolarHBondContact O-N 3.15Å; Q238-K241 PolarHBondContact O-N 3.17Å; Q238-K241 VanDerWaalsContact O-N 3.15Å; K241-Y295 HydrophobicContact CB-CD2 3.77Å; K241-Y295 HydrophobicContact CB-CE2 4.33Å; K241-Y295 HydrophobicContact CB-CG 4.13Å; K241-Y295 HydrophobicContact CG-CD2 4.44Å; K241-Y295 WeakPolarHBondContact O-CE2 3.34Å
242	V	95.2	Very high	91.4	Very high	20 Å²	20	33.3 Å²	33.3	12%	0.121	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	157.6	-180	-62.6	0	0	0	0	112.1	Y237 R240 D266 I267	Y237-V242 HydrophobicContact CD2-CG2 4.2Å; Y237-V242 PolarHBondContact N-O 2.99Å; Y237-V242 PolarHBondContact O-N 3.02Å; R240-V242 VanDerWaalsContact C-N 3.27Å; R240-V242 HydrophobicContact CB-CG2 3.77Å; R240-V242 PolarHBondContact O-N 3.05Å; V242-D266 HydrophobicContact CB-CB 4.3Å; V242-D266 HydrophobicContact CG1-CB 4.23Å; V242-D266 HydrophobicContact CG2-CB 4.36Å; V242-I267 CarbonylContact C-O 3.41Å
243	T	95.9	Very high	90.6	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.043	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	131.8	175.7	-56.9	0	0	0	0	109	M234 V235 H236 V245 I267 Y295	M234-T243 HydrophobicContact CB-CG2 3.84Å; M234-T243 HydrophobicContact CG-CG2 4.38Å; M234-T243 HydrophobicContact SD-CG2 4.35Å; V235-T243 CarbonylContact O-C 3.59Å; V235-T243 VanDerWaalsContact O-CA 3.27Å; V235-T243 WeakPolarHBondContact O-CA 3.44Å; H236-T243 WeakPolarHBondContact ND1-CG2 3.43Å; H236-T243 PolarHBondContact ND1-OG1 3.28Å; T243-V245 HydrophobicContact CG2-CG2 4.45Å; T243-I267 WeakPolarHBondContact CA-O 3.48Å; T243-I267 WeakPolarHBondContact CB-O 3.43Å; T243-I267 PolarHBondContact N-O 3.19Å; T243-I267 PolarHBondContact O-N 3.44Å; T243-Y295 PolarHBondContact OG1-OH 3.39Å
244	S	95.5	Very high	89.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.8	165.9	-65.1	0	0	0	0	109.4	M234 V235 L264	M234-S244 WeakPolarHBondContact CA-O 3.32Å; V235-S244 PolarHBondContact N-O 3.26Å; V235-S244 PolarHBondContact O-N 3.18Å; S244-L264 WeakPolarHBondContact CA-O 3.36Å
245	V	95.4	Very high	88.5	Confident	13 Å²	13	47.1 Å²	47.1	8%	0.079	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.7	-177.8	-172.6	0	0	0	0	109.1	L232 M234 T243 P262 I263 L264	L232-V245 HydrophobicContact CB-CG1 4.06Å; L232-V245 HydrophobicContact CD1-CG1 4Å; L232-V245 HydrophobicContact CD2-CG1 4.03Å; L232-V245 HydrophobicContact CG-CG1 4.27Å; M234-V245 HydrophobicContact CE-CG1 4.46Å; M234-V245 HydrophobicContact CG-CG1 4.36Å; M234-V245 HydrophobicContact CG-CG2 4.34Å; T243-V245 HydrophobicContact CG2-CG2 4.45Å; V245-P262 CarbonylContact O-C 3.53Å; V245-P262 VanDerWaalsContact O-CA 3.25Å; V245-P262 WeakPolarHBondContact O-CA 3.48Å; V245-P262 WeakPolarHBondContact O-CB 3.36Å; V245-I263 HydrophobicContact CB-CG1 4.19Å; V245-I263 HydrophobicContact CG1-CD1 4.02Å; V245-I263 HydrophobicContact CG1-CG1 4.1Å; V245-I263 WeakPolarHBondContact O-CG1 3.48Å; V245-I263 PolarHBondContact O-N 2.97Å; V245-L264 HydrophobicContact CB-CB 4.07Å; V245-L264 HydrophobicContact CG2-CB 4.2Å; V245-L264 HydrophobicContact CG2-CD1 4.4Å; V245-L264 PolarHBondContact N-O 2.71Å; V245-L264 PolarHBondContact O-N 3.4Å
246	F	95	Very high	87.7	Confident	1 Å²	1	54.2 Å²	54.2	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.3	178.2	-60.2	-96.6	0	0	0	109.4	V216 F233 V235 H260 P262	V216-F246 HydrophobicContact CG1-CD1 3.66Å; V216-F246 HydrophobicContact CG1-CD2 4.05Å; V216-F246 HydrophobicContact CG1-CE1 3.49Å; V216-F246 VanDerWaalsContact CG1-CE1 3.49Å; V216-F246 HydrophobicContact CG1-CE2 3.92Å; V216-F246 HydrophobicContact CG1-CG 3.93Å; V216-F246 HydrophobicContact CG1-CZ 3.63Å; V216-F246 HydrophobicContact CG2-CD1 4.4Å; F233-F246 HydrophobicContact CB-CB 4.4Å; F233-F246 HydrophobicContact CD1-CB 4.48Å; F233-F246 HydrophobicContact CD1-CD2 4.29Å; F233-F246 PolarHBondContact N-O 3.27Å; F233-F246 WeakPolarHBondContact O-CB 3.4Å; F233-F246 PolarHBondContact O-N 3.04Å; V235-F246 HydrophobicContact CB-CE2 4.23Å; V235-F246 HydrophobicContact CG2-CD2 4.07Å; V235-F246 HydrophobicContact CG2-CE2 3.67Å; F246-H260 HydrophobicContact CD1-CB 4.43Å; F246-P262 HydrophobicContact CD1-CB 4.15Å; F246-P262 HydrophobicContact CE1-CB 3.73Å; F246-P262 VanDerWaalsContact CE1-CD 3.49Å; F246-P262 HydrophobicContact CE1-CG 4.14Å; F246-P262 VanDerWaalsContact CE1-N 3.27Å; F246-P262 HydrophobicContact CE2-CB 4.2Å; F246-P262 HydrophobicContact CZ-CB 3.76Å; F246-P262 HydrophobicContact CZ-CG 4.18Å
247	D	93.8	Very high	87.4	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.016	30%	0.301	C	S	.	.			trans	-124.9	118.6	169.8	-176.5	-3.5	0	0	0	108.3	Y176 L232 A249 V250 I263 R342	Y176-D247 VanDerWaalsContact CE2-OD1 3.3Å; Y176-D247 WeakPolarHBondContact CE2-OD1 3.43Å; Y176-D247 PolarHBondContact OH-OD1 3.42Å; Y176-D247 PolarHBondContact OH-OD2 3.46Å; L232-D247 HydrophobicContact CD2-CB 3.84Å; D247-A249 VanDerWaalsContact C-N 3.27Å; D247-A249 PolarHBondContact O-N 3.23Å; D247-A249 WeakPolarHBondContact OD1-CB 3.25Å; D247-A249 PolarHBondContact OD1-N 3Å; D247-V250 HydrophobicContact CB-CB 4.24Å; D247-V250 HydrophobicContact CB-CG2 3.91Å; D247-V250 PolarHBondContact O-N 2.86Å; D247-V250 WeakPolarHBondContact OD2-CG2 3.5Å; D247-I263 HydrophobicContact CB-CD1 4.03Å; D247-I263 HydrophobicContact CB-CG2 4.3Å; D247-R342 IonicContact OD2-CZ 2.74Å; D247-R342 IonicContact OD2-NH1 3.56Å; D247-R342 IonicContact OD2-NH2 3.83Å; D247-R342 PolarHBondContact OD2-NH2 3.3Å
248	I	92.5	Very high	87.2	Confident	13 Å²	13	57.8 Å²	57.8	7%	0.067	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-16.6	-177.7	64.5	164.5	0	0	0	113.2	L175 Y176 Y180 H260	L175-I248 HydrophobicContact CB-CD1 3.61Å; L175-I248 HydrophobicContact CB-CG1 4.35Å; L175-I248 HydrophobicContact CD1-CD1 3.81Å; L175-I248 HydrophobicContact CD1-CG1 4.27Å; L175-I248 HydrophobicContact CD1-CG2 4.21Å; L175-I248 HydrophobicContact CG-CD1 4.35Å; Y176-I248 HydrophobicContact CD2-CD1 4.07Å; Y176-I248 HydrophobicContact CD2-CG1 3.69Å; Y176-I248 HydrophobicContact CE2-CG1 3.78Å; Y180-I248 HydrophobicContact CE2-CD1 3.92Å; I248-H260 PolarHBondContact O-CE1 2.93Å; I248-H260 VanDerWaalsContact O-CE1 3.3Å
249	A	87	Confident	87.2	Confident	27 Å²	27	57.6 Å²	57.6	22%	0.223	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-19	176.7	0	0	0	0	0	112.6	Y176 D247	Y176-A249 HydrophobicContact CD2-CB 4.2Å; Y176-A249 HydrophobicContact CE1-CB 4.14Å; Y176-A249 HydrophobicContact CE2-CB 3.55Å; Y176-A249 VanDerWaalsContact CZ-CB 3.5Å; D247-A249 VanDerWaalsContact C-N 3.27Å; D247-A249 PolarHBondContact O-N 3.23Å; D247-A249 WeakPolarHBondContact OD1-CB 3.25Å; D247-A249 PolarHBondContact OD1-N 3Å
250	V	81.6	Confident	87.3	Confident	31 Å²	31	53.4 Å²	53.4	19%	0.188	28%	0.283	C	S	.	.	S	Bend	trans	-78.6	143.3	173.9	173.4	0	0	0	0	109.6	D247 G252 I263 L334	D247-V250 HydrophobicContact CB-CB 4.24Å; D247-V250 HydrophobicContact CB-CG2 3.91Å; D247-V250 PolarHBondContact O-N 2.86Å; D247-V250 WeakPolarHBondContact OD2-CG2 3.5Å; V250-G252 PolarHBondContact O-N 3.37Å; V250-G252 VanDerWaalsContact O-N 3.11Å; V250-I263 HydrophobicContact CB-CG2 4.44Å; V250-I263 HydrophobicContact CG1-CG2 4.31Å; V250-L334 HydrophobicContact CB-CD1 4.49Å; V250-L334 HydrophobicContact CG1-CD1 3.53Å; V250-L334 HydrophobicContact CG2-CD1 4.08Å
251	N	70.6	Confident	87.2	Confident	160 Å²	160	51.5 Å²	51.5	86%	0.856	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-50.1	116.4	-175.3	-71.7	-17.3	0	0	0	112.7
252	G	73.5	Confident	87.1	Confident	20 Å²	20	47 Å²	47	21%	0.206	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-96.7	166.8	166.2	0	0	0	0	0	111.9	V250 V254 H259	V250-G252 PolarHBondContact O-N 3.37Å; V250-G252 VanDerWaalsContact O-N 3.11Å; G252-V254 PolarHBondContact O-N 3.1Å; G252-H259 CarbonylContact C-O 3.6Å; G252-H259 WeakPolarHBondContact CA-O 3.36Å
253	T	78.3	Confident	87	Confident	84 Å²	84	47.4 Å²	47.4	52%	0.515	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	113.5	175.4	56.6	0	0	0	0	109.5	H255 H259	T253-H255 PolarHBondContact O-N 3.01Å; T253-H259 PolarHBondContact N-O 2.89Å; T253-H259 PolarHBondContact O-N 3.43Å; T253-H259 VanDerWaalsContact O-N 3.08Å; T253-H259 WeakPolarHBondContact OG1-CB 3.32Å
254	V	76.6	Confident	86.9	Confident	112 Å²	112	48.2 Å²	48.2	68%	0.679	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	116.9	-179.3	-173.2	0	0	0	0	109.3	G252 I258	G252-V254 PolarHBondContact O-N 3.1Å; V254-I258 HydrophobicContact CG2-CG1 4.45Å
255	H	72.4	Confident	86.7	Confident	118 Å²	118	54.8 Å²	54.8	55%	0.546	30%	0.299	S	S	.	.	S	Bend	trans	-108.8	-94.5	164	-64.2	79.1	0	0	0	107.6	T253 V257	T253-H255 PolarHBondContact O-N 3.01Å; H255-V257 PolarHBondContact N-O 3.35Å
256	N	80.3	Confident	86.6	Confident	149 Å²	149	56.9 Å²	56.9	80%	0.797	31%	0.309	S	S	*	.	S	Bend	trans	-106.4	-22.3	163.3	-70.7	-17.7	0	0	0	112.2
257	V	88.2	Confident	86.6	Confident	25 Å²	25	59.3 Å²	59.3	15%	0.152	32%	0.322	C	S	.	.	S	Bend	trans	-127.2	151.5	178.2	-179.9	0	0	0	0	105.8	L212 A213 L215 H255 H259	L212-V257 HydrophobicContact CB-CG2 4.39Å; L212-V257 HydrophobicContact CD1-CG1 4.43Å; L212-V257 HydrophobicContact CD2-CG1 4.3Å; L212-V257 HydrophobicContact CD2-CG2 3.83Å; L212-V257 HydrophobicContact CG-CG1 3.84Å; L212-V257 HydrophobicContact CG-CG2 3.82Å; A213-V257 WeakPolarHBondContact O-CG1 3.19Å; L215-V257 HydrophobicContact CB-CG1 3.88Å; H255-V257 PolarHBondContact N-O 3.35Å; V257-H259 PolarHBondContact O-CD2 3.39Å; V257-H259 VanDerWaalsContact O-CD2 3.29Å; V257-H259 PolarHBondContact O-N 2.95Å
258	I	90.5	Very high	86.5	Confident	55 Å²	55	62.8 Å²	62.8	28%	0.282	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	113.4	177.6	-56.7	172.2	0	0	0	108.1	A213 H214 L215 V254 H260	A213-I258 PolarHBondContact O-N 3.39Å; A213-I258 VanDerWaalsContact O-N 3.15Å; H214-I258 WeakPolarHBondContact CA-O 3.42Å; L215-I258 PolarHBondContact N-O 3.49Å; V254-I258 HydrophobicContact CG2-CG1 4.45Å; I258-H260 VanDerWaalsContact CG2-CE1 3.48Å; I258-H260 WeakPolarHBondContact CG2-CE1 3.34Å
259	H	91.7	Very high	86.6	Confident	31 Å²	31	64 Å²	64	14%	0.144	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.5	176.5	-68.9	-152.7	0	0	0	109.6	L215 G252 T253 V257	L215-H259 WeakPolarHBondContact O-CA 3.45Å; G252-H259 CarbonylContact C-O 3.6Å; G252-H259 WeakPolarHBondContact CA-O 3.36Å; T253-H259 PolarHBondContact N-O 2.89Å; T253-H259 PolarHBondContact O-N 3.43Å; T253-H259 VanDerWaalsContact O-N 3.08Å; T253-H259 WeakPolarHBondContact OG1-CB 3.32Å; V257-H259 PolarHBondContact O-CD2 3.39Å; V257-H259 VanDerWaalsContact O-CD2 3.29Å; V257-H259 PolarHBondContact O-N 2.95Å
260	H	92.8	Very high	86.9	Confident	5 Å²	5	66.3 Å²	66.3	2%	0.023	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	135.6	-177.2	-70	-60.1	0	0	0	111.5	H214 L215 V216 L217 F246 I248 I258	H214-H260 AromaticContact CG-NE2 3.7Å; H214-H260 AromaticContact ND1-NE2 3.2Å; H214-H260 PolarHBondContact ND1-NE2 3.02Å; H214-H260 VanDerWaalsContact ND1-NE2 3.2Å; L215-H260 PolarHBondContact O-N 2.97Å; V216-H260 HydrophobicContact CG2-CB 4.1Å; L217-H260 PolarHBondContact N-O 3.24Å; F246-H260 HydrophobicContact CD1-CB 4.43Å; I248-H260 PolarHBondContact O-CE1 2.93Å; I248-H260 VanDerWaalsContact O-CE1 3.3Å; I258-H260 VanDerWaalsContact CG2-CE1 3.48Å; I258-H260 WeakPolarHBondContact CG2-CE1 3.34Å
261	T	89.9	Confident	87.5	Confident	94 Å²	94	70.5 Å²	70.5	58%	0.577	40%	0.399	S	S	*	.			trans	-109.8	153.6	168.8	58	0	0	0	0	108.5	I263	T261-I263 PolarHBondContact O-N 3.48Å
262	P	93.1	Very high	88.5	Confident	18 Å²	18	67.3 Å²	67.3	12%	0.117	38%	0.378	C	S	.	.			trans	-66.2	131.7	-176.5	25.8	-32.6	0	0	0	110.6	V245 F246 L264 R265	V245-P262 CarbonylContact O-C 3.53Å; V245-P262 VanDerWaalsContact O-CA 3.25Å; V245-P262 WeakPolarHBondContact O-CA 3.48Å; V245-P262 WeakPolarHBondContact O-CB 3.36Å; F246-P262 HydrophobicContact CD1-CB 4.15Å; F246-P262 HydrophobicContact CE1-CB 3.73Å; F246-P262 VanDerWaalsContact CE1-CD 3.49Å; F246-P262 HydrophobicContact CE1-CG 4.14Å; F246-P262 VanDerWaalsContact CE1-N 3.27Å; F246-P262 HydrophobicContact CE2-CB 4.2Å; F246-P262 HydrophobicContact CZ-CB 3.76Å; F246-P262 HydrophobicContact CZ-CG 4.18Å; P262-L264 PolarHBondContact O-N 3.17Å; P262-R265 HydrophobicContact CG-CB 4.06Å; P262-R265 HydrophobicContact CG-CG 4.34Å
263	I	92.8	Very high	89.3	Confident	29 Å²	29	69.9 Å²	69.9	15%	0.149	39%	0.387	C	S	.	.	S	Bend	trans	-66.8	-30.5	171.2	55	165.7	0	0	0	111	L232 V245 D247 V250 T261 F325 L334 F338	L232-I263 HydrophobicContact CD2-CD1 4.03Å; V245-I263 HydrophobicContact CB-CG1 4.19Å; V245-I263 HydrophobicContact CG1-CD1 4.02Å; V245-I263 HydrophobicContact CG1-CG1 4.1Å; V245-I263 WeakPolarHBondContact O-CG1 3.48Å; V245-I263 PolarHBondContact O-N 2.97Å; D247-I263 HydrophobicContact CB-CD1 4.03Å; D247-I263 HydrophobicContact CB-CG2 4.3Å; V250-I263 HydrophobicContact CB-CG2 4.44Å; V250-I263 HydrophobicContact CG1-CG2 4.31Å; T261-I263 PolarHBondContact O-N 3.48Å; I263-F325 HydrophobicContact CD1-CE2 4.03Å; I263-F325 HydrophobicContact CD1-CZ 4.35Å; I263-L334 HydrophobicContact CG2-CD1 4.49Å; I263-F338 HydrophobicContact CD1-CD2 3.71Å; I263-F338 HydrophobicContact CD1-CE2 3.59Å
264	L	93.1	Very high	89.9	Confident	25 Å²	25	66.3 Å²	66.3	13%	0.131	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	120	174	-63.5	175.4	0	0	0	108.3	S244 V245 P262 I267 F325 I328 V329	S244-L264 WeakPolarHBondContact CA-O 3.36Å; V245-L264 HydrophobicContact CB-CB 4.07Å; V245-L264 HydrophobicContact CG2-CB 4.2Å; V245-L264 HydrophobicContact CG2-CD1 4.4Å; V245-L264 PolarHBondContact N-O 2.71Å; V245-L264 PolarHBondContact O-N 3.4Å; P262-L264 PolarHBondContact O-N 3.17Å; L264-I267 HydrophobicContact CB-CD1 3.55Å; L264-I267 HydrophobicContact CB-CG1 4.15Å; L264-I267 HydrophobicContact CD1-CD1 3.71Å; L264-I267 HydrophobicContact CD2-CD1 3.92Å; L264-I267 HydrophobicContact CG-CD1 3.91Å; L264-F325 HydrophobicContact CD1-CD2 3.85Å; L264-F325 HydrophobicContact CD1-CE2 3.79Å; L264-F325 HydrophobicContact CD2-CE2 4.11Å; L264-F325 HydrophobicContact CG-CD2 4.45Å; L264-F325 HydrophobicContact CG-CE2 3.94Å; L264-I328 HydrophobicContact CD2-CG2 4.1Å; L264-V329 HydrophobicContact CD2-CG2 3.55Å
265	R	91.9	Very high	90.3	Very high	138 Å²	138	64.9 Å²	64.9	52%	0.521	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	138.9	-178.8	-175.4	176.6	-88.9	149.4	-10.8	110.1	D219 P262 I267	D219-R265 IonicContact OD1-CZ 2.69Å; D219-R265 IonicContact OD1-NE 2.66Å; D219-R265 IonicContact OD1-NH2 3.68Å; D219-R265 PolarHBondContact OD1-NH2 3.02Å; D219-R265 IonicContact OD2-CZ 3.46Å; D219-R265 IonicContact OD2-NE 3.33Å; D219-R265 PolarHBondContact OD2-NE 3.23Å; D219-R265 IonicContact OD2-NH2 2.74Å; D219-R265 PolarHBondContact OD2-NH2 3.2Å; P262-R265 HydrophobicContact CG-CB 4.06Å; P262-R265 HydrophobicContact CG-CG 4.34Å; R265-I267 PolarHBondContact O-N 2.92Å
266	D	93	Very high	90.8	Very high	56 Å²	56	59.3 Å²	59.3	30%	0.299	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.7	43.6	170.9	-64	-23	0	0	0	115.5	Y220 V242	Y220-D266 VanDerWaalsContact CE2-OD1 3.31Å; Y220-D266 WeakPolarHBondContact CE2-OD1 3.48Å; Y220-D266 PolarHBondContact OH-OD1 2.95Å; Y220-D266 PolarHBondContact OH-OD2 3.24Å; V242-D266 HydrophobicContact CB-CB 4.3Å; V242-D266 HydrophobicContact CG1-CB 4.23Å; V242-D266 HydrophobicContact CG2-CB 4.36Å
267	I	94.4	Very high	91	Very high	52 Å²	52	58.3 Å²	58.3	27%	0.267	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	133.2	177.1	-59.9	-164.1	0	0	0	111	V242 T243 L264 R265 I328	V242-I267 CarbonylContact C-O 3.41Å; T243-I267 WeakPolarHBondContact CA-O 3.48Å; T243-I267 WeakPolarHBondContact CB-O 3.43Å; T243-I267 PolarHBondContact N-O 3.19Å; T243-I267 PolarHBondContact O-N 3.44Å; L264-I267 HydrophobicContact CB-CD1 3.55Å; L264-I267 HydrophobicContact CB-CG1 4.15Å; L264-I267 HydrophobicContact CD1-CD1 3.71Å; L264-I267 HydrophobicContact CD2-CD1 3.92Å; L264-I267 HydrophobicContact CG-CD1 3.91Å; R265-I267 PolarHBondContact O-N 2.92Å; I267-I328 HydrophobicContact CD1-CD1 4.24Å; I267-I328 HydrophobicContact CD1-CG2 4.44Å
268	S	93.2	Very high	90.6	Very high	76 Å²	76	61.9 Å²	61.9	53%	0.531	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-83.8	143.8	172.6	59.4	0	0	0	0	112.1
269	I	94.5	Very high	90.2	Very high	40 Å²	40	60 Å²	60	21%	0.205	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-54.7	141.4	164.2	-67.4	160.9	0	0	0	109.4	L294 Y295 W299 L318	I269-L294 HydrophobicContact CB-CD1 4.15Å; I269-L294 HydrophobicContact CG2-CD1 4.15Å; I269-L294 HydrophobicContact CG2-CD2 4.39Å; I269-L294 VanDerWaalsContact O-CD1 3.23Å; I269-L294 WeakPolarHBondContact O-CD1 3.46Å; I269-Y295 HydrophobicContact CB-CE2 4.12Å; I269-Y295 HydrophobicContact CD1-CE1 4.07Å; I269-Y295 HydrophobicContact CD1-CE2 3.98Å; I269-Y295 HydrophobicContact CG1-CE2 4.16Å; I269-Y295 WeakPolarHBondContact CG1-OH 3.48Å; I269-Y295 PolarHBondContact N-OH 3.41Å; I269-W299 HydrophobicContact CD1-CZ3 4.29Å; I269-L318 HydrophobicContact CD1-CD2 3.92Å; I269-L318 HydrophobicContact CG1-CD2 4.42Å
270	A	93.3	Very high	89.5	Confident	74 Å²	74	62.7 Å²	62.7	61%	0.612	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-60	138.7	178.9	0	0	0	0	0	111	F272	A270-F272 PolarHBondContact O-N 3.11Å
271	P	93.1	Very high	88.9	Confident	119 Å²	119	67.7 Å²	67.7	77%	0.773	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-57.5	139	178.7	25.1	-33.9	0	0	0	110.7
272	F	91.6	Very high	88.5	Confident	94 Å²	94	65.8 Å²	65.8	41%	0.412	36%	0.361	S	S	.	.			trans	-127	130.7	-177.6	178.9	-100.9	0	0	0	110	A270 L274 I292	A270-F272 PolarHBondContact O-N 3.11Å; F272-L274 HydrophobicContact CE1-CB 4.12Å; F272-L274 HydrophobicContact CE1-CD1 3.74Å; F272-L274 HydrophobicContact CZ-CD1 4.11Å; F272-I292 HydrophobicContact CD1-CB 4.42Å; F272-I292 HydrophobicContact CD1-CG1 3.91Å; F272-I292 HydrophobicContact CE1-CG1 4.43Å; F272-I292 PolarHBondContact O-N 2.91Å
273	N	91.4	Very high	88	Confident	74 Å²	74	66.7 Å²	66.7	40%	0.396	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.9	175.5	-63.1	-16.2	0	0	0	109.4	Q289 I290 P291	N273-Q289 HydrophobicContact CB-CB 4.17Å; N273-I290 CarbonylContact C-O 3.39Å; N273-I290 WeakPolarHBondContact CA-O 3.46Å; N273-P291 WeakPolarHBondContact OD1-CA 3.47Å
274	L	89.5	Confident	87.4	Confident	9 Å²	9	70.4 Å²	70.4	5%	0.047	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135.1	176.2	-166.8	77.7	0	0	0	110.1	F272 S276 I278 I279 L282 I290 I292	F272-L274 HydrophobicContact CE1-CB 4.12Å; F272-L274 HydrophobicContact CE1-CD1 3.74Å; F272-L274 HydrophobicContact CZ-CD1 4.11Å; L274-S276 PolarHBondContact O-N 2.98Å; L274-I278 HydrophobicContact CD1-CB 4.47Å; L274-I278 HydrophobicContact CD1-CD1 3.69Å; L274-I278 HydrophobicContact CD1-CG2 4.46Å; L274-I278 HydrophobicContact CD2-CB 4.47Å; L274-I278 HydrophobicContact CG-CB 4.41Å; L274-I278 HydrophobicContact CG-CD1 4.21Å; L274-I279 HydrophobicContact CD2-CB 4.38Å; L274-I279 HydrophobicContact CD2-CD1 3.29Å; L274-I279 HydrophobicContact CD2-CG1 3.69Å; L274-L282 HydrophobicContact CD2-CD1 3.84Å; L274-I290 PolarHBondContact N-O 2.96Å; L274-I290 PolarHBondContact O-N 3.39Å; L274-I292 HydrophobicContact CB-CD1 3.69Å; L274-I292 HydrophobicContact CB-CG1 3.85Å; L274-I292 HydrophobicContact CD2-CD1 4.31Å
275	F	86.3	Confident	87.1	Confident	82 Å²	82	73.9 Å²	73.9	36%	0.36	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	128.8	169.5	-68.7	-88.5	0	0	0	110.2	K277 I278 A288 Q289	F275-K277 HydrophobicContact CB-CD 4.48Å; F275-K277 HydrophobicContact CB-CG 3.97Å; F275-K277 PolarHBondContact O-N 3.42Å; F275-K277 VanDerWaalsContact O-N 3.11Å; F275-I278 HydrophobicContact CB-CD1 4.39Å; F275-I278 WeakPolarHBondContact O-CB 3.23Å; F275-I278 PolarHBondContact O-N 3.39Å; F275-A288 WeakPolarHBondContact CA-O 3.5Å; F275-Q289 HydrophobicContact CD1-CG 3.67Å; F275-Q289 HydrophobicContact CE1-CG 3.62Å; F275-Q289 HydrophobicContact CG-CG 4.2Å; F275-Q289 HydrophobicContact CZ-CG 4.11Å
276	S	82.6	Confident	86.6	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.6	178.1	40.4	0	0	0	0	114.1	L274 I278 I279 P280 N285 L286 A288	L274-S276 PolarHBondContact O-N 2.98Å; S276-I278 PolarHBondContact O-N 3.34Å; S276-I279 CarbonylContact O-C 3.58Å; S276-I279 PolarHBondContact O-N 2.92Å; S276-I279 VanDerWaalsContact O-N 3.15Å; S276-P280 WeakPolarHBondContact O-CA 3.41Å; S276-P280 VanDerWaalsContact O-N 3.13Å; S276-N285 PolarHBondContact OG-O 3.39Å; S276-L286 WeakPolarHBondContact OG-CA 3.34Å; S276-L286 PolarHBondContact OG-O 3.07Å; S276-A288 PolarHBondContact N-O 3.29Å; S276-A288 PolarHBondContact OG-N 3.43Å; S276-A288 PolarHBondContact OG-O 3.36Å
277	K	83.7	Confident	86.2	Confident	129 Å²	129	75.2 Å²	75.2	56%	0.561	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-25.7	171.7	72.1	-174.6	178.1	-178.7	0	113.8	F275 L286	F275-K277 HydrophobicContact CB-CD 4.48Å; F275-K277 HydrophobicContact CB-CG 3.97Å; F275-K277 PolarHBondContact O-N 3.42Å; F275-K277 VanDerWaalsContact O-N 3.11Å; K277-L286 HydrophobicContact CB-CB 4.44Å; K277-L286 HydrophobicContact CB-CD2 4.49Å; K277-L286 PolarHBondContact N-O 3.34Å
278	I	80.6	Confident	85.8	Confident	100 Å²	100	73.9 Å²	73.9	51%	0.513	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-39	178.4	-58.5	171.2	0	0	0	109.9	L274 F275 S276	L274-I278 HydrophobicContact CD1-CB 4.47Å; L274-I278 HydrophobicContact CD1-CD1 3.69Å; L274-I278 HydrophobicContact CD1-CG2 4.46Å; L274-I278 HydrophobicContact CD2-CB 4.47Å; L274-I278 HydrophobicContact CG-CB 4.41Å; L274-I278 HydrophobicContact CG-CD1 4.21Å; F275-I278 HydrophobicContact CB-CD1 4.39Å; F275-I278 WeakPolarHBondContact O-CB 3.23Å; F275-I278 PolarHBondContact O-N 3.39Å; S276-I278 PolarHBondContact O-N 3.34Å
279	I	82.9	Confident	85.6	Confident	16 Å²	16	75.2 Å²	75.2	8%	0.082	43%	0.434	C	S	.	.	S	Bend	trans	-130.9	89.1	177.9	-51.7	175.7	0	0	0	108.3	L274 S276 S281 L282 L312 C314	L274-I279 HydrophobicContact CD2-CB 4.38Å; L274-I279 HydrophobicContact CD2-CD1 3.29Å; L274-I279 HydrophobicContact CD2-CG1 3.69Å; S276-I279 CarbonylContact O-C 3.58Å; S276-I279 PolarHBondContact O-N 2.92Å; S276-I279 VanDerWaalsContact O-N 3.15Å; I279-S281 WeakPolarHBondContact CG2-OG 3.4Å; I279-S281 PolarHBondContact O-N 3.01Å; I279-L282 HydrophobicContact CB-CD1 3.85Å; I279-L282 HydrophobicContact CB-CG 3.96Å; I279-L282 HydrophobicContact CD1-CD1 4.03Å; I279-L282 HydrophobicContact CG1-CD1 4.44Å; I279-L282 HydrophobicContact CG2-CD1 4.28Å; I279-L282 HydrophobicContact CG2-CG 3.88Å; I279-L282 WeakPolarHBondContact O-CB 2.99Å; I279-L282 PolarHBondContact O-N 2.94Å; I279-L312 HydrophobicContact CD1-CB 3.94Å; I279-L312 HydrophobicContact CD1-CD2 4.39Å; I279-C314 WeakPolarHBondContact CD1-SG 3.34Å
280	P	75.3	Confident	85.4	Confident	86 Å²	86	75 Å²	75	56%	0.558	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-60.2	-19.6	-175.5	-26.3	35.1	0	0	0	114.2	S276 L282 L286	S276-P280 WeakPolarHBondContact O-CA 3.41Å; S276-P280 VanDerWaalsContact O-N 3.13Å; P280-L282 PolarHBondContact O-N 3.14Å; P280-L286 HydrophobicContact CB-CD2 4.36Å
281	S	81.4	Confident	85.3	Confident	111 Å²	111	76 Å²	76	78%	0.776	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-70.7	-14.4	175.9	55.1	0	0	0	0	113.9	I279	I279-S281 WeakPolarHBondContact CG2-OG 3.4Å; I279-S281 PolarHBondContact O-N 3.01Å
282	L	80.3	Confident	85.2	Confident	53 Å²	53	71.1 Å²	71.1	28%	0.277	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-77.7	-31.9	179.7	-69.4	175.7	0	0	0	113.4	L274 I279 P280 I290 L312	L274-L282 HydrophobicContact CD2-CD1 3.84Å; I279-L282 HydrophobicContact CB-CD1 3.85Å; I279-L282 HydrophobicContact CB-CG 3.96Å; I279-L282 HydrophobicContact CD1-CD1 4.03Å; I279-L282 HydrophobicContact CG1-CD1 4.44Å; I279-L282 HydrophobicContact CG2-CD1 4.28Å; I279-L282 HydrophobicContact CG2-CG 3.88Å; I279-L282 WeakPolarHBondContact O-CB 2.99Å; I279-L282 PolarHBondContact O-N 2.94Å; P280-L282 PolarHBondContact O-N 3.14Å; L282-I290 HydrophobicContact CB-CD1 3.35Å; L282-I290 HydrophobicContact CD1-CD1 4.37Å; L282-I290 HydrophobicContact CG-CD1 4.44Å; L282-I290 WeakPolarHBondContact O-CD1 3.32Å; L282-L312 HydrophobicContact CD2-CD2 3.8Å
283	S	82.8	Confident	85.1	Confident	37 Å²	37	72.5 Å²	72.5	26%	0.259	41%	0.412	S	S	.	.			trans	-161.3	146	178.2	172	0	0	0	0	111.3	N285	S283-N285 VanDerWaalsContact C-N 3.28Å; S283-N285 PolarHBondContact O-N 3.12Å; S283-N285 PolarHBondContact OG-N 3.36Å; S283-N285 VanDerWaalsContact OG-N 3.08Å; S283-N285 PolarHBondContact OG-O 3.3Å
284	A	80.8	Confident	85.2	Confident	108 Å²	108	70.4 Å²	70.4	89%	0.893	40%	0.4	S	S	*	.	S	Bend	trans	-68.9	-24.8	172.6	0	0	0	0	0	113.2	L286	A284-L286 PolarHBondContact O-N 2.74Å
285	N	86.3	Confident	85.3	Confident	98 Å²	98	70.4 Å²	70.4	52%	0.524	40%	0.4	S	S	.	.	S	Bend	trans	-88	103.4	174	178.8	0.5	0	0	0	109.2	S276 S283 D287 A288	S276-N285 PolarHBondContact OG-O 3.39Å; S283-N285 VanDerWaalsContact C-N 3.28Å; S283-N285 PolarHBondContact O-N 3.12Å; S283-N285 PolarHBondContact OG-N 3.36Å; S283-N285 VanDerWaalsContact OG-N 3.08Å; S283-N285 PolarHBondContact OG-O 3.3Å; N285-D287 PolarHBondContact O-N 3.06Å; N285-D287 VanDerWaalsContact O-N 3.17Å; N285-D287 PolarHBondContact OD1-N 2.99Å; N285-A288 HydrophobicContact CB-CB 4.29Å; N285-A288 VanDerWaalsContact O-CB 3.22Å; N285-A288 WeakPolarHBondContact O-CB 3.29Å; N285-A288 PolarHBondContact O-N 3.06Å
286	L	81	Confident	85.6	Confident	92 Å²	92	67.8 Å²	67.8	48%	0.482	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-25	-174.5	-69.8	166.8	0	0	0	114.5	S276 K277 P280 A284 A288	S276-L286 WeakPolarHBondContact OG-CA 3.34Å; S276-L286 PolarHBondContact OG-O 3.07Å; K277-L286 HydrophobicContact CB-CB 4.44Å; K277-L286 HydrophobicContact CB-CD2 4.49Å; K277-L286 PolarHBondContact N-O 3.34Å; P280-L286 HydrophobicContact CB-CD2 4.36Å; A284-L286 PolarHBondContact O-N 2.74Å; L286-A288 VanDerWaalsContact C-N 3.35Å
287	D	84.8	Confident	86	Confident	129 Å²	129	72.2 Å²	72.2	69%	0.69	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-2.5	179	-64.9	-40.9	0	0	0	113.4	N285	N285-D287 PolarHBondContact O-N 3.06Å; N285-D287 VanDerWaalsContact O-N 3.17Å; N285-D287 PolarHBondContact OD1-N 2.99Å
288	A	86.4	Confident	86.5	Confident	24 Å²	24	69.8 Å²	69.8	20%	0.198	42%	0.421	C	S	.	.			trans	-66.1	137.9	176.7	0	0	0	0	0	111.4	F275 S276 N285 L286 I290	F275-A288 WeakPolarHBondContact CA-O 3.5Å; S276-A288 PolarHBondContact N-O 3.29Å; S276-A288 PolarHBondContact OG-N 3.43Å; S276-A288 PolarHBondContact OG-O 3.36Å; N285-A288 HydrophobicContact CB-CB 4.29Å; N285-A288 VanDerWaalsContact O-CB 3.22Å; N285-A288 WeakPolarHBondContact O-CB 3.29Å; N285-A288 PolarHBondContact O-N 3.06Å; L286-A288 VanDerWaalsContact C-N 3.35Å; A288-I290 HydrophobicContact CB-CG1 4.5Å
289	Q	89.2	Confident	87.1	Confident	105 Å²	105	65.7 Å²	65.7	49%	0.491	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.6	167.4	-77	-172.6	8.3	0	0	109	N273 F275	N273-Q289 HydrophobicContact CB-CB 4.17Å; F275-Q289 HydrophobicContact CD1-CG 3.67Å; F275-Q289 HydrophobicContact CE1-CG 3.62Å; F275-Q289 HydrophobicContact CG-CG 4.2Å; F275-Q289 HydrophobicContact CZ-CG 4.11Å
290	I	89.2	Confident	87.7	Confident	35 Å²	35	68 Å²	68	18%	0.179	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.9	-172.9	-61.7	168.4	0	0	0	108.1	N273 L274 L282 A288 I292	N273-I290 CarbonylContact C-O 3.39Å; N273-I290 WeakPolarHBondContact CA-O 3.46Å; L274-I290 PolarHBondContact N-O 2.96Å; L274-I290 PolarHBondContact O-N 3.39Å; L282-I290 HydrophobicContact CB-CD1 3.35Å; L282-I290 HydrophobicContact CD1-CD1 4.37Å; L282-I290 HydrophobicContact CG-CD1 4.44Å; L282-I290 WeakPolarHBondContact O-CD1 3.32Å; A288-I290 HydrophobicContact CB-CG1 4.5Å; I290-I292 PolarHBondContact O-N 2.87Å
291	P	91.5	Very high	88.6	Confident	95 Å²	95	64.7 Å²	64.7	62%	0.617	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	132.2	176.1	27.7	-33.3	0	0	0	109.7	N273	N273-P291 WeakPolarHBondContact OD1-CA 3.47Å
292	I	90.9	Very high	89.2	Confident	17 Å²	17	63.3 Å²	63.3	9%	0.087	37%	0.373	C	S	.	.			trans	-88.1	135.1	178.5	-60.9	-54.8	0	0	0	110	F272 L274 I290 L294 W299 L312 W316	F272-I292 HydrophobicContact CD1-CB 4.42Å; F272-I292 HydrophobicContact CD1-CG1 3.91Å; F272-I292 HydrophobicContact CE1-CG1 4.43Å; F272-I292 PolarHBondContact O-N 2.91Å; L274-I292 HydrophobicContact CB-CD1 3.69Å; L274-I292 HydrophobicContact CB-CG1 3.85Å; L274-I292 HydrophobicContact CD2-CD1 4.31Å; I290-I292 PolarHBondContact O-N 2.87Å; I292-L294 PolarHBondContact O-N 3.26Å; I292-W299 HydrophobicContact CG2-CZ2 4.41Å; I292-L312 HydrophobicContact CD1-CD1 3.87Å; I292-L312 HydrophobicContact CG2-CD1 4.24Å; I292-W316 HydrophobicContact CG2-CH2 4.14Å; I292-W316 HydrophobicContact CG2-CZ2 4.28Å
293	D	90.3	Very high	89.9	Confident	123 Å²	123	63.1 Å²	63.1	66%	0.658	37%	0.372	S	S	*	.			trans	-69.8	94.4	171.9	-79.8	-36	0	0	0	110.7
294	L	92.8	Very high	90.3	Very high	30 Å²	30	65.4 Å²	65.4	16%	0.157	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	147.3	176.2	-56.4	178.4	0	0	0	111.5	I269 I292 S296 W299	I269-L294 HydrophobicContact CB-CD1 4.15Å; I269-L294 HydrophobicContact CG2-CD1 4.15Å; I269-L294 HydrophobicContact CG2-CD2 4.39Å; I269-L294 VanDerWaalsContact O-CD1 3.23Å; I269-L294 WeakPolarHBondContact O-CD1 3.46Å; I292-L294 PolarHBondContact O-N 3.26Å; L294-S296 PolarHBondContact O-N 3.43Å; L294-W299 HydrophobicContact CB-CH2 4.08Å; L294-W299 HydrophobicContact CD2-CH2 3.65Å; L294-W299 HydrophobicContact CD2-CZ2 4.18Å; L294-W299 HydrophobicContact CG-CH2 4.48Å
295	Y	93.3	Very high	90.9	Very high	8 Å²	8	60.2 Å²	60.2	3%	0.031	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	57	34.5	-177.8	-55.1	-97.9	0	0	0	113.2	H236 Q238 K241 T243 I269 W299	H236-Y295 HydrophobicContact CB-CE1 4.33Å; Q238-Y295 HydrophobicContact CG-CD1 4.46Å; K241-Y295 HydrophobicContact CB-CD2 3.77Å; K241-Y295 HydrophobicContact CB-CE2 4.33Å; K241-Y295 HydrophobicContact CB-CG 4.13Å; K241-Y295 HydrophobicContact CG-CD2 4.44Å; K241-Y295 WeakPolarHBondContact O-CE2 3.34Å; T243-Y295 PolarHBondContact OG1-OH 3.39Å; I269-Y295 HydrophobicContact CB-CE2 4.12Å; I269-Y295 HydrophobicContact CD1-CE1 4.07Å; I269-Y295 HydrophobicContact CD1-CE2 3.98Å; I269-Y295 HydrophobicContact CG1-CE2 4.16Å; I269-Y295 WeakPolarHBondContact CG1-OH 3.48Å; I269-Y295 PolarHBondContact N-OH 3.41Å; Y295-W299 VanDerWaalsContact N-CZ3 3.29Å
296	S	92.3	Very high	91.3	Very high	28 Å²	28	56.7 Å²	56.7	20%	0.196	33%	0.326	C	S	.	.			trans	-52.7	145.3	171	170.8	0	0	0	0	110.6	L294 N298 W299	L294-S296 PolarHBondContact O-N 3.43Å; S296-N298 PolarHBondContact O-N 3Å; S296-N298 VanDerWaalsContact O-N 3.1Å; S296-N298 PolarHBondContact OG-N 2.9Å; S296-W299 VanDerWaalsContact O-CB 3.27Å; S296-W299 WeakPolarHBondContact O-CB 3.49Å; S296-W299 PolarHBondContact O-N 2.91Å
297	A	91.3	Very high	92	Very high	93 Å²	93	52.4 Å²	52.4	77%	0.769	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.1	175.8	0	0	0	0	0	112.8	W299	A297-W299 VanDerWaalsContact C-N 3.3Å
298	N	92.9	Very high	92.4	Very high	77 Å²	77	49 Å²	49	41%	0.412	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-2.1	176.3	-59.5	-34.5	0	0	0	113.2	S296 N310 S311	S296-N298 PolarHBondContact O-N 3Å; S296-N298 VanDerWaalsContact O-N 3.1Å; S296-N298 PolarHBondContact OG-N 2.9Å; N298-N310 PolarHBondContact O-N 2.87Å; N298-S311 VanDerWaalsContact ND2-CB 3.33Å; N298-S311 WeakPolarHBondContact ND2-CB 3.35Å; N298-S311 PolarHBondContact ND2-OG 3.28Å
299	W	94.2	Very high	92.8	Very high	15 Å²	15	48.1 Å²	48.1	6%	0.057	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	130.6	178.8	-74.3	11.8	0	0	0	111.5	Q238 I269 I292 L294 Y295 S296 A297 V307 I308 D309 W316	Q238-W299 PolarHBondContact NE2-O 2.87Å; I269-W299 HydrophobicContact CD1-CZ3 4.29Å; I292-W299 HydrophobicContact CG2-CZ2 4.41Å; L294-W299 HydrophobicContact CB-CH2 4.08Å; L294-W299 HydrophobicContact CD2-CH2 3.65Å; L294-W299 HydrophobicContact CD2-CZ2 4.18Å; L294-W299 HydrophobicContact CG-CH2 4.48Å; Y295-W299 VanDerWaalsContact N-CZ3 3.29Å; S296-W299 VanDerWaalsContact O-CB 3.27Å; S296-W299 WeakPolarHBondContact O-CB 3.49Å; S296-W299 PolarHBondContact O-N 2.91Å; A297-W299 VanDerWaalsContact C-N 3.3Å; W299-V307 HydrophobicContact CB-CG1 4.17Å; W299-V307 HydrophobicContact CD2-CG1 3.61Å; W299-V307 HydrophobicContact CE3-CG1 3.55Å; W299-V307 HydrophobicContact CG-CG1 3.91Å; W299-V307 HydrophobicContact CZ3-CG1 4.05Å; W299-I308 WeakPolarHBondContact CA-O 3.46Å; W299-D309 VanDerWaalsContact CD1-OD2 3.29Å; W299-D309 PolarHBondContact NE1-OD2 3.27Å; W299-W316 HydrophobicContact CD2-CZ3 4.4Å; W299-W316 AromaticContact CE2-CZ3 3.53Å; W299-W316 HydrophobicContact CH2-CZ3 4.41Å; W299-W316 HydrophobicContact CZ2-CE3 4.2Å; W299-W316 HydrophobicContact CZ2-CH2 4.1Å; W299-W316 AromaticContact CZ2-CZ3 3.54Å; W299-W316 HydrophobicContact CZ2-CZ3 3.54Å; W299-W316 AromaticContact NE1-CH2 3.9Å; W299-W316 AromaticContact NE1-CZ3 3.47Å
300	V	94.9	Very high	92.9	Very high	64 Å²	64	48.3 Å²	48.3	39%	0.388	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.2	164.5	-177.2	0	0	0	0	107.7	V307 I308	V300-V307 WeakPolarHBondContact O-CA 3.39Å; V300-I308 PolarHBondContact N-O 3.41Å; V300-I308 PolarHBondContact O-N 3.49Å
301	I	95.2	Very high	92.9	Very high	16 Å²	16	50 Å²	50	8%	0.082	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.2	178.8	-52.1	177.3	0	0	0	108.3	H236 V307 L318	H236-I301 HydrophobicContact CB-CD1 3.81Å; I301-V307 HydrophobicContact CG1-CG1 4.37Å; I301-V307 HydrophobicContact CG1-CG2 4.16Å; I301-V307 HydrophobicContact CG2-CG2 4.28Å; I301-L318 HydrophobicContact CG2-CD1 4.45Å
302	H	93.8	Very high	92.8	Very high	83 Å²	83	47.5 Å²	47.5	38%	0.384	28%	0.277	S	S	.	.			trans	-91.1	152.9	175.8	-70.5	-83.3	0	0	0	111.6	F226 C304 G305 V306	F226-H302 CarbonylContact O-C 3.52Å; H302-C304 PolarHBondContact O-N 3.06Å; H302-C304 VanDerWaalsContact O-N 3.15Å; H302-G305 PolarHBondContact O-N 3.36Å; H302-V306 HydrophobicContact CB-CB 4.41Å; H302-V306 PolarHBondContact N-O 3.09Å
303	L	94.1	Very high	92.7	Very high	48 Å²	48	50.1 Å²	50.1	25%	0.251	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-31.2	-178.1	-168.4	68.9	0	0	0	113	F171 L172 F226 S227 V228 F233 G305	F171-L303 HydrophobicContact CD2-CD1 4.12Å; F171-L303 HydrophobicContact CD2-CD2 3.81Å; F171-L303 HydrophobicContact CE2-CD1 4.06Å; F171-L303 HydrophobicContact CE2-CD2 4.43Å; L172-L303 WeakPolarHBondContact O-CD2 3.33Å; F226-L303 HydrophobicContact CB-CD1 3.77Å; F226-L303 WeakPolarHBondContact O-CA 3.31Å; S227-L303 CarbonylContact C-O 3.54Å; S227-L303 WeakPolarHBondContact CA-O 3.32Å; V228-L303 HydrophobicContact CG2-CD1 3.72Å; V228-L303 HydrophobicContact CG2-CG 4.06Å; V228-L303 PolarHBondContact N-O 2.57Å; F233-L303 HydrophobicContact CE2-CD1 4.47Å; L303-G305 PolarHBondContact O-N 3.08Å
304	C	91.2	Very high	92.6	Very high	85 Å²	85	45.2 Å²	45.2	57%	0.574	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	7	175.3	57.6	0	0	0	0	114.5	H302	H302-C304 PolarHBondContact O-N 3.06Å; H302-C304 VanDerWaalsContact O-N 3.15Å
305	G	93.6	Very high	92.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	30%	0.298	C	S	.	.	S	Bend	trans	80.7	12.1	179.7	0	0	0	0	0	115	H302 L303 L318	H302-G305 PolarHBondContact O-N 3.36Å; L303-G305 PolarHBondContact O-N 3.08Å; G305-L318 WeakPolarHBondContact O-CB 3.37Å; G305-L318 WeakPolarHBondContact O-CG 3.47Å; G305-L318 PolarHBondContact O-N 3.36Å
306	V	94.7	Very high	92.4	Very high	24 Å²	24	48.7 Å²	48.7	15%	0.145	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	128	171.4	178.3	0	0	0	0	109.7	V8 H302 I308 W316 L317	V8-V306 HydrophobicContact CG2-CG1 4.37Å; H302-V306 HydrophobicContact CB-CB 4.41Å; H302-V306 PolarHBondContact N-O 3.09Å; V306-I308 HydrophobicContact CG1-CG1 4.24Å; V306-W316 CarbonylContact C-O 2.92Å; V306-W316 WeakPolarHBondContact CA-O 3.42Å; V306-L317 HydrophobicContact CG2-CD1 4Å
307	V	95.3	Very high	92.5	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.7	175.3	-177.9	0	0	0	0	108.7	W299 V300 I301 S315 W316 L318	W299-V307 HydrophobicContact CB-CG1 4.17Å; W299-V307 HydrophobicContact CD2-CG1 3.61Å; W299-V307 HydrophobicContact CE3-CG1 3.55Å; W299-V307 HydrophobicContact CG-CG1 3.91Å; W299-V307 HydrophobicContact CZ3-CG1 4.05Å; V300-V307 WeakPolarHBondContact O-CA 3.39Å; I301-V307 HydrophobicContact CG1-CG1 4.37Å; I301-V307 HydrophobicContact CG1-CG2 4.16Å; I301-V307 HydrophobicContact CG2-CG2 4.28Å; V307-S315 CarbonylContact O-C 3.58Å; V307-S315 VanDerWaalsContact O-CA 3.26Å; V307-S315 WeakPolarHBondContact O-CA 3.43Å; V307-W316 HydrophobicContact CB-CE3 4.11Å; V307-W316 HydrophobicContact CG1-CE3 3.83Å; V307-W316 HydrophobicContact CG1-CZ3 4.17Å; V307-W316 PolarHBondContact N-O 2.9Å; V307-W316 PolarHBondContact O-N 2.85Å; V307-L318 HydrophobicContact CG2-CD1 3.94Å; V307-L318 HydrophobicContact CG2-CD2 4.17Å; V307-L318 HydrophobicContact CG2-CG 3.85Å
308	I	94.4	Very high	92.6	Very high	59 Å²	59	48.4 Å²	48.4	30%	0.303	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.8	175.8	-57.2	176.6	0	0	0	108.4	W299 V300 V306	W299-I308 WeakPolarHBondContact CA-O 3.46Å; V300-I308 PolarHBondContact N-O 3.41Å; V300-I308 PolarHBondContact O-N 3.49Å; V306-I308 HydrophobicContact CG1-CG1 4.24Å
309	D	93.2	Very high	92.6	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	107.7	172.1	-171	-40.6	0	0	0	110.1	W299 S311 L312 G313 C314 W316	W299-D309 VanDerWaalsContact CD1-OD2 3.29Å; W299-D309 PolarHBondContact NE1-OD2 3.27Å; D309-S311 VanDerWaalsContact C-N 3.29Å; D309-S311 PolarHBondContact O-N 3.49Å; D309-S311 WeakPolarHBondContact OD1-CA 3.25Å; D309-S311 WeakPolarHBondContact OD1-CB 3.43Å; D309-S311 PolarHBondContact OD1-N 3.35Å; D309-S311 PolarHBondContact OD1-OG 3.02Å; D309-L312 HydrophobicContact CB-CB 4.2Å; D309-L312 PolarHBondContact O-N 3.16Å; D309-L312 PolarHBondContact OD1-N 2.99Å; D309-G313 WeakPolarHBondContact O-CA 3.2Å; D309-G313 PolarHBondContact O-N 3.04Å; D309-C314 PolarHBondContact N-O 2.89Å; D309-C314 PolarHBondContact O-N 3.32Å; D309-W316 HydrophobicContact CB-CE3 4.46Å; D309-W316 HydrophobicContact CB-CH2 3.36Å; D309-W316 HydrophobicContact CB-CZ2 4.42Å; D309-W316 HydrophobicContact CB-CZ3 3.4Å; D309-W316 VanDerWaalsContact CB-CZ3 3.4Å; D309-W316 WeakPolarHBondContact OD2-CH2 3.46Å
310	N	91.2	Very high	92.5	Very high	110 Å²	110	51.2 Å²	51.2	59%	0.588	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-23.8	-178.6	-66.6	-33	0	0	0	113.2	N298	N298-N310 PolarHBondContact O-N 2.87Å
311	S	90.5	Very high	92.5	Very high	70 Å²	70	53.2 Å²	53.2	49%	0.49	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-39.2	176.3	33.5	0	0	0	0	112.5	N298 D309	N298-S311 VanDerWaalsContact ND2-CB 3.33Å; N298-S311 WeakPolarHBondContact ND2-CB 3.35Å; N298-S311 PolarHBondContact ND2-OG 3.28Å; D309-S311 VanDerWaalsContact C-N 3.29Å; D309-S311 PolarHBondContact O-N 3.49Å; D309-S311 WeakPolarHBondContact OD1-CA 3.25Å; D309-S311 WeakPolarHBondContact OD1-CB 3.43Å; D309-S311 PolarHBondContact OD1-N 3.35Å; D309-S311 PolarHBondContact OD1-OG 3.02Å
312	L	88.9	Confident	92.3	Very high	42 Å²	42	52.5 Å²	52.5	22%	0.22	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-13.4	-178.9	-63.4	-175.9	0	0	0	113.2	I279 L282 I292 D309 C314 W316	I279-L312 HydrophobicContact CD1-CB 3.94Å; I279-L312 HydrophobicContact CD1-CD2 4.39Å; L282-L312 HydrophobicContact CD2-CD2 3.8Å; I292-L312 HydrophobicContact CD1-CD1 3.87Å; I292-L312 HydrophobicContact CG2-CD1 4.24Å; D309-L312 HydrophobicContact CB-CB 4.2Å; D309-L312 PolarHBondContact O-N 3.16Å; D309-L312 PolarHBondContact OD1-N 2.99Å; L312-C314 HydrophobicContact CB-CB 4.25Å; L312-C314 PolarHBondContact O-N 2.82Å; L312-W316 HydrophobicContact CD1-CH2 4.05Å; L312-W316 HydrophobicContact CD1-CZ2 4.17Å
313	G	88.8	Confident	92.3	Very high	72 Å²	72	51.3 Å²	51.3	74%	0.742	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	31.6	-174.2	0	0	0	0	0	112.4	D309	D309-G313 WeakPolarHBondContact O-CA 3.2Å; D309-G313 PolarHBondContact O-N 3.04Å
314	C	88.9	Confident	92.3	Very high	21 Å²	21	51.7 Å²	51.7	14%	0.142	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	151.2	-175.2	-76.5	0	0	0	0	111.8	I279 D309 L312 W316	I279-C314 WeakPolarHBondContact CD1-SG 3.34Å; D309-C314 PolarHBondContact N-O 2.89Å; D309-C314 PolarHBondContact O-N 3.32Å; L312-C314 HydrophobicContact CB-CB 4.25Å; L312-C314 PolarHBondContact O-N 2.82Å; C314-W316 HydrophobicContact CB-CH2 4.32Å; C314-W316 HydrophobicContact CB-CZ2 3.74Å
315	S	90.3	Very high	92.4	Very high	64 Å²	64	48 Å²	48	45%	0.448	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	134.6	170.6	60.3	0	0	0	0	109.8	V307	V307-S315 CarbonylContact O-C 3.58Å; V307-S315 VanDerWaalsContact O-CA 3.26Å; V307-S315 WeakPolarHBondContact O-CA 3.43Å
316	W	91.1	Very high	92.4	Very high	46 Å²	46	49.4 Å²	49.4	17%	0.174	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	157	175.8	-53.5	-71.7	0	0	0	111.2	I292 W299 V306 V307 D309 L312 C314	I292-W316 HydrophobicContact CG2-CH2 4.14Å; I292-W316 HydrophobicContact CG2-CZ2 4.28Å; W299-W316 HydrophobicContact CD2-CZ3 4.4Å; W299-W316 AromaticContact CE2-CZ3 3.53Å; W299-W316 HydrophobicContact CH2-CZ3 4.41Å; W299-W316 HydrophobicContact CZ2-CE3 4.2Å; W299-W316 HydrophobicContact CZ2-CH2 4.1Å; W299-W316 AromaticContact CZ2-CZ3 3.54Å; W299-W316 HydrophobicContact CZ2-CZ3 3.54Å; W299-W316 AromaticContact NE1-CH2 3.9Å; W299-W316 AromaticContact NE1-CZ3 3.47Å; V306-W316 CarbonylContact C-O 2.92Å; V306-W316 WeakPolarHBondContact CA-O 3.42Å; V307-W316 HydrophobicContact CB-CE3 4.11Å; V307-W316 HydrophobicContact CG1-CE3 3.83Å; V307-W316 HydrophobicContact CG1-CZ3 4.17Å; V307-W316 PolarHBondContact N-O 2.9Å; V307-W316 PolarHBondContact O-N 2.85Å; D309-W316 HydrophobicContact CB-CE3 4.46Å; D309-W316 HydrophobicContact CB-CH2 3.36Å; D309-W316 HydrophobicContact CB-CZ2 4.42Å; D309-W316 HydrophobicContact CB-CZ3 3.4Å; D309-W316 VanDerWaalsContact CB-CZ3 3.4Å; D309-W316 WeakPolarHBondContact OD2-CH2 3.46Å; L312-W316 HydrophobicContact CD1-CH2 4.05Å; L312-W316 HydrophobicContact CD1-CZ2 4.17Å; C314-W316 HydrophobicContact CB-CH2 4.32Å; C314-W316 HydrophobicContact CB-CZ2 3.74Å
317	L	93.3	Very high	92.3	Very high	87 Å²	87	56 Å²	56	46%	0.455	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.9	170.8	-169	71.2	0	0	0	108.8	V8 V306	V8-L317 HydrophobicContact CG1-CB 4.05Å; V8-L317 HydrophobicContact CG1-CD1 4.43Å; V306-L317 HydrophobicContact CG2-CD1 4Å
318	L	94.3	Very high	92.2	Very high	28 Å²	28	60.4 Å²	60.4	15%	0.147	35%	0.349	C	S	.	.			trans	-76.5	132.3	170.7	-66.4	173.9	0	0	0	109.5	L229 I269 I301 G305 V307	L229-L318 HydrophobicContact CD1-CB 3.52Å; L229-L318 WeakPolarHBondContact CD2-O 3.42Å; I269-L318 HydrophobicContact CD1-CD2 3.92Å; I269-L318 HydrophobicContact CG1-CD2 4.42Å; I301-L318 HydrophobicContact CG2-CD1 4.45Å; G305-L318 WeakPolarHBondContact O-CB 3.37Å; G305-L318 WeakPolarHBondContact O-CG 3.47Å; G305-L318 PolarHBondContact O-N 3.36Å; V307-L318 HydrophobicContact CG2-CD1 3.94Å; V307-L318 HydrophobicContact CG2-CD2 4.17Å; V307-L318 HydrophobicContact CG2-CG 3.85Å
319	C	92.9	Very high	92.1	Very high	106 Å²	106	58.5 Å²	58.5	72%	0.716	34%	0.34	S	S	*	.			trans	-125.7	143.2	178.1	-62.9	0	0	0	0	110.2
320	V	92.4	Very high	92	Very high	46 Å²	46	63.3 Å²	63.3	28%	0.279	38%	0.38	S	S	.	.			trans	-89.5	128.6	175.7	-176.7	0	0	0	0	109.4	L229 L232 M234 N322	L229-V320 HydrophobicContact CB-CG2 3.72Å; L229-V320 HydrophobicContact CD1-CG2 4.27Å; L232-V320 HydrophobicContact CD1-CG1 4.3Å; L232-V320 HydrophobicContact CD1-CG2 4.46Å; M234-V320 HydrophobicContact CE-CG2 3.69Å; V320-N322 WeakPolarHBondContact CG1-OD1 3.5Å
321	N	93.6	Very high	92.1	Very high	105 Å²	105	62.4 Å²	62.4	56%	0.561	38%	0.375	S	S	*	.			trans	-103.8	92.7	170.9	-173.5	-6.5	0	0	0	110.5	M323 V324	N321-M323 PolarHBondContact O-N 3.44Å; N321-M323 VanDerWaalsContact OD1-CB 3.29Å; N321-M323 WeakPolarHBondContact OD1-CB 3.31Å; N321-M323 PolarHBondContact OD1-N 2.94Å; N321-V324 HydrophobicContact CB-CG2 4.26Å; N321-V324 PolarHBondContact O-N 3.37Å
322	N	92.8	Very high	92.2	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.011	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-62.8	-21.6	-177.7	-68.3	-45.8	0	0	0	113.3	D230 V320 V324 F325 P326 F338 L339 S344 V348	D230-N322 PolarHBondContact OD2-ND2 3.27Å; V320-N322 WeakPolarHBondContact CG1-OD1 3.5Å; N322-V324 PolarHBondContact O-N 3.27Å; N322-F325 WeakPolarHBondContact O-CB 3.47Å; N322-F325 PolarHBondContact O-N 3.23Å; N322-P326 WeakPolarHBondContact O-CD 3.49Å; N322-F338 WeakPolarHBondContact OD1-CE1 3.34Å; N322-L339 HydrophobicContact CB-CD2 4.15Å; N322-S344 WeakPolarHBondContact CB-OG 3.45Å; N322-S344 PolarHBondContact ND2-OG 3.05Å; N322-V348 HydrophobicContact CB-CG2 3.91Å
323	M	93.5	Very high	92.4	Very high	57 Å²	57	61.1 Å²	61.1	28%	0.281	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-63.4	-22.1	177.7	-66	-60.5	-66.6	0	0	114	N321 V348 E351	N321-M323 PolarHBondContact O-N 3.44Å; N321-M323 VanDerWaalsContact OD1-CB 3.29Å; N321-M323 WeakPolarHBondContact OD1-CB 3.31Å; N321-M323 PolarHBondContact OD1-N 2.94Å; M323-V348 HydrophobicContact CG-CG2 4.13Å; M323-V348 HydrophobicContact SD-CB 3.89Å; M323-V348 HydrophobicContact SD-CG1 3.8Å; M323-V348 HydrophobicContact SD-CG2 3.34Å; M323-V348 WeakPolarHBondContact SD-CG2 3.18Å; M323-E351 HydrophobicContact CE-CG 4.4Å; M323-E351 WeakPolarHBondContact CE-OE1 3.48Å; M323-E351 WeakPolarHBondContact CE-OE2 3.31Å
324	V	92.7	Very high	92.5	Very high	56 Å²	56	59.2 Å²	59.2	34%	0.339	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-85.4	-25.3	-178.5	-173.7	0	0	0	0	110.8	N321 N322 K327 I328	N321-V324 HydrophobicContact CB-CG2 4.26Å; N321-V324 PolarHBondContact O-N 3.37Å; N322-V324 PolarHBondContact O-N 3.27Å; V324-K327 WeakPolarHBondContact O-CA 3.31Å; V324-K327 WeakPolarHBondContact O-CB 3.43Å; V324-K327 PolarHBondContact O-N 3.37Å; V324-I328 HydrophobicContact CG1-CD1 3.53Å; V324-I328 HydrophobicContact CG1-CG1 3.91Å; V324-I328 PolarHBondContact O-N 3.1Å
325	F	93.7	Very high	92.8	Very high	9 Å²	9	58.2 Å²	58.2	4%	0.039	33%	0.329	C	S	.	.	H	α-helix	trans	-56.8	-48.8	-174.6	-167.1	-93.7	0	0	0	113.2	I263 L264 N322 K327 I328 V329 L334 V335 F338	I263-F325 HydrophobicContact CD1-CE2 4.03Å; I263-F325 HydrophobicContact CD1-CZ 4.35Å; L264-F325 HydrophobicContact CD1-CD2 3.85Å; L264-F325 HydrophobicContact CD1-CE2 3.79Å; L264-F325 HydrophobicContact CD2-CE2 4.11Å; L264-F325 HydrophobicContact CG-CD2 4.45Å; L264-F325 HydrophobicContact CG-CE2 3.94Å; N322-F325 WeakPolarHBondContact O-CB 3.47Å; N322-F325 PolarHBondContact O-N 3.23Å; F325-K327 PolarHBondContact O-N 2.96Å; F325-K327 VanDerWaalsContact O-N 3.12Å; F325-I328 PolarHBondContact O-N 3.04Å; F325-V329 HydrophobicContact CD1-CB 4.43Å; F325-V329 HydrophobicContact CD1-CG2 4.24Å; F325-V329 HydrophobicContact CD2-CG2 4.23Å; F325-V329 HydrophobicContact CE1-CB 4.12Å; F325-V329 HydrophobicContact CE1-CG1 4.32Å; F325-V329 HydrophobicContact CE1-CG2 3.85Å; F325-V329 HydrophobicContact CE2-CG2 3.85Å; F325-V329 HydrophobicContact CG-CG2 4.41Å; F325-V329 HydrophobicContact CZ-CB 4.38Å; F325-V329 HydrophobicContact CZ-CG2 3.65Å; F325-V329 PolarHBondContact O-N 2.89Å; F325-L334 HydrophobicContact CZ-CG 4.5Å; F325-V335 HydrophobicContact CD1-CG2 4.14Å; F325-V335 HydrophobicContact CE1-CG2 4.16Å; F325-F338 HydrophobicContact CB-CD1 4.33Å; F325-F338 HydrophobicContact CB-CE1 3.97Å; F325-F338 HydrophobicContact CD1-CB 4.17Å; F325-F338 AromaticContact CD1-CD1 3.52Å; F325-F338 HydrophobicContact CD1-CD1 3.52Å; F325-F338 AromaticContact CD1-CE1 3.98Å; F325-F338 HydrophobicContact CD1-CE1 3.98Å; F325-F338 AromaticContact CD1-CG 3.84Å; F325-F338 HydrophobicContact CD1-CG 3.84Å; F325-F338 HydrophobicContact CD2-CD1 4.05Å; F325-F338 HydrophobicContact CD2-CD2 4.22Å; F325-F338 AromaticContact CD2-CE1 3.76Å; F325-F338 HydrophobicContact CD2-CE1 3.76Å; F325-F338 AromaticContact CD2-CE2 3.9Å; F325-F338 HydrophobicContact CD2-CE2 3.9Å; F325-F338 HydrophobicContact CD2-CG 4.28Å; F325-F338 AromaticContact CD2-CZ 3.68Å; F325-F338 HydrophobicContact CD2-CZ 3.68Å; F325-F338 HydrophobicContact CE1-CB 3.55Å; F325-F338 AromaticContact CE1-CD1 3.72Å; F325-F338 HydrophobicContact CE1-CD1 3.72Å; F325-F338 AromaticContact CE1-CD2 4Å; F325-F338 HydrophobicContact CE1-CD2 4Å; F325-F338 HydrophobicContact CE1-CE1 4.41Å; F325-F338 AromaticContact CE1-CG 3.5Å; F325-F338 HydrophobicContact CE1-CG 3.5Å; F325-F338 VanDerWaalsContact CE1-CG 3.5Å; F325-F338 HydrophobicContact CE2-CD1 4.23Å; F325-F338 AromaticContact CE2-CD2 3.68Å; F325-F338 HydrophobicContact CE2-CD2 3.68Å; F325-F338 HydrophobicContact CE2-CE1 4.22Å; F325-F338 AromaticContact CE2-CE2 3.62Å; F325-F338 HydrophobicContact CE2-CE2 3.62Å; F325-F338 AromaticContact CE2-CG 3.99Å; F325-F338 HydrophobicContact CE2-CG 3.99Å; F325-F338 AromaticContact CE2-CZ 3.92Å; F325-F338 HydrophobicContact CE2-CZ 3.92Å; F325-F338 AromaticContact CG-CD1 3.7Å; F325-F338 HydrophobicContact CG-CD1 3.7Å; F325-F338 AromaticContact CG-CE1 3.63Å; F325-F338 HydrophobicContact CG-CE1 3.63Å; F325-F338 HydrophobicContact CG-CG 4.22Å; F325-F338 HydrophobicContact CG-CZ 4.06Å; F325-F338 HydrophobicContact CZ-CB 3.88Å; F325-F338 HydrophobicContact CZ-CD1 4.07Å; F325-F338 AromaticContact CZ-CD2 3.55Å; F325-F338 HydrophobicContact CZ-CD2 3.55Å; F325-F338 HydrophobicContact CZ-CE2 4.01Å; F325-F338 AromaticContact CZ-CG 3.57Å; F325-F338 HydrophobicContact CZ-CG 3.57Å; F325-F338 HydrophobicContact CZ-CZ 4.49Å
326	P	93.7	Very high	93	Very high	28 Å²	28	55.2 Å²	55.2	18%	0.182	31%	0.307	C	S	.	.	H	α-helix	trans	-66.5	-13.8	177.3	-18.9	33.1	0	0	0	114.4	N322 V335 L339 V348 Y352	N322-P326 WeakPolarHBondContact O-CD 3.49Å; P326-V335 HydrophobicContact CB-CG1 3.92Å; P326-V335 HydrophobicContact CG-CG1 3.86Å; P326-L339 HydrophobicContact CG-CD1 4.1Å; P326-V348 HydrophobicContact CG-CG1 4.13Å; P326-Y352 HydrophobicContact CB-CD2 3.68Å; P326-Y352 HydrophobicContact CB-CE2 3.96Å; P326-Y352 HydrophobicContact CB-CG 4.48Å; P326-Y352 HydrophobicContact CG-CD2 4.31Å
327	K	93.1	Very high	92.9	Very high	164 Å²	164	54.8 Å²	54.8	71%	0.713	31%	0.309	S	S	*	.	H	α-helix	trans	-87.6	-27.9	178.7	-55.8	-179.5	-176	178.4	0	112	V324 F325	V324-K327 WeakPolarHBondContact O-CA 3.31Å; V324-K327 WeakPolarHBondContact O-CB 3.43Å; V324-K327 PolarHBondContact O-N 3.37Å; F325-K327 PolarHBondContact O-N 2.96Å; F325-K327 VanDerWaalsContact O-N 3.12Å
328	I	92.5	Very high	92.9	Very high	92 Å²	92	50.9 Å²	50.9	47%	0.472	29%	0.288	S	S	.	.	H	α-helix	trans	-93.2	-39.4	-179.3	-60.7	176.7	0	0	0	110.5	L264 I267 V324 F325	L264-I328 HydrophobicContact CD2-CG2 4.1Å; I267-I328 HydrophobicContact CD1-CD1 4.24Å; I267-I328 HydrophobicContact CD1-CG2 4.44Å; V324-I328 HydrophobicContact CG1-CD1 3.53Å; V324-I328 HydrophobicContact CG1-CG1 3.91Å; V324-I328 PolarHBondContact O-N 3.1Å; F325-I328 PolarHBondContact O-N 3.04Å
329	V	93	Very high	92.8	Very high	20 Å²	20	49.6 Å²	49.6	12%	0.121	28%	0.281	C	S	.	.			trans	-93.7	120	-175.1	178.9	0	0	0	0	110.5	L264 F325 N331 L334 V335	L264-V329 HydrophobicContact CD2-CG2 3.55Å; F325-V329 HydrophobicContact CD1-CB 4.43Å; F325-V329 HydrophobicContact CD1-CG2 4.24Å; F325-V329 HydrophobicContact CD2-CG2 4.23Å; F325-V329 HydrophobicContact CE1-CB 4.12Å; F325-V329 HydrophobicContact CE1-CG1 4.32Å; F325-V329 HydrophobicContact CE1-CG2 3.85Å; F325-V329 HydrophobicContact CE2-CG2 3.85Å; F325-V329 HydrophobicContact CG-CG2 4.41Å; F325-V329 HydrophobicContact CZ-CB 4.38Å; F325-V329 HydrophobicContact CZ-CG2 3.65Å; F325-V329 PolarHBondContact O-N 2.89Å; V329-N331 HydrophobicContact CG1-CB 4.25Å; V329-L334 HydrophobicContact CG1-CB 4.42Å; V329-L334 HydrophobicContact CG1-CD2 3.85Å; V329-L334 HydrophobicContact CG1-CG 4.41Å; V329-V335 HydrophobicContact CB-CG2 3.98Å; V329-V335 HydrophobicContact CG1-CG2 3.92Å
330	A	90.6	Very high	92.7	Very high	104 Å²	104	45.2 Å²	45.2	86%	0.86	25%	0.251	S	S	*	.			trans	-79.9	-24.7	177.5	0	0	0	0	0	113.6	H332	A330-H332 PolarHBondContact O-N 2.86Å; A330-H332 VanDerWaalsContact O-N 3.12Å
331	N	92.8	Very high	92.4	Very high	92 Å²	92	44 Å²	44	49%	0.492	24%	0.242	S	C	.	.			trans	-73.8	105.3	-177.7	-175.9	-24.9	0	0	0	110.7	V329 N333 L334 V335	V329-N331 HydrophobicContact CG1-CB 4.25Å; N331-N333 PolarHBondContact O-N 2.93Å; N331-N333 PolarHBondContact OD1-N 2.91Å; N331-L334 HydrophobicContact CB-CB 3.98Å; N331-L334 PolarHBondContact O-N 3.46Å; N331-L334 PolarHBondContact OD1-N 2.94Å; N331-V335 WeakPolarHBondContact O-CG2 3.2Å; N331-V335 PolarHBondContact O-N 2.84Å
332	H	92.9	Very high	92.2	Very high	12 Å²	12	39.1 Å²	39.1	6%	0.056	22%	0.216	C	C	.	.	H	α-helix	trans	-53.6	-47.6	179.5	175.4	78	0	0	0	113.1	A330 L334 V335 V336 Y352 Q387	A330-H332 PolarHBondContact O-N 2.86Å; A330-H332 VanDerWaalsContact O-N 3.12Å; H332-L334 VanDerWaalsContact C-N 3.31Å; H332-L334 PolarHBondContact O-N 3.13Å; H332-V335 WeakPolarHBondContact O-CB 3.23Å; H332-V335 PolarHBondContact O-N 3.06Å; H332-V335 VanDerWaalsContact O-N 3.1Å; H332-V336 WeakPolarHBondContact O-CG2 3.45Å; H332-V336 PolarHBondContact O-N 3.19Å; H332-Y352 AromaticContact CE1-CE1 3.64Å; H332-Y352 AromaticContact ND1-CE1 3.43Å; H332-Y352 WeakPolarHBondContact ND1-CE1 3.34Å; H332-Y352 AromaticContact ND1-CZ 3.61Å; H332-Y352 PolarHBondContact ND1-OH 3.13Å; H332-Q387 HydrophobicContact CB-CG 4.32Å; H332-Q387 WeakPolarHBondContact NE2-CA 3.45Å; H332-Q387 PolarHBondContact NE2-O 3.49Å; H332-Q387 VanDerWaalsContact NE2-O 3.12Å
333	N	93.2	Very high	91.9	Very high	73 Å²	73	41.9 Å²	41.9	39%	0.39	24%	0.235	S	C	.	.	H	α-helix	trans	-63	-42.8	-175.9	-62.6	6.4	0	0	0	110.7	N331 V335 V336 D337 F390	N331-N333 PolarHBondContact O-N 2.93Å; N331-N333 PolarHBondContact OD1-N 2.91Å; N333-V335 VanDerWaalsContact C-N 3.32Å; N333-V335 PolarHBondContact O-N 3.34Å; N333-V336 PolarHBondContact O-N 2.99Å; N333-D337 WeakPolarHBondContact O-CB 3.48Å; N333-D337 PolarHBondContact O-N 2.83Å; N333-F390 VanDerWaalsContact CA-CE1 3.44Å; N333-F390 HydrophobicContact CB-CD1 4.25Å; N333-F390 HydrophobicContact CB-CE1 3.65Å; N333-F390 HydrophobicContact CB-CE2 4.19Å; N333-F390 HydrophobicContact CB-CZ 3.61Å
334	L	92.5	Very high	91.6	Very high	32 Å²	32	41.3 Å²	41.3	17%	0.168	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-37.8	176.1	-174.9	67.7	0	0	0	112	V250 I263 F325 V329 N331 H332 F338	V250-L334 HydrophobicContact CB-CD1 4.49Å; V250-L334 HydrophobicContact CG1-CD1 3.53Å; V250-L334 HydrophobicContact CG2-CD1 4.08Å; I263-L334 HydrophobicContact CG2-CD1 4.49Å; F325-L334 HydrophobicContact CZ-CG 4.5Å; V329-L334 HydrophobicContact CG1-CB 4.42Å; V329-L334 HydrophobicContact CG1-CD2 3.85Å; V329-L334 HydrophobicContact CG1-CG 4.41Å; N331-L334 HydrophobicContact CB-CB 3.98Å; N331-L334 PolarHBondContact O-N 3.46Å; N331-L334 PolarHBondContact OD1-N 2.94Å; H332-L334 VanDerWaalsContact C-N 3.31Å; H332-L334 PolarHBondContact O-N 3.13Å; L334-F338 WeakPolarHBondContact O-CB 3.47Å; L334-F338 PolarHBondContact O-N 3.22Å
335	V	94.4	Very high	91.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-47.9	175.9	170.3	0	0	0	0	111	F325 P326 V329 N331 H332 N333 F338 L339 Y352	F325-V335 HydrophobicContact CD1-CG2 4.14Å; F325-V335 HydrophobicContact CE1-CG2 4.16Å; P326-V335 HydrophobicContact CB-CG1 3.92Å; P326-V335 HydrophobicContact CG-CG1 3.86Å; V329-V335 HydrophobicContact CB-CG2 3.98Å; V329-V335 HydrophobicContact CG1-CG2 3.92Å; N331-V335 WeakPolarHBondContact O-CG2 3.2Å; N331-V335 PolarHBondContact O-N 2.84Å; H332-V335 WeakPolarHBondContact O-CB 3.23Å; H332-V335 PolarHBondContact O-N 3.06Å; H332-V335 VanDerWaalsContact O-N 3.1Å; N333-V335 VanDerWaalsContact C-N 3.32Å; N333-V335 PolarHBondContact O-N 3.34Å; V335-F338 PolarHBondContact O-N 3.11Å; V335-L339 HydrophobicContact CG1-CD1 3.81Å; V335-L339 HydrophobicContact CG1-CG 4.4Å; V335-L339 WeakPolarHBondContact O-CB 3.42Å; V335-L339 VanDerWaalsContact O-CG 3.25Å; V335-L339 WeakPolarHBondContact O-CG 3.24Å; V335-L339 PolarHBondContact O-N 3.15Å; V335-Y352 HydrophobicContact CG1-CD1 4.29Å; V335-Y352 HydrophobicContact CG1-CE1 4.1Å; V335-Y352 HydrophobicContact CG1-CE2 4.38Å; V335-Y352 HydrophobicContact CG1-CG 4.49Å
336	V	93.3	Very high	91.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.3	-49.3	179.7	174.7	0	0	0	0	110.6	H332 N333 F338 L339 L340 L349 F390 V391 R394	H332-V336 WeakPolarHBondContact O-CG2 3.45Å; H332-V336 PolarHBondContact O-N 3.19Å; N333-V336 PolarHBondContact O-N 2.99Å; V336-F338 VanDerWaalsContact C-N 3.33Å; V336-F338 PolarHBondContact O-N 3.01Å; V336-L339 PolarHBondContact O-N 3.32Å; V336-L340 HydrophobicContact CG1-CD1 3.87Å; V336-L340 HydrophobicContact CG1-CG 4.47Å; V336-L340 VanDerWaalsContact O-CG 3.31Å; V336-L340 WeakPolarHBondContact O-CG 3.35Å; V336-L340 PolarHBondContact O-N 2.85Å; V336-L349 HydrophobicContact CG2-CD1 4.2Å; V336-F390 HydrophobicContact CB-CD1 4.15Å; V336-F390 HydrophobicContact CB-CE1 3.91Å; V336-F390 HydrophobicContact CG1-CD1 4.2Å; V336-F390 HydrophobicContact CG1-CE1 4.03Å; V336-F390 HydrophobicContact CG2-CD1 4.27Å; V336-F390 HydrophobicContact CG2-CE1 4.48Å; V336-V391 HydrophobicContact CG1-CG2 4.42Å; V336-V391 HydrophobicContact CG2-CG2 3.58Å; V336-R394 HydrophobicContact CG1-CB 4.02Å; V336-R394 HydrophobicContact CG1-CG 4.35Å
337	D	90.7	Very high	91.1	Very high	38 Å²	38	42.7 Å²	42.7	20%	0.203	24%	0.244	C	C	.	.	H	α-helix	trans	-60.2	-42.7	178.5	-78.1	-36.2	0	0	0	112	N333 H341 R394	N333-D337 WeakPolarHBondContact O-CB 3.48Å; N333-D337 PolarHBondContact O-N 2.83Å; D337-H341 PolarHBondContact O-ND1 3.05Å; D337-R394 IonicContact OD1-CZ 3.56Å; D337-R394 VanDerWaalsContact OD1-CZ 3.22Å; D337-R394 IonicContact OD1-NE 3.61Å; D337-R394 PolarHBondContact OD1-NE 3.28Å; D337-R394 IonicContact OD1-NH2 2.8Å; D337-R394 PolarHBondContact OD1-NH2 3.35Å
338	F	91.9	Very high	91.2	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-62.1	-51.6	176.3	175.9	-87.4	0	0	0	111.2	L232 I263 N322 F325 L334 V335 V336 L340 H341 R342	L232-F338 HydrophobicContact CD1-CE2 3.84Å; L232-F338 HydrophobicContact CD1-CZ 3.87Å; L232-F338 HydrophobicContact CD2-CE2 3.79Å; L232-F338 HydrophobicContact CG-CE2 4.37Å; I263-F338 HydrophobicContact CD1-CD2 3.71Å; I263-F338 HydrophobicContact CD1-CE2 3.59Å; N322-F338 WeakPolarHBondContact OD1-CE1 3.34Å; F325-F338 HydrophobicContact CB-CD1 4.33Å; F325-F338 HydrophobicContact CB-CE1 3.97Å; F325-F338 HydrophobicContact CD1-CB 4.17Å; F325-F338 AromaticContact CD1-CD1 3.52Å; F325-F338 HydrophobicContact CD1-CD1 3.52Å; F325-F338 AromaticContact CD1-CE1 3.98Å; F325-F338 HydrophobicContact CD1-CE1 3.98Å; F325-F338 AromaticContact CD1-CG 3.84Å; F325-F338 HydrophobicContact CD1-CG 3.84Å; F325-F338 HydrophobicContact CD2-CD1 4.05Å; F325-F338 HydrophobicContact CD2-CD2 4.22Å; F325-F338 AromaticContact CD2-CE1 3.76Å; F325-F338 HydrophobicContact CD2-CE1 3.76Å; F325-F338 AromaticContact CD2-CE2 3.9Å; F325-F338 HydrophobicContact CD2-CE2 3.9Å; F325-F338 HydrophobicContact CD2-CG 4.28Å; F325-F338 AromaticContact CD2-CZ 3.68Å; F325-F338 HydrophobicContact CD2-CZ 3.68Å; F325-F338 HydrophobicContact CE1-CB 3.55Å; F325-F338 AromaticContact CE1-CD1 3.72Å; F325-F338 HydrophobicContact CE1-CD1 3.72Å; F325-F338 AromaticContact CE1-CD2 4Å; F325-F338 HydrophobicContact CE1-CD2 4Å; F325-F338 HydrophobicContact CE1-CE1 4.41Å; F325-F338 AromaticContact CE1-CG 3.5Å; F325-F338 HydrophobicContact CE1-CG 3.5Å; F325-F338 VanDerWaalsContact CE1-CG 3.5Å; F325-F338 HydrophobicContact CE2-CD1 4.23Å; F325-F338 AromaticContact CE2-CD2 3.68Å; F325-F338 HydrophobicContact CE2-CD2 3.68Å; F325-F338 HydrophobicContact CE2-CE1 4.22Å; F325-F338 AromaticContact CE2-CE2 3.62Å; F325-F338 HydrophobicContact CE2-CE2 3.62Å; F325-F338 AromaticContact CE2-CG 3.99Å; F325-F338 HydrophobicContact CE2-CG 3.99Å; F325-F338 AromaticContact CE2-CZ 3.92Å; F325-F338 HydrophobicContact CE2-CZ 3.92Å; F325-F338 AromaticContact CG-CD1 3.7Å; F325-F338 HydrophobicContact CG-CD1 3.7Å; F325-F338 AromaticContact CG-CE1 3.63Å; F325-F338 HydrophobicContact CG-CE1 3.63Å; F325-F338 HydrophobicContact CG-CG 4.22Å; F325-F338 HydrophobicContact CG-CZ 4.06Å; F325-F338 HydrophobicContact CZ-CB 3.88Å; F325-F338 HydrophobicContact CZ-CD1 4.07Å; F325-F338 AromaticContact CZ-CD2 3.55Å; F325-F338 HydrophobicContact CZ-CD2 3.55Å; F325-F338 HydrophobicContact CZ-CE2 4.01Å; F325-F338 AromaticContact CZ-CG 3.57Å; F325-F338 HydrophobicContact CZ-CG 3.57Å; F325-F338 HydrophobicContact CZ-CZ 4.49Å; L334-F338 WeakPolarHBondContact O-CB 3.47Å; L334-F338 PolarHBondContact O-N 3.22Å; V335-F338 PolarHBondContact O-N 3.11Å; V336-F338 VanDerWaalsContact C-N 3.33Å; V336-F338 PolarHBondContact O-N 3.01Å; F338-L340 VanDerWaalsContact C-N 3.35Å; F338-L340 PolarHBondContact O-N 3.16Å; F338-H341 PolarHBondContact O-N 3.43Å; F338-R342 HydrophobicContact CD1-CG 4.11Å; F338-R342 HydrophobicContact CE1-CG 3.8Å; F338-R342 VanDerWaalsContact CE2-NH2 3.34Å; F338-R342 HydrophobicContact CZ-CG 4.2Å; F338-R342 VanDerWaalsContact O-CG 3.32Å; F338-R342 WeakPolarHBondContact O-CG 3.46Å
339	L	92.6	Very high	91.3	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-68.1	-31.1	-173.7	-69.7	176.1	0	0	0	113	N322 P326 V335 V336 H341 R342 G345 V348 L349	N322-L339 HydrophobicContact CB-CD2 4.15Å; P326-L339 HydrophobicContact CG-CD1 4.1Å; V335-L339 HydrophobicContact CG1-CD1 3.81Å; V335-L339 HydrophobicContact CG1-CG 4.4Å; V335-L339 WeakPolarHBondContact O-CB 3.42Å; V335-L339 VanDerWaalsContact O-CG 3.25Å; V335-L339 WeakPolarHBondContact O-CG 3.24Å; V335-L339 PolarHBondContact O-N 3.15Å; V336-L339 PolarHBondContact O-N 3.32Å; L339-H341 PolarHBondContact O-N 2.87Å; L339-H341 VanDerWaalsContact O-N 3.11Å; L339-R342 PolarHBondContact O-N 3.37Å; L339-G345 WeakPolarHBondContact O-CA 3.43Å; L339-V348 HydrophobicContact CD1-CB 4.33Å; L339-V348 HydrophobicContact CD1-CG1 3.84Å; L339-V348 HydrophobicContact CD2-CB 3.98Å; L339-V348 HydrophobicContact CD2-CG1 3.75Å; L339-V348 HydrophobicContact CG-CG1 4.48Å; L339-L349 HydrophobicContact CB-CB 4.24Å; L339-L349 HydrophobicContact CD1-CB 4.14Å; L339-L349 HydrophobicContact CD1-CD1 4.13Å
340	L	90.1	Very high	91.3	Very high	14 Å²	14	30.2 Å²	30.2	7%	0.073	19%	0.186	C	C	.	.	H	α-helix	trans	-63.1	-17.4	177.1	-73.8	169.1	0	0	0	113.6	V336 F338 L349 R394 I395 V398 I447	V336-L340 HydrophobicContact CG1-CD1 3.87Å; V336-L340 HydrophobicContact CG1-CG 4.47Å; V336-L340 VanDerWaalsContact O-CG 3.31Å; V336-L340 WeakPolarHBondContact O-CG 3.35Å; V336-L340 PolarHBondContact O-N 2.85Å; F338-L340 VanDerWaalsContact C-N 3.35Å; F338-L340 PolarHBondContact O-N 3.16Å; L340-L349 HydrophobicContact CD2-CD2 3.69Å; L340-L349 HydrophobicContact CG-CD2 4.05Å; L340-R394 HydrophobicContact CD1-CB 3.54Å; L340-I395 HydrophobicContact CD2-CG1 4.21Å; L340-V398 HydrophobicContact CB-CG2 4.46Å; L340-V398 HydrophobicContact CD1-CG2 4.09Å; L340-I447 HydrophobicContact CD2-CD1 4.31Å
341	H	86.9	Confident	91.4	Very high	22 Å²	22	30.6 Å²	30.6	10%	0.102	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	18.6	-177.3	-62.1	95.1	0	0	0	113.6	Y176 D337 F338 L339 F444	Y176-H341 HydrophobicContact CE1-CB 4.09Å; D337-H341 PolarHBondContact O-ND1 3.05Å; F338-H341 PolarHBondContact O-N 3.43Å; L339-H341 PolarHBondContact O-N 2.87Å; L339-H341 VanDerWaalsContact O-N 3.11Å; H341-F444 AromaticContact CD2-CE1 3.74Å; H341-F444 AromaticContact NE2-CE1 3.83Å
342	R	89.3	Confident	91.5	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.008	15%	0.153	C	C	.	.	S	Bend	trans	-119	147.3	-176.4	-62.2	-64.7	167.6	-96.5	-13.3	113.6	Y176 D230 L232 D247 F338 L339 S344 G345 Y445	Y176-R342 PolarHBondContact OH-NH1 3.33Å; D230-R342 PolarHBondContact O-NH1 3.35Å; D230-R342 WeakPolarHBondContact OD2-CB 3.49Å; D230-R342 WeakPolarHBondContact OD2-CD 3.33Å; L232-R342 VanDerWaalsContact CD2-NH2 3.25Å; D247-R342 IonicContact OD2-CZ 2.74Å; D247-R342 IonicContact OD2-NH1 3.56Å; D247-R342 IonicContact OD2-NH2 3.83Å; D247-R342 PolarHBondContact OD2-NH2 3.3Å; F338-R342 HydrophobicContact CD1-CG 4.11Å; F338-R342 HydrophobicContact CE1-CG 3.8Å; F338-R342 VanDerWaalsContact CE2-NH2 3.34Å; F338-R342 HydrophobicContact CZ-CG 4.2Å; F338-R342 VanDerWaalsContact O-CG 3.32Å; F338-R342 WeakPolarHBondContact O-CG 3.46Å; L339-R342 PolarHBondContact O-N 3.37Å; R342-S344 PolarHBondContact O-N 2.93Å; R342-G345 PolarHBondContact O-N 3.05Å; R342-Y445 WeakPolarHBondContact O-CD2 3.39Å
343	S	86.2	Confident	91.6	Very high	59 Å²	59	27.5 Å²	27.5	41%	0.413	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-49.6	176.1	58.7	0	0	0	0	114.4	D230 Y445	D230-S343 VanDerWaalsContact CG-OG 3.27Å; D230-S343 WeakPolarHBondContact OD1-CB 3.13Å; D230-S343 PolarHBondContact OD1-N 2.95Å; D230-S343 PolarHBondContact OD1-OG 3.46Å; D230-S343 PolarHBondContact OD2-N 3.39Å; D230-S343 VanDerWaalsContact OD2-N 3.16Å; D230-S343 PolarHBondContact OD2-OG 3.49Å; S343-Y445 VanDerWaalsContact CA-CE2 3.49Å
344	S	87.1	Confident	91.6	Very high	45 Å²	45	24.9 Å²	24.9	32%	0.315	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	12.5	177.2	79.1	0	0	0	0	112.9	N322 R342 K346 S347 V348	N322-S344 WeakPolarHBondContact CB-OG 3.45Å; N322-S344 PolarHBondContact ND2-OG 3.05Å; R342-S344 PolarHBondContact O-N 2.93Å; S344-K346 PolarHBondContact O-N 3.39Å; S344-S347 PolarHBondContact O-OG 3.34Å; S344-S347 VanDerWaalsContact O-OG 3.08Å; S344-V348 WeakPolarHBondContact O-CG2 3.19Å; S344-V348 PolarHBondContact O-N 2.66Å
345	G	89	Confident	91.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-69	-33.5	-167.9	0	0	0	0	0	113.6	L339 R342 V348 L349	L339-G345 WeakPolarHBondContact O-CA 3.43Å; R342-G345 PolarHBondContact O-N 3.05Å; G345-V348 PolarHBondContact O-N 3.35Å; G345-L349 WeakPolarHBondContact O-CB 3.25Å; G345-L349 PolarHBondContact O-N 3.02Å
346	K	90.3	Very high	91.5	Very high	53 Å²	53	29.6 Å²	29.6	23%	0.23	16%	0.158	C	C	.	.	H	α-helix	trans	-56.4	-52.9	176	167.7	171.6	173.8	168.9	0	113.2	S344 L349 L350 I446 I447 E451	S344-K346 PolarHBondContact O-N 3.39Å; K346-L349 PolarHBondContact O-N 2.96Å; K346-L350 HydrophobicContact CG-CD1 4.42Å; K346-L350 WeakPolarHBondContact O-CG 3.18Å; K346-L350 PolarHBondContact O-N 3.34Å; K346-I446 PolarHBondContact NZ-O 2.85Å; K346-I447 HydrophobicContact CB-CG1 4.5Å; K346-I447 HydrophobicContact CD-CG1 4.41Å; K346-I447 HydrophobicContact CG-CG1 4.11Å; K346-E451 WeakPolarHBondContact CE-OE1 3.35Å; K346-E451 WeakPolarHBondContact CE-OE2 3.42Å; K346-E451 IonicContact NZ-OE1 3.66Å; K346-E451 PolarHBondContact NZ-OE1 3Å; K346-E451 IonicContact NZ-OE2 2.68Å; K346-E451 PolarHBondContact NZ-OE2 3.32Å
347	S	91.8	Very high	91.4	Very high	70 Å²	70	29.7 Å²	29.7	49%	0.49	16%	0.158	S	C	.	.	H	α-helix	trans	-66.1	-42.3	-179	55.4	0	0	0	0	111.5	S344 L349 L350 E351	S344-S347 PolarHBondContact O-OG 3.34Å; S344-S347 VanDerWaalsContact O-OG 3.08Å; S347-L349 VanDerWaalsContact C-N 3.35Å; S347-L349 PolarHBondContact O-N 3.49Å; S347-L350 PolarHBondContact O-N 3.45Å; S347-E351 PolarHBondContact O-N 3.3Å
348	V	94	Very high	91.4	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.024	17%	0.166	C	C	.	.	H	α-helix	trans	-63.7	-41.2	177.6	-177.2	0	0	0	0	111	N322 M323 P326 L339 S344 G345 E351 Y352	N322-V348 HydrophobicContact CB-CG2 3.91Å; M323-V348 HydrophobicContact CG-CG2 4.13Å; M323-V348 HydrophobicContact SD-CB 3.89Å; M323-V348 HydrophobicContact SD-CG1 3.8Å; M323-V348 HydrophobicContact SD-CG2 3.34Å; M323-V348 WeakPolarHBondContact SD-CG2 3.18Å; P326-V348 HydrophobicContact CG-CG1 4.13Å; L339-V348 HydrophobicContact CD1-CB 4.33Å; L339-V348 HydrophobicContact CD1-CG1 3.84Å; L339-V348 HydrophobicContact CD2-CB 3.98Å; L339-V348 HydrophobicContact CD2-CG1 3.75Å; L339-V348 HydrophobicContact CG-CG1 4.48Å; S344-V348 WeakPolarHBondContact O-CG2 3.19Å; S344-V348 PolarHBondContact O-N 2.66Å; G345-V348 PolarHBondContact O-N 3.35Å; V348-E351 PolarHBondContact O-N 3.17Å; V348-Y352 VanDerWaalsContact O-CB 3.32Å; V348-Y352 WeakPolarHBondContact O-CB 3.28Å; V348-Y352 PolarHBondContact O-N 3.41Å
349	L	94.4	Very high	91.4	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-66.5	-41.8	179.5	-176.4	62.3	0	0	0	111	V336 L339 L340 G345 K346 S347 E351 Y352 C353 I447	V336-L349 HydrophobicContact CG2-CD1 4.2Å; L339-L349 HydrophobicContact CB-CB 4.24Å; L339-L349 HydrophobicContact CD1-CB 4.14Å; L339-L349 HydrophobicContact CD1-CD1 4.13Å; L340-L349 HydrophobicContact CD2-CD2 3.69Å; L340-L349 HydrophobicContact CG-CD2 4.05Å; G345-L349 WeakPolarHBondContact O-CB 3.25Å; G345-L349 PolarHBondContact O-N 3.02Å; K346-L349 PolarHBondContact O-N 2.96Å; S347-L349 VanDerWaalsContact C-N 3.35Å; S347-L349 PolarHBondContact O-N 3.49Å; L349-E351 VanDerWaalsContact C-N 3.35Å; L349-Y352 HydrophobicContact CD1-CD1 4.29Å; L349-Y352 WeakPolarHBondContact O-CB 3.47Å; L349-Y352 PolarHBondContact O-N 3.14Å; L349-C353 WeakPolarHBondContact O-CB 3.36Å; L349-C353 PolarHBondContact O-N 3.24Å; L349-C353 PolarHBondContact O-SG 3.15Å; L349-I447 HydrophobicContact CD2-CD1 3.74Å
350	L	93.6	Very high	91.2	Very high	9 Å²	9	32.7 Å²	32.7	5%	0.047	18%	0.177	C	C	.	.	H	α-helix	trans	-62.9	-41.3	174.6	-70.4	172.5	0	0	0	111.8	K346 S347 C353 S354 I447 E451 H455 L456	K346-L350 HydrophobicContact CG-CD1 4.42Å; K346-L350 WeakPolarHBondContact O-CG 3.18Å; K346-L350 PolarHBondContact O-N 3.34Å; S347-L350 PolarHBondContact O-N 3.45Å; L350-C353 PolarHBondContact O-N 3.1Å; L350-S354 PolarHBondContact O-N 2.81Å; L350-S354 PolarHBondContact O-OG 2.89Å; L350-I447 HydrophobicContact CD2-CG2 4.04Å; L350-E451 HydrophobicContact CD1-CB 4.08Å; L350-H455 HydrophobicContact CB-CB 4.38Å; L350-H455 HydrophobicContact CD2-CB 4.32Å; L350-L456 HydrophobicContact CD2-CD1 4.44Å
351	E	93.6	Very high	91.2	Very high	111 Å²	111	33 Å²	33	52%	0.519	18%	0.178	S	C	.	.	H	α-helix	trans	-66	-38.8	174.9	-169.2	174.2	155.7	0	0	112.1	M323 S347 V348 L349 S354 K355	M323-E351 HydrophobicContact CE-CG 4.4Å; M323-E351 WeakPolarHBondContact CE-OE1 3.48Å; M323-E351 WeakPolarHBondContact CE-OE2 3.31Å; S347-E351 PolarHBondContact O-N 3.3Å; V348-E351 PolarHBondContact O-N 3.17Å; L349-E351 VanDerWaalsContact C-N 3.35Å; E351-S354 PolarHBondContact O-N 3.09Å; E351-K355 PolarHBondContact O-N 3.49Å
352	Y	94.2	Very high	91.3	Very high	36 Å²	36	37.9 Å²	37.9	14%	0.141	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-45	173.3	179.4	-109.2	0	0	0	111.6	P326 H332 V335 V348 L349 K355 L356	P326-Y352 HydrophobicContact CB-CD2 3.68Å; P326-Y352 HydrophobicContact CB-CE2 3.96Å; P326-Y352 HydrophobicContact CB-CG 4.48Å; P326-Y352 HydrophobicContact CG-CD2 4.31Å; H332-Y352 AromaticContact CE1-CE1 3.64Å; H332-Y352 AromaticContact ND1-CE1 3.43Å; H332-Y352 WeakPolarHBondContact ND1-CE1 3.34Å; H332-Y352 AromaticContact ND1-CZ 3.61Å; H332-Y352 PolarHBondContact ND1-OH 3.13Å; V335-Y352 HydrophobicContact CG1-CD1 4.29Å; V335-Y352 HydrophobicContact CG1-CE1 4.1Å; V335-Y352 HydrophobicContact CG1-CE2 4.38Å; V335-Y352 HydrophobicContact CG1-CG 4.49Å; V348-Y352 VanDerWaalsContact O-CB 3.32Å; V348-Y352 WeakPolarHBondContact O-CB 3.28Å; V348-Y352 PolarHBondContact O-N 3.41Å; L349-Y352 HydrophobicContact CD1-CD1 4.29Å; L349-Y352 WeakPolarHBondContact O-CB 3.47Å; L349-Y352 PolarHBondContact O-N 3.14Å; Y352-K355 WeakPolarHBondContact O-CB 3.46Å; Y352-K355 PolarHBondContact O-N 3.23Å; Y352-L356 HydrophobicContact CD1-CD1 4.11Å; Y352-L356 HydrophobicContact CE1-CD1 3.7Å; Y352-L356 HydrophobicContact CE1-CG 4.27Å; Y352-L356 WeakPolarHBondContact O-CG 3.29Å; Y352-L356 PolarHBondContact O-N 3.22Å
353	C	94	Very high	91.2	Very high	4 Å²	4	39.8 Å²	39.8	3%	0.027	21%	0.21	C	C	.	.	H	α-helix	trans	-62.7	-43.5	173.8	-68.6	0	0	0	0	112.1	L349 L350 K355 L356 V357 L456	L349-C353 WeakPolarHBondContact O-CB 3.36Å; L349-C353 PolarHBondContact O-N 3.24Å; L349-C353 PolarHBondContact O-SG 3.15Å; L350-C353 PolarHBondContact O-N 3.1Å; C353-K355 VanDerWaalsContact C-N 3.26Å; C353-K355 PolarHBondContact O-N 3.26Å; C353-L356 WeakPolarHBondContact O-CB 3.32Å; C353-L356 PolarHBondContact O-N 2.79Å; C353-L356 VanDerWaalsContact O-N 3.13Å; C353-V357 WeakPolarHBondContact O-CG2 2.82Å; C353-V357 PolarHBondContact O-N 3.32Å; C353-L456 HydrophobicContact CB-CD1 3.82Å; C353-L456 HydrophobicContact CB-CD2 4.33Å; C353-L456 HydrophobicContact CB-CG 4.14Å
354	S	93.2	Very high	91.3	Very high	17 Å²	17	37.6 Å²	37.6	12%	0.119	19%	0.194	C	C	.	.	H	α-helix	trans	-58.3	-40.8	174.1	-66.5	0	0	0	0	111.2	L350 E351 V357 V358 H455	L350-S354 PolarHBondContact O-N 2.81Å; L350-S354 PolarHBondContact O-OG 2.89Å; E351-S354 PolarHBondContact O-N 3.09Å; S354-V357 WeakPolarHBondContact O-CB 3.35Å; S354-V357 PolarHBondContact O-N 3.2Å; S354-V358 WeakPolarHBondContact O-CG2 3.07Å; S354-V358 PolarHBondContact O-N 3.39Å; S354-H455 PolarHBondContact OG-O 3.39Å
355	K	92.2	Very high	91.2	Very high	125 Å²	125	37.4 Å²	37.4	54%	0.543	19%	0.191	S	C	.	.	H	α-helix	trans	-62.8	-44.2	173.9	-176.2	178.6	176	175.2	0	112.1	E351 Y352 C353 V357 V358 D359	E351-K355 PolarHBondContact O-N 3.49Å; Y352-K355 WeakPolarHBondContact O-CB 3.46Å; Y352-K355 PolarHBondContact O-N 3.23Å; C353-K355 VanDerWaalsContact C-N 3.26Å; C353-K355 PolarHBondContact O-N 3.26Å; K355-V357 PolarHBondContact O-N 2.74Å; K355-V358 PolarHBondContact O-N 3.33Å; K355-V358 VanDerWaalsContact O-N 3.13Å; K355-D359 VanDerWaalsContact O-CG 3.29Å; K355-D359 PolarHBondContact O-N 3.1Å
356	L	92.6	Very high	91	Very high	7 Å²	7	40.1 Å²	40.1	4%	0.037	21%	0.213	C	C	.	.	H	α-helix	trans	-59.1	-36	176	-69	176.8	0	0	0	112.3	Y352 C353 G360 F388	Y352-L356 HydrophobicContact CD1-CD1 4.11Å; Y352-L356 HydrophobicContact CE1-CD1 3.7Å; Y352-L356 HydrophobicContact CE1-CG 4.27Å; Y352-L356 WeakPolarHBondContact O-CG 3.29Å; Y352-L356 PolarHBondContact O-N 3.22Å; C353-L356 WeakPolarHBondContact O-CB 3.32Å; C353-L356 PolarHBondContact O-N 2.79Å; C353-L356 VanDerWaalsContact O-N 3.13Å; L356-G360 PolarHBondContact O-N 3.11Å; L356-F388 HydrophobicContact CB-CE1 4.31Å; L356-F388 HydrophobicContact CB-CE2 4.24Å; L356-F388 HydrophobicContact CB-CZ 3.69Å
357	V	92.1	Very high	90.5	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-65.2	-49	173.7	175.4	0	0	0	0	110.5	C353 S354 K355 D359 G360 I361 F388 L456 N460 F472	C353-V357 WeakPolarHBondContact O-CG2 2.82Å; C353-V357 PolarHBondContact O-N 3.32Å; S354-V357 WeakPolarHBondContact O-CB 3.35Å; S354-V357 PolarHBondContact O-N 3.2Å; K355-V357 PolarHBondContact O-N 2.74Å; V357-D359 PolarHBondContact O-N 3.4Å; V357-G360 PolarHBondContact O-N 2.65Å; V357-G360 VanDerWaalsContact O-N 3.15Å; V357-I361 HydrophobicContact CG1-CD1 3.89Å; V357-I361 HydrophobicContact CG1-CG1 4.38Å; V357-I361 WeakPolarHBondContact O-CG1 3.39Å; V357-I361 PolarHBondContact O-N 3.18Å; V357-F388 HydrophobicContact CB-CZ 4.46Å; V357-F388 HydrophobicContact CG2-CE1 4.06Å; V357-F388 HydrophobicContact CG2-CE2 4.44Å; V357-F388 HydrophobicContact CG2-CZ 3.51Å; V357-L456 HydrophobicContact CG2-CB 4.41Å; V357-L456 HydrophobicContact CG2-CG 4.33Å; V357-N460 WeakPolarHBondContact CG1-ND2 3.09Å; V357-F472 HydrophobicContact CG1-CE1 3.68Å; V357-F472 HydrophobicContact CG1-CZ 3.68Å
358	V	91.2	Very high	89.7	Confident	59 Å²	59	38.1 Å²	38.1	36%	0.358	20%	0.202	S	C	.	.	H	α-helix	trans	-59.5	-48.6	179.4	173.1	0	0	0	0	111.1	S354 K355 G360 I361 E362	S354-V358 WeakPolarHBondContact O-CG2 3.07Å; S354-V358 PolarHBondContact O-N 3.39Å; K355-V358 PolarHBondContact O-N 3.33Å; K355-V358 VanDerWaalsContact O-N 3.13Å; V358-G360 VanDerWaalsContact C-N 3.25Å; V358-G360 PolarHBondContact O-N 3.15Å; V358-I361 WeakPolarHBondContact O-CB 3.3Å; V358-I361 PolarHBondContact O-N 3.37Å; V358-I361 VanDerWaalsContact O-N 3.1Å; V358-E362 WeakPolarHBondContact O-CG 3.25Å; V358-E362 PolarHBondContact O-N 3.5Å
359	D	90.2	Very high	88.7	Confident	48 Å²	48	44.4 Å²	44.4	26%	0.257	24%	0.235	S	C	.	.	H	α-helix	trans	-57.8	-40.8	176	-66.6	-6.7	0	0	0	111.1	K355 V357 E362 E363 R384	K355-D359 VanDerWaalsContact O-CG 3.29Å; K355-D359 PolarHBondContact O-N 3.1Å; V357-D359 PolarHBondContact O-N 3.4Å; D359-E362 PolarHBondContact O-N 3.17Å; D359-E363 WeakPolarHBondContact O-CB 3.34Å; D359-E363 PolarHBondContact O-N 3.26Å; D359-R384 VanDerWaalsContact CB-NH1 3.34Å; D359-R384 IonicContact OD2-NH1 3.72Å; D359-R384 PolarHBondContact OD2-NH1 3.34Å
360	G	89.9	Confident	87.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-40.5	176	0	0	0	0	0	112.9	L356 V357 V358 E363 V364	L356-G360 PolarHBondContact O-N 3.11Å; V357-G360 PolarHBondContact O-N 2.65Å; V357-G360 VanDerWaalsContact O-N 3.15Å; V358-G360 VanDerWaalsContact C-N 3.25Å; V358-G360 PolarHBondContact O-N 3.15Å; G360-E363 PolarHBondContact O-N 3.02Å; G360-V364 WeakPolarHBondContact O-CB 3.32Å; G360-V364 VanDerWaalsContact O-CG2 3.28Å; G360-V364 WeakPolarHBondContact O-CG2 3.48Å; G360-V364 PolarHBondContact O-N 3.39Å
361	I	89.7	Confident	86.2	Confident	21 Å²	21	52.7 Å²	52.7	11%	0.108	28%	0.281	C	S	.	.	H	α-helix	trans	-63.6	-44.5	175.4	-68.6	168.4	0	0	0	110.6	V357 V358 V364 T365 N460 V468 L471 F472	V357-I361 HydrophobicContact CG1-CD1 3.89Å; V357-I361 HydrophobicContact CG1-CG1 4.38Å; V357-I361 WeakPolarHBondContact O-CG1 3.39Å; V357-I361 PolarHBondContact O-N 3.18Å; V358-I361 WeakPolarHBondContact O-CB 3.3Å; V358-I361 PolarHBondContact O-N 3.37Å; V358-I361 VanDerWaalsContact O-N 3.1Å; I361-V364 PolarHBondContact O-N 3.26Å; I361-T365 WeakPolarHBondContact O-CB 3.45Å; I361-T365 PolarHBondContact O-N 3.37Å; I361-T365 PolarHBondContact O-OG1 3.13Å; I361-N460 HydrophobicContact CD1-CB 4.23Å; I361-V468 HydrophobicContact CD1-CG1 4.34Å; I361-V468 HydrophobicContact CG1-CG1 3.92Å; I361-V468 HydrophobicContact CG2-CG2 3.98Å; I361-L471 HydrophobicContact CG1-CD2 4.47Å; I361-F472 HydrophobicContact CD1-CE2 4.21Å; I361-F472 HydrophobicContact CD1-CZ 3.99Å
362	E	88.7	Confident	84.9	Confident	123 Å²	123	54.5 Å²	54.5	58%	0.575	30%	0.299	S	S	*	.	H	α-helix	trans	-62	-45.4	177.3	-72.5	-177.1	178.9	0	0	111.2	V358 D359 T365 A366	V358-E362 WeakPolarHBondContact O-CG 3.25Å; V358-E362 PolarHBondContact O-N 3.5Å; D359-E362 PolarHBondContact O-N 3.17Å; E362-T365 PolarHBondContact O-N 2.89Å; E362-A366 VanDerWaalsContact O-CB 3.31Å; E362-A366 WeakPolarHBondContact O-CB 3.44Å; E362-A366 PolarHBondContact O-N 2.95Å
363	E	87.8	Confident	83.5	Confident	43 Å²	43	60.1 Å²	60.1	20%	0.201	33%	0.332	C	S	.	.	H	α-helix	trans	-61.9	-45.7	178.1	-172.7	178.3	162.8	0	0	111.9	D359 G360 A366 N367 G380 L381 R384	D359-E363 WeakPolarHBondContact O-CB 3.34Å; D359-E363 PolarHBondContact O-N 3.26Å; G360-E363 PolarHBondContact O-N 3.02Å; E363-A366 PolarHBondContact O-N 3.5Å; E363-N367 PolarHBondContact O-N 2.92Å; E363-N367 PolarHBondContact O-ND2 3.23Å; E363-G380 WeakPolarHBondContact OE1-CA 3.44Å; E363-L381 HydrophobicContact CB-CD2 4.43Å; E363-L381 HydrophobicContact CG-CD2 4.37Å; E363-L381 HydrophobicContact CG-CG 4.22Å; E363-L381 PolarHBondContact OE1-N 3.14Å; E363-R384 IonicContact OE2-NH2 3.59Å; E363-R384 PolarHBondContact OE2-NH2 2.79Å
364	V	87	Confident	81.9	Confident	12 Å²	12	63.6 Å²	63.6	7%	0.073	35%	0.345	C	S	.	.	H	α-helix	trans	-58.6	-51	173.8	169.3	0	0	0	0	110.4	G360 I361 A366 N367 V368 L381 E467 V468 L471	G360-V364 WeakPolarHBondContact O-CB 3.32Å; G360-V364 VanDerWaalsContact O-CG2 3.28Å; G360-V364 WeakPolarHBondContact O-CG2 3.48Å; G360-V364 PolarHBondContact O-N 3.39Å; I361-V364 PolarHBondContact O-N 3.26Å; V364-A366 VanDerWaalsContact C-N 3.31Å; V364-A366 PolarHBondContact O-N 2.98Å; V364-N367 PolarHBondContact O-N 3.43Å; V364-V368 WeakPolarHBondContact O-CG2 3.47Å; V364-V368 PolarHBondContact O-N 3.12Å; V364-L381 HydrophobicContact CG2-CD1 3.77Å; V364-L381 HydrophobicContact CG2-CD2 3.66Å; V364-L381 HydrophobicContact CG2-CG 4.39Å; V364-E467 HydrophobicContact CG1-CB 3.29Å; V364-V468 HydrophobicContact CG1-CG2 4.26Å; V364-L471 HydrophobicContact CG2-CB 4.26Å; V364-L471 HydrophobicContact CG2-CD2 4.07Å
365	T	85.6	Confident	80.3	Confident	41 Å²	41	72 Å²	72	25%	0.252	38%	0.379	S	S	.	.	H	α-helix	trans	-60.7	-40	-176.8	-65.5	0	0	0	0	112	I361 E362 N367 V368	I361-T365 WeakPolarHBondContact O-CB 3.45Å; I361-T365 PolarHBondContact O-N 3.37Å; I361-T365 PolarHBondContact O-OG1 3.13Å; E362-T365 PolarHBondContact O-N 2.89Å; T365-N367 PolarHBondContact O-N 3.2Å; T365-V368 PolarHBondContact O-N 2.96Å
366	A	84.4	Confident	78.8	Confident	57 Å²	57	72 Å²	72	47%	0.471	38%	0.38	S	S	.	.	H	α-helix	trans	-67	-24.5	177.7	0	0	0	0	0	113	E362 E363 V364 K370	E362-A366 VanDerWaalsContact O-CB 3.31Å; E362-A366 WeakPolarHBondContact O-CB 3.44Å; E362-A366 PolarHBondContact O-N 2.95Å; E363-A366 PolarHBondContact O-N 3.5Å; V364-A366 VanDerWaalsContact C-N 3.31Å; V364-A366 PolarHBondContact O-N 2.98Å; A366-K370 VanDerWaalsContact O-CE 3.28Å; A366-K370 WeakPolarHBondContact O-CE 3.25Å; A366-K370 WeakPolarHBondContact O-CG 3.07Å
367	N	79.6	Confident	77.4	Confident	24 Å²	24	76.5 Å²	76.5	13%	0.128	40%	0.404	C	S	.	.	H	α-helix	trans	-86.1	-18.7	-178.2	-75.2	-38.5	0	0	0	114.3	E363 V364 T365 K370 Y374 F376	E363-N367 PolarHBondContact O-N 2.92Å; E363-N367 PolarHBondContact O-ND2 3.23Å; V364-N367 PolarHBondContact O-N 3.43Å; T365-N367 PolarHBondContact O-N 3.2Å; N367-K370 PolarHBondContact OD1-NZ 3.12Å; N367-Y374 PolarHBondContact OD1-OH 3.46Å; N367-F376 HydrophobicContact CB-CD2 4.34Å; N367-F376 HydrophobicContact CB-CE2 4.25Å
368	V	76.2	Confident	76.1	Confident	58 Å²	58	77 Å²	77	35%	0.352	41%	0.41	S	S	.	.	H	α-helix	trans	-71	-38	-175.7	179.3	0	0	0	0	113.1	V364 T365 K370 E467	V364-V368 WeakPolarHBondContact O-CG2 3.47Å; V364-V368 PolarHBondContact O-N 3.12Å; T365-V368 PolarHBondContact O-N 2.96Å; V368-K370 VanDerWaalsContact C-N 3.35Å; V368-K370 PolarHBondContact O-N 2.98Å; V368-E467 HydrophobicContact CG2-CB 4.14Å; V368-E467 HydrophobicContact CG2-CG 3.63Å
369	N	71.8	Confident	75.3	Confident	135 Å²	135	83.1 Å²	83.1	72%	0.722	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	16.9	-172.2	-67.4	-21.2	0	0	0	113.8
370	K	71.1	Confident	75	Confident	83 Å²	83	81.8 Å²	81.8	36%	0.361	43%	0.425	S	S	.	.			trans	-82.7	143	-176.5	-70.4	-174.4	177.9	167	0	111.1	A366 N367 V368 Y374	A366-K370 VanDerWaalsContact O-CE 3.28Å; A366-K370 WeakPolarHBondContact O-CE 3.25Å; A366-K370 WeakPolarHBondContact O-CG 3.07Å; N367-K370 PolarHBondContact OD1-NZ 3.12Å; V368-K370 VanDerWaalsContact C-N 3.35Å; V368-K370 PolarHBondContact O-N 2.98Å; K370-Y374 HydrophobicContact CB-CD1 3.61Å; K370-Y374 HydrophobicContact CB-CD2 4.14Å; K370-Y374 HydrophobicContact CB-CE1 4.28Å; K370-Y374 HydrophobicContact CB-CG 3.52Å; K370-Y374 HydrophobicContact CD-CD1 3.57Å; K370-Y374 HydrophobicContact CD-CD2 3.44Å; K370-Y374 VanDerWaalsContact CD-CD2 3.44Å; K370-Y374 HydrophobicContact CD-CE1 3.41Å; K370-Y374 VanDerWaalsContact CD-CE1 3.41Å; K370-Y374 HydrophobicContact CD-CE2 3.3Å; K370-Y374 HydrophobicContact CD-CG 3.57Å; K370-Y374 HydrophobicContact CG-CD1 4.21Å; K370-Y374 HydrophobicContact CG-CD2 4.38Å; K370-Y374 HydrophobicContact CG-CE1 4.42Å; K370-Y374 HydrophobicContact CG-CG 4.18Å; K370-Y374 PolarHBondContact NZ-OH 3.17Å
371	P	66.3	Low	74.7	Confident	101 Å²	101	82.9 Å²	82.9	66%	0.656	43%	0.431	S	S	*	.			trans	-61.1	158	-176.2	23.7	-33	0	0	0	111.7	N373 Y374	P371-N373 PolarHBondContact O-N 3.36Å; P371-Y374 WeakPolarHBondContact O-CB 3.4Å; P371-Y374 PolarHBondContact O-N 3.36Å
372	V	64.7	Low	74.6	Confident	149 Å²	149	86.6 Å²	86.6	90%	0.903	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-25.6	-174.5	-176	0	0	0	0	114	Y374	V372-Y374 PolarHBondContact O-N 3Å
373	N	66.3	Low	74.6	Confident	154 Å²	154	86.2 Å²	86.2	82%	0.824	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-0.7	-179.9	-52.1	-5.6	0	0	0	113.1	P371 K375	P371-N373 PolarHBondContact O-N 3.36Å; N373-K375 PolarHBondContact O-N 2.94Å
374	Y	58.8	Low	74.7	Confident	78 Å²	78	86 Å²	86	31%	0.306	45%	0.447	S	S	.	.			trans	-75.3	117.2	-179.1	-179.8	-112.2	0	0	0	110.9	N367 K370 P371 V372 F376	N367-Y374 PolarHBondContact OD1-OH 3.46Å; K370-Y374 HydrophobicContact CB-CD1 3.61Å; K370-Y374 HydrophobicContact CB-CD2 4.14Å; K370-Y374 HydrophobicContact CB-CE1 4.28Å; K370-Y374 HydrophobicContact CB-CG 3.52Å; K370-Y374 HydrophobicContact CD-CD1 3.57Å; K370-Y374 HydrophobicContact CD-CD2 3.44Å; K370-Y374 VanDerWaalsContact CD-CD2 3.44Å; K370-Y374 HydrophobicContact CD-CE1 3.41Å; K370-Y374 VanDerWaalsContact CD-CE1 3.41Å; K370-Y374 HydrophobicContact CD-CE2 3.3Å; K370-Y374 HydrophobicContact CD-CG 3.57Å; K370-Y374 HydrophobicContact CG-CD1 4.21Å; K370-Y374 HydrophobicContact CG-CD2 4.38Å; K370-Y374 HydrophobicContact CG-CE1 4.42Å; K370-Y374 HydrophobicContact CG-CG 4.18Å; K370-Y374 PolarHBondContact NZ-OH 3.17Å; P371-Y374 WeakPolarHBondContact O-CB 3.4Å; P371-Y374 PolarHBondContact O-N 3.36Å; V372-Y374 PolarHBondContact O-N 3Å; Y374-F376 HydrophobicContact CE1-CB 4.42Å; Y374-F376 PolarHBondContact O-N 3.18Å
375	K	60.2	Low	74.9	Confident	192 Å²	192	87 Å²	87	84%	0.835	45%	0.451	S	S	*	.			trans	-76.2	115.6	163.5	-86	-175.6	172.9	-179	0	108.4	N373 D377	N373-K375 PolarHBondContact O-N 2.94Å; K375-D377 PolarHBondContact O-N 3.23Å
376	F	60.9	Low	75.2	Confident	127 Å²	127	90.5 Å²	90.5	56%	0.557	47%	0.468	S	S	*	.			trans	-57.7	110.7	171.3	178.5	-102.4	0	0	0	109.8	N367 Y374 G378 L381	N367-F376 HydrophobicContact CB-CD2 4.34Å; N367-F376 HydrophobicContact CB-CE2 4.25Å; Y374-F376 HydrophobicContact CE1-CB 4.42Å; Y374-F376 PolarHBondContact O-N 3.18Å; F376-G378 PolarHBondContact O-N 3.19Å; F376-L381 HydrophobicContact CE2-CD1 4.23Å; F376-L381 HydrophobicContact CZ-CD1 3.89Å
377	D	62.7	Low	75.7	Confident	100 Å²	100	89.2 Å²	89.2	54%	0.535	45%	0.453	S	S	.	.			trans	-85	86.9	171.5	-168.2	5.6	0	0	0	109	K375 Y379	K375-D377 PolarHBondContact O-N 3.23Å; D377-Y379 PolarHBondContact O-N 2.91Å; D377-Y379 WeakPolarHBondContact OD1-CB 3.43Å; D377-Y379 PolarHBondContact OD1-N 3.12Å
378	G	65.8	Low	76.4	Confident	13 Å²	13	88.1 Å²	88.1	13%	0.134	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-2.7	-178.8	0	0	0	0	0	114.4	F376 G380 N382	F376-G378 PolarHBondContact O-N 3.19Å; G378-G380 VanDerWaalsContact C-N 3.3Å; G378-G380 PolarHBondContact O-N 3.44Å; G378-N382 WeakPolarHBondContact O-CB 3.44Å; G378-N382 PolarHBondContact O-N 2.96Å; G378-N382 PolarHBondContact O-ND2 3.38Å
379	Y	74.6	Confident	77.3	Confident	186 Å²	186	86.2 Å²	86.2	73%	0.729	44%	0.437	S	S	*	.	H	α-helix	trans	-60.6	-39.6	-177.7	-104.8	-85.2	0	0	0	112.4	D377 Q383	D377-Y379 PolarHBondContact O-N 2.91Å; D377-Y379 WeakPolarHBondContact OD1-CB 3.43Å; D377-Y379 PolarHBondContact OD1-N 3.12Å; Y379-Q383 WeakPolarHBondContact O-CB 3.41Å; Y379-Q383 PolarHBondContact O-N 3.25Å
380	G	82.6	Confident	78.4	Confident	20 Å²	20	82 Å²	82	21%	0.206	41%	0.412	C	S	.	.	H	α-helix	trans	-66.9	-46.4	-178.3	0	0	0	0	0	113	E363 G378 Q383 R384	E363-G380 WeakPolarHBondContact OE1-CA 3.44Å; G378-G380 VanDerWaalsContact C-N 3.3Å; G378-G380 PolarHBondContact O-N 3.44Å; G380-Q383 PolarHBondContact O-N 2.91Å; G380-R384 PolarHBondContact O-N 2.94Å
381	L	83.5	Confident	79.5	Confident	24 Å²	24	78.1 Å²	78.1	13%	0.126	40%	0.395	C	S	.	.	H	α-helix	trans	-69.8	-36.9	178	-74.2	168.5	0	0	0	113.5	E363 V364 F376 R384 L385 L471	E363-L381 HydrophobicContact CB-CD2 4.43Å; E363-L381 HydrophobicContact CG-CD2 4.37Å; E363-L381 HydrophobicContact CG-CG 4.22Å; E363-L381 PolarHBondContact OE1-N 3.14Å; V364-L381 HydrophobicContact CG2-CD1 3.77Å; V364-L381 HydrophobicContact CG2-CD2 3.66Å; V364-L381 HydrophobicContact CG2-CG 4.39Å; F376-L381 HydrophobicContact CE2-CD1 4.23Å; F376-L381 HydrophobicContact CZ-CD1 3.89Å; L381-R384 WeakPolarHBondContact O-CB 3.4Å; L381-R384 PolarHBondContact O-N 2.63Å; L381-L385 PolarHBondContact O-N 3.41Å; L381-L471 HydrophobicContact CD2-CD1 4.29Å
382	N	87.2	Confident	80.9	Confident	99 Å²	99	73.3 Å²	73.3	53%	0.529	36%	0.364	S	S	.	.	H	α-helix	trans	-63.9	-45.5	172.6	-72.5	-24.9	0	0	0	110.8	G378 R384 L385 D386	G378-N382 WeakPolarHBondContact O-CB 3.44Å; G378-N382 PolarHBondContact O-N 2.96Å; G378-N382 PolarHBondContact O-ND2 3.38Å; N382-R384 PolarHBondContact O-N 3.03Å; N382-L385 PolarHBondContact O-N 2.84Å; N382-L385 VanDerWaalsContact O-N 3.1Å; N382-D386 PolarHBondContact O-N 3.22Å
383	Q	88.9	Confident	82.2	Confident	115 Å²	115	70.4 Å²	70.4	54%	0.537	34%	0.34	S	S	.	.	H	α-helix	trans	-59.2	-35.4	174	-174.9	179.2	21.4	0	0	111.7	Y379 G380 D386 Q387	Y379-Q383 WeakPolarHBondContact O-CB 3.41Å; Y379-Q383 PolarHBondContact O-N 3.25Å; G380-Q383 PolarHBondContact O-N 2.91Å; Q383-D386 PolarHBondContact O-N 3.49Å; Q383-Q387 VanDerWaalsContact O-CG 3.24Å; Q383-Q387 WeakPolarHBondContact O-CG 3.31Å; Q383-Q387 PolarHBondContact O-N 2.63Å
384	R	89.7	Confident	83.4	Confident	39 Å²	39	65.3 Å²	65.3	15%	0.147	31%	0.309	C	S	.	.	H	α-helix	trans	-65	-41.1	175.8	-159.5	70.6	58.5	157	9.9	112.1	D359 E363 G380 L381 N382 Q387 F388	D359-R384 VanDerWaalsContact CB-NH1 3.34Å; D359-R384 IonicContact OD2-NH1 3.72Å; D359-R384 PolarHBondContact OD2-NH1 3.34Å; E363-R384 IonicContact OE2-NH2 3.59Å; E363-R384 PolarHBondContact OE2-NH2 2.79Å; G380-R384 PolarHBondContact O-N 2.94Å; L381-R384 WeakPolarHBondContact O-CB 3.4Å; L381-R384 PolarHBondContact O-N 2.63Å; N382-R384 PolarHBondContact O-N 3.03Å; R384-Q387 WeakPolarHBondContact O-CB 3.32Å; R384-Q387 PolarHBondContact O-N 3.18Å; R384-F388 HydrophobicContact CG-CD2 4.33Å; R384-F388 HydrophobicContact CG-CE2 4.01Å; R384-F388 VanDerWaalsContact O-CD2 3.23Å; R384-F388 WeakPolarHBondContact O-CD2 3.31Å; R384-F388 PolarHBondContact O-N 3.4Å
385	L	91.3	Very high	84.9	Confident	32 Å²	32	61.8 Å²	61.8	17%	0.168	30%	0.295	C	S	.	.	H	α-helix	trans	-65.3	-41.2	174.5	-74	169.8	0	0	0	111.2	L381 N382 Q387 F388 A389 I475 E478	L381-L385 PolarHBondContact O-N 3.41Å; N382-L385 PolarHBondContact O-N 2.84Å; N382-L385 VanDerWaalsContact O-N 3.1Å; L385-Q387 VanDerWaalsContact C-N 3.28Å; L385-Q387 PolarHBondContact O-N 2.91Å; L385-F388 PolarHBondContact O-N 3.37Å; L385-A389 WeakPolarHBondContact O-CB 3.4Å; L385-A389 PolarHBondContact O-N 3.41Å; L385-I475 HydrophobicContact CD2-CG1 3.85Å; L385-E478 HydrophobicContact CD2-CG 4.42Å
386	D	93.2	Very high	86.4	Confident	114 Å²	114	52.7 Å²	52.7	61%	0.61	26%	0.255	S	S	*	.	H	α-helix	trans	-61.1	-38	174.8	-66	-28.3	0	0	0	111.9	N382 Q383 A389 F390	N382-D386 PolarHBondContact O-N 3.22Å; Q383-D386 PolarHBondContact O-N 3.49Å; D386-A389 PolarHBondContact O-N 3.08Å; D386-F390 WeakPolarHBondContact O-CB 3.5Å; D386-F390 PolarHBondContact O-N 3.23Å
387	Q	94.2	Very high	87.6	Confident	31 Å²	31	49.8 Å²	49.8	15%	0.145	24%	0.244	C	C	.	.	H	α-helix	trans	-62.3	-49.1	173.8	-74.1	171.9	-6.5	0	0	111.6	H332 Q383 R384 L385 A389 F390 V391	H332-Q387 HydrophobicContact CB-CG 4.32Å; H332-Q387 WeakPolarHBondContact NE2-CA 3.45Å; H332-Q387 PolarHBondContact NE2-O 3.49Å; H332-Q387 VanDerWaalsContact NE2-O 3.12Å; Q383-Q387 VanDerWaalsContact O-CG 3.24Å; Q383-Q387 WeakPolarHBondContact O-CG 3.31Å; Q383-Q387 PolarHBondContact O-N 2.63Å; R384-Q387 WeakPolarHBondContact O-CB 3.32Å; R384-Q387 PolarHBondContact O-N 3.18Å; L385-Q387 VanDerWaalsContact C-N 3.28Å; L385-Q387 PolarHBondContact O-N 2.91Å; Q387-A389 VanDerWaalsContact C-N 3.32Å; Q387-A389 PolarHBondContact O-N 3.23Å; Q387-F390 PolarHBondContact O-N 3.34Å; Q387-V391 WeakPolarHBondContact O-CG2 3.2Å; Q387-V391 PolarHBondContact O-N 2.97Å
388	F	94.8	Very high	88.4	Confident	1 Å²	1	45.6 Å²	45.6	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-61.7	-41.8	175.5	-80.2	-64.9	0	0	0	112.2	L356 V357 R384 L385 F390 V391 F392 L456 I475	L356-F388 HydrophobicContact CB-CE1 4.31Å; L356-F388 HydrophobicContact CB-CE2 4.24Å; L356-F388 HydrophobicContact CB-CZ 3.69Å; V357-F388 HydrophobicContact CB-CZ 4.46Å; V357-F388 HydrophobicContact CG2-CE1 4.06Å; V357-F388 HydrophobicContact CG2-CE2 4.44Å; V357-F388 HydrophobicContact CG2-CZ 3.51Å; R384-F388 HydrophobicContact CG-CD2 4.33Å; R384-F388 HydrophobicContact CG-CE2 4.01Å; R384-F388 VanDerWaalsContact O-CD2 3.23Å; R384-F388 WeakPolarHBondContact O-CD2 3.31Å; R384-F388 PolarHBondContact O-N 3.4Å; L385-F388 PolarHBondContact O-N 3.37Å; F388-F390 VanDerWaalsContact C-N 3.29Å; F388-F390 PolarHBondContact O-N 3.44Å; F388-V391 PolarHBondContact O-N 2.91Å; F388-F392 HydrophobicContact CB-CD2 4.42Å; F388-F392 HydrophobicContact CB-CE2 3.9Å; F388-F392 HydrophobicContact CB-CZ 4.28Å; F388-F392 HydrophobicContact CD1-CE1 4.46Å; F388-F392 HydrophobicContact CD1-CE2 4.36Å; F388-F392 AromaticContact CD1-CZ 3.89Å; F388-F392 HydrophobicContact CD1-CZ 3.89Å; F388-F392 HydrophobicContact CG-CE2 4.49Å; F388-F392 HydrophobicContact CG-CZ 4.45Å; F388-F392 WeakPolarHBondContact O-CD2 3.13Å; F388-F392 VanDerWaalsContact O-CG 3.25Å; F388-F392 WeakPolarHBondContact O-CG 3.5Å; F388-F392 PolarHBondContact O-N 3.41Å; F388-L456 HydrophobicContact CD1-CD2 4.26Å; F388-L456 HydrophobicContact CE1-CD2 3.89Å; F388-I475 HydrophobicContact CD1-CG2 4.37Å; F388-I475 HydrophobicContact CD2-CD1 3.91Å; F388-I475 HydrophobicContact CD2-CG1 3.94Å; F388-I475 HydrophobicContact CD2-CG2 4.39Å; F388-I475 HydrophobicContact CE2-CD1 3.66Å; F388-I475 HydrophobicContact CE2-CG1 4.22Å; F388-I475 HydrophobicContact CG-CG2 4.19Å; F388-I475 HydrophobicContact CZ-CD1 4.25Å
389	A	94.8	Very high	88.7	Confident	17 Å²	17	45.3 Å²	45.3	14%	0.14	22%	0.218	C	C	.	.	H	α-helix	trans	-59.4	-42.9	176.6	0	0	0	0	0	111.3	L385 D386 Q387 K393 I482	L385-A389 WeakPolarHBondContact O-CB 3.4Å; L385-A389 PolarHBondContact O-N 3.41Å; D386-A389 PolarHBondContact O-N 3.08Å; Q387-A389 VanDerWaalsContact C-N 3.32Å; Q387-A389 PolarHBondContact O-N 3.23Å; A389-K393 VanDerWaalsContact O-CB 3.24Å; A389-K393 WeakPolarHBondContact O-CB 3.39Å; A389-K393 PolarHBondContact O-N 3.49Å; A389-I482 VanDerWaalsContact CA-CD1 3.46Å; A389-I482 HydrophobicContact CB-CD1 3.84Å; A389-I482 WeakPolarHBondContact O-CD1 3.24Å
390	F	95.1	Very high	88.2	Confident	48 Å²	48	39.3 Å²	39.3	21%	0.211	19%	0.194	C	C	.	.	H	α-helix	trans	-62.5	-47.3	175.3	-174.1	-96	0	0	0	112.1	N333 V336 D386 Q387 F388 F392 K393 R394	N333-F390 VanDerWaalsContact CA-CE1 3.44Å; N333-F390 HydrophobicContact CB-CD1 4.25Å; N333-F390 HydrophobicContact CB-CE1 3.65Å; N333-F390 HydrophobicContact CB-CE2 4.19Å; N333-F390 HydrophobicContact CB-CZ 3.61Å; V336-F390 HydrophobicContact CB-CD1 4.15Å; V336-F390 HydrophobicContact CB-CE1 3.91Å; V336-F390 HydrophobicContact CG1-CD1 4.2Å; V336-F390 HydrophobicContact CG1-CE1 4.03Å; V336-F390 HydrophobicContact CG2-CD1 4.27Å; V336-F390 HydrophobicContact CG2-CE1 4.48Å; D386-F390 WeakPolarHBondContact O-CB 3.5Å; D386-F390 PolarHBondContact O-N 3.23Å; Q387-F390 PolarHBondContact O-N 3.34Å; F388-F390 VanDerWaalsContact C-N 3.29Å; F388-F390 PolarHBondContact O-N 3.44Å; F390-F392 PolarHBondContact O-N 2.96Å; F390-K393 PolarHBondContact O-N 3.42Å; F390-R394 HydrophobicContact CD1-CG 4.17Å; F390-R394 HydrophobicContact CE1-CG 3.68Å; F390-R394 HydrophobicContact CE2-CG 4.11Å; F390-R394 HydrophobicContact CZ-CG 3.65Å; F390-R394 WeakPolarHBondContact O-CG 3.34Å; F390-R394 PolarHBondContact O-N 3.31Å
391	V	94.6	Very high	86.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-56	-54	177.2	171.3	0	0	0	0	111	V336 Q387 F388 K393 R394 I395	V336-V391 HydrophobicContact CG1-CG2 4.42Å; V336-V391 HydrophobicContact CG2-CG2 3.58Å; Q387-V391 WeakPolarHBondContact O-CG2 3.2Å; Q387-V391 PolarHBondContact O-N 2.97Å; F388-V391 PolarHBondContact O-N 2.91Å; V391-K393 VanDerWaalsContact C-N 3.32Å; V391-K393 PolarHBondContact O-N 3.43Å; V391-R394 PolarHBondContact O-N 2.74Å; V391-I395 HydrophobicContact CG1-CD1 3.67Å; V391-I395 HydrophobicContact CG1-CG1 4.36Å; V391-I395 VanDerWaalsContact O-CG1 3.31Å; V391-I395 WeakPolarHBondContact O-CG1 3.45Å; V391-I395 PolarHBondContact O-N 3.05Å
392	F	94.3	Very high	85.2	Confident	1 Å²	1	42 Å²	42	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-62.7	-42.2	-176.6	-60.3	-33.5	0	0	0	111.4	F388 F390 R394 I395 C396 I452 L456 I475 Y479 I482 F483	F388-F392 HydrophobicContact CB-CD2 4.42Å; F388-F392 HydrophobicContact CB-CE2 3.9Å; F388-F392 HydrophobicContact CB-CZ 4.28Å; F388-F392 HydrophobicContact CD1-CE1 4.46Å; F388-F392 HydrophobicContact CD1-CE2 4.36Å; F388-F392 AromaticContact CD1-CZ 3.89Å; F388-F392 HydrophobicContact CD1-CZ 3.89Å; F388-F392 HydrophobicContact CG-CE2 4.49Å; F388-F392 HydrophobicContact CG-CZ 4.45Å; F388-F392 WeakPolarHBondContact O-CD2 3.13Å; F388-F392 VanDerWaalsContact O-CG 3.25Å; F388-F392 WeakPolarHBondContact O-CG 3.5Å; F388-F392 PolarHBondContact O-N 3.41Å; F390-F392 PolarHBondContact O-N 2.96Å; F392-R394 PolarHBondContact O-N 3.3Å; F392-I395 PolarHBondContact O-N 2.69Å; F392-C396 PolarHBondContact O-N 3.16Å; F392-C396 PolarHBondContact O-SG 3.38Å; F392-I452 HydrophobicContact CE1-CG2 4.28Å; F392-L456 HydrophobicContact CE1-CD2 3.87Å; F392-L456 HydrophobicContact CZ-CD2 3.86Å; F392-I475 HydrophobicContact CE2-CG2 4.02Å; F392-I475 HydrophobicContact CZ-CG2 4.04Å; F392-Y479 AromaticContact CD1-CD2 3.87Å; F392-Y479 HydrophobicContact CD1-CD2 3.87Å; F392-Y479 HydrophobicContact CD1-CE2 4.43Å; F392-Y479 HydrophobicContact CD2-CD2 4.08Å; F392-Y479 AromaticContact CE1-CD2 3.9Å; F392-Y479 HydrophobicContact CE1-CD2 3.9Å; F392-Y479 HydrophobicContact CE2-CD2 4.1Å; F392-Y479 HydrophobicContact CE2-CG 4.48Å; F392-Y479 AromaticContact CG-CD2 3.98Å; F392-Y479 HydrophobicContact CG-CD2 3.98Å; F392-Y479 HydrophobicContact CZ-CD2 4.02Å; F392-I482 HydrophobicContact CB-CB 4.44Å; F392-I482 HydrophobicContact CB-CD1 3.91Å; F392-I482 HydrophobicContact CB-CG2 4.08Å; F392-I482 HydrophobicContact CD2-CD1 4.35Å; F392-F483 HydrophobicContact CB-CE2 4.49Å
393	K	93.7	Very high	83.2	Confident	88 Å²	88	40.7 Å²	40.7	38%	0.383	21%	0.213	S	C	.	.	H	α-helix	trans	-57.9	-48	176.3	-177.4	176	-179.5	175.7	0	111.4	A389 F390 V391 I395 C396 E397 I482	A389-K393 VanDerWaalsContact O-CB 3.24Å; A389-K393 WeakPolarHBondContact O-CB 3.39Å; A389-K393 PolarHBondContact O-N 3.49Å; F390-K393 PolarHBondContact O-N 3.42Å; V391-K393 VanDerWaalsContact C-N 3.32Å; V391-K393 PolarHBondContact O-N 3.43Å; K393-I395 PolarHBondContact O-N 2.89Å; K393-C396 WeakPolarHBondContact O-CB 3.39Å; K393-C396 PolarHBondContact O-N 3.03Å; K393-E397 WeakPolarHBondContact CE-OE1 3.27Å; K393-E397 WeakPolarHBondContact O-CG 3.48Å; K393-E397 PolarHBondContact O-N 3.34Å; K393-I482 HydrophobicContact CB-CG2 4.26Å
394	R	90.9	Very high	80.8	Confident	47 Å²	47	39.7 Å²	39.7	18%	0.177	21%	0.211	C	C	.	.	H	α-helix	trans	-67.8	-35.2	179.7	-67.7	-62.7	-67.8	139.6	0.2	112.8	V336 D337 L340 F390 V391 F392 E397 V398	V336-R394 HydrophobicContact CG1-CB 4.02Å; V336-R394 HydrophobicContact CG1-CG 4.35Å; D337-R394 IonicContact OD1-CZ 3.56Å; D337-R394 VanDerWaalsContact OD1-CZ 3.22Å; D337-R394 IonicContact OD1-NE 3.61Å; D337-R394 PolarHBondContact OD1-NE 3.28Å; D337-R394 IonicContact OD1-NH2 2.8Å; D337-R394 PolarHBondContact OD1-NH2 3.35Å; L340-R394 HydrophobicContact CD1-CB 3.54Å; F390-R394 HydrophobicContact CD1-CG 4.17Å; F390-R394 HydrophobicContact CE1-CG 3.68Å; F390-R394 HydrophobicContact CE2-CG 4.11Å; F390-R394 HydrophobicContact CZ-CG 3.65Å; F390-R394 WeakPolarHBondContact O-CG 3.34Å; F390-R394 PolarHBondContact O-N 3.31Å; V391-R394 PolarHBondContact O-N 2.74Å; F392-R394 PolarHBondContact O-N 3.3Å; R394-E397 VanDerWaalsContact CD-OE2 3.29Å; R394-E397 WeakPolarHBondContact CD-OE2 3.4Å; R394-E397 IonicContact CZ-OE2 3.49Å; R394-E397 IonicContact NE-OE2 3.77Å; R394-E397 IonicContact NH1-OE2 2.85Å; R394-E397 PolarHBondContact NH1-OE2 3.41Å; R394-E397 PolarHBondContact O-N 2.97Å; R394-V398 WeakPolarHBondContact O-CB 3.22Å; R394-V398 WeakPolarHBondContact O-CG2 3.44Å; R394-V398 PolarHBondContact O-N 2.84Å
395	I	90.8	Very high	78.4	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-45.4	172.2	-69	171	0	0	0	110.6	L340 V391 F392 K393 S399 I447 I452	L340-I395 HydrophobicContact CD2-CG1 4.21Å; V391-I395 HydrophobicContact CG1-CD1 3.67Å; V391-I395 HydrophobicContact CG1-CG1 4.36Å; V391-I395 VanDerWaalsContact O-CG1 3.31Å; V391-I395 WeakPolarHBondContact O-CG1 3.45Å; V391-I395 PolarHBondContact O-N 3.05Å; F392-I395 PolarHBondContact O-N 2.69Å; K393-I395 PolarHBondContact O-N 2.89Å; I395-S399 WeakPolarHBondContact O-CB 3.33Å; I395-S399 PolarHBondContact O-N 2.96Å; I395-S399 PolarHBondContact O-OG 3.32Å; I395-I447 HydrophobicContact CD1-CD1 4.11Å; I395-I447 HydrophobicContact CG1-CD1 4.19Å; I395-I447 HydrophobicContact CG2-CB 4.28Å; I395-I452 HydrophobicContact CD1-CD1 4.24Å; I395-I452 HydrophobicContact CG2-CD1 4.43Å
396	C	90	Very high	75.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.9	-49	177.1	-65.8	0	0	0	0	111.8	F392 K393 V398 Y400 C401 F483 H486 I488	F392-C396 PolarHBondContact O-N 3.16Å; F392-C396 PolarHBondContact O-SG 3.38Å; K393-C396 WeakPolarHBondContact O-CB 3.39Å; K393-C396 PolarHBondContact O-N 3.03Å; C396-V398 PolarHBondContact O-N 3.17Å; C396-Y400 WeakPolarHBondContact O-CB 3.27Å; C396-Y400 PolarHBondContact O-N 2.81Å; C396-C401 PolarHBondContact O-N 3.32Å; C396-F483 VanDerWaalsContact SG-CD2 3.59Å; C396-F483 WeakPolarHBondContact SG-CE2 3.3Å; C396-H486 HydrophobicContact CB-CB 4.11Å; C396-I488 HydrophobicContact CB-CD1 3.79Å
397	E	86.9	Confident	72.9	Confident	66 Å²	66	42 Å²	42	31%	0.308	24%	0.238	S	C	.	.	H	α-helix	trans	-61.2	-44.4	-179.8	-72.2	174.4	177.9	0	0	112.5	K393 R394 C401	K393-E397 WeakPolarHBondContact CE-OE1 3.27Å; K393-E397 WeakPolarHBondContact O-CG 3.48Å; K393-E397 PolarHBondContact O-N 3.34Å; R394-E397 VanDerWaalsContact CD-OE2 3.29Å; R394-E397 WeakPolarHBondContact CD-OE2 3.4Å; R394-E397 IonicContact CZ-OE2 3.49Å; R394-E397 IonicContact NE-OE2 3.77Å; R394-E397 IonicContact NH1-OE2 2.85Å; R394-E397 PolarHBondContact NH1-OE2 3.41Å; R394-E397 PolarHBondContact O-N 2.97Å; E397-C401 WeakPolarHBondContact O-CB 3.41Å
398	V	79.4	Confident	70.2	Confident	13 Å²	13	47.9 Å²	47.9	8%	0.079	26%	0.263	C	S	.	.	H	α-helix	trans	-78	-44.9	-177	174.5	0	0	0	0	111.8	L340 R394 C396 F444	L340-V398 HydrophobicContact CB-CG2 4.46Å; L340-V398 HydrophobicContact CD1-CG2 4.09Å; R394-V398 WeakPolarHBondContact O-CB 3.22Å; R394-V398 WeakPolarHBondContact O-CG2 3.44Å; R394-V398 PolarHBondContact O-N 2.84Å; C396-V398 PolarHBondContact O-N 3.17Å; V398-F444 HydrophobicContact CG1-CB 4.03Å; V398-F444 HydrophobicContact CG1-CD1 3.37Å; V398-F444 HydrophobicContact CG1-CD2 4.41Å; V398-F444 HydrophobicContact CG1-CE1 3.74Å; V398-F444 HydrophobicContact CG1-CG 3.71Å; V398-F444 HydrophobicContact CG1-CZ 4.36Å
399	S	71.6	Confident	67.4	Low	7 Å²	7	54.5 Å²	54.5	5%	0.049	30%	0.298	C	S	.	.	H	α-helix	trans	-82.4	-28.8	-170.5	-52.3	0	0	0	0	113.2	I395	I395-S399 WeakPolarHBondContact O-CB 3.33Å; I395-S399 PolarHBondContact O-N 2.96Å; I395-S399 PolarHBondContact O-OG 3.32Å
400	Y	65.4	Low	64.6	Low	59 Å²	59	60.8 Å²	60.8	23%	0.231	33%	0.328	C	S	.	.	H	α-helix	trans	-124.6	-18.8	-166.1	-63.7	-81.9	0	0	0	115	C396 T403 I488	C396-Y400 WeakPolarHBondContact O-CB 3.27Å; C396-Y400 PolarHBondContact O-N 2.81Å; Y400-T403 PolarHBondContact O-OG1 3.41Å; Y400-I488 HydrophobicContact CD2-CD1 3.7Å; Y400-I488 HydrophobicContact CG-CD1 3.71Å; Y400-I488 HydrophobicContact CG-CG1 4.35Å
401	C	53.5	Low	61.8	Low	65 Å²	65	61.8 Å²	61.8	44%	0.439	35%	0.345	S	S	.	.	H	α-helix	trans	-77.7	-25.7	170	-67.7	0	0	0	0	112.9	C396 E397 T403 N404	C396-C401 PolarHBondContact O-N 3.32Å; E397-C401 WeakPolarHBondContact O-CB 3.41Å; C401-T403 VanDerWaalsContact C-N 3.31Å; C401-T403 PolarHBondContact O-N 3.36Å; C401-N404 PolarHBondContact O-N 3.36Å
402	G	49.3	Very low	59.2	Low	37 Å²	37	69.3 Å²	69.3	38%	0.381	39%	0.385	S	S	.	.	H	α-helix	trans	-63.4	-34.5	176.2	0	0	0	0	0	113.7	T406	G402-T406 PolarHBondContact O-OG1 2.96Å; G402-T406 VanDerWaalsContact O-OG1 3.13Å
403	T	44.3	Very low	56.4	Low	70 Å²	70	74 Å²	74	43%	0.429	42%	0.418	S	S	.	.	H	α-helix	trans	-71.5	-28.5	178.5	32.6	0	0	0	0	113.6	Y400 C401 V405 T406 S407	Y400-T403 PolarHBondContact O-OG1 3.41Å; C401-T403 VanDerWaalsContact C-N 3.31Å; C401-T403 PolarHBondContact O-N 3.36Å; T403-V405 VanDerWaalsContact C-N 3.33Å; T403-V405 PolarHBondContact O-N 3.25Å; T403-T406 PolarHBondContact O-N 3.22Å; T403-T406 PolarHBondContact O-OG1 3.37Å; T403-S407 PolarHBondContact O-N 2.72Å
404	N	38.4	Very low	53.5	Low	94 Å²	94	76.2 Å²	76.2	50%	0.503	43%	0.434	S	S	.	.	H	α-helix	trans	-75.9	-21.3	-178.1	-73.8	-14.5	0	0	0	113.3	C401 K408	C401-N404 PolarHBondContact O-N 3.36Å; N404-K408 PolarHBondContact O-N 3.06Å
405	V	39	Very low	50.8	Low	79 Å²	79	86 Å²	86	48%	0.479	47%	0.471	S	S	.	.	H	α-helix	trans	-78.5	-34.7	173.3	-177.5	0	0	0	0	110.8	T403 L409	T403-V405 VanDerWaalsContact C-N 3.33Å; T403-V405 PolarHBondContact O-N 3.25Å; V405-L409 PolarHBondContact O-N 3.29Å
406	T	35.2	Very low	48	Very low	88 Å²	88	95.5 Å²	95.5	54%	0.54	51%	0.513	S	S	.	.	H	α-helix	trans	-74.8	-34.2	176.5	10.5	0	0	0	0	112.6	G402 T403	G402-T406 PolarHBondContact O-OG1 2.96Å; G402-T406 VanDerWaalsContact O-OG1 3.13Å; T403-T406 PolarHBondContact O-N 3.22Å; T403-T406 PolarHBondContact O-OG1 3.37Å
407	S	34.8	Very low	45.3	Very low	67 Å²	67	100.1 Å²	100.1	47%	0.469	55%	0.551	S	S	.	*	H	α-helix	trans	-73.4	-32.3	177.6	78.2	0	0	0	0	113.3	T403 L410 A411	T403-S407 PolarHBondContact O-N 2.72Å; S407-L410 PolarHBondContact O-N 3.06Å; S407-A411 PolarHBondContact O-N 3.39Å
408	K	36.4	Very low	42.7	Very low	154 Å²	154	103.4 Å²	103.4	67%	0.67	58%	0.578	S	S	*	*	H	α-helix	trans	-70.2	-33.2	176.4	-82.1	-176.9	177	177.9	0	113.4	N404 L410 A411	N404-K408 PolarHBondContact O-N 3.06Å; K408-L410 VanDerWaalsContact C-N 3.28Å; K408-L410 PolarHBondContact O-N 2.89Å; K408-A411 PolarHBondContact O-N 3.48Å
409	L	37.5	Very low	40.5	Very low	141 Å²	141	108.9 Å²	108.9	74%	0.738	62%	0.617	S	S	*	*	H	α-helix	trans	-72.8	-19.8	177.7	-73.7	167.1	0	0	0	113.6	V405	V405-L409 PolarHBondContact O-N 3.29Å
410	L	36	Very low	38.5	Very low	148 Å²	148	113.1 Å²	113.1	78%	0.775	65%	0.652	S	S	*	*	H	α-helix	trans	-95.5	-15.6	177.3	-70.4	167	0	0	0	113.5	S407 K408	S407-L410 PolarHBondContact O-N 3.06Å; K408-L410 VanDerWaalsContact C-N 3.28Å; K408-L410 PolarHBondContact O-N 2.89Å
411	A	36.3	Very low	36.7	Very low	70 Å²	70	116.1 Å²	116.1	58%	0.579	68%	0.682	S	S	*	*	H	α-helix	trans	-91.1	-13	-178.5	0	0	0	0	0	114.5	S407 K408 S413	S407-A411 PolarHBondContact O-N 3.39Å; K408-A411 PolarHBondContact O-N 3.48Å; A411-S413 PolarHBondContact O-N 2.83Å
412	D	39.4	Very low	35.7	Very low	157 Å²	157	117.4 Å²	117.4	84%	0.84	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	8.2	-175.8	-92.1	-13	0	0	0	115.1
413	S	36.1	Very low	34.6	Very low	100 Å²	100	122 Å²	122	70%	0.699	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-8.3	178.5	-170.5	0	0	0	0	115.4	A411	A411-S413 PolarHBondContact O-N 2.83Å
414	D	31.6	Very low	33.8	Very low	134 Å²	134	123.8 Å²	123.8	72%	0.717	74%	0.736	S	S	*	*	S	Bend	trans	-150	98.2	-178.9	-90.6	-39.7	0	0	0	111.9
415	R	35.9	Very low	33.3	Very low	252 Å²	252	125.1 Å²	125.1	95%	0.951	75%	0.751	S	S	*	*				173.5	123.4	127.8	-89.8	155.6	-158.3	-150.1	6.8	112.5
416	K	30.7	Very low	32.6	Very low	205 Å²	205	130.3 Å²	130.3	89%	0.891	77%	0.77	S	S	*	*			trans	-73.3	147.1	163.3	-78.9	175	174	173.2	0	111.1
417	A	33.7	Very low	32.3	Very low	97 Å²	97	131.5 Å²	131.5	80%	0.802	78%	0.78	S	S	*	*			trans	79	124.3	157.2	0	0	0	0	0	118.6
418	P	33.2	Very low	31.8	Very low	135 Å²	135	133.4 Å²	133.4	88%	0.877	79%	0.794	S	S	*	*			trans	-94.4	142.1	177.2	36.1	-29.4	0	0	0	111.8
419	S	32.8	Very low	31.3	Very low	128 Å²	128	132.4 Å²	132.4	90%	0.895	80%	0.8	S	S	*	*			trans	-127.9	151.5	158.6	63.1	0	0	0	0	110.2
420	A	29.5	Very low	30.8	Very low	95 Å²	95	131.6 Å²	131.6	79%	0.785	80%	0.801	S	S	*	*			trans	-86.1	168.6	-152.6	0	0	0	0	0	115.5
421	S	27.5	Very low	30.2	Very low	123 Å²	123	133.8 Å²	133.8	86%	0.86	80%	0.804	S	S	*	*			trans	92.3	93.5	157.4	72.2	0	0	0	0	119.3
422	A	31.4	Very low	29.7	Very low	92 Å²	92	135.5 Å²	135.5	76%	0.76	81%	0.808	S	S	*	*			trans	-167.3	145.9	135.3	0	0	0	0	0	109.5	S424	A422-S424 PolarHBondContact O-N 3.48Å
423	P	26.8	Very low	29.1	Very low	132 Å²	132	135.4 Å²	135.4	86%	0.857	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-79.1	120.7	-169.1	31.8	-31	0	0	0	110.7
424	S	28.5	Very low	28.7	Very low	109 Å²	109	135.9 Å²	135.9	76%	0.762	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-87.1	121.3	171.2	48.4	0	0	0	0	110.1	A422	A422-S424 PolarHBondContact O-N 3.48Å
425	C	27.6	Very low	28.4	Very low	122 Å²	122	139.3 Å²	139.3	82%	0.824	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-65.2	126.8	173.7	-174.3	0	0	0	0	109.8	C427	C425-C427 PolarHBondContact O-N 2.95Å
426	H	23.1	Very low	27.9	Very low	188 Å²	188	130.2 Å²	130.2	87%	0.87	80%	0.802	S	S	*	*			trans	-70.7	104.2	170.1	-69.9	-56.5	0	0	0	109.6
427	C	28.7	Very low	27.8	Very low	113 Å²	113	124.9 Å²	124.9	76%	0.764	78%	0.783	S	S	*	*			trans	-116.2	114.5	159.2	-164.1	0	0	0	0	109.9	C425 T429	C425-C427 PolarHBondContact O-N 2.95Å; C427-T429 PolarHBondContact O-N 2.91Å
428	S	24.4	Very low	27.7	Very low	107 Å²	107	127.3 Å²	127.3	75%	0.748	78%	0.777	S	S	*	*			trans	-54.6	115.7	178	-6.6	0	0	0	0	111.4	V430	S428-V430 PolarHBondContact O-N 2.87Å
429	T	27.3	Very low	27.4	Very low	133 Å²	133	125.2 Å²	125.2	82%	0.816	77%	0.772	S	S	*	*			trans	-63.4	104	171.3	-34.9	0	0	0	0	109.4	C427 K431	C427-T429 PolarHBondContact O-N 2.91Å; T429-K431 PolarHBondContact O-N 3.31Å; T429-K431 VanDerWaalsContact O-N 3.08Å
430	V	25.8	Very low	27.2	Very low	123 Å²	123	121 Å²	121	75%	0.745	75%	0.748	S	S	*	*			trans	-67.2	106.3	163.9	176.1	0	0	0	0	106.7	S428 T432	S428-V430 PolarHBondContact O-N 2.87Å; V430-T432 VanDerWaalsContact C-N 3.25Å; V430-T432 PolarHBondContact O-N 3.02Å
431	K	23.9	Very low	27.5	Very low	194 Å²	194	121.5 Å²	121.5	84%	0.843	75%	0.746	S	S	*	*			trans	-64.8	85.4	169.5	-76.4	175.5	175.8	171.7	0	108.9	T429 I433	T429-K431 PolarHBondContact O-N 3.31Å; T429-K431 VanDerWaalsContact O-N 3.08Å; K431-I433 PolarHBondContact O-N 3.43Å
432	T	26.2	Very low	28.3	Very low	106 Å²	106	117.7 Å²	117.7	65%	0.65	72%	0.716	S	S	*	*			trans	-75.7	118	159	-47.8	0	0	0	0	107	V430 S434	V430-T432 VanDerWaalsContact C-N 3.25Å; V430-T432 PolarHBondContact O-N 3.02Å; T432-S434 VanDerWaalsContact C-N 3.27Å; T432-S434 PolarHBondContact O-N 3.1Å
433	I	26.4	Very low	28.9	Very low	155 Å²	155	118.8 Å²	118.8	80%	0.795	71%	0.713	S	S	*	*			trans	-68.1	87	178.1	-61.2	163.5	0	0	0	107.4	K431	K431-I433 PolarHBondContact O-N 3.43Å
434	S	28.3	Very low	30.2	Very low	110 Å²	110	115 Å²	115	77%	0.769	68%	0.683	S	S	*	*			trans	-110.7	57.5	157.5	61.8	0	0	0	0	108.3	T432 G436	T432-S434 VanDerWaalsContact C-N 3.27Å; T432-S434 PolarHBondContact O-N 3.1Å; S434-G436 PolarHBondContact O-N 3.4Å
435	K	24.7	Very low	31.7	Very low	206 Å²	206	115.2 Å²	115.2	90%	0.896	67%	0.668	S	S	*	*			trans	-78.9	98.9	162	-81.6	-174	174.8	-176.7	0	107.1
436	G	26.3	Very low	33.8	Very low	62 Å²	62	113.7 Å²	113.7	64%	0.639	65%	0.651	S	S	*	*			trans	147.4	61.3	169.5	0	0	0	0	0	114.1	S434	S434-G436 PolarHBondContact O-N 3.4Å
437	L	28.4	Very low	36.7	Very low	93 Å²	93	104.8 Å²	104.8	49%	0.487	61%	0.61	S	S	.	*			trans	-149.4	111.9	142.5	-131.9	77.7	0	0	0	105.9	A439 L442 F444	L437-A439 PolarHBondContact O-N 3.37Å; L437-A439 VanDerWaalsContact O-N 3.16Å; L437-L442 HydrophobicContact CD2-CD1 4.44Å; L437-F444 HydrophobicContact CD2-CZ 4.35Å
438	H	30.4	Very low	39.6	Very low	147 Å²	147	101 Å²	101	68%	0.681	58%	0.584	S	S	*	*			trans	-62.4	118.2	178.4	-77.8	-74.5	0	0	0	108.3	G440	H438-G440 PolarHBondContact O-N 3.4Å
439	A	27.9	Very low	42.8	Very low	92 Å²	92	96.5 Å²	96.5	76%	0.76	55%	0.552	S	S	*	*			trans	-68.5	83.3	170.4	0	0	0	0	0	108.8	L437	L437-A439 PolarHBondContact O-N 3.37Å; L437-A439 VanDerWaalsContact O-N 3.16Å
440	G	27.1	Very low	45.8	Very low	38 Å²	38	93.5 Å²	93.5	39%	0.392	54%	0.536	S	S	.	.	S	Bend	trans	-132.9	103.3	171.3	0	0	0	0	0	108.4	H438 L442	H438-G440 PolarHBondContact O-N 3.4Å; G440-L442 VanDerWaalsContact C-N 3.3Å; G440-L442 PolarHBondContact O-N 2.92Å
441	S	36.1	Very low	49	Very low	106 Å²	106	90.2 Å²	90.2	74%	0.741	51%	0.513	S	S	*	.			trans	42.9	34.4	163.1	-159.8	0	0	0	0	119.7	T443	S441-T443 PolarHBondContact O-N 3.4Å; S441-T443 VanDerWaalsContact O-N 3.16Å
442	L	44.9	Very low	52.2	Low	43 Å²	43	81.1 Å²	81.1	23%	0.225	47%	0.473	C	S	.	.			trans	-67.1	116	170.5	-76.3	144	0	0	0	109.8	Y176 L437 G440 F444	Y176-L442 HydrophobicContact CD1-CD2 3.97Å; L437-L442 HydrophobicContact CD2-CD1 4.44Å; G440-L442 VanDerWaalsContact C-N 3.3Å; G440-L442 PolarHBondContact O-N 2.92Å; L442-F444 HydrophobicContact CB-CD1 3.9Å; L442-F444 HydrophobicContact CB-CD2 3.4Å; L442-F444 HydrophobicContact CB-CE1 3.72Å; L442-F444 HydrophobicContact CB-CE2 3.2Å; L442-F444 HydrophobicContact CB-CG 3.79Å; L442-F444 HydrophobicContact CB-CZ 3.41Å; L442-F444 VanDerWaalsContact CB-CZ 3.41Å; L442-F444 HydrophobicContact CD1-CE1 3.75Å; L442-F444 HydrophobicContact CD1-CE2 3.58Å; L442-F444 HydrophobicContact CD1-CZ 3.08Å; L442-F444 HydrophobicContact CD2-CD1 4.44Å; L442-F444 HydrophobicContact CD2-CE1 3.89Å; L442-F444 HydrophobicContact CD2-CZ 4.08Å; L442-F444 HydrophobicContact CG-CE1 3.96Å; L442-F444 HydrophobicContact CG-CE2 3.92Å; L442-F444 HydrophobicContact CG-CZ 3.64Å; L442-F444 PolarHBondContact O-N 3.04Å
443	T	44.3	Very low	55.3	Low	116 Å²	116	78.1 Å²	78.1	71%	0.712	45%	0.45	S	S	*	.			trans	-66.7	71.8	157.3	47.5	0	0	0	0	108.1	S441 Y445	S441-T443 PolarHBondContact O-N 3.4Å; S441-T443 VanDerWaalsContact O-N 3.16Å; T443-Y445 PolarHBondContact O-N 3.11Å
444	F	54.1	Low	58.4	Low	52 Å²	52	72.8 Å²	72.8	23%	0.228	43%	0.426	C	S	.	.			trans	-66.3	122.7	169.9	-66.8	-64.6	0	0	0	107.5	H341 V398 L437 L442 I446	H341-F444 AromaticContact CD2-CE1 3.74Å; H341-F444 AromaticContact NE2-CE1 3.83Å; V398-F444 HydrophobicContact CG1-CB 4.03Å; V398-F444 HydrophobicContact CG1-CD1 3.37Å; V398-F444 HydrophobicContact CG1-CD2 4.41Å; V398-F444 HydrophobicContact CG1-CE1 3.74Å; V398-F444 HydrophobicContact CG1-CG 3.71Å; V398-F444 HydrophobicContact CG1-CZ 4.36Å; L437-F444 HydrophobicContact CD2-CZ 4.35Å; L442-F444 HydrophobicContact CB-CD1 3.9Å; L442-F444 HydrophobicContact CB-CD2 3.4Å; L442-F444 HydrophobicContact CB-CE1 3.72Å; L442-F444 HydrophobicContact CB-CE2 3.2Å; L442-F444 HydrophobicContact CB-CG 3.79Å; L442-F444 HydrophobicContact CB-CZ 3.41Å; L442-F444 VanDerWaalsContact CB-CZ 3.41Å; L442-F444 HydrophobicContact CD1-CE1 3.75Å; L442-F444 HydrophobicContact CD1-CE2 3.58Å; L442-F444 HydrophobicContact CD1-CZ 3.08Å; L442-F444 HydrophobicContact CD2-CD1 4.44Å; L442-F444 HydrophobicContact CD2-CE1 3.89Å; L442-F444 HydrophobicContact CD2-CZ 4.08Å; L442-F444 HydrophobicContact CG-CE1 3.96Å; L442-F444 HydrophobicContact CG-CE2 3.92Å; L442-F444 HydrophobicContact CG-CZ 3.64Å; L442-F444 PolarHBondContact O-N 3.04Å; F444-I446 VanDerWaalsContact C-N 3.32Å; F444-I446 PolarHBondContact O-N 3.29Å
445	Y	60.6	Low	61.2	Low	114 Å²	114	70.1 Å²	70.1	45%	0.447	40%	0.402	S	S	.	.			trans	-70.6	94.3	175.4	-66	-86.5	0	0	0	108.3	R342 S343 T443 I447	R342-Y445 WeakPolarHBondContact O-CD2 3.39Å; S343-Y445 VanDerWaalsContact CA-CE2 3.49Å; T443-Y445 PolarHBondContact O-N 3.11Å; Y445-I447 PolarHBondContact O-N 3.3Å
446	I	70.8	Confident	64.3	Low	89 Å²	89	60.4 Å²	60.4	46%	0.456	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-58.2	120.6	179.4	-60.2	172.6	0	0	0	108.4	K346 F444	K346-I446 PolarHBondContact NZ-O 2.85Å; F444-I446 VanDerWaalsContact C-N 3.32Å; F444-I446 PolarHBondContact O-N 3.29Å
447	I	84.7	Confident	67.1	Low	2 Å²	2	57.6 Å²	57.6	1%	0.01	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-86.6	117.7	171.4	-54.8	-171.7	0	0	0	106.7	L340 K346 L349 L350 I395 Y445 I452	L340-I447 HydrophobicContact CD2-CD1 4.31Å; K346-I447 HydrophobicContact CB-CG1 4.5Å; K346-I447 HydrophobicContact CD-CG1 4.41Å; K346-I447 HydrophobicContact CG-CG1 4.11Å; L349-I447 HydrophobicContact CD2-CD1 3.74Å; L350-I447 HydrophobicContact CD2-CG2 4.04Å; I395-I447 HydrophobicContact CD1-CD1 4.11Å; I395-I447 HydrophobicContact CG1-CD1 4.19Å; I395-I447 HydrophobicContact CG2-CB 4.28Å; Y445-I447 PolarHBondContact O-N 3.3Å; I447-I452 HydrophobicContact CG2-CD1 4.09Å; I447-I452 HydrophobicContact CG2-CG1 3.74Å
448	S	88.5	Confident	69.9	Low	32 Å²	32	57.6 Å²	57.6	22%	0.224	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-79.4	152.9	-179.2	71	0	0	0	0	111.1	S450 E451 I452	S448-S450 PolarHBondContact O-N 3.24Å; S448-S450 PolarHBondContact OG-OG 3.42Å; S448-E451 PolarHBondContact N-OE2 2.76Å; S448-E451 PolarHBondContact O-N 2.93Å; S448-E451 VanDerWaalsContact O-N 3.14Å; S448-E451 VanDerWaalsContact OG-CD 3.25Å; S448-E451 WeakPolarHBondContact OG-CG 3.25Å; S448-E451 PolarHBondContact OG-N 3.41Å; S448-E451 PolarHBondContact OG-OE2 3.39Å; S448-I452 PolarHBondContact O-N 3.16Å
449	Q	92	Very high	72.4	Confident	14 Å²	14	56.9 Å²	56.9	7%	0.065	33%	0.325	C	S	.	.	H	α-helix	trans	-58.5	-36.4	173.2	-63.9	-163	47.7	0	0	111.9	E451 I452 Y453 Y479 F483 C489 D491 F494	Q449-E451 VanDerWaalsContact C-N 3.33Å; Q449-E451 PolarHBondContact O-N 3.39Å; Q449-I452 PolarHBondContact O-N 3Å; Q449-Y453 WeakPolarHBondContact O-CB 3.39Å; Q449-Y453 PolarHBondContact O-N 2.88Å; Q449-Y479 VanDerWaalsContact CG-OH 3.3Å; Q449-Y479 WeakPolarHBondContact CG-OH 3.46Å; Q449-Y479 PolarHBondContact OE1-OH 3.22Å; Q449-F483 HydrophobicContact CG-CE1 3.86Å; Q449-C489 PolarHBondContact NE2-O 2.99Å; Q449-D491 HydrophobicContact CB-CB 4.48Å; Q449-D491 VanDerWaalsContact CB-OD2 3.25Å; Q449-D491 WeakPolarHBondContact CB-OD2 3.39Å; Q449-F494 HydrophobicContact CB-CE2 4.03Å; Q449-F494 WeakPolarHBondContact O-CZ 3.36Å
450	S	91.5	Very high	74.8	Confident	70 Å²	70	53.9 Å²	53.9	49%	0.49	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-35.1	175.8	59.2	0	0	0	0	113.7	S448 S454	S448-S450 PolarHBondContact O-N 3.24Å; S448-S450 PolarHBondContact OG-OG 3.42Å; S450-S454 WeakPolarHBondContact O-CB 3.26Å; S450-S454 PolarHBondContact O-N 3.27Å; S450-S454 PolarHBondContact O-OG 3.44Å
451	E	91	Very high	77	Confident	54 Å²	54	55.8 Å²	55.8	25%	0.252	30%	0.295	S	S	.	.	H	α-helix	trans	-72	-41.5	176.1	-72.4	163.4	162.4	0	0	111.3	K346 L350 S448 Q449 Y453 S454 H455	K346-E451 WeakPolarHBondContact CE-OE1 3.35Å; K346-E451 WeakPolarHBondContact CE-OE2 3.42Å; K346-E451 IonicContact NZ-OE1 3.66Å; K346-E451 PolarHBondContact NZ-OE1 3Å; K346-E451 IonicContact NZ-OE2 2.68Å; K346-E451 PolarHBondContact NZ-OE2 3.32Å; L350-E451 HydrophobicContact CD1-CB 4.08Å; S448-E451 PolarHBondContact N-OE2 2.76Å; S448-E451 PolarHBondContact O-N 2.93Å; S448-E451 VanDerWaalsContact O-N 3.14Å; S448-E451 VanDerWaalsContact OG-CD 3.25Å; S448-E451 WeakPolarHBondContact OG-CG 3.25Å; S448-E451 PolarHBondContact OG-N 3.41Å; S448-E451 PolarHBondContact OG-OE2 3.39Å; Q449-E451 VanDerWaalsContact C-N 3.33Å; Q449-E451 PolarHBondContact O-N 3.39Å; E451-Y453 VanDerWaalsContact C-N 3.32Å; E451-Y453 PolarHBondContact O-N 2.96Å; E451-S454 WeakPolarHBondContact CA-OG 3.46Å; E451-S454 PolarHBondContact O-N 3.23Å; E451-S454 PolarHBondContact O-OG 3.32Å; E451-H455 WeakPolarHBondContact O-CB 3.44Å; E451-H455 PolarHBondContact O-N 3.25Å
452	I	91.8	Very high	78.7	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-60.1	-47.2	173.8	-61.6	173.3	0	0	0	109.5	F392 I395 I447 S448 Q449 S454 H455 L456 F457 Y479 F483 F494	F392-I452 HydrophobicContact CE1-CG2 4.28Å; I395-I452 HydrophobicContact CD1-CD1 4.24Å; I395-I452 HydrophobicContact CG2-CD1 4.43Å; I447-I452 HydrophobicContact CG2-CD1 4.09Å; I447-I452 HydrophobicContact CG2-CG1 3.74Å; S448-I452 PolarHBondContact O-N 3.16Å; Q449-I452 PolarHBondContact O-N 3Å; I452-S454 PolarHBondContact O-N 2.96Å; I452-H455 PolarHBondContact O-N 2.96Å; I452-L456 HydrophobicContact CG2-CD1 4.18Å; I452-L456 HydrophobicContact CG2-CD2 4.14Å; I452-L456 WeakPolarHBondContact O-CB 3.37Å; I452-L456 PolarHBondContact O-N 2.9Å; I452-F457 HydrophobicContact CG2-CE2 4.45Å; I452-Y479 HydrophobicContact CD1-CE2 4.01Å; I452-Y479 HydrophobicContact CG2-CD2 4.4Å; I452-Y479 HydrophobicContact CG2-CE2 3.93Å; I452-F483 HydrophobicContact CD1-CZ 4.46Å; I452-F494 HydrophobicContact CG2-CZ 4.48Å
453	Y	92.4	Very high	80	Confident	43 Å²	43	58.1 Å²	58.1	17%	0.169	30%	0.3	C	S	.	.	I	π-helix	trans	-57	-50.6	178.7	-174.5	-102.4	0	0	0	112	Q449 E451 F457 L458 C493 F494 M497	Q449-Y453 WeakPolarHBondContact O-CB 3.39Å; Q449-Y453 PolarHBondContact O-N 2.88Å; E451-Y453 VanDerWaalsContact C-N 3.32Å; E451-Y453 PolarHBondContact O-N 2.96Å; Y453-F457 WeakPolarHBondContact O-CB 3.4Å; Y453-F457 PolarHBondContact O-N 2.75Å; Y453-F457 VanDerWaalsContact O-N 3.17Å; Y453-L458 HydrophobicContact CD1-CD1 4.36Å; Y453-L458 HydrophobicContact CE1-CD1 3.65Å; Y453-L458 PolarHBondContact O-N 3.16Å; Y453-C493 HydrophobicContact CD2-CB 4.29Å; Y453-C493 HydrophobicContact CE1-CB 4.35Å; Y453-C493 HydrophobicContact CE2-CB 4.04Å; Y453-F494 HydrophobicContact CD2-CD1 4.19Å; Y453-F494 HydrophobicContact CD2-CE1 4.03Å; Y453-F494 HydrophobicContact CD2-CE2 4.38Å; Y453-F494 HydrophobicContact CD2-CG 4.45Å; Y453-F494 HydrophobicContact CD2-CZ 4.14Å; Y453-F494 HydrophobicContact CG-CZ 4.41Å; Y453-M497 HydrophobicContact CD2-CE 4.09Å; Y453-M497 HydrophobicContact CE2-CB 4.24Å; Y453-M497 HydrophobicContact CE2-CE 3.63Å; Y453-M497 HydrophobicContact CE2-SD 3.77Å
454	S	91.6	Very high	81.4	Confident	43 Å²	43	59.7 Å²	59.7	30%	0.301	30%	0.3	S	S	.	.	I	π-helix	trans	-67.2	-43.1	-178.5	56.2	0	0	0	0	113.3	S450 E451 I452 K459	S450-S454 WeakPolarHBondContact O-CB 3.26Å; S450-S454 PolarHBondContact O-N 3.27Å; S450-S454 PolarHBondContact O-OG 3.44Å; E451-S454 WeakPolarHBondContact CA-OG 3.46Å; E451-S454 PolarHBondContact O-N 3.23Å; E451-S454 PolarHBondContact O-OG 3.32Å; I452-S454 PolarHBondContact O-N 2.96Å; S454-K459 PolarHBondContact O-N 3.28Å
455	H	87.2	Confident	82.8	Confident	54 Å²	54	62.4 Å²	62.4	25%	0.25	31%	0.309	C	S	.	.	I	π-helix	trans	-79.4	-37.5	-175.3	-91.3	-101.3	0	0	0	114.7	L350 S354 E451 I452	L350-H455 HydrophobicContact CB-CB 4.38Å; L350-H455 HydrophobicContact CD2-CB 4.32Å; S354-H455 PolarHBondContact OG-O 3.39Å; E451-H455 WeakPolarHBondContact O-CB 3.44Å; E451-H455 PolarHBondContact O-N 3.25Å; I452-H455 PolarHBondContact O-N 2.96Å
456	L	88.2	Confident	84.1	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.01	30%	0.304	C	S	.	.	I	π-helix	trans	-88.7	-42	-176.1	-80.3	69.6	0	0	0	111.4	L350 C353 V357 F388 F392 I452 N460	L350-L456 HydrophobicContact CD2-CD1 4.44Å; C353-L456 HydrophobicContact CB-CD1 3.82Å; C353-L456 HydrophobicContact CB-CD2 4.33Å; C353-L456 HydrophobicContact CB-CG 4.14Å; V357-L456 HydrophobicContact CG2-CB 4.41Å; V357-L456 HydrophobicContact CG2-CG 4.33Å; F388-L456 HydrophobicContact CD1-CD2 4.26Å; F388-L456 HydrophobicContact CE1-CD2 3.89Å; F392-L456 HydrophobicContact CE1-CD2 3.87Å; F392-L456 HydrophobicContact CZ-CD2 3.86Å; I452-L456 HydrophobicContact CG2-CD1 4.18Å; I452-L456 HydrophobicContact CG2-CD2 4.14Å; I452-L456 WeakPolarHBondContact O-CB 3.37Å; I452-L456 PolarHBondContact O-N 2.9Å; L456-N460 PolarHBondContact O-ND2 3.19Å
457	F	86.6	Confident	84.8	Confident	4 Å²	4	59 Å²	59	2%	0.018	30%	0.297	C	S	.	.	I	π-helix	trans	-108.2	-51.8	-166.8	-57.5	-83.7	0	0	0	113.2	I452 Y453 K459 N460 Q461 F472 I475 L476 F494 M497	I452-F457 HydrophobicContact CG2-CE2 4.45Å; Y453-F457 WeakPolarHBondContact O-CB 3.4Å; Y453-F457 PolarHBondContact O-N 2.75Å; Y453-F457 VanDerWaalsContact O-N 3.17Å; F457-K459 VanDerWaalsContact C-N 3.3Å; F457-K459 PolarHBondContact O-N 2.85Å; F457-N460 PolarHBondContact O-N 3.35Å; F457-N460 VanDerWaalsContact O-N 3.07Å; F457-Q461 WeakPolarHBondContact O-CG 3.29Å; F457-Q461 PolarHBondContact O-N 2.89Å; F457-F472 AromaticContact CD1-CD1 3.7Å; F457-F472 HydrophobicContact CD1-CD1 3.7Å; F457-F472 HydrophobicContact CD1-CE1 4.2Å; F457-F472 HydrophobicContact CE1-CD1 4.07Å; F457-I475 HydrophobicContact CE1-CG2 4.14Å; F457-I475 HydrophobicContact CZ-CG2 3.93Å; F457-L476 HydrophobicContact CD1-CD1 4.22Å; F457-L476 HydrophobicContact CE1-CB 4.3Å; F457-L476 HydrophobicContact CE1-CD1 3.75Å; F457-L476 HydrophobicContact CE2-CD1 4.35Å; F457-L476 HydrophobicContact CZ-CD1 3.82Å; F457-F494 HydrophobicContact CD2-CE1 4.16Å; F457-F494 HydrophobicContact CE2-CD1 4.35Å; F457-F494 AromaticContact CE2-CE1 3.8Å; F457-F494 HydrophobicContact CE2-CE1 3.8Å; F457-M497 HydrophobicContact CB-CE 3.23Å; F457-M497 HydrophobicContact CB-SD 3.69Å; F457-M497 HydrophobicContact CD1-CE 3.29Å; F457-M497 HydrophobicContact CD1-SD 4.42Å; F457-M497 HydrophobicContact CD2-CE 3.82Å; F457-M497 HydrophobicContact CE1-CE 4.01Å; F457-M497 HydrophobicContact CE2-CE 4.47Å; F457-M497 HydrophobicContact CG-CE 3.16Å; F457-M497 HydrophobicContact CG-SD 4.26Å
458	L	86.5	Confident	85	Confident	93 Å²	93	59 Å²	59	49%	0.487	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-59	-41.1	-174.6	-157.4	97.9	0	0	0	112.3	Y453 N460 Q461	Y453-L458 HydrophobicContact CD1-CD1 4.36Å; Y453-L458 HydrophobicContact CE1-CD1 3.65Å; Y453-L458 PolarHBondContact O-N 3.16Å; L458-N460 PolarHBondContact O-N 3.18Å; L458-N460 VanDerWaalsContact O-N 3.17Å; L458-Q461 PolarHBondContact O-N 3.32Å
459	K	82.9	Confident	85.1	Confident	132 Å²	132	59.4 Å²	59.4	57%	0.574	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-60.3	-22.9	178.5	-81.8	-176.9	176.6	176.5	0	115	S454 F457	S454-K459 PolarHBondContact O-N 3.28Å; F457-K459 VanDerWaalsContact C-N 3.3Å; F457-K459 PolarHBondContact O-N 2.85Å
460	N	78.8	Confident	85	Confident	28 Å²	28	63.5 Å²	63.5	15%	0.15	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-119.9	13.7	-170.8	-61.4	-57	0	0	0	112.9	V357 I361 L456 F457 L458 D462 V463 F472	V357-N460 WeakPolarHBondContact CG1-ND2 3.09Å; I361-N460 HydrophobicContact CD1-CB 4.23Å; L456-N460 PolarHBondContact O-ND2 3.19Å; F457-N460 PolarHBondContact O-N 3.35Å; F457-N460 VanDerWaalsContact O-N 3.07Å; L458-N460 PolarHBondContact O-N 3.18Å; L458-N460 VanDerWaalsContact O-N 3.17Å; N460-D462 VanDerWaalsContact C-N 3.26Å; N460-D462 PolarHBondContact O-N 2.82Å; N460-V463 PolarHBondContact O-N 3.16Å; N460-F472 HydrophobicContact CB-CE1 4.34Å; N460-F472 HydrophobicContact CB-CE2 4.18Å; N460-F472 HydrophobicContact CB-CZ 3.49Å; N460-F472 VanDerWaalsContact CB-CZ 3.49Å
461	Q	72.5	Confident	84.9	Confident	79 Å²	79	60.7 Å²	60.7	37%	0.369	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-25.5	-177.7	-78.8	-167.4	-7.3	0	0	114	F457 L458 V463 M497	F457-Q461 WeakPolarHBondContact O-CG 3.29Å; F457-Q461 PolarHBondContact O-N 2.89Å; L458-Q461 PolarHBondContact O-N 3.32Å; Q461-V463 PolarHBondContact O-N 3.4Å; Q461-M497 PolarHBondContact NE2-SD 3.2Å; Q461-M497 VanDerWaalsContact NE2-SD 3.4Å
462	D	72.3	Confident	85	Confident	148 Å²	148	58.8 Å²	58.8	79%	0.791	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-7.6	-176.4	-59.7	-31.4	0	0	0	113.2	N460 E464	N460-D462 VanDerWaalsContact C-N 3.26Å; N460-D462 PolarHBondContact O-N 2.82Å; D462-E464 PolarHBondContact O-N 3.29Å
463	V	71.9	Confident	85	Confident	49 Å²	49	60.6 Å²	60.6	30%	0.297	29%	0.288	S	S	.	.			trans	-78	97.4	179.5	-171.7	0	0	0	0	109.9	N460 Q461 R465 V468	N460-V463 PolarHBondContact O-N 3.16Å; Q461-V463 PolarHBondContact O-N 3.4Å; V463-R465 VanDerWaalsContact C-N 3.26Å; V463-R465 PolarHBondContact O-N 3.15Å; V463-V468 HydrophobicContact CB-CG1 4.07Å; V463-V468 HydrophobicContact CG1-CB 4.01Å; V463-V468 HydrophobicContact CG1-CG1 3.78Å; V463-V468 HydrophobicContact CG1-CG2 3.91Å
464	E	73.3	Confident	85	Confident	150 Å²	150	60.7 Å²	60.7	70%	0.701	30%	0.295	S	S	*	.			trans	-76.1	0.3	-173.2	-65.7	-154.2	148	0	0	116.1	D462 R469	D462-E464 PolarHBondContact O-N 3.29Å; E464-R469 PolarHBondContact O-NH2 2.78Å
465	R	84.6	Confident	85.1	Confident	108 Å²	108	58.7 Å²	58.7	41%	0.408	28%	0.281	S	S	.	.			trans	-68.9	136.2	-176.8	-69.4	-169.9	179.4	-160.2	3.5	112.5	V463 E467 V468 R469	V463-R465 VanDerWaalsContact C-N 3.26Å; V463-R465 PolarHBondContact O-N 3.15Å; R465-E467 VanDerWaalsContact C-N 3.29Å; R465-E467 PolarHBondContact O-N 2.96Å; R465-V468 HydrophobicContact CB-CB 4.23Å; R465-V468 HydrophobicContact CB-CG2 3.96Å; R465-V468 PolarHBondContact O-N 3.27Å; R465-R469 WeakPolarHBondContact O-CG 3.34Å; R465-R469 PolarHBondContact O-N 3.21Å; R465-R469 VanDerWaalsContact O-N 3.08Å
466	L	86.3	Confident	85.5	Confident	68 Å²	68	56.1 Å²	56.1	36%	0.356	27%	0.269	S	S	.	.	H	α-helix	trans	-58.3	-41.6	-178.7	178.6	63.2	0	0	0	112	V468 R469 K470 M505	L466-V468 VanDerWaalsContact C-N 3.33Å; L466-R469 WeakPolarHBondContact O-CB 3.37Å; L466-R469 PolarHBondContact O-N 3.39Å; L466-K470 PolarHBondContact O-N 3.42Å; L466-K470 VanDerWaalsContact O-N 3.1Å; L466-M505 HydrophobicContact CD1-CB 4.09Å; L466-M505 HydrophobicContact CD1-CG 3.76Å; L466-M505 HydrophobicContact CD1-SD 4.34Å
467	E	87	Confident	85.7	Confident	65 Å²	65	57.9 Å²	57.9	30%	0.304	28%	0.278	S	S	.	.	H	α-helix	trans	-71.4	-32.8	-176.5	-55.2	79.4	-168.4	0	0	111.5	V364 V368 R465 K470 L471	V364-E467 HydrophobicContact CG1-CB 3.29Å; V368-E467 HydrophobicContact CG2-CB 4.14Å; V368-E467 HydrophobicContact CG2-CG 3.63Å; R465-E467 VanDerWaalsContact C-N 3.29Å; R465-E467 PolarHBondContact O-N 2.96Å; E467-K470 WeakPolarHBondContact O-CB 3.41Å; E467-K470 PolarHBondContact O-N 3.03Å; E467-L471 PolarHBondContact O-N 2.9Å; E467-L471 VanDerWaalsContact O-N 3.11Å
468	V	88.4	Confident	86.1	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-69.1	-39.4	173.8	175.3	0	0	0	0	110.6	I361 V364 V463 R465 L466 K470 L471 F472	I361-V468 HydrophobicContact CD1-CG1 4.34Å; I361-V468 HydrophobicContact CG1-CG1 3.92Å; I361-V468 HydrophobicContact CG2-CG2 3.98Å; V364-V468 HydrophobicContact CG1-CG2 4.26Å; V463-V468 HydrophobicContact CB-CG1 4.07Å; V463-V468 HydrophobicContact CG1-CB 4.01Å; V463-V468 HydrophobicContact CG1-CG1 3.78Å; V463-V468 HydrophobicContact CG1-CG2 3.91Å; R465-V468 HydrophobicContact CB-CB 4.23Å; R465-V468 HydrophobicContact CB-CG2 3.96Å; R465-V468 PolarHBondContact O-N 3.27Å; L466-V468 VanDerWaalsContact C-N 3.33Å; V468-K470 VanDerWaalsContact C-N 3.27Å; V468-K470 PolarHBondContact O-N 2.83Å; V468-L471 WeakPolarHBondContact O-CB 3.35Å; V468-L471 PolarHBondContact O-N 2.88Å; V468-L471 VanDerWaalsContact O-N 3.15Å; V468-F472 HydrophobicContact CG1-CD2 3.7Å; V468-F472 HydrophobicContact CG1-CE2 3.44Å; V468-F472 VanDerWaalsContact CG1-CE2 3.44Å; V468-F472 VanDerWaalsContact O-CD2 3.3Å; V468-F472 WeakPolarHBondContact O-CD2 3.44Å; V468-F472 PolarHBondContact O-N 3.47Å
469	R	89.8	Confident	86.5	Confident	41 Å²	41	55 Å²	55	16%	0.155	26%	0.262	C	S	.	.	H	α-helix	trans	-60.4	-37.4	172.3	-65.4	176.4	-170.9	148.8	4	112	E464 R465 L466 F472 R473 L501 R504 M505	E464-R469 PolarHBondContact O-NH2 2.78Å; R465-R469 WeakPolarHBondContact O-CG 3.34Å; R465-R469 PolarHBondContact O-N 3.21Å; R465-R469 VanDerWaalsContact O-N 3.08Å; L466-R469 WeakPolarHBondContact O-CB 3.37Å; L466-R469 PolarHBondContact O-N 3.39Å; R469-F472 PolarHBondContact O-N 2.98Å; R469-R473 WeakPolarHBondContact O-CB 3.48Å; R469-R473 PolarHBondContact O-N 2.98Å; R469-L501 HydrophobicContact CB-CD2 4.3Å; R469-L501 HydrophobicContact CG-CD2 4.18Å; R469-R504 PolarHBondContact NH1-O 3.25Å; R469-M505 HydrophobicContact CB-CG 3.82Å; R469-M505 HydrophobicContact CB-SD 3.73Å
470	K	90	Very high	87	Confident	100 Å²	100	48.7 Å²	48.7	44%	0.435	24%	0.235	S	C	.	.	H	α-helix	trans	-63.3	-42.1	174.3	-70.3	177.8	179.9	176.8	0	111.7	L466 E467 V468 R473 S474 M505	L466-K470 PolarHBondContact O-N 3.42Å; L466-K470 VanDerWaalsContact O-N 3.1Å; E467-K470 WeakPolarHBondContact O-CB 3.41Å; E467-K470 PolarHBondContact O-N 3.03Å; V468-K470 VanDerWaalsContact C-N 3.27Å; V468-K470 PolarHBondContact O-N 2.83Å; K470-R473 PolarHBondContact O-N 3.1Å; K470-S474 PolarHBondContact O-N 2.7Å; K470-S474 PolarHBondContact O-OG 2.89Å; K470-M505 HydrophobicContact CB-SD 4.3Å; K470-M505 HydrophobicContact CG-SD 3.51Å; K470-M505 VanDerWaalsContact CG-SD 3.51Å
471	L	90.3	Very high	87.7	Confident	12 Å²	12	52.6 Å²	52.6	6%	0.063	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-50.9	174.5	174.9	64.3	0	0	0	111.3	I361 V364 L381 E467 V468 R473 S474 I475	I361-L471 HydrophobicContact CG1-CD2 4.47Å; V364-L471 HydrophobicContact CG2-CB 4.26Å; V364-L471 HydrophobicContact CG2-CD2 4.07Å; L381-L471 HydrophobicContact CD2-CD1 4.29Å; E467-L471 PolarHBondContact O-N 2.9Å; E467-L471 VanDerWaalsContact O-N 3.11Å; V468-L471 WeakPolarHBondContact O-CB 3.35Å; V468-L471 PolarHBondContact O-N 2.88Å; V468-L471 VanDerWaalsContact O-N 3.15Å; L471-R473 VanDerWaalsContact C-N 3.32Å; L471-R473 PolarHBondContact O-N 3.38Å; L471-S474 PolarHBondContact O-N 3.37Å; L471-S474 VanDerWaalsContact O-N 3.1Å; L471-I475 HydrophobicContact CD1-CD1 3.95Å; L471-I475 HydrophobicContact CD1-CG1 4.23Å; L471-I475 HydrophobicContact CG-CD1 3.91Å; L471-I475 WeakPolarHBondContact O-CG1 3.47Å; L471-I475 PolarHBondContact O-N 2.88Å
472	F	92.1	Very high	88.7	Confident	13 Å²	13	49.1 Å²	49.1	6%	0.057	23%	0.231	C	C	.	.	H	α-helix	trans	-60.2	-41.4	178.4	-79.4	-62.3	0	0	0	112.6	V357 I361 F457 N460 V468 R469 S474 I475 L476 L501	V357-F472 HydrophobicContact CG1-CE1 3.68Å; V357-F472 HydrophobicContact CG1-CZ 3.68Å; I361-F472 HydrophobicContact CD1-CE2 4.21Å; I361-F472 HydrophobicContact CD1-CZ 3.99Å; F457-F472 AromaticContact CD1-CD1 3.7Å; F457-F472 HydrophobicContact CD1-CD1 3.7Å; F457-F472 HydrophobicContact CD1-CE1 4.2Å; F457-F472 HydrophobicContact CE1-CD1 4.07Å; N460-F472 HydrophobicContact CB-CE1 4.34Å; N460-F472 HydrophobicContact CB-CE2 4.18Å; N460-F472 HydrophobicContact CB-CZ 3.49Å; N460-F472 VanDerWaalsContact CB-CZ 3.49Å; V468-F472 HydrophobicContact CG1-CD2 3.7Å; V468-F472 HydrophobicContact CG1-CE2 3.44Å; V468-F472 VanDerWaalsContact CG1-CE2 3.44Å; V468-F472 VanDerWaalsContact O-CD2 3.3Å; V468-F472 WeakPolarHBondContact O-CD2 3.44Å; V468-F472 PolarHBondContact O-N 3.47Å; R469-F472 PolarHBondContact O-N 2.98Å; F472-S474 VanDerWaalsContact C-N 3.32Å; F472-S474 PolarHBondContact O-N 2.86Å; F472-I475 PolarHBondContact O-N 3.42Å; F472-L476 VanDerWaalsContact O-CB 3.29Å; F472-L476 WeakPolarHBondContact O-CB 3.38Å; F472-L476 PolarHBondContact O-N 2.87Å; F472-L501 HydrophobicContact CB-CD1 3.83Å
473	R	92	Very high	89.7	Confident	40 Å²	40	42.1 Å²	42.1	15%	0.151	19%	0.193	C	C	.	.	H	α-helix	trans	-56.3	-47.4	173.2	177.5	177.9	66.1	178.1	6.1	111.1	R469 K470 L471 L476 I477 L498 M505 D507	R469-R473 WeakPolarHBondContact O-CB 3.48Å; R469-R473 PolarHBondContact O-N 2.98Å; K470-R473 PolarHBondContact O-N 3.1Å; L471-R473 VanDerWaalsContact C-N 3.32Å; L471-R473 PolarHBondContact O-N 3.38Å; R473-L476 PolarHBondContact O-N 2.58Å; R473-I477 HydrophobicContact CG-CD1 3.72Å; R473-I477 HydrophobicContact CG-CG1 4.47Å; R473-I477 WeakPolarHBondContact O-CD1 3.31Å; R473-I477 VanDerWaalsContact O-CG1 3.27Å; R473-I477 WeakPolarHBondContact O-CG1 3.48Å; R473-I477 PolarHBondContact O-N 3.42Å; R473-L498 HydrophobicContact CG-CD1 3.94Å; R473-M505 HydrophobicContact CB-CE 3.92Å; R473-M505 VanDerWaalsContact CD-CE 3.43Å; R473-M505 HydrophobicContact CG-CE 4.23Å; R473-D507 IonicContact CZ-OD2 2.94Å; R473-D507 IonicContact NH1-OD2 2.63Å; R473-D507 PolarHBondContact NH1-OD2 2.84Å; R473-D507 IonicContact NH2-OD2 3.13Å
474	S	92.7	Very high	90.6	Very high	45 Å²	45	42.6 Å²	42.6	32%	0.315	20%	0.199	S	C	.	.	H	α-helix	trans	-62.9	-46.7	179.8	-62.4	0	0	0	0	112.4	K470 L471 F472 L476 I477 E478	K470-S474 PolarHBondContact O-N 2.7Å; K470-S474 PolarHBondContact O-OG 2.89Å; L471-S474 PolarHBondContact O-N 3.37Å; L471-S474 VanDerWaalsContact O-N 3.1Å; F472-S474 VanDerWaalsContact C-N 3.32Å; F472-S474 PolarHBondContact O-N 2.86Å; S474-L476 VanDerWaalsContact C-N 3.26Å; S474-L476 PolarHBondContact O-N 3.41Å; S474-I477 PolarHBondContact O-N 2.63Å; S474-E478 WeakPolarHBondContact O-CG 3.34Å; S474-E478 PolarHBondContact O-N 2.87Å
475	I	94.1	Very high	91.5	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-60.1	-40	177.7	-63.9	169.2	0	0	0	110.8	L385 F388 F392 F457 L471 F472 E478 Y479	L385-I475 HydrophobicContact CD2-CG1 3.85Å; F388-I475 HydrophobicContact CD1-CG2 4.37Å; F388-I475 HydrophobicContact CD2-CD1 3.91Å; F388-I475 HydrophobicContact CD2-CG1 3.94Å; F388-I475 HydrophobicContact CD2-CG2 4.39Å; F388-I475 HydrophobicContact CE2-CD1 3.66Å; F388-I475 HydrophobicContact CE2-CG1 4.22Å; F388-I475 HydrophobicContact CG-CG2 4.19Å; F388-I475 HydrophobicContact CZ-CD1 4.25Å; F392-I475 HydrophobicContact CE2-CG2 4.02Å; F392-I475 HydrophobicContact CZ-CG2 4.04Å; F457-I475 HydrophobicContact CE1-CG2 4.14Å; F457-I475 HydrophobicContact CZ-CG2 3.93Å; L471-I475 HydrophobicContact CD1-CD1 3.95Å; L471-I475 HydrophobicContact CD1-CG1 4.23Å; L471-I475 HydrophobicContact CG-CD1 3.91Å; L471-I475 WeakPolarHBondContact O-CG1 3.47Å; L471-I475 PolarHBondContact O-N 2.88Å; F472-I475 PolarHBondContact O-N 3.42Å; I475-E478 WeakPolarHBondContact O-CB 3.31Å; I475-E478 PolarHBondContact O-N 3.29Å; I475-Y479 WeakPolarHBondContact O-CB 3.49Å; I475-Y479 PolarHBondContact O-N 3.45Å
476	L	94.3	Very high	91.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-71.6	-36.7	-178.2	-160.8	109.4	0	0	0	112.8	F457 F472 R473 S474 Y479 I480 F494 M497 L498	F457-L476 HydrophobicContact CD1-CD1 4.22Å; F457-L476 HydrophobicContact CE1-CB 4.3Å; F457-L476 HydrophobicContact CE1-CD1 3.75Å; F457-L476 HydrophobicContact CE2-CD1 4.35Å; F457-L476 HydrophobicContact CZ-CD1 3.82Å; F472-L476 VanDerWaalsContact O-CB 3.29Å; F472-L476 WeakPolarHBondContact O-CB 3.38Å; F472-L476 PolarHBondContact O-N 2.87Å; R473-L476 PolarHBondContact O-N 2.58Å; S474-L476 VanDerWaalsContact C-N 3.26Å; S474-L476 PolarHBondContact O-N 3.41Å; L476-Y479 WeakPolarHBondContact O-CB 3.25Å; L476-Y479 PolarHBondContact O-N 3.43Å; L476-I480 HydrophobicContact CD2-CD1 3.86Å; L476-I480 HydrophobicContact CG-CD1 4.34Å; L476-I480 WeakPolarHBondContact O-CG1 3.35Å; L476-I480 PolarHBondContact O-N 3.15Å; L476-F494 HydrophobicContact CD1-CB 4.46Å; L476-F494 HydrophobicContact CD1-CD1 3.85Å; L476-F494 WeakPolarHBondContact CD2-O 3.4Å; L476-M497 HydrophobicContact CD1-CE 3.26Å; L476-L498 HydrophobicContact CD2-CB 3.33Å; L476-L498 HydrophobicContact CD2-CD1 3.74Å; L476-L498 HydrophobicContact CD2-CD2 4.13Å; L476-L498 HydrophobicContact CD2-CG 3.88Å
477	I	93.8	Very high	91.9	Very high	39 Å²	39	42.9 Å²	42.9	20%	0.2	21%	0.208	C	C	.	.	H	α-helix	trans	-65.1	-42.4	173.8	-68.4	164	0	0	0	110.4	R473 S474 Y479 I480 R481 L498 Y514 L519	R473-I477 HydrophobicContact CG-CD1 3.72Å; R473-I477 HydrophobicContact CG-CG1 4.47Å; R473-I477 WeakPolarHBondContact O-CD1 3.31Å; R473-I477 VanDerWaalsContact O-CG1 3.27Å; R473-I477 WeakPolarHBondContact O-CG1 3.48Å; R473-I477 PolarHBondContact O-N 3.42Å; S474-I477 PolarHBondContact O-N 2.63Å; I477-Y479 VanDerWaalsContact C-N 3.34Å; I477-I480 PolarHBondContact O-N 2.89Å; I477-R481 WeakPolarHBondContact O-CB 3.44Å; I477-R481 PolarHBondContact O-N 2.68Å; I477-L498 HydrophobicContact CG1-CD1 4.24Å; I477-L498 HydrophobicContact CG1-CD2 4.43Å; I477-Y514 HydrophobicContact CD1-CE1 4.06Å; I477-Y514 WeakPolarHBondContact CD1-OH 3.3Å; I477-L519 HydrophobicContact CG1-CD2 4.43Å; I477-L519 HydrophobicContact CG2-CD2 4.47Å
478	E	93.7	Very high	91.9	Very high	37 Å²	37	40.8 Å²	40.8	17%	0.173	20%	0.199	C	C	.	.	H	α-helix	trans	-57.7	-47.4	172.7	-76.5	-60.9	141.3	0	0	111.5	L385 S474 I475 R481 I482	L385-E478 HydrophobicContact CD2-CG 4.42Å; S474-E478 WeakPolarHBondContact O-CG 3.34Å; S474-E478 PolarHBondContact O-N 2.87Å; I475-E478 WeakPolarHBondContact O-CB 3.31Å; I475-E478 PolarHBondContact O-N 3.29Å; E478-R481 PolarHBondContact O-N 2.86Å; E478-R481 IonicContact OE1-CZ 2.89Å; E478-R481 IonicContact OE1-NH1 3.22Å; E478-R481 PolarHBondContact OE1-NH1 2.86Å; E478-R481 IonicContact OE1-NH2 3.97Å; E478-R481 IonicContact OE2-CZ 3.72Å; E478-R481 IonicContact OE2-NH1 2.63Å; E478-R481 PolarHBondContact OE2-NH1 2.87Å; E478-R481 IonicContact OE2-NH2 2.69Å; E478-R481 PolarHBondContact OE2-NH2 3.22Å; E478-I482 WeakPolarHBondContact O-CB 3.46Å; E478-I482 WeakPolarHBondContact O-CD1 3.46Å; E478-I482 VanDerWaalsContact O-CG1 3.28Å; E478-I482 WeakPolarHBondContact O-CG1 3.44Å; E478-I482 PolarHBondContact O-N 2.82Å
479	Y	95.2	Very high	92	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-56.7	-53.1	176.6	178.9	-90.3	0	0	0	111.9	F392 Q449 I452 I475 L476 I477 R481 I482 F483 V490 F494	F392-Y479 AromaticContact CD1-CD2 3.87Å; F392-Y479 HydrophobicContact CD1-CD2 3.87Å; F392-Y479 HydrophobicContact CD1-CE2 4.43Å; F392-Y479 HydrophobicContact CD2-CD2 4.08Å; F392-Y479 AromaticContact CE1-CD2 3.9Å; F392-Y479 HydrophobicContact CE1-CD2 3.9Å; F392-Y479 HydrophobicContact CE2-CD2 4.1Å; F392-Y479 HydrophobicContact CE2-CG 4.48Å; F392-Y479 AromaticContact CG-CD2 3.98Å; F392-Y479 HydrophobicContact CG-CD2 3.98Å; F392-Y479 HydrophobicContact CZ-CD2 4.02Å; Q449-Y479 VanDerWaalsContact CG-OH 3.3Å; Q449-Y479 WeakPolarHBondContact CG-OH 3.46Å; Q449-Y479 PolarHBondContact OE1-OH 3.22Å; I452-Y479 HydrophobicContact CD1-CE2 4.01Å; I452-Y479 HydrophobicContact CG2-CD2 4.4Å; I452-Y479 HydrophobicContact CG2-CE2 3.93Å; I475-Y479 WeakPolarHBondContact O-CB 3.49Å; I475-Y479 PolarHBondContact O-N 3.45Å; L476-Y479 WeakPolarHBondContact O-CB 3.25Å; L476-Y479 PolarHBondContact O-N 3.43Å; I477-Y479 VanDerWaalsContact C-N 3.34Å; Y479-R481 VanDerWaalsContact C-N 3.33Å; Y479-R481 PolarHBondContact O-N 3.24Å; Y479-I482 PolarHBondContact O-N 2.89Å; Y479-F483 HydrophobicContact CD1-CD2 4.4Å; Y479-F483 HydrophobicContact CD2-CD2 4.01Å; Y479-F483 AromaticContact CD2-CE2 3.69Å; Y479-F483 HydrophobicContact CD2-CE2 3.69Å; Y479-F483 HydrophobicContact CD2-CZ 4.42Å; Y479-F483 HydrophobicContact CE1-CD1 4.5Å; Y479-F483 HydrophobicContact CE1-CD2 4.18Å; Y479-F483 HydrophobicContact CE1-CE2 4.31Å; Y479-F483 HydrophobicContact CE1-CG 4.29Å; Y479-F483 AromaticContact CE2-CD2 3.78Å; Y479-F483 HydrophobicContact CE2-CD2 3.78Å; Y479-F483 HydrophobicContact CE2-CE1 4.28Å; Y479-F483 AromaticContact CE2-CE2 3.18Å; Y479-F483 HydrophobicContact CE2-CE2 3.18Å; Y479-F483 AromaticContact CE2-CZ 3.48Å; Y479-F483 HydrophobicContact CE2-CZ 3.48Å; Y479-F483 VanDerWaalsContact CE2-CZ 3.48Å; Y479-F483 HydrophobicContact CG-CD2 4.31Å; Y479-F483 HydrophobicContact CG-CE2 4.43Å; Y479-F483 AromaticContact CZ-CD2 3.87Å; Y479-F483 AromaticContact CZ-CE1 3.88Å; Y479-F483 AromaticContact CZ-CE2 3.54Å; Y479-F483 AromaticContact CZ-CZ 3.55Å; Y479-F483 VanDerWaalsContact O-CD2 3.32Å; Y479-F483 WeakPolarHBondContact O-CD2 3.47Å; Y479-F483 PolarHBondContact O-N 3.18Å; Y479-F483 WeakPolarHBondContact OH-CE1 3.28Å; Y479-F483 WeakPolarHBondContact OH-CZ 3.25Å; Y479-V490 HydrophobicContact CE1-CG1 3.99Å; Y479-F494 AromaticContact CD1-CD1 3.77Å; Y479-F494 HydrophobicContact CD1-CD1 3.77Å; Y479-F494 AromaticContact CD1-CE1 3.95Å; Y479-F494 HydrophobicContact CD1-CE1 3.95Å; Y479-F494 HydrophobicContact CD1-CG 4.2Å; Y479-F494 AromaticContact CE1-CD1 3.63Å; Y479-F494 HydrophobicContact CE1-CD1 3.63Å; Y479-F494 AromaticContact CE1-CD2 3.93Å; Y479-F494 HydrophobicContact CE1-CD2 3.93Å; Y479-F494 AromaticContact CE1-CE1 3.59Å; Y479-F494 HydrophobicContact CE1-CE1 3.59Å; Y479-F494 AromaticContact CE1-CE2 3.91Å; Y479-F494 HydrophobicContact CE1-CE2 3.91Å; Y479-F494 AromaticContact CE1-CG 3.8Å; Y479-F494 HydrophobicContact CE1-CG 3.8Å; Y479-F494 AromaticContact CE1-CZ 3.73Å; Y479-F494 HydrophobicContact CE1-CZ 3.73Å; Y479-F494 HydrophobicContact CE2-CE1 4.25Å; Y479-F494 HydrophobicContact CE2-CZ 4.29Å; Y479-F494 HydrophobicContact CG-CE1 4.44Å; Y479-F494 AromaticContact CZ-CE1 3.75Å; Y479-F494 AromaticContact CZ-CE2 3.98Å; Y479-F494 AromaticContact CZ-CZ 3.58Å; Y479-F494 WeakPolarHBondContact OH-CZ 3.47Å
480	I	94.2	Very high	92.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.7	-44.4	-179.3	-68.5	164.6	0	0	0	110.8	L476 I477 F483 S484 V490 Y495 L498 L519	L476-I480 HydrophobicContact CD2-CD1 3.86Å; L476-I480 HydrophobicContact CG-CD1 4.34Å; L476-I480 WeakPolarHBondContact O-CG1 3.35Å; L476-I480 PolarHBondContact O-N 3.15Å; I477-I480 PolarHBondContact O-N 2.89Å; I480-F483 PolarHBondContact O-N 2.74Å; I480-S484 VanDerWaalsContact O-CB 3.29Å; I480-S484 WeakPolarHBondContact O-CB 3.48Å; I480-S484 PolarHBondContact O-N 2.74Å; I480-S484 PolarHBondContact O-OG 2.97Å; I480-V490 HydrophobicContact CG1-CG1 4.35Å; I480-Y495 HydrophobicContact CD1-CD1 3.98Å; I480-Y495 HydrophobicContact CD1-CE1 4.01Å; I480-Y495 HydrophobicContact CG1-CE1 4.22Å; I480-Y495 HydrophobicContact CG2-CE1 4.03Å; I480-L498 HydrophobicContact CD1-CD2 3.84Å; I480-L519 HydrophobicContact CG2-CD1 4.1Å; I480-L519 HydrophobicContact CG2-CG 4.32Å
481	R	93.3	Very high	92.2	Very high	110 Å²	110	43.3 Å²	43.3	42%	0.415	23%	0.228	S	C	.	.	H	α-helix	trans	-60	-49.3	179.9	-170.3	-170	74.9	-124.7	-5.4	110.9	I477 E478 Y479 S484 E485	I477-R481 WeakPolarHBondContact O-CB 3.44Å; I477-R481 PolarHBondContact O-N 2.68Å; E478-R481 PolarHBondContact O-N 2.86Å; E478-R481 IonicContact OE1-CZ 2.89Å; E478-R481 IonicContact OE1-NH1 3.22Å; E478-R481 PolarHBondContact OE1-NH1 2.86Å; E478-R481 IonicContact OE1-NH2 3.97Å; E478-R481 IonicContact OE2-CZ 3.72Å; E478-R481 IonicContact OE2-NH1 2.63Å; E478-R481 PolarHBondContact OE2-NH1 2.87Å; E478-R481 IonicContact OE2-NH2 2.69Å; E478-R481 PolarHBondContact OE2-NH2 3.22Å; Y479-R481 VanDerWaalsContact C-N 3.33Å; Y479-R481 PolarHBondContact O-N 3.24Å; R481-S484 PolarHBondContact O-N 3.17Å; R481-E485 WeakPolarHBondContact O-CB 3.36Å; R481-E485 PolarHBondContact O-N 3.49Å
482	I	94.3	Very high	92.1	Very high	5 Å²	5	47.8 Å²	47.8	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-44.1	-176.8	-70.3	166	0	0	0	110.9	A389 F392 K393 E478 Y479 S484 E485 H486	A389-I482 VanDerWaalsContact CA-CD1 3.46Å; A389-I482 HydrophobicContact CB-CD1 3.84Å; A389-I482 WeakPolarHBondContact O-CD1 3.24Å; F392-I482 HydrophobicContact CB-CB 4.44Å; F392-I482 HydrophobicContact CB-CD1 3.91Å; F392-I482 HydrophobicContact CB-CG2 4.08Å; F392-I482 HydrophobicContact CD2-CD1 4.35Å; K393-I482 HydrophobicContact CB-CG2 4.26Å; E478-I482 WeakPolarHBondContact O-CB 3.46Å; E478-I482 WeakPolarHBondContact O-CD1 3.46Å; E478-I482 VanDerWaalsContact O-CG1 3.28Å; E478-I482 WeakPolarHBondContact O-CG1 3.44Å; E478-I482 PolarHBondContact O-N 2.82Å; Y479-I482 PolarHBondContact O-N 2.89Å; I482-S484 VanDerWaalsContact C-N 3.31Å; I482-S484 PolarHBondContact O-N 3.2Å; I482-E485 PolarHBondContact O-N 2.97Å; I482-H486 PolarHBondContact O-N 3.47Å; I482-H486 VanDerWaalsContact O-N 3.16Å; I482-H486 PolarHBondContact O-ND1 3.45Å
483	F	92.7	Very high	92	Very high	1 Å²	1	48.9 Å²	48.9	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-63.7	-40.7	178	-87.4	-115.4	0	0	0	111.6	F392 C396 Q449 I452 Y479 I480 H486 D487 I488 V490	F392-F483 HydrophobicContact CB-CE2 4.49Å; C396-F483 VanDerWaalsContact SG-CD2 3.59Å; C396-F483 WeakPolarHBondContact SG-CE2 3.3Å; Q449-F483 HydrophobicContact CG-CE1 3.86Å; I452-F483 HydrophobicContact CD1-CZ 4.46Å; Y479-F483 HydrophobicContact CD1-CD2 4.4Å; Y479-F483 HydrophobicContact CD2-CD2 4.01Å; Y479-F483 AromaticContact CD2-CE2 3.69Å; Y479-F483 HydrophobicContact CD2-CE2 3.69Å; Y479-F483 HydrophobicContact CD2-CZ 4.42Å; Y479-F483 HydrophobicContact CE1-CD1 4.5Å; Y479-F483 HydrophobicContact CE1-CD2 4.18Å; Y479-F483 HydrophobicContact CE1-CE2 4.31Å; Y479-F483 HydrophobicContact CE1-CG 4.29Å; Y479-F483 AromaticContact CE2-CD2 3.78Å; Y479-F483 HydrophobicContact CE2-CD2 3.78Å; Y479-F483 HydrophobicContact CE2-CE1 4.28Å; Y479-F483 AromaticContact CE2-CE2 3.18Å; Y479-F483 HydrophobicContact CE2-CE2 3.18Å; Y479-F483 AromaticContact CE2-CZ 3.48Å; Y479-F483 HydrophobicContact CE2-CZ 3.48Å; Y479-F483 VanDerWaalsContact CE2-CZ 3.48Å; Y479-F483 HydrophobicContact CG-CD2 4.31Å; Y479-F483 HydrophobicContact CG-CE2 4.43Å; Y479-F483 AromaticContact CZ-CD2 3.87Å; Y479-F483 AromaticContact CZ-CE1 3.88Å; Y479-F483 AromaticContact CZ-CE2 3.54Å; Y479-F483 AromaticContact CZ-CZ 3.55Å; Y479-F483 VanDerWaalsContact O-CD2 3.32Å; Y479-F483 WeakPolarHBondContact O-CD2 3.47Å; Y479-F483 PolarHBondContact O-N 3.18Å; Y479-F483 WeakPolarHBondContact OH-CE1 3.28Å; Y479-F483 WeakPolarHBondContact OH-CZ 3.25Å; I480-F483 PolarHBondContact O-N 2.74Å; F483-H486 PolarHBondContact O-N 3.5Å; F483-D487 PolarHBondContact O-N 3.05Å; F483-I488 HydrophobicContact CB-CB 4.41Å; F483-I488 HydrophobicContact CD1-CB 3.97Å; F483-I488 HydrophobicContact CD1-CD1 4.45Å; F483-I488 HydrophobicContact CD1-CG2 3.62Å; F483-I488 HydrophobicContact CE1-CG2 4.09Å; F483-I488 PolarHBondContact O-N 3.02Å; F483-V490 HydrophobicContact CB-CG2 3.52Å; F483-V490 HydrophobicContact CD1-CG2 4.45Å; F483-V490 HydrophobicContact CG-CG2 4.24Å
484	S	90.7	Very high	92	Very high	60 Å²	60	47 Å²	47	42%	0.42	25%	0.25	S	S	.	.	H	α-helix	trans	-66.9	-37.1	176.2	-61.8	0	0	0	0	112.5	I480 R481 I482 H486 D487	I480-S484 VanDerWaalsContact O-CB 3.29Å; I480-S484 WeakPolarHBondContact O-CB 3.48Å; I480-S484 PolarHBondContact O-N 2.74Å; I480-S484 PolarHBondContact O-OG 2.97Å; R481-S484 PolarHBondContact O-N 3.17Å; I482-S484 VanDerWaalsContact C-N 3.31Å; I482-S484 PolarHBondContact O-N 3.2Å; S484-H486 PolarHBondContact O-N 3.17Å; S484-D487 PolarHBondContact O-N 3.31Å
485	E	91.7	Very high	92	Very high	132 Å²	132	45.5 Å²	45.5	62%	0.617	24%	0.238	S	C	*	.	H	α-helix	trans	-64	-27.8	175.2	-173.3	179.5	175.7	0	0	112.5	R481 I482	R481-E485 WeakPolarHBondContact O-CB 3.36Å; R481-E485 PolarHBondContact O-N 3.49Å; I482-E485 PolarHBondContact O-N 2.97Å
486	H	90	Very high	91.7	Very high	43 Å²	43	49.9 Å²	49.9	20%	0.199	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	12.8	177.3	-65.5	74.4	0	0	0	113.3	C396 I482 F483 S484 I488	C396-H486 HydrophobicContact CB-CB 4.11Å; I482-H486 PolarHBondContact O-N 3.47Å; I482-H486 VanDerWaalsContact O-N 3.16Å; I482-H486 PolarHBondContact O-ND1 3.45Å; F483-H486 PolarHBondContact O-N 3.5Å; S484-H486 PolarHBondContact O-N 3.17Å; H486-I488 HydrophobicContact CB-CD1 3.9Å; H486-I488 HydrophobicContact CB-CG1 4.11Å; H486-I488 PolarHBondContact O-N 2.78Å
487	D	89.3	Confident	91.5	Very high	156 Å²	156	50.2 Å²	50.2	83%	0.834	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	34.1	-176.9	-61.5	-49	0	0	0	113.7	F483 S484	F483-D487 PolarHBondContact O-N 3.05Å; S484-D487 PolarHBondContact O-N 3.31Å
488	I	88.2	Confident	91.5	Very high	22 Å²	22	48.4 Å²	48.4	11%	0.113	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-103.3	123.7	178.4	-55.4	168.5	0	0	0	109.4	C396 Y400 F483 H486 V490	C396-I488 HydrophobicContact CB-CD1 3.79Å; Y400-I488 HydrophobicContact CD2-CD1 3.7Å; Y400-I488 HydrophobicContact CG-CD1 3.71Å; Y400-I488 HydrophobicContact CG-CG1 4.35Å; F483-I488 HydrophobicContact CB-CB 4.41Å; F483-I488 HydrophobicContact CD1-CB 3.97Å; F483-I488 HydrophobicContact CD1-CD1 4.45Å; F483-I488 HydrophobicContact CD1-CG2 3.62Å; F483-I488 HydrophobicContact CE1-CG2 4.09Å; F483-I488 PolarHBondContact O-N 3.02Å; H486-I488 HydrophobicContact CB-CD1 3.9Å; H486-I488 HydrophobicContact CB-CG1 4.11Å; H486-I488 PolarHBondContact O-N 2.78Å; I488-V490 PolarHBondContact O-N 2.85Å
489	C	89.8	Confident	91.4	Very high	114 Å²	114	46.6 Å²	46.6	77%	0.77	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-63.3	124.8	173.4	-66.3	0	0	0	0	110.7	Q449	Q449-C489 PolarHBondContact NE2-O 2.99Å
490	V	91.8	Very high	91.1	Very high	10 Å²	10	49.6 Å²	49.6	6%	0.061	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-82.7	134.2	176.1	175.7	0	0	0	0	110.2	Y479 I480 F483 I488 F494 Y495	Y479-V490 HydrophobicContact CE1-CG1 3.99Å; I480-V490 HydrophobicContact CG1-CG1 4.35Å; F483-V490 HydrophobicContact CB-CG2 3.52Å; F483-V490 HydrophobicContact CD1-CG2 4.45Å; F483-V490 HydrophobicContact CG-CG2 4.24Å; I488-V490 PolarHBondContact O-N 2.85Å; V490-F494 HydrophobicContact CG1-CB 3.72Å; V490-F494 HydrophobicContact CG1-CD2 3.96Å; V490-F494 HydrophobicContact CG1-CG 4.04Å; V490-Y495 HydrophobicContact CB-CE2 4.06Å; V490-Y495 HydrophobicContact CG1-CE1 4.45Å; V490-Y495 HydrophobicContact CG1-CE2 4.23Å
491	D	91.3	Very high	90.9	Very high	69 Å²	69	50.6 Å²	50.6	37%	0.369	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-61.7	141.5	176.9	-73.5	-9	0	0	0	111.5	Q449 C493 F494	Q449-D491 HydrophobicContact CB-CB 4.48Å; Q449-D491 VanDerWaalsContact CB-OD2 3.25Å; Q449-D491 WeakPolarHBondContact CB-OD2 3.39Å; D491-C493 PolarHBondContact O-N 2.91Å; D491-C493 VanDerWaalsContact O-N 3.09Å; D491-F494 HydrophobicContact CB-CD2 4.06Å; D491-F494 HydrophobicContact CB-CE2 4.24Å; D491-F494 PolarHBondContact O-N 3.11Å; D491-F494 VanDerWaalsContact O-N 3.1Å
492	H	88.4	Confident	90.8	Very high	107 Å²	107	45.3 Å²	45.3	50%	0.495	24%	0.244	S	C	.	.	H	α-helix	trans	-60.4	-25.6	-173.6	-68.6	-13.6	0	0	0	114.7	F494 Y495 E496	H492-F494 PolarHBondContact O-N 2.8Å; H492-Y495 PolarHBondContact O-N 3.49Å; H492-Y495 VanDerWaalsContact O-N 3.13Å; H492-E496 PolarHBondContact O-N 2.85Å
493	C	89.9	Confident	90.6	Very high	35 Å²	35	46.2 Å²	46.2	24%	0.236	25%	0.249	C	C	.	.	H	α-helix	trans	-59.7	-30.7	177	57.4	0	0	0	0	113.1	Y453 D491 M497	Y453-C493 HydrophobicContact CD2-CB 4.29Å; Y453-C493 HydrophobicContact CE1-CB 4.35Å; Y453-C493 HydrophobicContact CE2-CB 4.04Å; D491-C493 PolarHBondContact O-N 2.91Å; D491-C493 VanDerWaalsContact O-N 3.09Å; C493-M497 WeakPolarHBondContact O-CB 3.37Å; C493-M497 PolarHBondContact O-N 2.96Å; C493-M497 VanDerWaalsContact O-N 3.12Å
494	F	92.7	Very high	90.4	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69.9	-42.9	176.1	-68.5	-89.1	0	0	0	111.1	Q449 I452 Y453 F457 L476 Y479 V490 D491 H492 M497 L498	Q449-F494 HydrophobicContact CB-CE2 4.03Å; Q449-F494 WeakPolarHBondContact O-CZ 3.36Å; I452-F494 HydrophobicContact CG2-CZ 4.48Å; Y453-F494 HydrophobicContact CD2-CD1 4.19Å; Y453-F494 HydrophobicContact CD2-CE1 4.03Å; Y453-F494 HydrophobicContact CD2-CE2 4.38Å; Y453-F494 HydrophobicContact CD2-CG 4.45Å; Y453-F494 HydrophobicContact CD2-CZ 4.14Å; Y453-F494 HydrophobicContact CG-CZ 4.41Å; F457-F494 HydrophobicContact CD2-CE1 4.16Å; F457-F494 HydrophobicContact CE2-CD1 4.35Å; F457-F494 AromaticContact CE2-CE1 3.8Å; F457-F494 HydrophobicContact CE2-CE1 3.8Å; L476-F494 HydrophobicContact CD1-CB 4.46Å; L476-F494 HydrophobicContact CD1-CD1 3.85Å; L476-F494 WeakPolarHBondContact CD2-O 3.4Å; Y479-F494 AromaticContact CD1-CD1 3.77Å; Y479-F494 HydrophobicContact CD1-CD1 3.77Å; Y479-F494 AromaticContact CD1-CE1 3.95Å; Y479-F494 HydrophobicContact CD1-CE1 3.95Å; Y479-F494 HydrophobicContact CD1-CG 4.2Å; Y479-F494 AromaticContact CE1-CD1 3.63Å; Y479-F494 HydrophobicContact CE1-CD1 3.63Å; Y479-F494 AromaticContact CE1-CD2 3.93Å; Y479-F494 HydrophobicContact CE1-CD2 3.93Å; Y479-F494 AromaticContact CE1-CE1 3.59Å; Y479-F494 HydrophobicContact CE1-CE1 3.59Å; Y479-F494 AromaticContact CE1-CE2 3.91Å; Y479-F494 HydrophobicContact CE1-CE2 3.91Å; Y479-F494 AromaticContact CE1-CG 3.8Å; Y479-F494 HydrophobicContact CE1-CG 3.8Å; Y479-F494 AromaticContact CE1-CZ 3.73Å; Y479-F494 HydrophobicContact CE1-CZ 3.73Å; Y479-F494 HydrophobicContact CE2-CE1 4.25Å; Y479-F494 HydrophobicContact CE2-CZ 4.29Å; Y479-F494 HydrophobicContact CG-CE1 4.44Å; Y479-F494 AromaticContact CZ-CE1 3.75Å; Y479-F494 AromaticContact CZ-CE2 3.98Å; Y479-F494 AromaticContact CZ-CZ 3.58Å; Y479-F494 WeakPolarHBondContact OH-CZ 3.47Å; V490-F494 HydrophobicContact CG1-CB 3.72Å; V490-F494 HydrophobicContact CG1-CD2 3.96Å; V490-F494 HydrophobicContact CG1-CG 4.04Å; D491-F494 HydrophobicContact CB-CD2 4.06Å; D491-F494 HydrophobicContact CB-CE2 4.24Å; D491-F494 PolarHBondContact O-N 3.11Å; D491-F494 VanDerWaalsContact O-N 3.1Å; H492-F494 PolarHBondContact O-N 2.8Å; F494-M497 PolarHBondContact O-N 3.1Å; F494-L498 PolarHBondContact O-N 2.88Å
495	Y	92	Very high	90.3	Very high	14 Å²	14	51.5 Å²	51.5	6%	0.055	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-45.3	177.6	-62.6	-50.2	0	0	0	112	I480 V490 H492 M497 L498 V499 L519 L520 A521	I480-Y495 HydrophobicContact CD1-CD1 3.98Å; I480-Y495 HydrophobicContact CD1-CE1 4.01Å; I480-Y495 HydrophobicContact CG1-CE1 4.22Å; I480-Y495 HydrophobicContact CG2-CE1 4.03Å; V490-Y495 HydrophobicContact CB-CE2 4.06Å; V490-Y495 HydrophobicContact CG1-CE1 4.45Å; V490-Y495 HydrophobicContact CG1-CE2 4.23Å; H492-Y495 PolarHBondContact O-N 3.49Å; H492-Y495 VanDerWaalsContact O-N 3.13Å; Y495-M497 VanDerWaalsContact C-N 3.27Å; Y495-M497 PolarHBondContact O-N 2.82Å; Y495-L498 WeakPolarHBondContact O-CB 3.21Å; Y495-L498 PolarHBondContact O-N 2.73Å; Y495-L498 VanDerWaalsContact O-N 3.14Å; Y495-V499 WeakPolarHBondContact O-CG2 3.48Å; Y495-V499 PolarHBondContact O-N 3.11Å; Y495-L519 WeakPolarHBondContact CE1-O 3.31Å; Y495-L520 HydrophobicContact CD1-CD2 3.58Å; Y495-L520 HydrophobicContact CG-CD2 4.15Å; Y495-A521 HydrophobicContact CD2-CB 4.06Å; Y495-A521 HydrophobicContact CE1-CB 4.47Å; Y495-A521 HydrophobicContact CE2-CB 3.39Å
496	E	89.4	Confident	90.2	Very high	93 Å²	93	47.1 Å²	47.1	44%	0.435	25%	0.252	S	S	.	.	H	α-helix	trans	-58.3	-42.3	176.2	-169.5	-172	158.5	0	0	111.4	H492 V499 N500	H492-E496 PolarHBondContact O-N 2.85Å; E496-V499 PolarHBondContact O-N 3.43Å; E496-N500 WeakPolarHBondContact O-CB 3.2Å; E496-N500 PolarHBondContact O-N 2.82Å; E496-N500 PolarHBondContact O-ND2 2.95Å
497	M	90.2	Very high	90.2	Very high	8 Å²	8	47.1 Å²	47.1	4%	0.039	25%	0.253	C	S	.	.	H	α-helix	trans	-67.6	-37.1	177	-170.8	162.1	69	0	0	112.7	Y453 F457 Q461 L476 C493 F494 Y495 V499 N500 L501	Y453-M497 HydrophobicContact CD2-CE 4.09Å; Y453-M497 HydrophobicContact CE2-CB 4.24Å; Y453-M497 HydrophobicContact CE2-CE 3.63Å; Y453-M497 HydrophobicContact CE2-SD 3.77Å; F457-M497 HydrophobicContact CB-CE 3.23Å; F457-M497 HydrophobicContact CB-SD 3.69Å; F457-M497 HydrophobicContact CD1-CE 3.29Å; F457-M497 HydrophobicContact CD1-SD 4.42Å; F457-M497 HydrophobicContact CD2-CE 3.82Å; F457-M497 HydrophobicContact CE1-CE 4.01Å; F457-M497 HydrophobicContact CE2-CE 4.47Å; F457-M497 HydrophobicContact CG-CE 3.16Å; F457-M497 HydrophobicContact CG-SD 4.26Å; Q461-M497 PolarHBondContact NE2-SD 3.2Å; Q461-M497 VanDerWaalsContact NE2-SD 3.4Å; L476-M497 HydrophobicContact CD1-CE 3.26Å; C493-M497 WeakPolarHBondContact O-CB 3.37Å; C493-M497 PolarHBondContact O-N 2.96Å; C493-M497 VanDerWaalsContact O-N 3.12Å; F494-M497 PolarHBondContact O-N 3.1Å; Y495-M497 VanDerWaalsContact C-N 3.27Å; Y495-M497 PolarHBondContact O-N 2.82Å; M497-V499 VanDerWaalsContact C-N 3.33Å; M497-V499 PolarHBondContact O-N 2.85Å; M497-N500 PolarHBondContact O-N 2.82Å; M497-L501 HydrophobicContact CG-CD1 4.03Å; M497-L501 HydrophobicContact CG-CG 4.28Å; M497-L501 WeakPolarHBondContact O-CB 3.46Å; M497-L501 VanDerWaalsContact O-CG 3.3Å; M497-L501 WeakPolarHBondContact O-CG 3.16Å; M497-L501 PolarHBondContact O-N 3.48Å
498	L	92.3	Very high	90.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.2	-45.7	174.4	-169.4	47.9	0	0	0	111.3	R473 L476 I477 I480 F494 Y495 L501 T502 Y514 L519 L520	R473-L498 HydrophobicContact CG-CD1 3.94Å; L476-L498 HydrophobicContact CD2-CB 3.33Å; L476-L498 HydrophobicContact CD2-CD1 3.74Å; L476-L498 HydrophobicContact CD2-CD2 4.13Å; L476-L498 HydrophobicContact CD2-CG 3.88Å; I477-L498 HydrophobicContact CG1-CD1 4.24Å; I477-L498 HydrophobicContact CG1-CD2 4.43Å; I480-L498 HydrophobicContact CD1-CD2 3.84Å; F494-L498 PolarHBondContact O-N 2.88Å; Y495-L498 WeakPolarHBondContact O-CB 3.21Å; Y495-L498 PolarHBondContact O-N 2.73Å; Y495-L498 VanDerWaalsContact O-N 3.14Å; L498-L501 PolarHBondContact O-N 2.62Å; L498-T502 WeakPolarHBondContact O-CB 3.35Å; L498-T502 PolarHBondContact O-N 2.89Å; L498-T502 PolarHBondContact O-OG1 3.15Å; L498-Y514 HydrophobicContact CD1-CE2 4.34Å; L498-Y514 HydrophobicContact CD2-CD2 4.29Å; L498-Y514 HydrophobicContact CG-CD2 4.42Å; L498-Y514 HydrophobicContact CG-CE2 4.48Å; L498-L519 HydrophobicContact CD2-CD2 4.4Å; L498-L520 HydrophobicContact CB-CD2 4.17Å; L498-L520 HydrophobicContact CD2-CD2 3.81Å; L498-L520 HydrophobicContact CG-CD2 4.35Å
499	V	91.2	Very high	90.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-51.1	178	174.9	0	0	0	0	109.6	Y495 E496 M497 L501 T502 V503 L511 L520 T526 Q529 L533	Y495-V499 WeakPolarHBondContact O-CG2 3.48Å; Y495-V499 PolarHBondContact O-N 3.11Å; E496-V499 PolarHBondContact O-N 3.43Å; M497-V499 VanDerWaalsContact C-N 3.33Å; M497-V499 PolarHBondContact O-N 2.85Å; V499-L501 PolarHBondContact O-N 2.85Å; V499-T502 PolarHBondContact O-N 3.18Å; V499-T502 VanDerWaalsContact O-N 3.16Å; V499-V503 HydrophobicContact CG1-CG2 4.21Å; V499-V503 WeakPolarHBondContact O-CB 3.25Å; V499-V503 VanDerWaalsContact O-CG2 3.24Å; V499-V503 WeakPolarHBondContact O-CG2 3.47Å; V499-V503 PolarHBondContact O-N 2.74Å; V499-L511 HydrophobicContact CB-CD1 4.47Å; V499-L511 HydrophobicContact CG1-CD1 4.28Å; V499-L511 HydrophobicContact CG2-CD1 4.03Å; V499-L520 HydrophobicContact CG2-CD1 3.78Å; V499-L520 HydrophobicContact CG2-CD2 4.43Å; V499-T526 HydrophobicContact CG2-CG2 4.01Å; V499-Q529 HydrophobicContact CG1-CG 4.19Å; V499-L533 HydrophobicContact CG1-CD1 4.15Å
500	N	90	Very high	90.4	Very high	63 Å²	63	44.2 Å²	44.2	34%	0.337	23%	0.228	S	C	.	.	H	α-helix	trans	-56.8	-44.9	178.5	-80.3	-36.8	0	0	0	112.8	E496 M497 R504 Q529	E496-N500 WeakPolarHBondContact O-CB 3.2Å; E496-N500 PolarHBondContact O-N 2.82Å; E496-N500 PolarHBondContact O-ND2 2.95Å; M497-N500 PolarHBondContact O-N 2.82Å; N500-R504 WeakPolarHBondContact O-CB 3.47Å; N500-R504 VanDerWaalsContact O-CG 3.26Å; N500-R504 WeakPolarHBondContact O-CG 3.35Å; N500-R504 PolarHBondContact O-N 3.09Å; N500-Q529 PolarHBondContact ND2-NE2 3.48Å; N500-Q529 PolarHBondContact OD1-NE2 2.93Å
501	L	90.5	Very high	90.3	Very high	20 Å²	20	43.9 Å²	43.9	11%	0.105	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-43.1	177.4	-74.7	171.5	0	0	0	111.7	R469 F472 M497 L498 V499 R504 M505	R469-L501 HydrophobicContact CB-CD2 4.3Å; R469-L501 HydrophobicContact CG-CD2 4.18Å; F472-L501 HydrophobicContact CB-CD1 3.83Å; M497-L501 HydrophobicContact CG-CD1 4.03Å; M497-L501 HydrophobicContact CG-CG 4.28Å; M497-L501 WeakPolarHBondContact O-CB 3.46Å; M497-L501 VanDerWaalsContact O-CG 3.3Å; M497-L501 WeakPolarHBondContact O-CG 3.16Å; M497-L501 PolarHBondContact O-N 3.48Å; L498-L501 PolarHBondContact O-N 2.62Å; V499-L501 PolarHBondContact O-N 2.85Å; L501-R504 PolarHBondContact O-N 3.03Å; L501-M505 VanDerWaalsContact O-CG 3.31Å; L501-M505 WeakPolarHBondContact O-CG 3.34Å; L501-M505 PolarHBondContact O-N 2.92Å; L501-M505 VanDerWaalsContact O-N 3.16Å
502	T	90.9	Very high	90.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-68.2	-41.3	-177.4	-52.8	0	0	0	0	111.5	L498 V499 M505 G506 D507 L511 Y514	L498-T502 WeakPolarHBondContact O-CB 3.35Å; L498-T502 PolarHBondContact O-N 2.89Å; L498-T502 PolarHBondContact O-OG1 3.15Å; V499-T502 PolarHBondContact O-N 3.18Å; V499-T502 VanDerWaalsContact O-N 3.16Å; T502-M505 PolarHBondContact O-N 3.2Å; T502-G506 PolarHBondContact O-N 2.93Å; T502-D507 HydrophobicContact CG2-CB 4.26Å; T502-D507 VanDerWaalsContact CG2-O 3.25Å; T502-D507 WeakPolarHBondContact CG2-O 3.49Å; T502-D507 PolarHBondContact O-N 3.35Å; T502-L511 HydrophobicContact CG2-CB 3.89Å; T502-Y514 HydrophobicContact CG2-CE2 4.43Å
503	V	90.1	Very high	90.3	Very high	24 Å²	24	41.5 Å²	41.5	15%	0.145	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-47.2	173.8	171.4	0	0	0	0	111	V499 M505 G506 Y508 L511 L533	V499-V503 HydrophobicContact CG1-CG2 4.21Å; V499-V503 WeakPolarHBondContact O-CB 3.25Å; V499-V503 VanDerWaalsContact O-CG2 3.24Å; V499-V503 WeakPolarHBondContact O-CG2 3.47Å; V499-V503 PolarHBondContact O-N 2.74Å; V503-M505 PolarHBondContact O-N 2.88Å; V503-M505 VanDerWaalsContact O-N 3.12Å; V503-G506 PolarHBondContact O-N 3.42Å; V503-Y508 HydrophobicContact CG1-CE1 4.49Å; V503-L511 HydrophobicContact CG2-CD2 4.14Å; V503-L533 HydrophobicContact CB-CD2 4.43Å; V503-L533 HydrophobicContact CG1-CD2 3.61Å; V503-L533 HydrophobicContact CG2-CD1 3.47Å; V503-L533 VanDerWaalsContact CG2-CD1 3.47Å; V503-L533 HydrophobicContact CG2-CD2 3.96Å; V503-L533 HydrophobicContact CG2-CG 4.37Å
504	R	88.7	Confident	90.4	Very high	142 Å²	142	40.3 Å²	40.3	54%	0.536	20%	0.203	S	C	.	.	H	α-helix	trans	-63	-17.6	177.2	-75.2	179	179.7	-171.8	0.5	113.8	R469 N500 L501	R469-R504 PolarHBondContact NH1-O 3.25Å; N500-R504 WeakPolarHBondContact O-CB 3.47Å; N500-R504 VanDerWaalsContact O-CG 3.26Å; N500-R504 WeakPolarHBondContact O-CG 3.35Å; N500-R504 PolarHBondContact O-N 3.09Å; L501-R504 PolarHBondContact O-N 3.03Å
505	M	88.8	Confident	90.1	Very high	29 Å²	29	40.4 Å²	40.4	14%	0.143	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-8.9	173.6	-67.7	-166	-67.3	0	0	113.5	L466 R469 K470 R473 L501 T502 V503 D507	L466-M505 HydrophobicContact CD1-CB 4.09Å; L466-M505 HydrophobicContact CD1-CG 3.76Å; L466-M505 HydrophobicContact CD1-SD 4.34Å; R469-M505 HydrophobicContact CB-CG 3.82Å; R469-M505 HydrophobicContact CB-SD 3.73Å; K470-M505 HydrophobicContact CB-SD 4.3Å; K470-M505 HydrophobicContact CG-SD 3.51Å; K470-M505 VanDerWaalsContact CG-SD 3.51Å; R473-M505 HydrophobicContact CB-CE 3.92Å; R473-M505 VanDerWaalsContact CD-CE 3.43Å; R473-M505 HydrophobicContact CG-CE 4.23Å; L501-M505 VanDerWaalsContact O-CG 3.31Å; L501-M505 WeakPolarHBondContact O-CG 3.34Å; L501-M505 PolarHBondContact O-N 2.92Å; L501-M505 VanDerWaalsContact O-N 3.16Å; T502-M505 PolarHBondContact O-N 3.2Å; V503-M505 PolarHBondContact O-N 2.88Å; V503-M505 VanDerWaalsContact O-N 3.12Å; M505-D507 VanDerWaalsContact C-N 3.27Å; M505-D507 PolarHBondContact O-N 3.16Å
506	G	89.1	Confident	89.9	Confident	40 Å²	40	46.5 Å²	46.5	41%	0.412	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	15.5	-177.1	0	0	0	0	0	114.7	T502 V503 Y508	T502-G506 PolarHBondContact O-N 2.93Å; V503-G506 PolarHBondContact O-N 3.42Å; G506-Y508 WeakPolarHBondContact O-CD2 3.25Å; G506-Y508 PolarHBondContact O-N 3.13Å
507	D	89.8	Confident	89.8	Confident	44 Å²	44	44.8 Å²	44.8	24%	0.235	23%	0.231	C	C	.	.			trans	-92.9	65.2	-175.2	-168	-4	0	0	0	111.8	R473 T502 M505 T509 Q510 L511	R473-D507 IonicContact CZ-OD2 2.94Å; R473-D507 IonicContact NH1-OD2 2.63Å; R473-D507 PolarHBondContact NH1-OD2 2.84Å; R473-D507 IonicContact NH2-OD2 3.13Å; T502-D507 HydrophobicContact CG2-CB 4.26Å; T502-D507 VanDerWaalsContact CG2-O 3.25Å; T502-D507 WeakPolarHBondContact CG2-O 3.49Å; T502-D507 PolarHBondContact O-N 3.35Å; M505-D507 VanDerWaalsContact C-N 3.27Å; M505-D507 PolarHBondContact O-N 3.16Å; D507-T509 VanDerWaalsContact C-N 3.29Å; D507-T509 PolarHBondContact O-N 2.84Å; D507-T509 PolarHBondContact OD1-OG1 3.32Å; D507-Q510 HydrophobicContact CB-CB 4.39Å; D507-Q510 VanDerWaalsContact CG-CB 3.4Å; D507-Q510 PolarHBondContact O-N 2.94Å; D507-Q510 VanDerWaalsContact OD1-CB 3.24Å; D507-Q510 WeakPolarHBondContact OD1-CB 3.42Å; D507-Q510 PolarHBondContact OD1-N 3.38Å; D507-Q510 WeakPolarHBondContact OD2-CB 3.29Å; D507-L511 PolarHBondContact O-N 3.11Å; D507-L511 VanDerWaalsContact O-N 3.17Å
508	Y	90.2	Very high	89.5	Confident	58 Å²	58	53 Å²	53	23%	0.227	26%	0.262	C	S	.	.	H	α-helix	trans	-69.5	-26.3	-174.2	-54.5	-68.4	0	0	0	113.8	V503 G506 Q510 L511 S512 I536 Y537	V503-Y508 HydrophobicContact CG1-CE1 4.49Å; G506-Y508 WeakPolarHBondContact O-CD2 3.25Å; G506-Y508 PolarHBondContact O-N 3.13Å; Y508-Q510 VanDerWaalsContact C-N 3.32Å; Y508-L511 PolarHBondContact O-N 3.03Å; Y508-S512 PolarHBondContact O-N 3.16Å; Y508-S512 PolarHBondContact O-OG 3.09Å; Y508-I536 HydrophobicContact CE1-CG2 4.48Å; Y508-I536 WeakPolarHBondContact OH-CG2 3.48Å; Y508-Y537 HydrophobicContact CD1-CD1 4.09Å; Y508-Y537 HydrophobicContact CD1-CD2 4.44Å; Y508-Y537 AromaticContact CD1-CG 3.84Å; Y508-Y537 HydrophobicContact CD1-CG 3.84Å; Y508-Y537 HydrophobicContact CD2-CD2 4.47Å; Y508-Y537 HydrophobicContact CG-CD1 4.24Å; Y508-Y537 AromaticContact CG-CD2 3.95Å; Y508-Y537 HydrophobicContact CG-CD2 3.95Å; Y508-Y537 AromaticContact CG-CG 3.82Å; Y508-Y537 HydrophobicContact CG-CG 3.82Å
509	T	89.8	Confident	89.2	Confident	108 Å²	108	55.1 Å²	55.1	66%	0.663	27%	0.273	S	S	*	.	H	α-helix	trans	-60.2	-45.5	172	38.5	0	0	0	0	110.8	D507 S512 F513	D507-T509 VanDerWaalsContact C-N 3.29Å; D507-T509 PolarHBondContact O-N 2.84Å; D507-T509 PolarHBondContact OD1-OG1 3.32Å; T509-S512 PolarHBondContact O-N 2.87Å; T509-F513 PolarHBondContact O-N 3.3Å; T509-F513 VanDerWaalsContact O-N 3.11Å
510	Q	90.4	Very high	88.9	Confident	65 Å²	65	55.1 Å²	55.1	30%	0.304	27%	0.273	S	S	.	.	H	α-helix	trans	-71.8	-36.5	-179.8	-161.4	69.1	10.4	0	0	111.9	D507 Y508 S512 F513 Y514	D507-Q510 HydrophobicContact CB-CB 4.39Å; D507-Q510 VanDerWaalsContact CG-CB 3.4Å; D507-Q510 PolarHBondContact O-N 2.94Å; D507-Q510 VanDerWaalsContact OD1-CB 3.24Å; D507-Q510 WeakPolarHBondContact OD1-CB 3.42Å; D507-Q510 PolarHBondContact OD1-N 3.38Å; D507-Q510 WeakPolarHBondContact OD2-CB 3.29Å; Y508-Q510 VanDerWaalsContact C-N 3.32Å; Q510-S512 VanDerWaalsContact C-N 3.29Å; Q510-S512 PolarHBondContact O-N 3.06Å; Q510-F513 WeakPolarHBondContact O-CB 3.36Å; Q510-F513 PolarHBondContact O-N 3.24Å; Q510-Y514 HydrophobicContact CB-CE2 4.42Å; Q510-Y514 HydrophobicContact CG-CD2 4.41Å; Q510-Y514 HydrophobicContact CG-CE1 3.81Å; Q510-Y514 HydrophobicContact CG-CE2 3.66Å; Q510-Y514 WeakPolarHBondContact CG-OH 3.4Å; Q510-Y514 WeakPolarHBondContact O-CD2 3.32Å; Q510-Y514 VanDerWaalsContact O-CG 3.27Å; Q510-Y514 PolarHBondContact O-N 3.43Å
511	L	90.2	Very high	88.7	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-56.9	-45.3	172.3	180	60.5	0	0	0	111.4	V499 T502 V503 D507 Y508 F513 Y514 I515 L520 L530	V499-L511 HydrophobicContact CB-CD1 4.47Å; V499-L511 HydrophobicContact CG1-CD1 4.28Å; V499-L511 HydrophobicContact CG2-CD1 4.03Å; T502-L511 HydrophobicContact CG2-CB 3.89Å; V503-L511 HydrophobicContact CG2-CD2 4.14Å; D507-L511 PolarHBondContact O-N 3.11Å; D507-L511 VanDerWaalsContact O-N 3.17Å; Y508-L511 PolarHBondContact O-N 3.03Å; L511-F513 VanDerWaalsContact C-N 3.31Å; L511-F513 PolarHBondContact O-N 3.43Å; L511-Y514 PolarHBondContact O-N 2.65Å; L511-I515 HydrophobicContact CD1-CD1 4.26Å; L511-I515 HydrophobicContact CG-CD1 4.19Å; L511-I515 WeakPolarHBondContact O-CG1 3.39Å; L511-I515 PolarHBondContact O-N 2.98Å; L511-L520 HydrophobicContact CD1-CD1 4.34Å; L511-L530 HydrophobicContact CD2-CD2 4.03Å; L511-L530 HydrophobicContact CG-CD2 4.44Å
512	S	89.9	Confident	88.5	Confident	12 Å²	12	54.7 Å²	54.7	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-62.3	-41.3	178.2	-55.2	0	0	0	0	111.3	Y508 T509 Q510 I515 Q516 Y537	Y508-S512 PolarHBondContact O-N 3.16Å; Y508-S512 PolarHBondContact O-OG 3.09Å; T509-S512 PolarHBondContact O-N 2.87Å; Q510-S512 VanDerWaalsContact C-N 3.29Å; Q510-S512 PolarHBondContact O-N 3.06Å; S512-I515 PolarHBondContact O-N 3.3Å; S512-Q516 WeakPolarHBondContact O-CB 3.47Å; S512-Q516 VanDerWaalsContact O-CG 3.28Å; S512-Q516 WeakPolarHBondContact O-CG 3.46Å; S512-Q516 PolarHBondContact O-N 3Å; S512-Y537 WeakPolarHBondContact OG-CE1 3.26Å; S512-Y537 PolarHBondContact OG-OH 3.33Å
513	F	90.9	Very high	88.4	Confident	114 Å²	114	55 Å²	55	50%	0.5	28%	0.277	S	S	.	.	H	α-helix	trans	-62.6	-43	174.9	-179.7	-96.8	0	0	0	112.3	T509 Q510 L511 I515 Q516 S517	T509-F513 PolarHBondContact O-N 3.3Å; T509-F513 VanDerWaalsContact O-N 3.11Å; Q510-F513 WeakPolarHBondContact O-CB 3.36Å; Q510-F513 PolarHBondContact O-N 3.24Å; L511-F513 VanDerWaalsContact C-N 3.31Å; L511-F513 PolarHBondContact O-N 3.43Å; F513-I515 VanDerWaalsContact C-N 3.28Å; F513-I515 PolarHBondContact O-N 2.87Å; F513-Q516 PolarHBondContact O-N 3.11Å; F513-S517 VanDerWaalsContact O-CB 3.25Å; F513-S517 WeakPolarHBondContact O-CB 3.44Å; F513-S517 PolarHBondContact O-N 2.89Å; F513-S517 PolarHBondContact O-OG 3.33Å
514	Y	90.5	Very high	88.3	Confident	10 Å²	10	58.1 Å²	58.1	4%	0.039	29%	0.289	C	S	.	.	H	α-helix	trans	-61.5	-36.1	178.9	-63.1	-33.3	0	0	0	113.1	I477 L498 T502 Q510 L511 S517 L519 L520	I477-Y514 HydrophobicContact CD1-CE1 4.06Å; I477-Y514 WeakPolarHBondContact CD1-OH 3.3Å; L498-Y514 HydrophobicContact CD1-CE2 4.34Å; L498-Y514 HydrophobicContact CD2-CD2 4.29Å; L498-Y514 HydrophobicContact CG-CD2 4.42Å; L498-Y514 HydrophobicContact CG-CE2 4.48Å; T502-Y514 HydrophobicContact CG2-CE2 4.43Å; Q510-Y514 HydrophobicContact CB-CE2 4.42Å; Q510-Y514 HydrophobicContact CG-CD2 4.41Å; Q510-Y514 HydrophobicContact CG-CE1 3.81Å; Q510-Y514 HydrophobicContact CG-CE2 3.66Å; Q510-Y514 WeakPolarHBondContact CG-OH 3.4Å; Q510-Y514 WeakPolarHBondContact O-CD2 3.32Å; Q510-Y514 VanDerWaalsContact O-CG 3.27Å; Q510-Y514 PolarHBondContact O-N 3.43Å; L511-Y514 PolarHBondContact O-N 2.65Å; Y514-S517 PolarHBondContact O-OG 3.31Å; Y514-L519 HydrophobicContact CD1-CD2 3.49Å; Y514-L519 VanDerWaalsContact CD1-CD2 3.49Å; Y514-L519 HydrophobicContact CE1-CD2 3.92Å; Y514-L519 HydrophobicContact CG-CD2 4.1Å; Y514-L519 PolarHBondContact O-N 3.2Å; Y514-L520 PolarHBondContact O-N 2.87Å
515	I	87.3	Confident	88.2	Confident	3 Å²	3	54 Å²	54	2%	0.015	29%	0.285	C	S	.	.	H	α-helix	trans	-73.3	-47.9	177	-62	162	0	0	0	110.2	L511 S512 F513 S517 R518 L520 L530 L543 M547	L511-I515 HydrophobicContact CD1-CD1 4.26Å; L511-I515 HydrophobicContact CG-CD1 4.19Å; L511-I515 WeakPolarHBondContact O-CG1 3.39Å; L511-I515 PolarHBondContact O-N 2.98Å; S512-I515 PolarHBondContact O-N 3.3Å; F513-I515 VanDerWaalsContact C-N 3.28Å; F513-I515 PolarHBondContact O-N 2.87Å; I515-S517 PolarHBondContact O-N 3.08Å; I515-R518 PolarHBondContact O-N 3.42Å; I515-R518 VanDerWaalsContact O-N 3.15Å; I515-L520 HydrophobicContact CG1-CD1 3.8Å; I515-L530 HydrophobicContact CD1-CD1 3.52Å; I515-L530 HydrophobicContact CD1-CD2 3.75Å; I515-L530 HydrophobicContact CD1-CG 4.3Å; I515-L530 HydrophobicContact CG1-CD1 4.35Å; I515-L543 HydrophobicContact CD1-CB 4.22Å; I515-L543 HydrophobicContact CD1-CD1 3.94Å; I515-L543 HydrophobicContact CG2-CD2 4.28Å; I515-M547 HydrophobicContact CG1-CE 4.26Å; I515-M547 HydrophobicContact CG2-CE 3.77Å
516	Q	88	Confident	88.1	Confident	141 Å²	141	52.7 Å²	52.7	66%	0.659	28%	0.279	S	S	*	.	H	α-helix	trans	-66.3	-36.3	-177.7	-72.1	175.1	-9	0	0	112.8	S512 F513 R518	S512-Q516 WeakPolarHBondContact O-CB 3.47Å; S512-Q516 VanDerWaalsContact O-CG 3.28Å; S512-Q516 WeakPolarHBondContact O-CG 3.46Å; S512-Q516 PolarHBondContact O-N 3Å; F513-Q516 PolarHBondContact O-N 3.11Å; Q516-R518 PolarHBondContact O-N 3.13Å
517	S	86.6	Confident	88.1	Confident	57 Å²	57	50.8 Å²	50.8	40%	0.399	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-3.2	176.2	60	0	0	0	0	114	F513 Y514 I515 L519	F513-S517 VanDerWaalsContact O-CB 3.25Å; F513-S517 WeakPolarHBondContact O-CB 3.44Å; F513-S517 PolarHBondContact O-N 2.89Å; F513-S517 PolarHBondContact O-OG 3.33Å; Y514-S517 PolarHBondContact O-OG 3.31Å; I515-S517 PolarHBondContact O-N 3.08Å; S517-L519 PolarHBondContact O-N 2.96Å
518	R	84.5	Confident	88.1	Confident	182 Å²	182	52.3 Å²	52.3	69%	0.687	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	28.9	-173.8	-55.6	-167.2	178.3	-157.2	-0.3	114.3	I515 Q516 L520	I515-R518 PolarHBondContact O-N 3.42Å; I515-R518 VanDerWaalsContact O-N 3.15Å; Q516-R518 PolarHBondContact O-N 3.13Å; R518-L520 VanDerWaalsContact C-N 3.32Å
519	L	85.5	Confident	88.1	Confident	43 Å²	43	50.7 Å²	50.7	23%	0.225	26%	0.261	C	S	.	.			trans	-67	-39.2	168.9	-173	76	0	0	0	110.5	I477 I480 Y495 L498 Y514 S517	I477-L519 HydrophobicContact CG1-CD2 4.43Å; I477-L519 HydrophobicContact CG2-CD2 4.47Å; I480-L519 HydrophobicContact CG2-CD1 4.1Å; I480-L519 HydrophobicContact CG2-CG 4.32Å; Y495-L519 WeakPolarHBondContact CE1-O 3.31Å; L498-L519 HydrophobicContact CD2-CD2 4.4Å; Y514-L519 HydrophobicContact CD1-CD2 3.49Å; Y514-L519 VanDerWaalsContact CD1-CD2 3.49Å; Y514-L519 HydrophobicContact CE1-CD2 3.92Å; Y514-L519 HydrophobicContact CG-CD2 4.1Å; Y514-L519 PolarHBondContact O-N 3.2Å; S517-L519 PolarHBondContact O-N 2.96Å
520	L	86.1	Confident	88	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	23%	0.23	C	C	.	.	S	Bend	trans	-82.8	125	169.5	-66.9	173.3	0	0	0	108.8	Y495 L498 V499 L511 Y514 I515 R518	Y495-L520 HydrophobicContact CD1-CD2 3.58Å; Y495-L520 HydrophobicContact CG-CD2 4.15Å; L498-L520 HydrophobicContact CB-CD2 4.17Å; L498-L520 HydrophobicContact CD2-CD2 3.81Å; L498-L520 HydrophobicContact CG-CD2 4.35Å; V499-L520 HydrophobicContact CG2-CD1 3.78Å; V499-L520 HydrophobicContact CG2-CD2 4.43Å; L511-L520 HydrophobicContact CD1-CD1 4.34Å; Y514-L520 PolarHBondContact O-N 2.87Å; I515-L520 HydrophobicContact CG1-CD1 3.8Å; R518-L520 VanDerWaalsContact C-N 3.32Å
521	A	84.8	Confident	88	Confident	34 Å²	34	44 Å²	44	28%	0.281	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-66	138.9	170.2	0	0	0	0	0	109.7	Y495 S523	Y495-A521 HydrophobicContact CD2-CB 4.06Å; Y495-A521 HydrophobicContact CE1-CB 4.47Å; Y495-A521 HydrophobicContact CE2-CB 3.39Å; A521-S523 PolarHBondContact O-N 3.3Å
522	D	86.1	Confident	88	Confident	40 Å²	40	47.9 Å²	47.9	21%	0.214	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-62.4	125.1	173.6	-67.2	-26.3	0	0	0	108.3	M547 R550 L551	D522-M547 HydrophobicContact CB-CG 3.93Å; D522-M547 WeakPolarHBondContact OD1-CG 3.36Å; D522-R550 IonicContact OD1-CZ 3.58Å; D522-R550 IonicContact OD1-NE 2.74Å; D522-R550 PolarHBondContact OD1-NE 3Å; D522-R550 IonicContact OD1-NH2 2.63Å; D522-R550 PolarHBondContact OD1-NH2 3.16Å; D522-R550 WeakPolarHBondContact OD2-CB 3.29Å; D522-R550 IonicContact OD2-CZ 3.45Å; D522-R550 IonicContact OD2-NE 2.57Å; D522-R550 PolarHBondContact OD2-NE 2.82Å; D522-R550 IonicContact OD2-NH2 3.94Å; D522-L551 HydrophobicContact CB-CD2 3.77Å; D522-L551 HydrophobicContact CB-CG 4.04Å; D522-L551 WeakPolarHBondContact O-CD2 3.26Å
523	S	88.4	Confident	87.9	Confident	5 Å²	5	48.4 Å²	48.4	4%	0.035	25%	0.252	C	S	.	.			trans	-146.9	150.1	175.6	94.1	0	0	0	0	110.2	A521 A525 T526 A527	A521-S523 PolarHBondContact O-N 3.3Å; S523-A525 VanDerWaalsContact C-N 3.29Å; S523-A525 PolarHBondContact O-N 2.92Å; S523-A525 PolarHBondContact OG-N 2.88Å; S523-T526 PolarHBondContact O-N 3.45Å; S523-T526 WeakPolarHBondContact OG-CB 3.25Å; S523-T526 PolarHBondContact OG-N 3.5Å; S523-T526 VanDerWaalsContact OG-N 3.07Å; S523-T526 PolarHBondContact OG-OG1 3.43Å; S523-A527 WeakPolarHBondContact O-CB 3.5Å; S523-A527 PolarHBondContact O-N 3.49Å
524	K	88.4	Confident	87.8	Confident	91 Å²	91	46 Å²	46	40%	0.396	24%	0.243	S	C	.	.	H	α-helix	trans	-57.4	-44	177.2	179.2	177.3	167.6	174.9	0	111.3	A527 L528 E557	K524-A527 PolarHBondContact O-N 3.02Å; K524-L528 HydrophobicContact CG-CD1 4.05Å; K524-L528 HydrophobicContact CG-CG 4.44Å; K524-L528 WeakPolarHBondContact O-CG 3.4Å; K524-L528 PolarHBondContact O-N 3.46Å; K524-E557 VanDerWaalsContact CE-OE1 3.31Å; K524-E557 WeakPolarHBondContact CE-OE1 3.33Å; K524-E557 IonicContact NZ-OE1 3.26Å; K524-E557 PolarHBondContact NZ-OE1 2.76Å
525	A	87.4	Confident	87.7	Confident	55 Å²	55	50.7 Å²	50.7	46%	0.455	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-46.7	-179.5	0	0	0	0	0	111.8	S523 A527 L528 Q529	S523-A525 VanDerWaalsContact C-N 3.29Å; S523-A525 PolarHBondContact O-N 2.92Å; S523-A525 PolarHBondContact OG-N 2.88Å; A525-A527 VanDerWaalsContact C-N 3.32Å; A525-A527 PolarHBondContact O-N 3.14Å; A525-L528 PolarHBondContact O-N 2.8Å; A525-Q529 WeakPolarHBondContact O-CB 3.35Å; A525-Q529 PolarHBondContact O-N 3.19Å
526	T	87.2	Confident	87.7	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-40.5	177.2	-44.5	0	0	0	0	111.2	V499 S523 Q529 L530 M547	V499-T526 HydrophobicContact CG2-CG2 4.01Å; S523-T526 PolarHBondContact O-N 3.45Å; S523-T526 WeakPolarHBondContact OG-CB 3.25Å; S523-T526 PolarHBondContact OG-N 3.5Å; S523-T526 VanDerWaalsContact OG-N 3.07Å; S523-T526 PolarHBondContact OG-OG1 3.43Å; T526-Q529 WeakPolarHBondContact O-CB 3.4Å; T526-Q529 PolarHBondContact O-N 3.42Å; T526-L530 HydrophobicContact CG2-CD1 4.48Å; T526-L530 VanDerWaalsContact O-CG 3.31Å; T526-L530 WeakPolarHBondContact O-CG 3.38Å; T526-L530 PolarHBondContact O-N 2.75Å; T526-M547 HydrophobicContact CG2-CE 4.29Å; T526-M547 HydrophobicContact CG2-SD 4.07Å
527	A	89.3	Confident	87.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66.4	-44.2	-179.6	0	0	0	0	0	112.4	S523 K524 A525 Q529 L530 L531 M547 L548	S523-A527 WeakPolarHBondContact O-CB 3.5Å; S523-A527 PolarHBondContact O-N 3.49Å; K524-A527 PolarHBondContact O-N 3.02Å; A525-A527 VanDerWaalsContact C-N 3.32Å; A525-A527 PolarHBondContact O-N 3.14Å; A527-Q529 VanDerWaalsContact C-N 3.32Å; A527-Q529 PolarHBondContact O-N 2.85Å; A527-L530 PolarHBondContact O-N 3.07Å; A527-L531 WeakPolarHBondContact O-CG 3.38Å; A527-L531 PolarHBondContact O-N 3.46Å; A527-M547 HydrophobicContact CB-CB 4.08Å; A527-M547 HydrophobicContact CB-CG 4.02Å; A527-M547 HydrophobicContact CB-SD 3.98Å; A527-L548 HydrophobicContact CB-CD2 3.65Å; A527-L548 HydrophobicContact CB-CG 3.76Å
528	L	89	Confident	87.8	Confident	75 Å²	75	52.8 Å²	52.8	39%	0.393	29%	0.289	S	S	.	.	H	α-helix	trans	-64.5	-37.1	175.1	-66.9	175.7	0	0	0	111.9	K524 A525 L530 L531 S532	K524-L528 HydrophobicContact CG-CD1 4.05Å; K524-L528 HydrophobicContact CG-CG 4.44Å; K524-L528 WeakPolarHBondContact O-CG 3.4Å; K524-L528 PolarHBondContact O-N 3.46Å; A525-L528 PolarHBondContact O-N 2.8Å; L528-L530 VanDerWaalsContact C-N 3.32Å; L528-L530 PolarHBondContact O-N 3.26Å; L528-L531 HydrophobicContact CD2-CD1 4.19Å; L528-L531 PolarHBondContact O-N 3.29Å; L528-S532 PolarHBondContact O-N 3.43Å; L528-S532 VanDerWaalsContact O-N 3.08Å
529	Q	89.1	Confident	88	Confident	24 Å²	24	46.1 Å²	46.1	11%	0.112	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-36.5	173.2	-170.6	-175.5	18.8	0	0	112	V499 N500 A525 T526 A527 S532 L533	V499-Q529 HydrophobicContact CG1-CG 4.19Å; N500-Q529 PolarHBondContact ND2-NE2 3.48Å; N500-Q529 PolarHBondContact OD1-NE2 2.93Å; A525-Q529 WeakPolarHBondContact O-CB 3.35Å; A525-Q529 PolarHBondContact O-N 3.19Å; T526-Q529 WeakPolarHBondContact O-CB 3.4Å; T526-Q529 PolarHBondContact O-N 3.42Å; A527-Q529 VanDerWaalsContact C-N 3.32Å; A527-Q529 PolarHBondContact O-N 2.85Å; Q529-S532 PolarHBondContact O-OG 2.8Å; Q529-L533 WeakPolarHBondContact O-CD1 3.49Å; Q529-L533 VanDerWaalsContact O-CG 3.22Å; Q529-L533 WeakPolarHBondContact O-CG 3.27Å; Q529-L533 PolarHBondContact O-N 2.76Å
530	L	89.6	Confident	88.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-70.3	-37	175.2	-69.9	168	0	0	0	112.4	L511 I515 T526 A527 L528 S532 L533 A540 M547	L511-L530 HydrophobicContact CD2-CD2 4.03Å; L511-L530 HydrophobicContact CG-CD2 4.44Å; I515-L530 HydrophobicContact CD1-CD1 3.52Å; I515-L530 HydrophobicContact CD1-CD2 3.75Å; I515-L530 HydrophobicContact CD1-CG 4.3Å; I515-L530 HydrophobicContact CG1-CD1 4.35Å; T526-L530 HydrophobicContact CG2-CD1 4.48Å; T526-L530 VanDerWaalsContact O-CG 3.31Å; T526-L530 WeakPolarHBondContact O-CG 3.38Å; T526-L530 PolarHBondContact O-N 2.75Å; A527-L530 PolarHBondContact O-N 3.07Å; L528-L530 VanDerWaalsContact C-N 3.32Å; L528-L530 PolarHBondContact O-N 3.26Å; L530-S532 VanDerWaalsContact C-N 3.35Å; L530-L533 HydrophobicContact CD2-CD1 4.45Å; L530-L533 PolarHBondContact O-N 2.88Å; L530-A540 VanDerWaalsContact O-CB 3.24Å; L530-A540 WeakPolarHBondContact O-CB 3.44Å; L530-M547 HydrophobicContact CD1-CE 3.86Å; L530-M547 HydrophobicContact CD1-SD 4.33Å
531	L	89.5	Confident	88.4	Confident	33 Å²	33	44 Å²	44	17%	0.173	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-41.4	175.2	-71.9	167.4	0	0	0	111.6	A527 L528 L533 E534 G541 I545 L548 A561	A527-L531 WeakPolarHBondContact O-CG 3.38Å; A527-L531 PolarHBondContact O-N 3.46Å; L528-L531 HydrophobicContact CD2-CD1 4.19Å; L528-L531 PolarHBondContact O-N 3.29Å; L531-L533 PolarHBondContact O-N 3.45Å; L531-E534 VanDerWaalsContact O-CB 3.27Å; L531-E534 WeakPolarHBondContact O-CB 3.44Å; L531-E534 PolarHBondContact O-N 2.9Å; L531-G541 WeakPolarHBondContact CD2-O 3.25Å; L531-I545 HydrophobicContact CD2-CG1 4.13Å; L531-L548 HydrophobicContact CD1-CD1 3.95Å; L531-A561 HydrophobicContact CD1-CB 3.81Å; L531-A561 HydrophobicContact CD2-CB 4.24Å
532	S	89.7	Confident	88.6	Confident	84 Å²	84	45.6 Å²	45.6	59%	0.587	26%	0.264	S	S	*	.	H	α-helix	trans	-67.1	-21.3	177.3	68.9	0	0	0	0	113.7	L528 Q529 L530 E534	L528-S532 PolarHBondContact O-N 3.43Å; L528-S532 VanDerWaalsContact O-N 3.08Å; Q529-S532 PolarHBondContact O-OG 2.8Å; L530-S532 VanDerWaalsContact C-N 3.35Å; S532-E534 VanDerWaalsContact C-N 3.33Å
533	L	88.6	Confident	88.8	Confident	22 Å²	22	44.5 Å²	44.5	12%	0.115	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.3	177.7	-68.1	166	0	0	0	114.1	V499 V503 Q529 L530 L531 S535 I536 Y537 A540	V499-L533 HydrophobicContact CG1-CD1 4.15Å; V503-L533 HydrophobicContact CB-CD2 4.43Å; V503-L533 HydrophobicContact CG1-CD2 3.61Å; V503-L533 HydrophobicContact CG2-CD1 3.47Å; V503-L533 VanDerWaalsContact CG2-CD1 3.47Å; V503-L533 HydrophobicContact CG2-CD2 3.96Å; V503-L533 HydrophobicContact CG2-CG 4.37Å; Q529-L533 WeakPolarHBondContact O-CD1 3.49Å; Q529-L533 VanDerWaalsContact O-CG 3.22Å; Q529-L533 WeakPolarHBondContact O-CG 3.27Å; Q529-L533 PolarHBondContact O-N 2.76Å; L530-L533 HydrophobicContact CD2-CD1 4.45Å; L530-L533 PolarHBondContact O-N 2.88Å; L531-L533 PolarHBondContact O-N 3.45Å; L533-S535 PolarHBondContact O-N 3.3Å; L533-I536 PolarHBondContact O-N 3.16Å; L533-Y537 PolarHBondContact O-N 2.82Å; L533-A540 HydrophobicContact CB-CB 4.02Å
534	E	88.4	Confident	88.9	Confident	63 Å²	63	44.2 Å²	44.2	29%	0.294	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.2	-176.9	174.9	164.1	-170.8	0	0	113.5	L531 S532 I536 Y537 P538 K565	L531-E534 VanDerWaalsContact O-CB 3.27Å; L531-E534 WeakPolarHBondContact O-CB 3.44Å; L531-E534 PolarHBondContact O-N 2.9Å; S532-E534 VanDerWaalsContact C-N 3.33Å; E534-I536 PolarHBondContact O-N 2.98Å; E534-Y537 CarbonylContact O-C 3.49Å; E534-P538 WeakPolarHBondContact O-CA 3.41Å; E534-K565 WeakPolarHBondContact OE1-CE 3.34Å; E534-K565 IonicContact OE1-NZ 3.07Å; E534-K565 PolarHBondContact OE1-NZ 2.95Å; E534-K565 WeakPolarHBondContact OE2-CE 3.41Å; E534-K565 IonicContact OE2-NZ 2.75Å; E534-K565 PolarHBondContact OE2-NZ 3.21Å
535	S	87.7	Confident	89	Confident	109 Å²	109	40.4 Å²	40.4	76%	0.762	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-31.1	178.8	58.2	0	0	0	0	113.4	L533	L533-S535 PolarHBondContact O-N 3.3Å
536	I	88.3	Confident	89.1	Confident	103 Å²	103	40.6 Å²	40.6	53%	0.528	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-39.9	-177.3	-53.5	171.1	0	0	0	110.4	Y508 L533 E534	Y508-I536 HydrophobicContact CE1-CG2 4.48Å; Y508-I536 WeakPolarHBondContact OH-CG2 3.48Å; L533-I536 PolarHBondContact O-N 3.16Å; E534-I536 PolarHBondContact O-N 2.98Å
537	Y	89.1	Confident	89.3	Confident	51 Å²	51	40.5 Å²	40.5	20%	0.2	23%	0.232	C	C	.	.			trans	-129.4	94.7	179	-178.1	-130.4	0	0	0	109.7	Y508 S512 L533 E534 A539 A540 L543	Y508-Y537 HydrophobicContact CD1-CD1 4.09Å; Y508-Y537 HydrophobicContact CD1-CD2 4.44Å; Y508-Y537 AromaticContact CD1-CG 3.84Å; Y508-Y537 HydrophobicContact CD1-CG 3.84Å; Y508-Y537 HydrophobicContact CD2-CD2 4.47Å; Y508-Y537 HydrophobicContact CG-CD1 4.24Å; Y508-Y537 AromaticContact CG-CD2 3.95Å; Y508-Y537 HydrophobicContact CG-CD2 3.95Å; Y508-Y537 AromaticContact CG-CG 3.82Å; Y508-Y537 HydrophobicContact CG-CG 3.82Å; S512-Y537 WeakPolarHBondContact OG-CE1 3.26Å; S512-Y537 PolarHBondContact OG-OH 3.33Å; L533-Y537 PolarHBondContact O-N 2.82Å; E534-Y537 CarbonylContact O-C 3.49Å; Y537-A539 HydrophobicContact CE1-CB 3.87Å; Y537-A539 HydrophobicContact CE2-CB 3.94Å; Y537-A539 PolarHBondContact O-N 3.29Å; Y537-A539 VanDerWaalsContact O-N 3.07Å; Y537-A540 HydrophobicContact CD1-CB 3.79Å; Y537-A540 HydrophobicContact CG-CB 4.44Å; Y537-A540 WeakPolarHBondContact O-CB 3.47Å; Y537-A540 PolarHBondContact O-N 3.46Å; Y537-L543 HydrophobicContact CE1-CD1 4.44Å
538	P	87	Confident	89.2	Confident	92 Å²	92	40.5 Å²	40.5	60%	0.597	23%	0.232	S	C	*	.	H	α-helix	trans	-55.8	-32.7	-172.6	-30.3	36	0	0	0	114.7	E534 A540 G541	E534-P538 WeakPolarHBondContact O-CA 3.41Å; P538-A540 PolarHBondContact O-N 2.93Å; P538-G541 PolarHBondContact O-N 3.35Å
539	A	89.2	Confident	89.1	Confident	41 Å²	41	43.6 Å²	43.6	34%	0.339	24%	0.242	S	C	.	.	H	α-helix	trans	-68.8	-20.7	177	0	0	0	0	0	113.2	Y537 G541 Q542 L543	Y537-A539 HydrophobicContact CE1-CB 3.87Å; Y537-A539 HydrophobicContact CE2-CB 3.94Å; Y537-A539 PolarHBondContact O-N 3.29Å; Y537-A539 VanDerWaalsContact O-N 3.07Å; A539-G541 VanDerWaalsContact C-N 3.27Å; A539-G541 PolarHBondContact O-N 3.28Å; A539-Q542 PolarHBondContact O-N 3.08Å; A539-L543 WeakPolarHBondContact O-CG 3Å; A539-L543 PolarHBondContact O-N 2.93Å
540	A	89.7	Confident	89.1	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.008	25%	0.254	C	S	.	.	H	α-helix	trans	-57.8	-40.8	174.9	0	0	0	0	0	111.6	L530 L533 Y537 P538 Q542 L543 G544	L530-A540 VanDerWaalsContact O-CB 3.24Å; L530-A540 WeakPolarHBondContact O-CB 3.44Å; L533-A540 HydrophobicContact CB-CB 4.02Å; Y537-A540 HydrophobicContact CD1-CB 3.79Å; Y537-A540 HydrophobicContact CG-CB 4.44Å; Y537-A540 WeakPolarHBondContact O-CB 3.47Å; Y537-A540 PolarHBondContact O-N 3.46Å; P538-A540 PolarHBondContact O-N 2.93Å; A540-Q542 VanDerWaalsContact C-N 3.34Å; A540-Q542 PolarHBondContact O-N 2.86Å; A540-L543 PolarHBondContact O-N 2.88Å; A540-G544 PolarHBondContact O-N 2.84Å
541	G	89.1	Confident	88.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.9	-40.2	-178.6	0	0	0	0	0	112.2	L531 P538 A539 G544 I545	L531-G541 WeakPolarHBondContact CD2-O 3.25Å; P538-G541 PolarHBondContact O-N 3.35Å; A539-G541 VanDerWaalsContact C-N 3.27Å; A539-G541 PolarHBondContact O-N 3.28Å; G541-G544 PolarHBondContact O-N 3.15Å; G541-I545 WeakPolarHBondContact O-CG1 3.41Å; G541-I545 PolarHBondContact O-N 3Å; G541-I545 VanDerWaalsContact O-N 3.1Å
542	Q	90.5	Very high	88.5	Confident	67 Å²	67	51.6 Å²	51.6	31%	0.313	28%	0.279	S	S	.	.	H	α-helix	trans	-68.3	-40.4	174.6	-172	60.6	48	0	0	111.6	A539 A540 G544 I545 D546	A539-Q542 PolarHBondContact O-N 3.08Å; A540-Q542 VanDerWaalsContact C-N 3.34Å; A540-Q542 PolarHBondContact O-N 2.86Å; Q542-G544 VanDerWaalsContact C-N 3.28Å; Q542-G544 PolarHBondContact O-N 3.36Å; Q542-I545 PolarHBondContact O-N 3.03Å; Q542-D546 PolarHBondContact NE2-OD1 2.95Å; Q542-D546 WeakPolarHBondContact O-CB 3.35Å; Q542-D546 PolarHBondContact O-N 2.84Å
543	L	90.8	Very high	87.9	Confident	16 Å²	16	53.1 Å²	53.1	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-62.5	-36.3	176.2	-68.8	169.8	0	0	0	112.3	I515 Y537 A539 A540 M547	I515-L543 HydrophobicContact CD1-CB 4.22Å; I515-L543 HydrophobicContact CD1-CD1 3.94Å; I515-L543 HydrophobicContact CG2-CD2 4.28Å; Y537-L543 HydrophobicContact CE1-CD1 4.44Å; A539-L543 WeakPolarHBondContact O-CG 3Å; A539-L543 PolarHBondContact O-N 2.93Å; A540-L543 PolarHBondContact O-N 2.88Å; L543-M547 VanDerWaalsContact O-CB 3.32Å; L543-M547 WeakPolarHBondContact O-CB 3.31Å; L543-M547 PolarHBondContact O-N 3.34Å
544	G	90.1	Very high	87.4	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.8	-47.1	173.4	0	0	0	0	0	112.2	A540 G541 Q542 D546 M547 L548	A540-G544 PolarHBondContact O-N 2.84Å; G541-G544 PolarHBondContact O-N 3.15Å; Q542-G544 VanDerWaalsContact C-N 3.28Å; Q542-G544 PolarHBondContact O-N 3.36Å; G544-D546 PolarHBondContact O-N 3.03Å; G544-M547 WeakPolarHBondContact O-CB 3.28Å; G544-M547 PolarHBondContact O-N 3.31Å; G544-L548 WeakPolarHBondContact O-CG 3.49Å; G544-L548 PolarHBondContact O-N 2.82Å
545	I	88.9	Confident	87.1	Confident	10 Å²	10	49.7 Å²	49.7	5%	0.051	27%	0.269	C	S	.	.	H	α-helix	trans	-59.1	-47.3	173.9	-72.6	172.4	0	0	0	111.3	L531 G541 Q542 M547 L548 K549 L558 A561 L562 K565	L531-I545 HydrophobicContact CD2-CG1 4.13Å; G541-I545 WeakPolarHBondContact O-CG1 3.41Å; G541-I545 PolarHBondContact O-N 3Å; G541-I545 VanDerWaalsContact O-N 3.1Å; Q542-I545 PolarHBondContact O-N 3.03Å; I545-M547 PolarHBondContact O-N 2.81Å; I545-L548 PolarHBondContact O-N 3.39Å; I545-K549 WeakPolarHBondContact O-CB 3.41Å; I545-K549 PolarHBondContact O-N 2.84Å; I545-L558 HydrophobicContact CB-CD1 4.42Å; I545-L558 HydrophobicContact CG1-CD1 4.48Å; I545-L558 HydrophobicContact CG2-CD1 3.8Å; I545-A561 HydrophobicContact CG1-CB 4.46Å; I545-L562 HydrophobicContact CD1-CD2 4.24Å; I545-K565 HydrophobicContact CD1-CD 4.19Å; I545-K565 HydrophobicContact CD1-CG 3.95Å
546	D	89.7	Confident	86.8	Confident	59 Å²	59	46.8 Å²	46.8	32%	0.316	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-35.3	179.2	-67.9	-14.4	0	0	0	111.1	Q542 G544 R550	Q542-D546 PolarHBondContact NE2-OD1 2.95Å; Q542-D546 WeakPolarHBondContact O-CB 3.35Å; Q542-D546 PolarHBondContact O-N 2.84Å; G544-D546 PolarHBondContact O-N 3.03Å; D546-R550 WeakPolarHBondContact O-CG 3.36Å; D546-R550 PolarHBondContact O-N 3.14Å; D546-R550 VanDerWaalsContact O-N 3.1Å; D546-R550 PolarHBondContact O-NH1 2.69Å
547	M	91.2	Very high	86.5	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-68.9	-47.1	175.5	-171.6	174	-67.3	0	0	112.1	I515 D522 T526 A527 L530 L543 G544 I545 K549 R550 L551	I515-M547 HydrophobicContact CG1-CE 4.26Å; I515-M547 HydrophobicContact CG2-CE 3.77Å; D522-M547 HydrophobicContact CB-CG 3.93Å; D522-M547 WeakPolarHBondContact OD1-CG 3.36Å; T526-M547 HydrophobicContact CG2-CE 4.29Å; T526-M547 HydrophobicContact CG2-SD 4.07Å; A527-M547 HydrophobicContact CB-CB 4.08Å; A527-M547 HydrophobicContact CB-CG 4.02Å; A527-M547 HydrophobicContact CB-SD 3.98Å; L530-M547 HydrophobicContact CD1-CE 3.86Å; L530-M547 HydrophobicContact CD1-SD 4.33Å; L543-M547 VanDerWaalsContact O-CB 3.32Å; L543-M547 WeakPolarHBondContact O-CB 3.31Å; L543-M547 PolarHBondContact O-N 3.34Å; G544-M547 WeakPolarHBondContact O-CB 3.28Å; G544-M547 PolarHBondContact O-N 3.31Å; I545-M547 PolarHBondContact O-N 2.81Å; M547-K549 VanDerWaalsContact C-N 3.29Å; M547-K549 PolarHBondContact O-N 3Å; M547-R550 PolarHBondContact O-N 2.88Å; M547-R550 VanDerWaalsContact O-N 3.15Å; M547-L551 WeakPolarHBondContact O-CG 3.18Å; M547-L551 PolarHBondContact O-N 2.92Å; M547-L551 VanDerWaalsContact O-N 3.11Å
548	L	88.3	Confident	86.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.4	-43.2	174.6	-70.2	175.3	0	0	0	111.4	A527 L531 G544 I545 R550 L551 N552 C554 L558 A561	A527-L548 HydrophobicContact CB-CD2 3.65Å; A527-L548 HydrophobicContact CB-CG 3.76Å; L531-L548 HydrophobicContact CD1-CD1 3.95Å; G544-L548 WeakPolarHBondContact O-CG 3.49Å; G544-L548 PolarHBondContact O-N 2.82Å; I545-L548 PolarHBondContact O-N 3.39Å; L548-R550 VanDerWaalsContact C-N 3.31Å; L548-R550 PolarHBondContact O-N 3.3Å; L548-L551 WeakPolarHBondContact O-CB 3.15Å; L548-L551 PolarHBondContact O-N 2.77Å; L548-N552 PolarHBondContact O-N 3.16Å; L548-C554 HydrophobicContact CD2-CB 3.81Å; L548-L558 HydrophobicContact CB-CB 4.18Å; L548-L558 HydrophobicContact CB-CD1 4.27Å; L548-L558 HydrophobicContact CD1-CB 4.33Å; L548-A561 HydrophobicContact CD1-CB 4.41Å
549	K	87.1	Confident	86.2	Confident	140 Å²	140	37.4 Å²	37.4	61%	0.609	20%	0.197	S	C	*	.	H	α-helix	trans	-61.8	-37.4	177	-171.9	179.9	179.7	178.1	0	112.5	I545 M547 L558	I545-K549 WeakPolarHBondContact O-CB 3.41Å; I545-K549 PolarHBondContact O-N 2.84Å; M547-K549 VanDerWaalsContact C-N 3.29Å; M547-K549 PolarHBondContact O-N 3Å; K549-L558 HydrophobicContact CB-CD2 4.16Å
550	R	88.4	Confident	86	Confident	93 Å²	93	37.7 Å²	37.7	35%	0.351	19%	0.193	S	C	.	.	H	α-helix	trans	-69.3	-31.9	175.9	-75.8	-170.9	-53.3	-88.8	6	113	D522 D546 M547 L548 N552	D522-R550 IonicContact OD1-CZ 3.58Å; D522-R550 IonicContact OD1-NE 2.74Å; D522-R550 PolarHBondContact OD1-NE 3Å; D522-R550 IonicContact OD1-NH2 2.63Å; D522-R550 PolarHBondContact OD1-NH2 3.16Å; D522-R550 WeakPolarHBondContact OD2-CB 3.29Å; D522-R550 IonicContact OD2-CZ 3.45Å; D522-R550 IonicContact OD2-NE 2.57Å; D522-R550 PolarHBondContact OD2-NE 2.82Å; D522-R550 IonicContact OD2-NH2 3.94Å; D546-R550 WeakPolarHBondContact O-CG 3.36Å; D546-R550 PolarHBondContact O-N 3.14Å; D546-R550 VanDerWaalsContact O-N 3.1Å; D546-R550 PolarHBondContact O-NH1 2.69Å; M547-R550 PolarHBondContact O-N 2.88Å; M547-R550 VanDerWaalsContact O-N 3.15Å; L548-R550 VanDerWaalsContact C-N 3.31Å; L548-R550 PolarHBondContact O-N 3.3Å; R550-N552 VanDerWaalsContact C-N 3.34Å
551	L	85.9	Confident	85.7	Confident	42 Å²	42	38 Å²	38	22%	0.22	20%	0.195	C	C	.	.	H	α-helix	trans	-68.7	-31	178.7	-72.9	168.9	0	0	0	113	D522 M547 L548 T553	D522-L551 HydrophobicContact CB-CD2 3.77Å; D522-L551 HydrophobicContact CB-CG 4.04Å; D522-L551 WeakPolarHBondContact O-CD2 3.26Å; M547-L551 WeakPolarHBondContact O-CG 3.18Å; M547-L551 PolarHBondContact O-N 2.92Å; M547-L551 VanDerWaalsContact O-N 3.11Å; L548-L551 WeakPolarHBondContact O-CB 3.15Å; L548-L551 PolarHBondContact O-N 2.77Å; L551-T553 PolarHBondContact O-N 2.82Å; L551-T553 PolarHBondContact O-OG1 3.25Å
552	N	80	Confident	85.5	Confident	91 Å²	91	38.6 Å²	38.6	49%	0.487	20%	0.198	S	C	.	.	S	Bend	trans	56.6	1.5	178.2	-159.5	46.3	0	0	0	116.1	L548 R550 N555	L548-N552 PolarHBondContact O-N 3.16Å; R550-N552 VanDerWaalsContact C-N 3.34Å; N552-N555 PolarHBondContact O-ND2 2.75Å
553	T	78.8	Confident	85.2	Confident	115 Å²	115	35.9 Å²	35.9	71%	0.706	19%	0.186	S	C	*	.	S	Bend	trans	-108.7	-9.7	179.1	52.1	0	0	0	0	113	L551	L551-T553 PolarHBondContact O-N 2.82Å; L551-T553 PolarHBondContact O-OG1 3.25Å
554	C	78.1	Confident	84.9	Confident	10 Å²	10	42.2 Å²	42.2	7%	0.068	22%	0.218	C	C	.	.			trans	-111.4	50.9	-175.1	-58.9	0	0	0	0	111	L548 E557 L558	L548-C554 HydrophobicContact CD2-CB 3.81Å; C554-E557 VanDerWaalsContact C-OE2 3.27Å; C554-E557 WeakPolarHBondContact CA-OE2 3.22Å; C554-E557 VanDerWaalsContact CB-OE2 3.31Å; C554-E557 WeakPolarHBondContact CB-OE2 3.38Å; C554-L558 WeakPolarHBondContact O-CB 3.14Å; C554-L558 PolarHBondContact O-N 3.04Å
555	N	80.5	Confident	84.5	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-77.2	-27.1	-169.6	-66.5	-25.8	0	0	0	112.7	N552 F559 F574 E581 I583	N552-N555 PolarHBondContact O-ND2 2.75Å; N555-F559 WeakPolarHBondContact O-CB 3.44Å; N555-F559 PolarHBondContact O-N 3.42Å; N555-F559 VanDerWaalsContact O-N 3.09Å; N555-F574 HydrophobicContact CB-CE1 3.99Å; N555-F574 HydrophobicContact CB-CZ 4.03Å; N555-E581 PolarHBondContact ND2-OE2 3.12Å; N555-I583 HydrophobicContact CB-CD1 3.76Å; N555-I583 HydrophobicContact CB-CG1 4.05Å
556	S	81.8	Confident	84.2	Confident	47 Å²	47	45.8 Å²	45.8	33%	0.329	25%	0.245	S	C	.	.	H	α-helix	trans	-68.6	-47.9	170.5	50	0	0	0	0	111.6	L558 F559 D560	S556-L558 VanDerWaalsContact C-N 3.29Å; S556-L558 PolarHBondContact O-N 3.49Å; S556-F559 WeakPolarHBondContact O-CB 3.26Å; S556-F559 PolarHBondContact O-N 2.9Å; S556-F559 VanDerWaalsContact O-N 3.08Å; S556-D560 PolarHBondContact O-N 3.06Å
557	E	83.1	Confident	83.9	Confident	44 Å²	44	47.3 Å²	47.3	21%	0.206	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-31.7	-179.5	-59.7	83.3	178.9	0	0	112.2	K524 C554 A561	K524-E557 VanDerWaalsContact CE-OE1 3.31Å; K524-E557 WeakPolarHBondContact CE-OE1 3.33Å; K524-E557 IonicContact NZ-OE1 3.26Å; K524-E557 PolarHBondContact NZ-OE1 2.76Å; C554-E557 VanDerWaalsContact C-OE2 3.27Å; C554-E557 WeakPolarHBondContact CA-OE2 3.22Å; C554-E557 VanDerWaalsContact CB-OE2 3.31Å; C554-E557 WeakPolarHBondContact CB-OE2 3.38Å; E557-A561 VanDerWaalsContact O-CB 3.24Å; E557-A561 WeakPolarHBondContact O-CB 3.38Å; E557-A561 PolarHBondContact O-N 3.37Å
558	L	84.3	Confident	83.4	Confident	4 Å²	4	47.3 Å²	47.3	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-66.1	-40.6	171.5	176.9	55.8	0	0	0	111.5	I545 L548 K549 C554 S556 A561 L562 F574	I545-L558 HydrophobicContact CB-CD1 4.42Å; I545-L558 HydrophobicContact CG1-CD1 4.48Å; I545-L558 HydrophobicContact CG2-CD1 3.8Å; L548-L558 HydrophobicContact CB-CB 4.18Å; L548-L558 HydrophobicContact CB-CD1 4.27Å; L548-L558 HydrophobicContact CD1-CB 4.33Å; K549-L558 HydrophobicContact CB-CD2 4.16Å; C554-L558 WeakPolarHBondContact O-CB 3.14Å; C554-L558 PolarHBondContact O-N 3.04Å; S556-L558 VanDerWaalsContact C-N 3.29Å; S556-L558 PolarHBondContact O-N 3.49Å; L558-A561 PolarHBondContact O-N 3.47Å; L558-L562 HydrophobicContact CD1-CD1 4.41Å; L558-L562 HydrophobicContact CD1-CG 4.34Å; L558-L562 HydrophobicContact CG-CD1 4.46Å; L558-L562 WeakPolarHBondContact O-CG 3.4Å; L558-L562 PolarHBondContact O-N 2.93Å; L558-F574 HydrophobicContact CB-CE1 4.39Å; L558-F574 HydrophobicContact CD2-CD2 4.27Å; L558-F574 HydrophobicContact CD2-CE1 3.96Å; L558-F574 HydrophobicContact CD2-CE2 3.63Å; L558-F574 HydrophobicContact CD2-CZ 3.46Å; L558-F574 VanDerWaalsContact CD2-CZ 3.46Å; L558-F574 HydrophobicContact CG-CE1 4.17Å; L558-F574 HydrophobicContact CG-CZ 4.18Å
559	F	84.9	Confident	83.2	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.009	25%	0.253	C	S	.	.	H	α-helix	trans	-60.1	-50.1	174.6	-178.6	-93.1	0	0	0	110.8	N555 S556 A561 L562 L563 A571 A575 I583 N588	N555-F559 WeakPolarHBondContact O-CB 3.44Å; N555-F559 PolarHBondContact O-N 3.42Å; N555-F559 VanDerWaalsContact O-N 3.09Å; S556-F559 WeakPolarHBondContact O-CB 3.26Å; S556-F559 PolarHBondContact O-N 2.9Å; S556-F559 VanDerWaalsContact O-N 3.08Å; F559-A561 VanDerWaalsContact C-N 3.34Å; F559-A561 PolarHBondContact O-N 3.17Å; F559-L562 PolarHBondContact O-N 3.14Å; F559-L562 VanDerWaalsContact O-N 3.14Å; F559-L563 HydrophobicContact CD1-CD1 3.98Å; F559-L563 HydrophobicContact CD1-CG 4.33Å; F559-L563 HydrophobicContact CE1-CD1 3.47Å; F559-L563 VanDerWaalsContact CE1-CD1 3.47Å; F559-L563 HydrophobicContact CE1-CD2 4.4Å; F559-L563 HydrophobicContact CE1-CG 4.03Å; F559-L563 HydrophobicContact CZ-CD1 4.15Å; F559-L563 HydrophobicContact CZ-CD2 4.32Å; F559-L563 HydrophobicContact CZ-CG 4.43Å; F559-L563 WeakPolarHBondContact O-CG 3.18Å; F559-L563 PolarHBondContact O-N 3.31Å; F559-L563 VanDerWaalsContact O-N 3.1Å; F559-A571 HydrophobicContact CD2-CB 3.8Å; F559-A571 WeakPolarHBondContact CD2-O 3.35Å; F559-A571 HydrophobicContact CE2-CB 3.68Å; F559-A571 WeakPolarHBondContact CE2-O 3.43Å; F559-A571 HydrophobicContact CZ-CB 4.33Å; F559-A575 HydrophobicContact CD2-CB 4.08Å; F559-A575 HydrophobicContact CE2-CB 3.99Å; F559-I583 HydrophobicContact CB-CG2 3.71Å; F559-I583 HydrophobicContact CD2-CG2 4.14Å; F559-I583 HydrophobicContact CG-CG2 3.93Å; F559-N588 HydrophobicContact CD1-CB 4.26Å; F559-N588 HydrophobicContact CE1-CB 3.92Å
560	D	84	Confident	83	Confident	47 Å²	47	46.5 Å²	46.5	25%	0.251	25%	0.245	S	C	.	.	H	α-helix	trans	-61.9	-40.8	178.3	-65.3	-26.2	0	0	0	112.1	S556 L562 L563 I564 N588	S556-D560 PolarHBondContact O-N 3.06Å; D560-L562 VanDerWaalsContact C-N 3.3Å; D560-L562 PolarHBondContact O-N 2.85Å; D560-L563 PolarHBondContact O-N 3.07Å; D560-I564 WeakPolarHBondContact O-CG1 3.32Å; D560-I564 PolarHBondContact O-N 3.23Å; D560-N588 PolarHBondContact OD1-OD1 3.46Å
561	A	84.4	Confident	82.8	Confident	7 Å²	7	42 Å²	42	6%	0.058	23%	0.229	C	C	.	.	H	α-helix	trans	-62	-36	176.4	0	0	0	0	0	112.6	L531 I545 L548 E557 L558 F559 K565	L531-A561 HydrophobicContact CD1-CB 3.81Å; L531-A561 HydrophobicContact CD2-CB 4.24Å; I545-A561 HydrophobicContact CG1-CB 4.46Å; L548-A561 HydrophobicContact CD1-CB 4.41Å; E557-A561 VanDerWaalsContact O-CB 3.24Å; E557-A561 WeakPolarHBondContact O-CB 3.38Å; E557-A561 PolarHBondContact O-N 3.37Å; L558-A561 PolarHBondContact O-N 3.47Å; F559-A561 VanDerWaalsContact C-N 3.34Å; F559-A561 PolarHBondContact O-N 3.17Å; A561-K565 WeakPolarHBondContact O-CB 3.32Å; A561-K565 WeakPolarHBondContact O-CG 3.15Å; A561-K565 PolarHBondContact O-N 3.21Å; A561-K565 VanDerWaalsContact O-N 3.16Å
562	L	85.1	Confident	82.4	Confident	12 Å²	12	40.6 Å²	40.6	6%	0.063	22%	0.221	C	C	.	.	H	α-helix	trans	-70.4	-34.8	175.6	-71.4	169.8	0	0	0	112.2	I545 L558 F559 D560 K565 R567 A571 F574	I545-L562 HydrophobicContact CD1-CD2 4.24Å; L558-L562 HydrophobicContact CD1-CD1 4.41Å; L558-L562 HydrophobicContact CD1-CG 4.34Å; L558-L562 HydrophobicContact CG-CD1 4.46Å; L558-L562 WeakPolarHBondContact O-CG 3.4Å; L558-L562 PolarHBondContact O-N 2.93Å; F559-L562 PolarHBondContact O-N 3.14Å; F559-L562 VanDerWaalsContact O-N 3.14Å; D560-L562 VanDerWaalsContact C-N 3.3Å; D560-L562 PolarHBondContact O-N 2.85Å; L562-K565 PolarHBondContact O-N 3.19Å; L562-R567 PolarHBondContact O-N 2.91Å; L562-A571 HydrophobicContact CB-CB 3.79Å; L562-A571 HydrophobicContact CD1-CB 4.31Å; L562-F574 HydrophobicContact CD1-CB 4.33Å
563	L	84.5	Confident	82.5	Confident	11 Å²	11	42.8 Å²	42.8	6%	0.058	22%	0.222	C	C	.	.	H	α-helix	trans	-65.5	-47.7	173.7	-63.3	-174.8	0	0	0	111.3	F559 D560 K565 G566 P568 A571 N591 Y592 A595	F559-L563 HydrophobicContact CD1-CD1 3.98Å; F559-L563 HydrophobicContact CD1-CG 4.33Å; F559-L563 HydrophobicContact CE1-CD1 3.47Å; F559-L563 VanDerWaalsContact CE1-CD1 3.47Å; F559-L563 HydrophobicContact CE1-CD2 4.4Å; F559-L563 HydrophobicContact CE1-CG 4.03Å; F559-L563 HydrophobicContact CZ-CD1 4.15Å; F559-L563 HydrophobicContact CZ-CD2 4.32Å; F559-L563 HydrophobicContact CZ-CG 4.43Å; F559-L563 WeakPolarHBondContact O-CG 3.18Å; F559-L563 PolarHBondContact O-N 3.31Å; F559-L563 VanDerWaalsContact O-N 3.1Å; D560-L563 PolarHBondContact O-N 3.07Å; L563-K565 PolarHBondContact O-N 3.5Å; L563-G566 PolarHBondContact O-N 3.28Å; L563-P568 HydrophobicContact CD2-CB 4.27Å; L563-A571 HydrophobicContact CD2-CB 3.73Å; L563-A571 HydrophobicContact CG-CB 4.36Å; L563-N591 HydrophobicContact CD1-CB 3.99Å; L563-Y592 HydrophobicContact CD2-CD2 3.77Å; L563-Y592 HydrophobicContact CD2-CG 4.44Å; L563-A595 HydrophobicContact CB-CB 4.46Å
564	I	84.2	Confident	82.6	Confident	148 Å²	148	38.6 Å²	38.6	76%	0.759	20%	0.195	S	C	*	.	H	α-helix	trans	-59.4	-31.1	177.7	-66.5	166.1	0	0	0	111.4	D560 G566	D560-I564 WeakPolarHBondContact O-CG1 3.32Å; D560-I564 PolarHBondContact O-N 3.23Å; I564-G566 PolarHBondContact O-N 3.46Å
565	K	81.5	Confident	82.6	Confident	44 Å²	44	38.5 Å²	38.5	19%	0.191	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-1.9	176.1	-75.7	-92.7	-166.6	-176	0	114.8	E534 I545 A561 L562 L563 R567	E534-K565 WeakPolarHBondContact OE1-CE 3.34Å; E534-K565 IonicContact OE1-NZ 3.07Å; E534-K565 PolarHBondContact OE1-NZ 2.95Å; E534-K565 WeakPolarHBondContact OE2-CE 3.41Å; E534-K565 IonicContact OE2-NZ 2.75Å; E534-K565 PolarHBondContact OE2-NZ 3.21Å; I545-K565 HydrophobicContact CD1-CD 4.19Å; I545-K565 HydrophobicContact CD1-CG 3.95Å; A561-K565 WeakPolarHBondContact O-CB 3.32Å; A561-K565 WeakPolarHBondContact O-CG 3.15Å; A561-K565 PolarHBondContact O-N 3.21Å; A561-K565 VanDerWaalsContact O-N 3.16Å; L562-K565 PolarHBondContact O-N 3.19Å; L563-K565 PolarHBondContact O-N 3.5Å; K565-R567 HydrophobicContact CB-CG 4.29Å
566	G	81.8	Confident	82.5	Confident	41 Å²	41	44 Å²	44	42%	0.423	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	31.6	-174.2	0	0	0	0	0	113.2	L563 I564 P568	L563-G566 PolarHBondContact O-N 3.28Å; I564-G566 PolarHBondContact O-N 3.46Å; G566-P568 VanDerWaalsContact O-CD 3.29Å; G566-P568 WeakPolarHBondContact O-CD 3.16Å
567	R	84.4	Confident	82.3	Confident	92 Å²	92	48.7 Å²	48.7	35%	0.347	24%	0.235	S	C	.	.			trans	-118.2	60	178.5	-55.9	-167.7	-171.2	-175.5	2.5	113	L562 K565 L569 E570 A571	L562-R567 PolarHBondContact O-N 2.91Å; K565-R567 HydrophobicContact CB-CG 4.29Å; R567-L569 VanDerWaalsContact C-N 3.3Å; R567-L569 PolarHBondContact O-N 2.96Å; R567-E570 HydrophobicContact CB-CB 4.15Å; R567-E570 HydrophobicContact CB-CG 4.35Å; R567-E570 WeakPolarHBondContact CD-OE2 3.34Å; R567-E570 IonicContact NH1-OE1 2.82Å; R567-E570 IonicContact NH1-OE2 3.79Å; R567-E570 PolarHBondContact NH1-OE2 2.99Å; R567-E570 VanDerWaalsContact NH1-OE2 3.16Å; R567-E570 PolarHBondContact O-N 2.66Å; R567-A571 PolarHBondContact O-N 2.83Å; R567-A571 VanDerWaalsContact O-N 3.08Å
568	P	81.4	Confident	81.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-33.1	-175	22.3	-30	0	0	0	113.4	L563 G566 A571 L572 Y592 V596 I599	L563-P568 HydrophobicContact CD2-CB 4.27Å; G566-P568 VanDerWaalsContact O-CD 3.29Å; G566-P568 WeakPolarHBondContact O-CD 3.16Å; P568-A571 WeakPolarHBondContact O-CB 3.4Å; P568-A571 PolarHBondContact O-N 3Å; P568-L572 PolarHBondContact O-N 2.93Å; P568-Y592 HydrophobicContact CB-CD2 3.84Å; P568-Y592 HydrophobicContact CB-CE2 3.39Å; P568-V596 HydrophobicContact CB-CG2 3.76Å; P568-V596 HydrophobicContact CG-CG2 3.91Å; P568-I599 HydrophobicContact CG-CD1 3.37Å
569	L	82.5	Confident	80.7	Confident	28 Å²	28	54.6 Å²	54.6	15%	0.147	26%	0.257	C	S	.	.	H	α-helix	trans	-67.6	-40.1	179	-170.2	66.9	0	0	0	111.8	R567 A571 R573 C607 N608 F611	R567-L569 VanDerWaalsContact C-N 3.3Å; R567-L569 PolarHBondContact O-N 2.96Å; L569-A571 VanDerWaalsContact C-N 3.35Å; L569-R573 WeakPolarHBondContact O-CB 3.26Å; L569-R573 VanDerWaalsContact O-CG 3.25Å; L569-R573 WeakPolarHBondContact O-CG 3.44Å; L569-R573 PolarHBondContact O-N 2.84Å; L569-C607 HydrophobicContact CD2-CB 4.31Å; L569-N608 VanDerWaalsContact CA-OD1 3.23Å; L569-N608 WeakPolarHBondContact CA-OD1 3.4Å; L569-N608 VanDerWaalsContact CB-OD1 3.31Å; L569-N608 WeakPolarHBondContact CB-OD1 3.39Å; L569-N608 PolarHBondContact N-OD1 3.01Å; L569-N608 VanDerWaalsContact N-OD1 3.12Å; L569-F611 HydrophobicContact CD1-CB 3.88Å; L569-F611 HydrophobicContact CD1-CD1 4.49Å; L569-F611 HydrophobicContact CD1-CD2 4.39Å; L569-F611 HydrophobicContact CD1-CG 4.01Å
570	E	84.4	Confident	79.3	Confident	94 Å²	94	59.7 Å²	59.7	44%	0.439	29%	0.293	S	S	.	.	H	α-helix	trans	-65.3	-41.5	174.6	-67.2	-175.9	-176.4	0	0	110.5	R567 R573 F574	R567-E570 HydrophobicContact CB-CB 4.15Å; R567-E570 HydrophobicContact CB-CG 4.35Å; R567-E570 WeakPolarHBondContact CD-OE2 3.34Å; R567-E570 IonicContact NH1-OE1 2.82Å; R567-E570 IonicContact NH1-OE2 3.79Å; R567-E570 PolarHBondContact NH1-OE2 2.99Å; R567-E570 VanDerWaalsContact NH1-OE2 3.16Å; R567-E570 PolarHBondContact O-N 2.66Å; E570-R573 PolarHBondContact O-N 2.93Å; E570-F574 VanDerWaalsContact O-CB 3.32Å; E570-F574 WeakPolarHBondContact O-CB 3.39Å; E570-F574 PolarHBondContact O-N 2.91Å
571	A	82.9	Confident	78.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.1	-46.9	176.4	0	0	0	0	0	112	F559 L562 L563 R567 P568 L569 F574 A575	F559-A571 HydrophobicContact CD2-CB 3.8Å; F559-A571 WeakPolarHBondContact CD2-O 3.35Å; F559-A571 HydrophobicContact CE2-CB 3.68Å; F559-A571 WeakPolarHBondContact CE2-O 3.43Å; F559-A571 HydrophobicContact CZ-CB 4.33Å; L562-A571 HydrophobicContact CB-CB 3.79Å; L562-A571 HydrophobicContact CD1-CB 4.31Å; L563-A571 HydrophobicContact CD2-CB 3.73Å; L563-A571 HydrophobicContact CG-CB 4.36Å; R567-A571 PolarHBondContact O-N 2.83Å; R567-A571 VanDerWaalsContact O-N 3.08Å; P568-A571 WeakPolarHBondContact O-CB 3.4Å; P568-A571 PolarHBondContact O-N 3Å; L569-A571 VanDerWaalsContact C-N 3.35Å; A571-F574 WeakPolarHBondContact O-CB 3.45Å; A571-F574 PolarHBondContact O-N 3.21Å; A571-A575 PolarHBondContact O-N 3.43Å
572	L	78.7	Confident	77.1	Confident	11 Å²	11	67.9 Å²	67.9	6%	0.058	33%	0.333	C	S	.	.	H	α-helix	trans	-65.3	-40.3	176.9	-82.1	-179.6	0	0	0	113.1	P568 F574 A575 R576 Y592 F611 L612	P568-L572 PolarHBondContact O-N 2.93Å; L572-F574 VanDerWaalsContact C-N 3.29Å; L572-F574 PolarHBondContact O-N 2.86Å; L572-A575 PolarHBondContact O-N 3.28Å; L572-R576 WeakPolarHBondContact O-CB 3.42Å; L572-R576 PolarHBondContact O-N 3.14Å; L572-Y592 HydrophobicContact CD1-CD2 4.35Å; L572-Y592 HydrophobicContact CD1-CE1 4.31Å; L572-Y592 HydrophobicContact CD1-CE2 3.34Å; L572-Y592 WeakPolarHBondContact CD1-OH 3.43Å; L572-Y592 HydrophobicContact CD2-CD2 4.39Å; L572-Y592 HydrophobicContact CD2-CE2 4.12Å; L572-Y592 HydrophobicContact CG-CD2 4.01Å; L572-Y592 HydrophobicContact CG-CE2 3.38Å; L572-F611 HydrophobicContact CB-CD1 4.03Å; L572-F611 HydrophobicContact CB-CE1 3.83Å; L572-F611 HydrophobicContact CD1-CD1 4.06Å; L572-L612 HydrophobicContact CD1-CD1 4.49Å; L572-L612 HydrophobicContact CD1-CD2 3.99Å; L572-L612 HydrophobicContact CD1-CG 3.87Å; L572-L612 HydrophobicContact CD2-CD2 4.47Å
573	R	81.9	Confident	75.9	Confident	138 Å²	138	67.9 Å²	67.9	52%	0.521	33%	0.333	S	S	.	.	H	α-helix	trans	-62.8	-40.4	174.9	-75.3	174.9	179.5	-161.3	2.6	111	L569 E570 R576 L577 F611	L569-R573 WeakPolarHBondContact O-CB 3.26Å; L569-R573 VanDerWaalsContact O-CG 3.25Å; L569-R573 WeakPolarHBondContact O-CG 3.44Å; L569-R573 PolarHBondContact O-N 2.84Å; E570-R573 PolarHBondContact O-N 2.93Å; R573-R576 PolarHBondContact O-N 3.25Å; R573-L577 PolarHBondContact O-N 2.79Å; R573-L577 VanDerWaalsContact O-N 3.14Å; R573-F611 HydrophobicContact CG-CE1 4.4Å; R573-F611 HydrophobicContact CG-CE2 3.88Å; R573-F611 HydrophobicContact CG-CZ 3.71Å
574	F	80.9	Confident	74.8	Confident	27 Å²	27	69.3 Å²	69.3	12%	0.118	34%	0.34	C	S	.	.	H	α-helix	trans	-62.8	-49.3	175.4	177.9	-100.5	0	0	0	111.7	N555 L558 L562 E570 A571 L572 R576 L577 H578 I583	N555-F574 HydrophobicContact CB-CE1 3.99Å; N555-F574 HydrophobicContact CB-CZ 4.03Å; L558-F574 HydrophobicContact CB-CE1 4.39Å; L558-F574 HydrophobicContact CD2-CD2 4.27Å; L558-F574 HydrophobicContact CD2-CE1 3.96Å; L558-F574 HydrophobicContact CD2-CE2 3.63Å; L558-F574 HydrophobicContact CD2-CZ 3.46Å; L558-F574 VanDerWaalsContact CD2-CZ 3.46Å; L558-F574 HydrophobicContact CG-CE1 4.17Å; L558-F574 HydrophobicContact CG-CZ 4.18Å; L562-F574 HydrophobicContact CD1-CB 4.33Å; E570-F574 VanDerWaalsContact O-CB 3.32Å; E570-F574 WeakPolarHBondContact O-CB 3.39Å; E570-F574 PolarHBondContact O-N 2.91Å; A571-F574 WeakPolarHBondContact O-CB 3.45Å; A571-F574 PolarHBondContact O-N 3.21Å; L572-F574 VanDerWaalsContact C-N 3.29Å; L572-F574 PolarHBondContact O-N 2.86Å; F574-R576 PolarHBondContact O-N 3.39Å; F574-L577 WeakPolarHBondContact O-CB 3.06Å; F574-L577 PolarHBondContact O-N 2.87Å; F574-H578 AromaticContact CD2-CD2 3.79Å; F574-H578 AromaticContact CE2-CD2 3.31Å; F574-H578 WeakPolarHBondContact CE2-CD2 3.33Å; F574-H578 AromaticContact CE2-NE2 3.31Å; F574-H578 VanDerWaalsContact CE2-NE2 3.31Å; F574-H578 WeakPolarHBondContact CE2-NE2 3.39Å; F574-H578 AromaticContact CZ-CD2 3.56Å; F574-H578 AromaticContact CZ-NE2 3.78Å; F574-H578 PolarHBondContact O-N 2.9Å; F574-I583 HydrophobicContact CE1-CD1 4.23Å
575	A	77.9	Confident	73.8	Confident	7 Å²	7	67.2 Å²	67.2	6%	0.058	33%	0.33	C	S	.	.	H	α-helix	trans	-58.7	-36.5	176.7	0	0	0	0	0	112.5	F559 A571 L572 H578 R579 I583 I584	F559-A575 HydrophobicContact CD2-CB 4.08Å; F559-A575 HydrophobicContact CE2-CB 3.99Å; A571-A575 PolarHBondContact O-N 3.43Å; L572-A575 PolarHBondContact O-N 3.28Å; A575-H578 CarbonylContact O-C 3.55Å; A575-H578 PolarHBondContact O-N 2.99Å; A575-R579 PolarHBondContact O-N 3.22Å; A575-I583 HydrophobicContact CB-CG2 4.5Å; A575-I584 HydrophobicContact CB-CD1 3.93Å; A575-I584 HydrophobicContact CB-CG1 4.02Å
576	R	77	Confident	72.6	Confident	120 Å²	120	70.8 Å²	70.8	45%	0.453	35%	0.349	S	S	.	.	H	α-helix	trans	-64.3	-39.4	174.4	179.4	178.5	171.8	178.5	-2.9	112.6	L572 R573 F574 H578 R579 N615	L572-R576 WeakPolarHBondContact O-CB 3.42Å; L572-R576 PolarHBondContact O-N 3.14Å; R573-R576 PolarHBondContact O-N 3.25Å; F574-R576 PolarHBondContact O-N 3.39Å; R576-H578 VanDerWaalsContact C-N 3.29Å; R576-H578 PolarHBondContact O-N 2.86Å; R576-R579 WeakPolarHBondContact O-CG 3.46Å; R576-N615 VanDerWaalsContact CZ-OD1 3.29Å; R576-N615 PolarHBondContact NE-OD1 2.73Å; R576-N615 PolarHBondContact NH1-OD1 2.96Å
577	L	78.2	Confident	71.5	Confident	145 Å²	145	76 Å²	76	76%	0.759	36%	0.362	S	S	*	.	H	α-helix	trans	-65.9	-33.5	178.6	-104.1	126.5	0	0	0	112	R573 F574	R573-L577 PolarHBondContact O-N 2.79Å; R573-L577 VanDerWaalsContact O-N 3.14Å; F574-L577 WeakPolarHBondContact O-CB 3.06Å; F574-L577 PolarHBondContact O-N 2.87Å
578	H	72	Confident	70.7	Confident	40 Å²	40	72.4 Å²	72.4	19%	0.185	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	35.7	-176.6	-68.3	-93.2	0	0	0	113.3	F574 A575 R576 S580 E581 I583	F574-H578 AromaticContact CD2-CD2 3.79Å; F574-H578 AromaticContact CE2-CD2 3.31Å; F574-H578 WeakPolarHBondContact CE2-CD2 3.33Å; F574-H578 AromaticContact CE2-NE2 3.31Å; F574-H578 VanDerWaalsContact CE2-NE2 3.31Å; F574-H578 WeakPolarHBondContact CE2-NE2 3.39Å; F574-H578 AromaticContact CZ-CD2 3.56Å; F574-H578 AromaticContact CZ-NE2 3.78Å; F574-H578 PolarHBondContact O-N 2.9Å; A575-H578 CarbonylContact O-C 3.55Å; A575-H578 PolarHBondContact O-N 2.99Å; R576-H578 VanDerWaalsContact C-N 3.29Å; R576-H578 PolarHBondContact O-N 2.86Å; H578-S580 PolarHBondContact O-N 3.3Å; H578-E581 PolarHBondContact O-N 2.89Å; H578-E581 VanDerWaalsContact O-N 3.13Å; H578-I583 HydrophobicContact CB-CD1 3.34Å
579	R	62.2	Low	70	Confident	132 Å²	132	72.6 Å²	72.6	50%	0.498	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-49.3	-23.1	-176.7	-100.9	-176.8	-172.5	178.8	3.1	116.1	A575 R576 E581	A575-R579 PolarHBondContact O-N 3.22Å; R576-R579 WeakPolarHBondContact O-CG 3.46Å; R579-E581 VanDerWaalsContact C-N 3.27Å; R579-E581 PolarHBondContact O-N 2.6Å
580	S	55.8	Low	69.4	Low	109 Å²	109	77.5 Å²	77.5	76%	0.762	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-73.7	-12.1	-178	49	0	0	0	0	114.6	H578	H578-S580 PolarHBondContact O-N 3.3Å
581	E	59	Low	68.8	Low	94 Å²	94	76.4 Å²	76.4	44%	0.439	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-110.8	8.7	-166.5	-66.1	-179.3	-162.8	0	0	115.3	N555 H578 R579 I583	N555-E581 PolarHBondContact ND2-OE2 3.12Å; H578-E581 PolarHBondContact O-N 2.89Å; H578-E581 VanDerWaalsContact O-N 3.13Å; R579-E581 VanDerWaalsContact C-N 3.27Å; R579-E581 PolarHBondContact O-N 2.6Å; E581-I583 VanDerWaalsContact C-N 3.29Å; E581-I583 HydrophobicContact CB-CG1 4.17Å; E581-I583 PolarHBondContact O-N 2.8Å
582	N	62.2	Low	68.5	Low	133 Å²	133	76.5 Å²	76.5	71%	0.711	37%	0.365	S	S	*	.			trans	46.9	48	-178.7	-71.8	-11.7	0	0	0	113.5	I584	N582-I584 PolarHBondContact O-N 2.9Å; N582-I584 VanDerWaalsContact O-N 3.16Å
583	I	61.2	Low	68.3	Low	12 Å²	12	76.5 Å²	76.5	6%	0.062	37%	0.365	C	S	.	.			trans	-62.9	-22.5	-178.8	-64.7	163.5	0	0	0	112.6	N555 F559 F574 A575 H578 E581 N588	N555-I583 HydrophobicContact CB-CD1 3.76Å; N555-I583 HydrophobicContact CB-CG1 4.05Å; F559-I583 HydrophobicContact CB-CG2 3.71Å; F559-I583 HydrophobicContact CD2-CG2 4.14Å; F559-I583 HydrophobicContact CG-CG2 3.93Å; F574-I583 HydrophobicContact CE1-CD1 4.23Å; A575-I583 HydrophobicContact CB-CG2 4.5Å; H578-I583 HydrophobicContact CB-CD1 3.34Å; E581-I583 VanDerWaalsContact C-N 3.29Å; E581-I583 HydrophobicContact CB-CG1 4.17Å; E581-I583 PolarHBondContact O-N 2.8Å; I583-N588 PolarHBondContact O-ND2 2.77Å
584	I	61.8	Low	68.1	Low	41 Å²	41	73.2 Å²	73.2	21%	0.21	36%	0.358	C	S	.	.			trans	-99.5	95	-176	-54	176.3	0	0	0	109	A575 N582 V589 C618 M619	A575-I584 HydrophobicContact CB-CD1 3.93Å; A575-I584 HydrophobicContact CB-CG1 4.02Å; N582-I584 PolarHBondContact O-N 2.9Å; N582-I584 VanDerWaalsContact O-N 3.16Å; I584-V589 HydrophobicContact CG2-CG2 3.42Å; I584-V589 VanDerWaalsContact CG2-CG2 3.42Å; I584-C618 HydrophobicContact CD1-CB 4.49Å; I584-M619 HydrophobicContact CD1-CE 4.48Å; I584-M619 HydrophobicContact CG2-CE 3.8Å; I584-M619 HydrophobicContact CG2-CG 4.46Å; I584-M619 HydrophobicContact CG2-SD 4.01Å
585	D	62.9	Low	67.9	Low	104 Å²	104	72.5 Å²	72.5	56%	0.556	36%	0.357	S	S	*	.			trans	-92.4	159.8	165.7	-78.3	-28.5	0	0	0	111	E587 N588 V589	D585-E587 PolarHBondContact O-N 2.83Å; D585-N588 PolarHBondContact O-N 2.89Å; D585-V589 WeakPolarHBondContact O-CG2 3.35Å; D585-V589 PolarHBondContact O-N 3.01Å
586	M	56.5	Low	67.8	Low	118 Å²	118	72.3 Å²	72.3	58%	0.581	36%	0.355	S	S	*	.	H	α-helix	trans	-51	-32.5	-178	-71.5	-71.7	-62	0	0	113.7	Y622	M586-Y622 HydrophobicContact CB-CE2 4.35Å; M586-Y622 HydrophobicContact CE-CD2 3.75Å; M586-Y622 HydrophobicContact CE-CE2 3.34Å; M586-Y622 HydrophobicContact CG-CE2 4.45Å; M586-Y622 HydrophobicContact SD-CD2 3.26Å; M586-Y622 WeakPolarHBondContact SD-CD2 3.34Å; M586-Y622 HydrophobicContact SD-CE2 3.35Å; M586-Y622 WeakPolarHBondContact SD-CE2 3.46Å; M586-Y622 HydrophobicContact SD-CG 4.48Å
587	E	58.8	Low	67.8	Low	151 Å²	151	71.7 Å²	71.7	71%	0.706	36%	0.357	S	S	*	.	H	α-helix	trans	-72.6	-41.2	179.6	-163.9	166.3	-167.6	0	0	111.8	D585 V589 R590 N591	D585-E587 PolarHBondContact O-N 2.83Å; E587-V589 VanDerWaalsContact C-N 3.27Å; E587-V589 PolarHBondContact O-N 2.87Å; E587-R590 PolarHBondContact O-N 2.73Å; E587-N591 PolarHBondContact O-N 3.13Å
588	N	66.9	Low	67.9	Low	17 Å²	17	72.6 Å²	72.6	9%	0.091	36%	0.358	C	S	.	.	H	α-helix	trans	-67.7	-28.5	178.3	-67.1	-4.1	0	0	0	112.3	F559 D560 I583 D585 Y592	F559-N588 HydrophobicContact CD1-CB 4.26Å; F559-N588 HydrophobicContact CE1-CB 3.92Å; D560-N588 PolarHBondContact OD1-OD1 3.46Å; I583-N588 PolarHBondContact O-ND2 2.77Å; D585-N588 PolarHBondContact O-N 2.89Å; N588-Y592 WeakPolarHBondContact O-CB 3.36Å; N588-Y592 PolarHBondContact O-N 2.91Å
589	V	65.6	Low	68.1	Low	3 Å²	3	71.9 Å²	71.9	2%	0.018	36%	0.355	C	S	.	.	H	α-helix	trans	-68.2	-39.3	175.4	-175.9	0	0	0	0	111.7	I584 D585 E587 Y592 L593 M619 Y622	I584-V589 HydrophobicContact CG2-CG2 3.42Å; I584-V589 VanDerWaalsContact CG2-CG2 3.42Å; D585-V589 WeakPolarHBondContact O-CG2 3.35Å; D585-V589 PolarHBondContact O-N 3.01Å; E587-V589 VanDerWaalsContact C-N 3.27Å; E587-V589 PolarHBondContact O-N 2.87Å; V589-Y592 WeakPolarHBondContact O-CB 3.36Å; V589-Y592 PolarHBondContact O-N 3.49Å; V589-L593 HydrophobicContact CG1-CD1 4.39Å; V589-L593 WeakPolarHBondContact O-CG 3.09Å; V589-L593 PolarHBondContact O-N 3.1Å; V589-M619 HydrophobicContact CB-CE 4.2Å; V589-M619 HydrophobicContact CB-SD 4.25Å; V589-M619 HydrophobicContact CG1-CE 3.71Å; V589-M619 HydrophobicContact CG1-SD 3.75Å; V589-M619 HydrophobicContact CG2-CE 3.59Å; V589-M619 HydrophobicContact CG2-SD 3.43Å; V589-M619 WeakPolarHBondContact CG2-SD 3.26Å; V589-Y622 HydrophobicContact CB-CD1 4.46Å; V589-Y622 HydrophobicContact CB-CD2 4.02Å; V589-Y622 HydrophobicContact CB-CE1 4.03Å; V589-Y622 HydrophobicContact CB-CE2 3.54Å; V589-Y622 HydrophobicContact CB-CG 4.46Å; V589-Y622 HydrophobicContact CG1-CD1 3.57Å; V589-Y622 HydrophobicContact CG1-CD2 3.99Å; V589-Y622 HydrophobicContact CG1-CE1 3.22Å; V589-Y622 HydrophobicContact CG1-CE2 3.69Å; V589-Y622 HydrophobicContact CG1-CG 3.94Å; V589-Y622 HydrophobicContact CG2-CD2 3.83Å; V589-Y622 HydrophobicContact CG2-CE2 3.81Å; V589-Y622 HydrophobicContact CG2-CG 4.34Å
590	R	69.5	Low	68.7	Low	132 Å²	132	74.2 Å²	74.2	50%	0.498	37%	0.372	S	S	.	.	H	α-helix	trans	-65.3	-47.6	176.4	-174.1	177	-179.6	139.6	4.2	110.5	E587 Y592 L593 D594 E627	E587-R590 PolarHBondContact O-N 2.73Å; R590-Y592 PolarHBondContact O-N 3.23Å; R590-L593 PolarHBondContact O-N 3.05Å; R590-D594 VanDerWaalsContact O-CG 3.32Å; R590-D594 PolarHBondContact O-N 2.95Å; R590-E627 IonicContact NH1-OE1 3.95Å
591	N	72.9	Confident	69.9	Low	71 Å²	71	73.2 Å²	73.2	38%	0.38	36%	0.358	S	S	.	.	H	α-helix	trans	-57.3	-37.5	175	-63.3	-17.8	0	0	0	111.8	L563 E587 A595	L563-N591 HydrophobicContact CD1-CB 3.99Å; E587-N591 PolarHBondContact O-N 3.13Å; N591-A595 WeakPolarHBondContact O-CB 3.36Å; N591-A595 PolarHBondContact O-N 2.81Å
592	Y	76.8	Confident	70.8	Confident	2 Å²	2	75.6 Å²	75.6	1%	0.008	36%	0.364	C	S	.	.	H	α-helix	trans	-64.8	-48	173.4	170.6	-84	0	0	0	111.8	L563 P568 L572 N588 V589 R590 D594 A595 V596 N608 L612	L563-Y592 HydrophobicContact CD2-CD2 3.77Å; L563-Y592 HydrophobicContact CD2-CG 4.44Å; P568-Y592 HydrophobicContact CB-CD2 3.84Å; P568-Y592 HydrophobicContact CB-CE2 3.39Å; L572-Y592 HydrophobicContact CD1-CD2 4.35Å; L572-Y592 HydrophobicContact CD1-CE1 4.31Å; L572-Y592 HydrophobicContact CD1-CE2 3.34Å; L572-Y592 WeakPolarHBondContact CD1-OH 3.43Å; L572-Y592 HydrophobicContact CD2-CD2 4.39Å; L572-Y592 HydrophobicContact CD2-CE2 4.12Å; L572-Y592 HydrophobicContact CG-CD2 4.01Å; L572-Y592 HydrophobicContact CG-CE2 3.38Å; N588-Y592 WeakPolarHBondContact O-CB 3.36Å; N588-Y592 PolarHBondContact O-N 2.91Å; V589-Y592 WeakPolarHBondContact O-CB 3.36Å; V589-Y592 PolarHBondContact O-N 3.49Å; R590-Y592 PolarHBondContact O-N 3.23Å; Y592-D594 VanDerWaalsContact C-N 3.31Å; Y592-D594 PolarHBondContact O-N 3.13Å; Y592-A595 PolarHBondContact O-N 3.47Å; Y592-V596 HydrophobicContact CD1-CG2 4.1Å; Y592-V596 HydrophobicContact CD2-CG2 4.44Å; Y592-V596 HydrophobicContact CE1-CG2 3.45Å; Y592-V596 VanDerWaalsContact CE1-CG2 3.45Å; Y592-V596 HydrophobicContact CE2-CG2 3.9Å; Y592-V596 WeakPolarHBondContact O-CG2 3.28Å; Y592-V596 PolarHBondContact O-N 2.92Å; Y592-V596 WeakPolarHBondContact OH-CG2 3.34Å; Y592-N608 PolarHBondContact OH-OD1 2.8Å; Y592-L612 HydrophobicContact CE1-CD1 3.71Å; Y592-L612 WeakPolarHBondContact OH-CD1 3.37Å
593	L	74	Confident	71.7	Confident	10 Å²	10	75.1 Å²	75.1	5%	0.052	36%	0.359	C	S	.	.	H	α-helix	trans	-62.2	-41	-179.7	-72.6	172.7	0	0	0	111.7	V589 R590 A595 V596 Q597 Y622 C628 Y631	V589-L593 HydrophobicContact CG1-CD1 4.39Å; V589-L593 WeakPolarHBondContact O-CG 3.09Å; V589-L593 PolarHBondContact O-N 3.1Å; R590-L593 PolarHBondContact O-N 3.05Å; L593-A595 VanDerWaalsContact C-N 3.35Å; L593-V596 PolarHBondContact O-N 3.34Å; L593-Q597 WeakPolarHBondContact O-CG 3.25Å; L593-Q597 PolarHBondContact O-N 3.31Å; L593-Y622 HydrophobicContact CD1-CE1 4.37Å; L593-C628 HydrophobicContact CD1-CB 4.43Å; L593-Y631 HydrophobicContact CD2-CD1 3.58Å; L593-Y631 HydrophobicContact CD2-CE1 4.05Å; L593-Y631 HydrophobicContact CD2-CG 4.11Å
594	D	77.2	Confident	72.4	Confident	70 Å²	70	77.9 Å²	77.9	37%	0.374	37%	0.371	S	S	.	.	H	α-helix	trans	-61.6	-44.9	174.6	-66	-19.3	0	0	0	110.1	R590 Y592 V596 Q597 E598	R590-D594 VanDerWaalsContact O-CG 3.32Å; R590-D594 PolarHBondContact O-N 2.95Å; Y592-D594 VanDerWaalsContact C-N 3.31Å; Y592-D594 PolarHBondContact O-N 3.13Å; D594-V596 VanDerWaalsContact C-N 3.33Å; D594-V596 PolarHBondContact O-N 2.77Å; D594-Q597 PolarHBondContact O-N 3.34Å; D594-E598 PolarHBondContact O-N 2.84Å
595	A	77.5	Confident	73.1	Confident	12 Å²	12	76.3 Å²	76.3	10%	0.099	36%	0.363	C	S	.	.	H	α-helix	trans	-64.6	-31.5	176.9	0	0	0	0	0	113.8	L563 N591 Y592 L593	L563-A595 HydrophobicContact CB-CB 4.46Å; N591-A595 WeakPolarHBondContact O-CB 3.36Å; N591-A595 PolarHBondContact O-N 2.81Å; Y592-A595 PolarHBondContact O-N 3.47Å; L593-A595 VanDerWaalsContact C-N 3.35Å
596	V	76.3	Confident	73.8	Confident	3 Å²	3	76.3 Å²	76.3	2%	0.018	36%	0.356	C	S	.	.	H	α-helix	trans	-77.7	-32.1	175	-173	0	0	0	0	111.5	P568 Y592 L593 D594 E598 I599 L605 N608 Y631	P568-V596 HydrophobicContact CB-CG2 3.76Å; P568-V596 HydrophobicContact CG-CG2 3.91Å; Y592-V596 HydrophobicContact CD1-CG2 4.1Å; Y592-V596 HydrophobicContact CD2-CG2 4.44Å; Y592-V596 HydrophobicContact CE1-CG2 3.45Å; Y592-V596 VanDerWaalsContact CE1-CG2 3.45Å; Y592-V596 HydrophobicContact CE2-CG2 3.9Å; Y592-V596 WeakPolarHBondContact O-CG2 3.28Å; Y592-V596 PolarHBondContact O-N 2.92Å; Y592-V596 WeakPolarHBondContact OH-CG2 3.34Å; L593-V596 PolarHBondContact O-N 3.34Å; D594-V596 VanDerWaalsContact C-N 3.33Å; D594-V596 PolarHBondContact O-N 2.77Å; V596-E598 PolarHBondContact O-N 2.86Å; V596-I599 HydrophobicContact CG1-CD1 4.39Å; V596-I599 WeakPolarHBondContact O-CB 3.49Å; V596-I599 PolarHBondContact O-N 3.48Å; V596-I599 VanDerWaalsContact O-N 3.1Å; V596-L605 HydrophobicContact CG1-CD1 4.37Å; V596-L605 HydrophobicContact CG1-CG 4.42Å; V596-N608 HydrophobicContact CG1-CB 4.3Å; V596-Y631 HydrophobicContact CG1-CE1 4.42Å; V596-Y631 WeakPolarHBondContact CG1-OH 3.34Å
597	Q	77.5	Confident	75	Confident	106 Å²	106	73.2 Å²	73.2	50%	0.495	35%	0.346	S	S	.	.	H	α-helix	trans	-63.6	-28	175.3	-79.3	177.1	20.2	0	0	112.8	L593 D594 I599 Y631	L593-Q597 WeakPolarHBondContact O-CG 3.25Å; L593-Q597 PolarHBondContact O-N 3.31Å; D594-Q597 PolarHBondContact O-N 3.34Å; Q597-I599 VanDerWaalsContact C-N 3.27Å; Q597-I599 PolarHBondContact O-N 3.26Å; Q597-Y631 HydrophobicContact CG-CD2 3.9Å; Q597-Y631 HydrophobicContact CG-CE2 3.41Å; Q597-Y631 VanDerWaalsContact CG-CE2 3.41Å
598	E	78.8	Confident	75.8	Confident	165 Å²	165	66 Å²	66	77%	0.771	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-6.1	175.7	-67.2	-173.4	166.5	0	0	113.7	D594 V596 E600	D594-E598 PolarHBondContact O-N 2.84Å; V596-E598 PolarHBondContact O-N 2.86Å; E598-E600 PolarHBondContact O-N 2.93Å
599	I	76.6	Confident	76.1	Confident	25 Å²	25	66.7 Å²	66.7	13%	0.128	31%	0.314	C	S	.	.			trans	-78.3	116.6	-179.9	-65.4	-180	0	0	0	110.9	P568 V596 Q597 D601 E604	P568-I599 HydrophobicContact CG-CD1 3.37Å; V596-I599 HydrophobicContact CG1-CD1 4.39Å; V596-I599 WeakPolarHBondContact O-CB 3.49Å; V596-I599 PolarHBondContact O-N 3.48Å; V596-I599 VanDerWaalsContact O-N 3.1Å; Q597-I599 VanDerWaalsContact C-N 3.27Å; Q597-I599 PolarHBondContact O-N 3.26Å; I599-D601 HydrophobicContact CG2-CB 4.32Å; I599-D601 WeakPolarHBondContact CG2-O 3.32Å; I599-E604 HydrophobicContact CD1-CG 4.18Å; I599-E604 HydrophobicContact CG2-CB 4.05Å; I599-E604 HydrophobicContact CG2-CG 4.35Å
600	E	75.6	Confident	76.6	Confident	181 Å²	181	70 Å²	70	85%	0.846	33%	0.33	S	S	*	.			trans	-81.3	-21.6	174.4	-62.6	-174.8	170.6	0	0	113.5	E598 Y602	E598-E600 PolarHBondContact O-N 2.93Å; E600-Y602 PolarHBondContact O-N 2.81Å
601	D	81	Confident	76.7	Confident	87 Å²	87	65 Å²	65	47%	0.465	31%	0.311	S	S	.	.			trans	-79.4	108.2	-179.5	-170.8	-12.9	0	0	0	111.8	I599 M603 E604 L605	I599-D601 HydrophobicContact CG2-CB 4.32Å; I599-D601 WeakPolarHBondContact CG2-O 3.32Å; D601-M603 PolarHBondContact O-N 3.14Å; D601-M603 WeakPolarHBondContact OD1-CB 3.34Å; D601-M603 PolarHBondContact OD1-N 3.14Å; D601-E604 HydrophobicContact CB-CB 4.1Å; D601-E604 PolarHBondContact O-N 3.3Å; D601-E604 VanDerWaalsContact O-N 3.1Å; D601-L605 PolarHBondContact O-N 2.93Å
602	Y	77.5	Confident	76.6	Confident	144 Å²	144	62.7 Å²	62.7	57%	0.565	30%	0.299	S	S	*	.	H	α-helix	trans	-51	-38.6	175	-70.5	-85.9	0	0	0	113.7	E600 Y606 L639 F640	E600-Y602 PolarHBondContact O-N 2.81Å; Y602-Y606 WeakPolarHBondContact O-CB 3.33Å; Y602-Y606 PolarHBondContact O-N 2.82Å; Y602-L639 HydrophobicContact CD1-CD2 4.45Å; Y602-L639 HydrophobicContact CE1-CD2 3.66Å; Y602-F640 AromaticContact CD1-CZ 4Å; Y602-F640 HydrophobicContact CD1-CZ 4Å; Y602-F640 WeakPolarHBondContact O-CZ 3.16Å
603	M	80.4	Confident	76.3	Confident	124 Å²	124	69.4 Å²	69.4	61%	0.611	33%	0.328	S	S	*	.	H	α-helix	trans	-70.3	-39.2	-179.4	-73.9	-60.7	-57.6	0	0	111.5	D601 Y606 C607	D601-M603 PolarHBondContact O-N 3.14Å; D601-M603 WeakPolarHBondContact OD1-CB 3.34Å; D601-M603 PolarHBondContact OD1-N 3.14Å; M603-Y606 PolarHBondContact O-N 3.2Å; M603-C607 WeakPolarHBondContact O-CB 3.35Å; M603-C607 PolarHBondContact O-N 3.03Å; M603-C607 PolarHBondContact O-SG 2.91Å
604	E	76.6	Confident	76	Confident	69 Å²	69	75 Å²	75	32%	0.322	36%	0.355	S	S	.	.	H	α-helix	trans	-70.6	-38.3	178	-170.4	167.2	-166.9	0	0	111	I599 D601 C607 N608	I599-E604 HydrophobicContact CD1-CG 4.18Å; I599-E604 HydrophobicContact CG2-CB 4.05Å; I599-E604 HydrophobicContact CG2-CG 4.35Å; D601-E604 HydrophobicContact CB-CB 4.1Å; D601-E604 PolarHBondContact O-N 3.3Å; D601-E604 VanDerWaalsContact O-N 3.1Å; E604-C607 PolarHBondContact O-N 2.9Å; E604-N608 WeakPolarHBondContact O-CB 3.43Å; E604-N608 PolarHBondContact O-N 2.94Å; E604-N608 PolarHBondContact O-ND2 2.95Å
605	L	76.3	Confident	75.3	Confident	9 Å²	9	72.6 Å²	72.6	5%	0.047	34%	0.342	C	S	.	.	H	α-helix	trans	-62.9	-42.2	173.4	-163.8	132	0	0	0	111.8	V596 D601 N608 H609 F636 L639 F640	V596-L605 HydrophobicContact CG1-CD1 4.37Å; V596-L605 HydrophobicContact CG1-CG 4.42Å; D601-L605 PolarHBondContact O-N 2.93Å; L605-N608 PolarHBondContact O-N 2.8Å; L605-H609 WeakPolarHBondContact O-CB 3.26Å; L605-H609 PolarHBondContact O-N 3.34Å; L605-F636 HydrophobicContact CD2-CD2 4.03Å; L605-F636 HydrophobicContact CD2-CE2 4.35Å; L605-L639 HydrophobicContact CD2-CD1 4.08Å; L605-F640 HydrophobicContact CD2-CE2 3.9Å
606	Y	78	Confident	74.3	Confident	104 Å²	104	74.6 Å²	74.6	41%	0.408	35%	0.354	S	S	.	.	H	α-helix	trans	-60.5	-46.6	171.7	-176.2	-88.9	0	0	0	112.2	Y602 M603 N608 H609 H610 F636 F640	Y602-Y606 WeakPolarHBondContact O-CB 3.33Å; Y602-Y606 PolarHBondContact O-N 2.82Å; M603-Y606 PolarHBondContact O-N 3.2Å; Y606-N608 PolarHBondContact O-N 2.84Å; Y606-H609 PolarHBondContact O-N 2.82Å; Y606-H610 HydrophobicContact CE1-CB 4.34Å; Y606-H610 VanDerWaalsContact O-CB 3.3Å; Y606-H610 WeakPolarHBondContact O-CB 3.37Å; Y606-H610 PolarHBondContact O-N 2.89Å; Y606-F636 HydrophobicContact CD2-CE2 4.25Å; Y606-F636 AromaticContact CD2-CZ 3.65Å; Y606-F636 HydrophobicContact CD2-CZ 3.65Å; Y606-F636 HydrophobicContact CE2-CZ 4.07Å; Y606-F640 HydrophobicContact CD2-CD1 4.44Å; Y606-F640 HydrophobicContact CD2-CE1 4.5Å
607	C	80.6	Confident	73	Confident	53 Å²	53	80.9 Å²	80.9	36%	0.358	39%	0.385	S	S	.	.	H	α-helix	trans	-62.1	-43.5	179.3	-70	0	0	0	0	112.3	L569 M603 E604 F611	L569-C607 HydrophobicContact CD2-CB 4.31Å; M603-C607 WeakPolarHBondContact O-CB 3.35Å; M603-C607 PolarHBondContact O-N 3.03Å; M603-C607 PolarHBondContact O-SG 2.91Å; E604-C607 PolarHBondContact O-N 2.9Å; C607-F611 WeakPolarHBondContact O-CB 3.37Å; C607-F611 PolarHBondContact O-N 3.45Å
608	N	75.2	Confident	71.7	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-62.8	-46.1	176.8	-81	-63.7	0	0	0	111.5	L569 Y592 V596 E604 L605 Y606 F611 L612	L569-N608 VanDerWaalsContact CA-OD1 3.23Å; L569-N608 WeakPolarHBondContact CA-OD1 3.4Å; L569-N608 VanDerWaalsContact CB-OD1 3.31Å; L569-N608 WeakPolarHBondContact CB-OD1 3.39Å; L569-N608 PolarHBondContact N-OD1 3.01Å; L569-N608 VanDerWaalsContact N-OD1 3.12Å; Y592-N608 PolarHBondContact OH-OD1 2.8Å; V596-N608 HydrophobicContact CG1-CB 4.3Å; E604-N608 WeakPolarHBondContact O-CB 3.43Å; E604-N608 PolarHBondContact O-N 2.94Å; E604-N608 PolarHBondContact O-ND2 2.95Å; L605-N608 PolarHBondContact O-N 2.8Å; Y606-N608 PolarHBondContact O-N 2.84Å; N608-F611 PolarHBondContact O-N 2.85Å; N608-L612 WeakPolarHBondContact O-CB 3.29Å; N608-L612 WeakPolarHBondContact O-CG 3.36Å; N608-L612 PolarHBondContact O-N 3.35Å
609	H	73.4	Confident	70.5	Confident	30 Å²	30	70.8 Å²	70.8	14%	0.139	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-45.2	177.8	-176.1	84.3	0	0	0	112.2	L605 Y606 F611 L612 K613 C632 F636	L605-H609 WeakPolarHBondContact O-CB 3.26Å; L605-H609 PolarHBondContact O-N 3.34Å; Y606-H609 PolarHBondContact O-N 2.82Å; H609-F611 VanDerWaalsContact C-N 3.35Å; H609-F611 PolarHBondContact O-N 2.86Å; H609-L612 PolarHBondContact O-N 2.77Å; H609-K613 WeakPolarHBondContact O-CB 3.29Å; H609-K613 PolarHBondContact O-N 2.88Å; H609-C632 PolarHBondContact CE1-O 3.25Å; H609-F636 HydrophobicContact CB-CD2 3.68Å; H609-F636 HydrophobicContact CB-CE2 3.45Å; H609-F636 VanDerWaalsContact CB-CE2 3.45Å; H609-F636 HydrophobicContact CB-CG 4.48Å; H609-F636 HydrophobicContact CB-CZ 4.08Å; H609-F636 AromaticContact CD2-CD1 3.7Å; H609-F636 AromaticContact CD2-CD2 3.84Å; H609-F636 AromaticContact CD2-CE1 3.51Å; H609-F636 AromaticContact CD2-CE2 3.66Å; H609-F636 AromaticContact CD2-CG 3.85Å; H609-F636 AromaticContact CD2-CZ 3.48Å; H609-F636 VanDerWaalsContact CD2-CZ 3.48Å; H609-F636 WeakPolarHBondContact CD2-CZ 3.28Å; H609-F636 AromaticContact CE1-CD1 3.97Å; H609-F636 AromaticContact CE1-CG 3.82Å; H609-F636 AromaticContact CG-CD2 3.47Å; H609-F636 VanDerWaalsContact CG-CD2 3.47Å; H609-F636 AromaticContact CG-CE2 3.51Å; H609-F636 AromaticContact CG-CG 3.78Å; H609-F636 AromaticContact CG-CZ 3.85Å; H609-F636 AromaticContact ND1-CD2 3.78Å; H609-F636 AromaticContact ND1-CG 3.77Å; H609-F636 AromaticContact NE2-CD1 3.64Å; H609-F636 AromaticContact NE2-CE1 3.82Å; H609-F636 AromaticContact NE2-CG 3.91Å
610	H	76.6	Confident	69.3	Low	73 Å²	73	76.3 Å²	76.3	34%	0.338	37%	0.368	S	S	.	.	H	α-helix	trans	-62.1	-44.3	177	-169.1	-86.4	0	0	0	111.3	Y606 L612 K613 E614	Y606-H610 HydrophobicContact CE1-CB 4.34Å; Y606-H610 VanDerWaalsContact O-CB 3.3Å; Y606-H610 WeakPolarHBondContact O-CB 3.37Å; Y606-H610 PolarHBondContact O-N 2.89Å; H610-L612 VanDerWaalsContact C-N 3.34Å; H610-L612 PolarHBondContact O-N 3.36Å; H610-K613 PolarHBondContact O-N 2.76Å; H610-E614 IonicContact CE1-OE1 3.81Å; H610-E614 PolarHBondContact CE1-OE1 3.21Å; H610-E614 IonicContact CE1-OE2 3.46Å; H610-E614 IonicContact ND1-OE1 3.58Å; H610-E614 IonicContact ND1-OE2 3.16Å; H610-E614 PolarHBondContact ND1-OE2 3.21Å; H610-E614 PolarHBondContact O-N 2.79Å
611	F	72.4	Confident	68.1	Low	26 Å²	26	72.4 Å²	72.4	11%	0.114	36%	0.361	C	S	.	.	H	α-helix	trans	-62.7	-40.5	178.2	-170	-90	0	0	0	111.9	L569 L572 R573 C607 N608 H609 N615	L569-F611 HydrophobicContact CD1-CB 3.88Å; L569-F611 HydrophobicContact CD1-CD1 4.49Å; L569-F611 HydrophobicContact CD1-CD2 4.39Å; L569-F611 HydrophobicContact CD1-CG 4.01Å; L572-F611 HydrophobicContact CB-CD1 4.03Å; L572-F611 HydrophobicContact CB-CE1 3.83Å; L572-F611 HydrophobicContact CD1-CD1 4.06Å; R573-F611 HydrophobicContact CG-CE1 4.4Å; R573-F611 HydrophobicContact CG-CE2 3.88Å; R573-F611 HydrophobicContact CG-CZ 3.71Å; C607-F611 WeakPolarHBondContact O-CB 3.37Å; C607-F611 PolarHBondContact O-N 3.45Å; N608-F611 PolarHBondContact O-N 2.85Å; H609-F611 VanDerWaalsContact C-N 3.35Å; H609-F611 PolarHBondContact O-N 2.86Å; F611-N615 VanDerWaalsContact O-CB 3.32Å; F611-N615 WeakPolarHBondContact O-CB 3.42Å; F611-N615 PolarHBondContact O-N 3.39Å; F611-N615 PolarHBondContact O-ND2 2.83Å
612	L	70.4	Confident	66.6	Low	24 Å²	24	68.7 Å²	68.7	13%	0.126	34%	0.34	C	S	.	.	H	α-helix	trans	-61.5	-47.1	173	-82.7	160.5	0	0	0	112	L572 Y592 N608 H609 H610 E614 N615 S616 W623	L572-L612 HydrophobicContact CD1-CD1 4.49Å; L572-L612 HydrophobicContact CD1-CD2 3.99Å; L572-L612 HydrophobicContact CD1-CG 3.87Å; L572-L612 HydrophobicContact CD2-CD2 4.47Å; Y592-L612 HydrophobicContact CE1-CD1 3.71Å; Y592-L612 WeakPolarHBondContact OH-CD1 3.37Å; N608-L612 WeakPolarHBondContact O-CB 3.29Å; N608-L612 WeakPolarHBondContact O-CG 3.36Å; N608-L612 PolarHBondContact O-N 3.35Å; H609-L612 PolarHBondContact O-N 2.77Å; H610-L612 VanDerWaalsContact C-N 3.34Å; H610-L612 PolarHBondContact O-N 3.36Å; L612-E614 PolarHBondContact O-N 3.07Å; L612-N615 CarbonylContact O-C 3.36Å; L612-N615 PolarHBondContact O-N 3.36Å; L612-S616 PolarHBondContact O-N 2.75Å; L612-W623 WeakPolarHBondContact O-CZ2 3.2Å
613	K	70.1	Confident	65.3	Low	142 Å²	142	66.1 Å²	66.1	62%	0.617	33%	0.329	S	S	*	.	H	α-helix	trans	-62.7	-42.3	-179.5	-171.1	177.9	-179.2	177.5	0	112.3	H609 H610 N615	H609-K613 WeakPolarHBondContact O-CB 3.29Å; H609-K613 PolarHBondContact O-N 2.88Å; H610-K613 PolarHBondContact O-N 2.76Å; K613-N615 VanDerWaalsContact C-N 3.35Å
614	E	68.9	Low	63.9	Low	129 Å²	129	66 Å²	66	60%	0.603	33%	0.331	S	S	*	.	H	α-helix	trans	-70	-30.5	176.4	-75.5	-169.1	141.2	0	0	113.2	H610 L612	H610-E614 IonicContact CE1-OE1 3.81Å; H610-E614 PolarHBondContact CE1-OE1 3.21Å; H610-E614 IonicContact CE1-OE2 3.46Å; H610-E614 IonicContact ND1-OE1 3.58Å; H610-E614 IonicContact ND1-OE2 3.16Å; H610-E614 PolarHBondContact ND1-OE2 3.21Å; H610-E614 PolarHBondContact O-N 2.79Å; L612-E614 PolarHBondContact O-N 3.07Å
615	N	61.6	Low	63	Low	19 Å²	19	63.9 Å²	63.9	10%	0.102	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	32.1	-177.1	-64.9	-84.6	0	0	0	112.4	R576 F611 L612 K613 M617 C618	R576-N615 VanDerWaalsContact CZ-OD1 3.29Å; R576-N615 PolarHBondContact NE-OD1 2.73Å; R576-N615 PolarHBondContact NH1-OD1 2.96Å; F611-N615 VanDerWaalsContact O-CB 3.32Å; F611-N615 WeakPolarHBondContact O-CB 3.42Å; F611-N615 PolarHBondContact O-N 3.39Å; F611-N615 PolarHBondContact O-ND2 2.83Å; L612-N615 CarbonylContact O-C 3.36Å; L612-N615 PolarHBondContact O-N 3.36Å; K613-N615 VanDerWaalsContact C-N 3.35Å; N615-M617 PolarHBondContact O-N 2.93Å; N615-C618 PolarHBondContact O-N 3.49Å
616	S	56	Low	62.1	Low	53 Å²	53	69.7 Å²	69.7	37%	0.371	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-52.1	-21.4	-179.8	56.2	0	0	0	0	114.5	L612 C618 M619 W623	L612-S616 PolarHBondContact O-N 2.75Å; S616-C618 VanDerWaalsContact C-N 3.27Å; S616-C618 PolarHBondContact O-N 2.79Å; S616-M619 PolarHBondContact O-N 2.78Å; S616-W623 PolarHBondContact O-NE1 3.03Å
617	M	48.9	Very low	61.1	Low	135 Å²	135	69.8 Å²	69.8	67%	0.665	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-62.7	-21.3	170.8	-71.5	-162.3	125.4	0	0	115.3	N615 M619	N615-M617 PolarHBondContact O-N 2.93Å; M617-M619 VanDerWaalsContact C-N 3.27Å; M617-M619 PolarHBondContact O-N 2.96Å
618	C	51.6	Low	59.9	Low	40 Å²	40	68.1 Å²	68.1	27%	0.27	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-77.2	-11.2	179.3	-75.9	0	0	0	0	113.3	I584 N615 S616	I584-C618 HydrophobicContact CD1-CB 4.49Å; N615-C618 PolarHBondContact O-N 3.49Å; S616-C618 VanDerWaalsContact C-N 3.27Å; S616-C618 PolarHBondContact O-N 2.79Å
619	M	52.7	Low	59.1	Low	20 Å²	20	74.2 Å²	74.2	10%	0.099	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-144.6	40.6	-171.9	-70.2	-130.7	-148.9	0	0	112.8	I584 V589 S616 M617 S621 Y622 W623	I584-M619 HydrophobicContact CD1-CE 4.48Å; I584-M619 HydrophobicContact CG2-CE 3.8Å; I584-M619 HydrophobicContact CG2-CG 4.46Å; I584-M619 HydrophobicContact CG2-SD 4.01Å; V589-M619 HydrophobicContact CB-CE 4.2Å; V589-M619 HydrophobicContact CB-SD 4.25Å; V589-M619 HydrophobicContact CG1-CE 3.71Å; V589-M619 HydrophobicContact CG1-SD 3.75Å; V589-M619 HydrophobicContact CG2-CE 3.59Å; V589-M619 HydrophobicContact CG2-SD 3.43Å; V589-M619 WeakPolarHBondContact CG2-SD 3.26Å; S616-M619 PolarHBondContact O-N 2.78Å; M617-M619 VanDerWaalsContact C-N 3.27Å; M617-M619 PolarHBondContact O-N 2.96Å; M619-S621 PolarHBondContact O-N 2.91Å; M619-S621 VanDerWaalsContact O-N 3.1Å; M619-Y622 PolarHBondContact O-N 3.13Å; M619-Y622 HydrophobicContact SD-CD1 4.47Å; M619-Y622 HydrophobicContact SD-CG 4.06Å; M619-W623 PolarHBondContact O-N 2.65Å
620	E	50.8	Low	58.6	Low	140 Å²	140	79 Å²	79	65%	0.654	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-30.3	-179.6	-78.6	-175.4	168.2	0	0	113.5
621	S	50.3	Low	57.8	Low	100 Å²	100	76.5 Å²	76.5	70%	0.699	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-23.9	174.7	50.1	0	0	0	0	114.1	M619	M619-S621 PolarHBondContact O-N 2.91Å; M619-S621 VanDerWaalsContact O-N 3.1Å
622	Y	49.5	Very low	57.1	Low	9 Å²	9	75.9 Å²	75.9	4%	0.035	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-22.1	-169	-146.5	-85.4	0	0	0	114.3	M586 V589 L593 M619 N624 S625 C628	M586-Y622 HydrophobicContact CB-CE2 4.35Å; M586-Y622 HydrophobicContact CE-CD2 3.75Å; M586-Y622 HydrophobicContact CE-CE2 3.34Å; M586-Y622 HydrophobicContact CG-CE2 4.45Å; M586-Y622 HydrophobicContact SD-CD2 3.26Å; M586-Y622 WeakPolarHBondContact SD-CD2 3.34Å; M586-Y622 HydrophobicContact SD-CE2 3.35Å; M586-Y622 WeakPolarHBondContact SD-CE2 3.46Å; M586-Y622 HydrophobicContact SD-CG 4.48Å; V589-Y622 HydrophobicContact CB-CD1 4.46Å; V589-Y622 HydrophobicContact CB-CD2 4.02Å; V589-Y622 HydrophobicContact CB-CE1 4.03Å; V589-Y622 HydrophobicContact CB-CE2 3.54Å; V589-Y622 HydrophobicContact CB-CG 4.46Å; V589-Y622 HydrophobicContact CG1-CD1 3.57Å; V589-Y622 HydrophobicContact CG1-CD2 3.99Å; V589-Y622 HydrophobicContact CG1-CE1 3.22Å; V589-Y622 HydrophobicContact CG1-CE2 3.69Å; V589-Y622 HydrophobicContact CG1-CG 3.94Å; V589-Y622 HydrophobicContact CG2-CD2 3.83Å; V589-Y622 HydrophobicContact CG2-CE2 3.81Å; V589-Y622 HydrophobicContact CG2-CG 4.34Å; L593-Y622 HydrophobicContact CD1-CE1 4.37Å; M619-Y622 PolarHBondContact O-N 3.13Å; M619-Y622 HydrophobicContact SD-CD1 4.47Å; M619-Y622 HydrophobicContact SD-CG 4.06Å; Y622-N624 PolarHBondContact O-N 3.33Å; Y622-S625 WeakPolarHBondContact CD1-OG 3.46Å; Y622-S625 WeakPolarHBondContact CE1-OG 3.41Å; Y622-S625 PolarHBondContact O-N 3.27Å; Y622-S625 PolarHBondContact O-OG 2.84Å; Y622-C628 HydrophobicContact CD1-CB 3.68Å; Y622-C628 HydrophobicContact CE1-CB 3.73Å
623	W	50.7	Low	56.6	Low	90 Å²	90	78.5 Å²	78.5	34%	0.341	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-14.1	173.4	-70.5	103.8	0	0	0	113.7	L612 S616 M619	L612-W623 WeakPolarHBondContact O-CZ2 3.2Å; S616-W623 PolarHBondContact O-NE1 3.03Å; M619-W623 PolarHBondContact O-N 2.65Å
624	N	50.5	Low	56.2	Low	121 Å²	121	76.9 Å²	76.9	65%	0.647	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-1	176.6	-72.9	-28.6	0	0	0	114.4	Y622	Y622-N624 PolarHBondContact O-N 3.33Å
625	S	57.8	Low	56	Low	25 Å²	25	74.4 Å²	74.4	18%	0.175	38%	0.378	C	S	.	.	S	Bend	trans	-80.3	134	173	68.6	0	0	0	0	110.7	Y622 E627 C628 R629	Y622-S625 WeakPolarHBondContact CD1-OG 3.46Å; Y622-S625 WeakPolarHBondContact CE1-OG 3.41Å; Y622-S625 PolarHBondContact O-N 3.27Å; Y622-S625 PolarHBondContact O-OG 2.84Å; S625-E627 VanDerWaalsContact C-N 3.26Å; S625-E627 PolarHBondContact O-N 2.84Å; S625-C628 PolarHBondContact O-N 2.96Å; S625-C628 WeakPolarHBondContact OG-CB 3.29Å; S625-R629 PolarHBondContact O-N 2.91Å
626	D	58	Low	56.1	Low	131 Å²	131	75 Å²	75	70%	0.701	38%	0.379	S	S	*	.	H	α-helix	trans	-61.3	-32.9	-178	-78.8	-31.3	0	0	0	112.5	K630	D626-K630 WeakPolarHBondContact O-CB 3.42Å; D626-K630 PolarHBondContact O-N 3.24Å
627	E	57.8	Low	56.5	Low	106 Å²	106	75.4 Å²	75.4	50%	0.495	38%	0.382	S	S	.	.	H	α-helix	trans	-64.9	-44.3	179.7	-73	-179.6	159.7	0	0	112.5	R590 S625 K630 Y631	R590-E627 IonicContact NH1-OE1 3.95Å; S625-E627 VanDerWaalsContact C-N 3.26Å; S625-E627 PolarHBondContact O-N 2.84Å; E627-K630 PolarHBondContact O-N 3.07Å; E627-Y631 PolarHBondContact O-N 3.28Å; E627-Y631 VanDerWaalsContact O-N 3.12Å
628	C	55.5	Low	57.4	Low	17 Å²	17	75.3 Å²	75.3	12%	0.115	39%	0.385	C	S	.	.	H	α-helix	trans	-72.2	-35.2	-179	-147.1	0	0	0	0	111.5	L593 Y622 S625 Y631 C632	L593-C628 HydrophobicContact CD1-CB 4.43Å; Y622-C628 HydrophobicContact CD1-CB 3.68Å; Y622-C628 HydrophobicContact CE1-CB 3.73Å; S625-C628 PolarHBondContact O-N 2.96Å; S625-C628 WeakPolarHBondContact OG-CB 3.29Å; C628-Y631 PolarHBondContact O-N 2.68Å; C628-C632 VanDerWaalsContact O-CB 3.3Å; C628-C632 WeakPolarHBondContact O-CB 3.44Å; C628-C632 PolarHBondContact O-N 2.93Å
629	R	58	Low	58	Low	128 Å²	128	76 Å²	76	48%	0.483	39%	0.385	S	S	.	.	H	α-helix	trans	-63.4	-44.2	174	-162.6	175.6	-75.7	172.3	-2.8	110.4	S625 Y631 C632 T633	S625-R629 PolarHBondContact O-N 2.91Å; R629-Y631 PolarHBondContact O-N 2.84Å; R629-C632 PolarHBondContact O-N 3.44Å; R629-T633 WeakPolarHBondContact O-CB 3.46Å; R629-T633 PolarHBondContact O-N 2.82Å; R629-T633 PolarHBondContact O-OG1 3.46Å
630	K	62.2	Low	58.7	Low	131 Å²	131	77.8 Å²	77.8	57%	0.57	39%	0.393	S	S	*	.	H	α-helix	trans	-59	-46.9	177.2	-145.9	176	-171.8	-175	0	112.4	D626 E627 E634 H635	D626-K630 WeakPolarHBondContact O-CB 3.42Å; D626-K630 PolarHBondContact O-N 3.24Å; E627-K630 PolarHBondContact O-N 3.07Å; K630-E634 VanDerWaalsContact CE-OE2 3.29Å; K630-E634 WeakPolarHBondContact CE-OE2 3.46Å; K630-E634 HydrophobicContact CG-CG 4.46Å; K630-E634 WeakPolarHBondContact CG-OE2 3.48Å; K630-E634 VanDerWaalsContact O-CB 3.29Å; K630-E634 WeakPolarHBondContact O-CB 3.29Å; K630-E634 PolarHBondContact O-N 2.8Å; K630-H635 PolarHBondContact O-N 3.25Å
631	Y	60.5	Low	59.5	Low	20 Å²	20	75.8 Å²	75.8	8%	0.078	39%	0.392	C	S	.	.	I	π-helix	trans	-65.6	-50.7	176.9	-177.6	-102.6	0	0	0	113	L593 V596 Q597 E627 C628 R629 T633 H635 F636	L593-Y631 HydrophobicContact CD2-CD1 3.58Å; L593-Y631 HydrophobicContact CD2-CE1 4.05Å; L593-Y631 HydrophobicContact CD2-CG 4.11Å; V596-Y631 HydrophobicContact CG1-CE1 4.42Å; V596-Y631 WeakPolarHBondContact CG1-OH 3.34Å; Q597-Y631 HydrophobicContact CG-CD2 3.9Å; Q597-Y631 HydrophobicContact CG-CE2 3.41Å; Q597-Y631 VanDerWaalsContact CG-CE2 3.41Å; E627-Y631 PolarHBondContact O-N 3.28Å; E627-Y631 VanDerWaalsContact O-N 3.12Å; C628-Y631 PolarHBondContact O-N 2.68Å; R629-Y631 PolarHBondContact O-N 2.84Å; Y631-T633 PolarHBondContact O-N 3.36Å; Y631-H635 HydrophobicContact CD2-CB 4.21Å; Y631-H635 HydrophobicContact CE2-CB 4.49Å; Y631-H635 AromaticContact CE2-CD2 3.52Å; Y631-H635 WeakPolarHBondContact O-CB 3.46Å; Y631-H635 PolarHBondContact O-N 3.26Å; Y631-F636 PolarHBondContact O-N 3.14Å
632	C	57.9	Low	60	Low	14 Å²	14	76.8 Å²	76.8	10%	0.095	40%	0.399	C	S	.	.	I	π-helix	trans	-71.7	-26.9	-175.1	-73.9	0	0	0	0	113.9	H609 C628 R629 F636	H609-C632 PolarHBondContact CE1-O 3.25Å; C628-C632 VanDerWaalsContact O-CB 3.3Å; C628-C632 WeakPolarHBondContact O-CB 3.44Å; C628-C632 PolarHBondContact O-N 2.93Å; R629-C632 PolarHBondContact O-N 3.44Å; C632-F636 WeakPolarHBondContact O-CB 3.45Å
633	T	59.2	Low	59.9	Low	78 Å²	78	86.4 Å²	86.4	48%	0.479	46%	0.459	S	S	.	.	I	π-helix	trans	-109.2	-28.8	-176.7	55.9	0	0	0	0	115.2	R629 Y631 S637	R629-T633 WeakPolarHBondContact O-CB 3.46Å; R629-T633 PolarHBondContact O-N 2.82Å; R629-T633 PolarHBondContact O-OG1 3.46Å; Y631-T633 PolarHBondContact O-N 3.36Å; T633-S637 WeakPolarHBondContact O-CB 3.47Å; T633-S637 PolarHBondContact O-OG 2.83Å
634	E	62.2	Low	60.3	Low	108 Å²	108	86.2 Å²	86.2	51%	0.505	47%	0.465	S	S	.	.	I	π-helix	trans	-91.9	-56.2	176.9	-60.6	-179.4	167.5	0	0	109.7	K630 F636 S637 D638	K630-E634 VanDerWaalsContact CE-OE2 3.29Å; K630-E634 WeakPolarHBondContact CE-OE2 3.46Å; K630-E634 HydrophobicContact CG-CG 4.46Å; K630-E634 WeakPolarHBondContact CG-OE2 3.48Å; K630-E634 VanDerWaalsContact O-CB 3.29Å; K630-E634 WeakPolarHBondContact O-CB 3.29Å; K630-E634 PolarHBondContact O-N 2.8Å; E634-F636 PolarHBondContact O-N 3.33Å; E634-S637 PolarHBondContact O-N 3.32Å; E634-D638 VanDerWaalsContact O-CG 3.25Å; E634-D638 PolarHBondContact O-N 3.03Å
635	H	63.3	Low	60.8	Low	78 Å²	78	84.4 Å²	84.4	36%	0.361	46%	0.455	S	S	.	.	I	π-helix	trans	-66.1	-41.8	-174.1	-164.5	54.5	0	0	0	113.4	K630 Y631 L639	K630-H635 PolarHBondContact O-N 3.25Å; Y631-H635 HydrophobicContact CD2-CB 4.21Å; Y631-H635 HydrophobicContact CE2-CB 4.49Å; Y631-H635 AromaticContact CE2-CD2 3.52Å; Y631-H635 WeakPolarHBondContact O-CB 3.46Å; Y631-H635 PolarHBondContact O-N 3.26Å; H635-L639 WeakPolarHBondContact O-CD1 3.43Å; H635-L639 WeakPolarHBondContact O-CG 3.49Å; H635-L639 PolarHBondContact O-N 2.91Å
636	F	63.9	Low	61	Low	30 Å²	30	87.7 Å²	87.7	13%	0.132	47%	0.471	C	S	.	.	H	α-helix	trans	-71.4	-36.6	178.2	-168.7	-95.8	0	0	0	113	L605 Y606 H609 Y631 C632 E634 D638 L639 F640	L605-F636 HydrophobicContact CD2-CD2 4.03Å; L605-F636 HydrophobicContact CD2-CE2 4.35Å; Y606-F636 HydrophobicContact CD2-CE2 4.25Å; Y606-F636 AromaticContact CD2-CZ 3.65Å; Y606-F636 HydrophobicContact CD2-CZ 3.65Å; Y606-F636 HydrophobicContact CE2-CZ 4.07Å; H609-F636 HydrophobicContact CB-CD2 3.68Å; H609-F636 HydrophobicContact CB-CE2 3.45Å; H609-F636 VanDerWaalsContact CB-CE2 3.45Å; H609-F636 HydrophobicContact CB-CG 4.48Å; H609-F636 HydrophobicContact CB-CZ 4.08Å; H609-F636 AromaticContact CD2-CD1 3.7Å; H609-F636 AromaticContact CD2-CD2 3.84Å; H609-F636 AromaticContact CD2-CE1 3.51Å; H609-F636 AromaticContact CD2-CE2 3.66Å; H609-F636 AromaticContact CD2-CG 3.85Å; H609-F636 AromaticContact CD2-CZ 3.48Å; H609-F636 VanDerWaalsContact CD2-CZ 3.48Å; H609-F636 WeakPolarHBondContact CD2-CZ 3.28Å; H609-F636 AromaticContact CE1-CD1 3.97Å; H609-F636 AromaticContact CE1-CG 3.82Å; H609-F636 AromaticContact CG-CD2 3.47Å; H609-F636 VanDerWaalsContact CG-CD2 3.47Å; H609-F636 AromaticContact CG-CE2 3.51Å; H609-F636 AromaticContact CG-CG 3.78Å; H609-F636 AromaticContact CG-CZ 3.85Å; H609-F636 AromaticContact ND1-CD2 3.78Å; H609-F636 AromaticContact ND1-CG 3.77Å; H609-F636 AromaticContact NE2-CD1 3.64Å; H609-F636 AromaticContact NE2-CE1 3.82Å; H609-F636 AromaticContact NE2-CG 3.91Å; Y631-F636 PolarHBondContact O-N 3.14Å; C632-F636 WeakPolarHBondContact O-CB 3.45Å; E634-F636 PolarHBondContact O-N 3.33Å; F636-D638 VanDerWaalsContact C-N 3.31Å; F636-L639 PolarHBondContact O-N 3.32Å; F636-F640 HydrophobicContact CD1-CB 4.45Å; F636-F640 AromaticContact CD2-CD2 3.78Å; F636-F640 HydrophobicContact CD2-CD2 3.78Å; F636-F640 HydrophobicContact CD2-CE2 4.26Å; F636-F640 HydrophobicContact CE1-CB 4.01Å; F636-F640 HydrophobicContact CE1-CD2 4.22Å; F636-F640 HydrophobicContact CE1-CG 4.44Å; F636-F640 AromaticContact CE2-CD2 3.4Å; F636-F640 HydrophobicContact CE2-CD2 3.4Å; F636-F640 VanDerWaalsContact CE2-CD2 3.4Å; F636-F640 AromaticContact CE2-CE2 3.8Å; F636-F640 HydrophobicContact CE2-CE2 3.8Å; F636-F640 HydrophobicContact CE2-CG 4.26Å; F636-F640 HydrophobicContact CG-CD2 4.34Å; F636-F640 HydrophobicContact CZ-CB 4.14Å; F636-F640 AromaticContact CZ-CD2 3.67Å; F636-F640 HydrophobicContact CZ-CD2 3.67Å; F636-F640 HydrophobicContact CZ-CE2 4.36Å; F636-F640 HydrophobicContact CZ-CG 4.08Å; F636-F640 PolarHBondContact O-N 3.37Å
637	S	65.1	Low	61.2	Low	62 Å²	62	85.1 Å²	85.1	43%	0.434	46%	0.457	S	S	.	.	H	α-helix	trans	-70.4	-30	179.1	-55.2	0	0	0	0	112.2	T633 E634	T633-S637 WeakPolarHBondContact O-CB 3.47Å; T633-S637 PolarHBondContact O-OG 2.83Å; E634-S637 PolarHBondContact O-N 3.32Å
638	D	67.2	Low	61.4	Low	133 Å²	133	83.8 Å²	83.8	71%	0.711	46%	0.455	S	S	*	.	H	α-helix	trans	-70.5	-35.8	173	-72	-17.7	0	0	0	112	E634 F636	E634-D638 VanDerWaalsContact O-CG 3.25Å; E634-D638 PolarHBondContact O-N 3.03Å; F636-D638 VanDerWaalsContact C-N 3.31Å
639	L	65.2	Low	61.8	Low	55 Å²	55	88.3 Å²	88.3	29%	0.288	48%	0.477	S	S	.	.	H	α-helix	trans	-84.7	-32.2	-179.3	-70	162.6	0	0	0	113.2	Y602 L605 H635 F636	Y602-L639 HydrophobicContact CD1-CD2 4.45Å; Y602-L639 HydrophobicContact CE1-CD2 3.66Å; L605-L639 HydrophobicContact CD2-CD1 4.08Å; H635-L639 WeakPolarHBondContact O-CD1 3.43Å; H635-L639 WeakPolarHBondContact O-CG 3.49Å; H635-L639 PolarHBondContact O-N 2.91Å; F636-L639 PolarHBondContact O-N 3.32Å
640	F	67.9	Low	62.1	Low	57 Å²	57	85.4 Å²	85.4	25%	0.25	48%	0.477	C	S	.	.	S	Bend	trans	-134	76.7	-178	-60.4	-80	0	0	0	111	Y602 L605 Y606 F636 S642	Y602-F640 AromaticContact CD1-CZ 4Å; Y602-F640 HydrophobicContact CD1-CZ 4Å; Y602-F640 WeakPolarHBondContact O-CZ 3.16Å; L605-F640 HydrophobicContact CD2-CE2 3.9Å; Y606-F640 HydrophobicContact CD2-CD1 4.44Å; Y606-F640 HydrophobicContact CD2-CE1 4.5Å; F636-F640 HydrophobicContact CD1-CB 4.45Å; F636-F640 AromaticContact CD2-CD2 3.78Å; F636-F640 HydrophobicContact CD2-CD2 3.78Å; F636-F640 HydrophobicContact CD2-CE2 4.26Å; F636-F640 HydrophobicContact CE1-CB 4.01Å; F636-F640 HydrophobicContact CE1-CD2 4.22Å; F636-F640 HydrophobicContact CE1-CG 4.44Å; F636-F640 AromaticContact CE2-CD2 3.4Å; F636-F640 HydrophobicContact CE2-CD2 3.4Å; F636-F640 VanDerWaalsContact CE2-CD2 3.4Å; F636-F640 AromaticContact CE2-CE2 3.8Å; F636-F640 HydrophobicContact CE2-CE2 3.8Å; F636-F640 HydrophobicContact CE2-CG 4.26Å; F636-F640 HydrophobicContact CG-CD2 4.34Å; F636-F640 HydrophobicContact CZ-CB 4.14Å; F636-F640 AromaticContact CZ-CD2 3.67Å; F636-F640 HydrophobicContact CZ-CD2 3.67Å; F636-F640 HydrophobicContact CZ-CE2 4.36Å; F636-F640 HydrophobicContact CZ-CG 4.08Å; F636-F640 PolarHBondContact O-N 3.37Å; F640-S642 PolarHBondContact O-N 2.66Å
641	P	67	Low	62	Low	98 Å²	98	81.9 Å²	81.9	64%	0.636	47%	0.47	S	S	*	.			trans	-61.7	129.7	176.7	23.6	-32.4	0	0	0	110.5	T643	P641-T643 PolarHBondContact O-N 3.28Å; P641-T643 VanDerWaalsContact O-N 3.08Å
642	S	61.1	Low	62.2	Low	122 Å²	122	87.1 Å²	87.1	85%	0.853	50%	0.503	S	S	*	.			trans	-68.3	105	175.5	55	0	0	0	0	109.8	F640	F640-S642 PolarHBondContact O-N 2.66Å
643	T	46.1	Very low	62.6	Low	210 Å²	210	93.7 Å²	93.7	100%	1.288	54%	0.54	S	S	*	.			trans	-68.2	0	168.3	48.3	0	0	0	0	112.4	P641	P641-T643 PolarHBondContact O-N 3.28Å; P641-T643 VanDerWaalsContact O-N 3.08Å

Retrieved 643 of 643 residues in 1268.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).