A0A077ZHC6_TRITR Loading...

histidine kinase

AlphaFold DB , UniProt , Accession A0A077ZHC6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 786 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	61.1	Low	176 Å²	176	95.3 Å²	95.3	87%	0.867	50%	0.499	S	S	*	.				0	115.4	0	-68.5	-177.8	-168.1	0	0	106.7	G3 R80	M1-G3 PolarHBondContact O-N 3.31Å; M1-R80 PolarHBondContact O-NH2 2.78Å
2	L	38.3	Very low	62.6	Low	126 Å²	126	90.1 Å²	90.1	66%	0.66	49%	0.486	S	S	*	.			trans	-69.1	112.2	170.6	-83.3	148.4	0	0	0	106.8
3	G	48.5	Very low	64	Low	21 Å²	21	87.5 Å²	87.5	22%	0.216	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-61	159.9	167.1	0	0	0	0	0	109.8	M1 L5	M1-G3 PolarHBondContact O-N 3.31Å; G3-L5 PolarHBondContact O-N 2.85Å
4	P	50.1	Low	64.5	Low	95 Å²	95	87.9 Å²	87.9	62%	0.617	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-59.6	123.7	176	24.1	-28.2	0	0	0	108.7	P35	P4-P35 HydrophobicContact CG-CB 4.04Å; P4-P35 WeakPolarHBondContact O-CB 3.41Å; P4-P35 WeakPolarHBondContact O-CG 3.47Å
5	L	58.1	Low	64.7	Low	77 Å²	77	87.3 Å²	87.3	40%	0.403	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-68.7	134.2	174.8	-77.3	160.6	0	0	0	109.2	G3 V90 K93	G3-L5 PolarHBondContact O-N 2.85Å; L5-V90 HydrophobicContact CD2-CG1 3.95Å; L5-K93 HydrophobicContact CD1-CB 4.21Å; L5-K93 HydrophobicContact CD2-CB 3.97Å
6	A	62.9	Low	64.5	Low	16 Å²	16	86.3 Å²	86.3	13%	0.132	48%	0.478	C	S	.	.	B	Isolated β-bridge	trans	-70	144.9	179.2	0	0	0	0	0	112.1	F32 D33 V91 F92	A6-F32 HydrophobicContact CB-CB 3.99Å; A6-F32 HydrophobicContact CB-CD2 3.56Å; A6-F32 HydrophobicContact CB-CE2 4.46Å; A6-F32 HydrophobicContact CB-CG 4.13Å; A6-D33 WeakPolarHBondContact CB-O 3.38Å; A6-V91 PolarHBondContact N-O 2.99Å; A6-V91 VanDerWaalsContact N-O 3.16Å; A6-F92 WeakPolarHBondContact O-CD2 3.3Å
7	H	66.2	Low	63.5	Low	185 Å²	185	85.4 Å²	85.4	86%	0.856	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-93.1	128.5	168.7	-80.7	-62.5	0	0	0	109.3
8	A	70.7	Confident	62.3	Low	15 Å²	15	91.8 Å²	91.8	12%	0.124	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-93.4	135.5	176.6	0	0	0	0	0	112.4	E30 A31 F32 F92 K94	A8-E30 HydrophobicContact CB-CB 3.82Å; A8-A31 CarbonylContact C-O 3.57Å; A8-A31 WeakPolarHBondContact CA-O 3.33Å; A8-A31 WeakPolarHBondContact CB-O 3.45Å; A8-F32 HydrophobicContact CB-CB 3.93Å; A8-F32 HydrophobicContact CB-CD1 4.48Å; A8-F92 HydrophobicContact CB-CD2 4.21Å; A8-F92 HydrophobicContact CB-CE2 3.26Å; A8-F92 HydrophobicContact CB-CZ 3.61Å; A8-K94 HydrophobicContact CB-CD 4.48Å; A8-K94 PolarHBondContact O-NZ 3.38Å
9	E	79.9	Confident	61.1	Low	152 Å²	152	94.3 Å²	94.3	71%	0.71	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	136.3	175.2	-169.4	170.3	-173	0	0	110.3	I11 E30 A31	E9-I11 PolarHBondContact O-N 3.07Å; E9-E30 CarbonylContact O-C 3.53Å; E9-E30 WeakPolarHBondContact O-CA 3.46Å; E9-A31 PolarHBondContact N-O 3.36Å; E9-A31 PolarHBondContact O-N 2.83Å
10	E	81.3	Confident	60.1	Low	89 Å²	89	99.2 Å²	99.2	42%	0.416	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	115.5	177.4	179.6	166.2	151.6	0	0	109.1	V28 K48	E10-V28 HydrophobicContact CB-CG1 4.43Å; E10-V28 HydrophobicContact CG-CG1 3.5Å; E10-V28 VanDerWaalsContact CG-CG1 3.5Å; E10-K48 IonicContact OE1-NZ 2.74Å; E10-K48 IonicContact OE2-NZ 3.33Å; E10-K48 PolarHBondContact OE2-NZ 3.3Å
11	I	83.1	Confident	58.8	Low	96 Å²	96	102.2 Å²	102.2	49%	0.492	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-16.7	-177.2	59.7	160.3	0	0	0	113.2	E9 V29 A31 Y43	E9-I11 PolarHBondContact O-N 3.07Å; I11-V29 HydrophobicContact CD1-CB 4.24Å; I11-V29 HydrophobicContact CD1-CG1 3.69Å; I11-V29 HydrophobicContact CG1-CB 3.91Å; I11-V29 HydrophobicContact CG1-CG1 3.82Å; I11-V29 VanDerWaalsContact CG1-O 3.28Å; I11-V29 WeakPolarHBondContact CG1-O 3.36Å; I11-V29 PolarHBondContact N-O 3.33Å; I11-A31 HydrophobicContact CG2-CB 3.61Å; I11-Y43 HydrophobicContact CD1-CD1 3.48Å; I11-Y43 VanDerWaalsContact CD1-CD1 3.48Å; I11-Y43 HydrophobicContact CD1-CE1 3.71Å
12	G	79.5	Confident	59.1	Low	33 Å²	33	95.9 Å²	95.9	34%	0.34	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	173.3	168.7	179	0	0	0	0	0	113.2	V29	G12-V29 PolarHBondContact O-N 2.97Å
13	S	80.3	Confident	58.9	Low	56 Å²	56	93.7 Å²	93.7	39%	0.392	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	144.2	176.1	67.6	0	0	0	0	111.3	I27	S13-I27 CarbonylContact C-O 3.34Å; S13-I27 WeakPolarHBondContact CA-O 3.3Å
14	V	71.4	Confident	58.8	Low	93 Å²	93	96 Å²	96	56%	0.564	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.3	175.7	-178.9	0	0	0	0	109.1	K26 I27	V14-K26 CarbonylContact O-C 3.5Å; V14-K26 WeakPolarHBondContact O-CA 3.34Å; V14-I27 PolarHBondContact N-O 3.21Å; V14-I27 PolarHBondContact O-N 3.43Å
15	D	67.6	Low	59.1	Low	80 Å²	80	95.2 Å²	95.2	43%	0.428	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	127.4	172.8	-65.9	-47.9	0	0	0	110	H25 K26	D15-H25 WeakPolarHBondContact CA-O 3.46Å; D15-K26 WeakPolarHBondContact OD1-CE 3.19Å; D15-K26 WeakPolarHBondContact OD1-CG 3.45Å; D15-K26 IonicContact OD1-NZ 3.88Å
16	T	60.4	Low	59.4	Low	71 Å²	71	95.1 Å²	95.1	44%	0.436	51%	0.505	S	S	.	.	S	Bend	trans	-93.7	-12.4	-178.8	51.3	0	0	0	0	113.8	H25 I27	T16-H25 PolarHBondContact N-O 3.03Å; T16-H25 WeakPolarHBondContact OG1-CB 3.21Å; T16-H25 PolarHBondContact OG1-O 3.45Å; T16-I27 HydrophobicContact CG2-CB 4.41Å; T16-I27 HydrophobicContact CG2-CD1 3.38Å; T16-I27 HydrophobicContact CG2-CG1 3.51Å
17	V	47.9	Very low	59.8	Low	70 Å²	70	97.5 Å²	97.5	42%	0.424	52%	0.515	S	S	.	.			trans	-151.4	124	177.4	-172	0	0	0	0	111	K19	V17-K19 HydrophobicContact CG1-CG 4.25Å
18	F	41.4	Very low	60.1	Low	202 Å²	202	88.7 Å²	88.7	89%	0.886	47%	0.474	S	S	*	.			trans	-82.7	116.7	169	-135.8	-91.5	0	0	0	109.3
19	K	39.5	Very low	60.6	Low	138 Å²	138	89.9 Å²	89.9	60%	0.6	48%	0.48	S	S	*	.			trans	-127.4	128.2	169.9	-90	-176.9	177.5	176.6	0	110.3	V17 I21	V17-K19 HydrophobicContact CG1-CG 4.25Å; K19-I21 PolarHBondContact O-N 2.92Å
20	M	41.3	Very low	60.7	Low	193 Å²	193	82.9 Å²	82.9	95%	0.951	45%	0.447	S	S	*	.	S	Bend	trans	-61.3	-23.9	176	-107.4	-133.3	-70.5	0	0	113.1
21	I	33.4	Very low	61	Low	163 Å²	163	79.4 Å²	79.4	84%	0.836	43%	0.434	S	S	*	.	S	Bend	trans	-149.3	109.4	176.3	-55.2	179.4	0	0	0	108.1	K19	K19-I21 PolarHBondContact O-N 2.92Å
22	G	38.8	Very low	61.3	Low	43 Å²	43	75 Å²	75	44%	0.443	41%	0.411	S	S	.	.	S	Bend	trans	149.3	163.5	177.9	0	0	0	0	0	113.3
23	P	35.3	Very low	61.7	Low	79 Å²	79	78.4 Å²	78.4	51%	0.513	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-68.4	134.8	-177.5	26.4	-31.7	0	0	0	112.5	G50	P23-G50 WeakPolarHBondContact CA-O 3.23Å; P23-G50 WeakPolarHBondContact CB-O 3.26Å
24	D	45.7	Very low	62	Low	69 Å²	69	76.1 Å²	76.1	37%	0.369	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-72.4	132	176.2	-70.5	-29.1	0	0	0	110.9	G50	D24-G50 PolarHBondContact O-N 3.19Å; D24-G50 VanDerWaalsContact O-N 3.08Å
25	H	55.6	Low	62.6	Low	80 Å²	80	74 Å²	74	37%	0.37	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	124.9	167.8	-65.9	79	0	0	0	108	D15 T16 T49	D15-H25 WeakPolarHBondContact CA-O 3.46Å; T16-H25 PolarHBondContact N-O 3.03Å; T16-H25 WeakPolarHBondContact OG1-CB 3.21Å; T16-H25 PolarHBondContact OG1-O 3.45Å; H25-T49 WeakPolarHBondContact CD2-CG2 3.18Å; H25-T49 WeakPolarHBondContact NE2-CG2 3.19Å
26	K	65.9	Low	63.3	Low	74 Å²	74	72.1 Å²	72.1	32%	0.322	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.2	179.9	-67.3	-176.3	-174.4	-159.6	0	110.3	V14 D15 V28 A47 K48	V14-K26 CarbonylContact O-C 3.5Å; V14-K26 WeakPolarHBondContact O-CA 3.34Å; D15-K26 WeakPolarHBondContact OD1-CE 3.19Å; D15-K26 WeakPolarHBondContact OD1-CG 3.45Å; D15-K26 IonicContact OD1-NZ 3.88Å; K26-V28 HydrophobicContact CB-CG2 4.44Å; K26-A47 CarbonylContact O-C 3.46Å; K26-A47 WeakPolarHBondContact O-CA 3.31Å; K26-K48 PolarHBondContact N-O 3.32Å; K26-K48 PolarHBondContact O-N 3.06Å
27	I	70.1	Confident	64.5	Low	66 Å²	66	68.8 Å²	68.8	34%	0.338	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	116.4	158.9	-67.8	168.4	0	0	0	106.8	S13 V14 T16 R46	S13-I27 CarbonylContact C-O 3.34Å; S13-I27 WeakPolarHBondContact CA-O 3.3Å; V14-I27 PolarHBondContact N-O 3.21Å; V14-I27 PolarHBondContact O-N 3.43Å; T16-I27 HydrophobicContact CG2-CB 4.41Å; T16-I27 HydrophobicContact CG2-CD1 3.38Å; T16-I27 HydrophobicContact CG2-CG1 3.51Å; I27-R46 CarbonylContact C-O 3.58Å; I27-R46 WeakPolarHBondContact CA-O 3.4Å
28	V	73.5	Confident	66.3	Low	1 Å²	1	71.5 Å²	71.5	1%	0.006	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	135.3	175.2	178.7	0	0	0	0	109.5	E10 K26 E30 S45 R46 K48	E10-V28 HydrophobicContact CB-CG1 4.43Å; E10-V28 HydrophobicContact CG-CG1 3.5Å; E10-V28 VanDerWaalsContact CG-CG1 3.5Å; K26-V28 HydrophobicContact CB-CG2 4.44Å; V28-E30 HydrophobicContact CG1-CG 4Å; V28-S45 CarbonylContact O-C 3.57Å; V28-S45 WeakPolarHBondContact O-CA 3.27Å; V28-R46 HydrophobicContact CB-CG 4.27Å; V28-R46 PolarHBondContact N-O 3.33Å; V28-R46 PolarHBondContact O-N 3.32Å; V28-K48 HydrophobicContact CB-CD 4.48Å; V28-K48 HydrophobicContact CG2-CB 3.71Å; V28-K48 HydrophobicContact CG2-CD 3.47Å; V28-K48 VanDerWaalsContact CG2-CD 3.47Å; V28-K48 HydrophobicContact CG2-CG 4.27Å
29	V	81.5	Confident	68.6	Low	40 Å²	40	65 Å²	65	24%	0.242	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.8	172.8	-171.4	0	0	0	0	108.6	I11 G12 V44	I11-V29 HydrophobicContact CD1-CB 4.24Å; I11-V29 HydrophobicContact CD1-CG1 3.69Å; I11-V29 HydrophobicContact CG1-CB 3.91Å; I11-V29 HydrophobicContact CG1-CG1 3.82Å; I11-V29 VanDerWaalsContact CG1-O 3.28Å; I11-V29 WeakPolarHBondContact CG1-O 3.36Å; I11-V29 PolarHBondContact N-O 3.33Å; G12-V29 PolarHBondContact O-N 2.97Å; V29-V44 WeakPolarHBondContact CA-O 3.43Å
30	E	81.9	Confident	71	Confident	5 Å²	5	58.7 Å²	58.7	2%	0.023	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.1	177.5	-49.7	-170.2	135.6	0	0	110.1	A8 E9 V28 Y43 V44 R46 K94	A8-E30 HydrophobicContact CB-CB 3.82Å; E9-E30 CarbonylContact O-C 3.53Å; E9-E30 WeakPolarHBondContact O-CA 3.46Å; V28-E30 HydrophobicContact CG1-CG 4Å; E30-Y43 CarbonylContact O-C 3.3Å; E30-Y43 WeakPolarHBondContact O-CA 3.44Å; E30-V44 PolarHBondContact N-O 2.95Å; E30-V44 PolarHBondContact O-N 3.33Å; E30-R46 IonicContact OE1-CZ 2.78Å; E30-R46 IonicContact OE1-NE 2.88Å; E30-R46 PolarHBondContact OE1-NE 3.43Å; E30-R46 IonicContact OE1-NH2 2.64Å; E30-R46 PolarHBondContact OE1-NH2 3.05Å; E30-R46 IonicContact OE2-CZ 3.44Å; E30-R46 IonicContact OE2-NE 3.67Å; E30-R46 IonicContact OE2-NH2 2.81Å; E30-K94 IonicContact OE1-NZ 3.48Å; E30-K94 PolarHBondContact OE1-NZ 2.84Å; E30-K94 VanDerWaalsContact OE2-CD 3.26Å; E30-K94 WeakPolarHBondContact OE2-CD 3.4Å; E30-K94 WeakPolarHBondContact OE2-CE 3.31Å; E30-K94 IonicContact OE2-NZ 3.58Å; E30-K94 PolarHBondContact OE2-NZ 3.44Å
31	A	87.2	Confident	73.4	Confident	16 Å²	16	50.3 Å²	50.3	13%	0.132	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	140	177.8	0	0	0	0	0	110.6	A8 E9 I11 T41 C42 Y43	A8-A31 CarbonylContact C-O 3.57Å; A8-A31 WeakPolarHBondContact CA-O 3.33Å; A8-A31 WeakPolarHBondContact CB-O 3.45Å; E9-A31 PolarHBondContact N-O 3.36Å; E9-A31 PolarHBondContact O-N 2.83Å; I11-A31 HydrophobicContact CG2-CB 3.61Å; A31-T41 HydrophobicContact CB-CG2 4.31Å; A31-C42 CarbonylContact C-O 3.55Å; A31-C42 VanDerWaalsContact CA-O 3.31Å; A31-C42 WeakPolarHBondContact CA-O 3.27Å; A31-Y43 HydrophobicContact CB-CD1 3.78Å; A31-Y43 HydrophobicContact CB-CE1 3.83Å
32	F	88.3	Confident	76.1	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.018	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	150.7	169	72.3	-89.3	0	0	0	110.7	A6 A8 C42 V44 V91 F92 V105	A6-F32 HydrophobicContact CB-CB 3.99Å; A6-F32 HydrophobicContact CB-CD2 3.56Å; A6-F32 HydrophobicContact CB-CE2 4.46Å; A6-F32 HydrophobicContact CB-CG 4.13Å; A8-F32 HydrophobicContact CB-CB 3.93Å; A8-F32 HydrophobicContact CB-CD1 4.48Å; F32-C42 HydrophobicContact CD1-CB 3.98Å; F32-C42 HydrophobicContact CD2-CB 4.34Å; F32-C42 HydrophobicContact CE1-CB 3.42Å; F32-C42 VanDerWaalsContact CE1-CB 3.42Å; F32-C42 HydrophobicContact CE2-CB 3.83Å; F32-C42 HydrophobicContact CG-CB 4.41Å; F32-C42 HydrophobicContact CZ-CB 3.34Å; F32-C42 PolarHBondContact N-O 3.44Å; F32-C42 PolarHBondContact O-N 2.94Å; F32-V44 HydrophobicContact CD1-CG2 4.28Å; F32-V44 HydrophobicContact CE1-CG2 3.74Å; F32-V91 HydrophobicContact CE2-CB 4.46Å; F32-V91 HydrophobicContact CE2-CG2 3.92Å; F32-V91 HydrophobicContact CZ-CG2 4.11Å; F32-F92 HydrophobicContact CB-CD2 4.22Å; F32-F92 HydrophobicContact CD1-CB 4.02Å; F32-F92 HydrophobicContact CD1-CD1 4.35Å; F32-F92 AromaticContact CD1-CD2 3.74Å; F32-F92 HydrophobicContact CD1-CD2 3.74Å; F32-F92 HydrophobicContact CD1-CE2 4.23Å; F32-F92 AromaticContact CD1-CG 3.78Å; F32-F92 HydrophobicContact CD1-CG 3.78Å; F32-F92 HydrophobicContact CD2-CB 3.96Å; F32-F92 HydrophobicContact CD2-CD2 4.32Å; F32-F92 HydrophobicContact CD2-CG 4.44Å; F32-F92 HydrophobicContact CE1-CB 3.62Å; F32-F92 HydrophobicContact CE1-CD1 4.08Å; F32-F92 HydrophobicContact CE1-CD2 4.16Å; F32-F92 AromaticContact CE1-CG 3.7Å; F32-F92 HydrophobicContact CE1-CG 3.7Å; F32-F92 HydrophobicContact CE2-CB 3.58Å; F32-F92 HydrophobicContact CE2-CG 4.39Å; F32-F92 HydrophobicContact CG-CB 4.18Å; F32-F92 AromaticContact CG-CD2 3.82Å; F32-F92 HydrophobicContact CG-CD2 3.82Å; F32-F92 HydrophobicContact CG-CE2 4.48Å; F32-F92 HydrophobicContact CG-CG 4.16Å; F32-F92 HydrophobicContact CZ-CB 3.39Å; F32-F92 HydrophobicContact CZ-CG 4.03Å; F32-V105 HydrophobicContact CE1-CG2 4.07Å; F32-V105 HydrophobicContact CZ-CB 4.04Å; F32-V105 HydrophobicContact CZ-CG1 4.05Å; F32-V105 HydrophobicContact CZ-CG2 4.06Å
33	D	89	Confident	78.4	Confident	103 Å²	103	43.8 Å²	43.8	55%	0.551	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	143.1	173.6	-66.2	-32.3	0	0	0	111.1	A6 V40 T41	A6-D33 WeakPolarHBondContact CB-O 3.38Å; D33-V40 WeakPolarHBondContact CA-O 3.23Å; D33-T41 WeakPolarHBondContact OD1-CB 3.28Å; D33-T41 WeakPolarHBondContact OD1-CG2 3.3Å; D33-T41 PolarHBondContact OD1-OG1 3.49Å
34	D	87	Confident	80.7	Confident	8 Å²	8	40.1 Å²	40.1	4%	0.043	20%	0.204	C	C	.	.			trans	-65.1	124.3	172.5	-174.1	-55.9	0	0	0	110.4	D36 V37 V40 V91 R107 Y118	D34-D36 VanDerWaalsContact C-N 3.33Å; D34-D36 PolarHBondContact O-N 3.14Å; D34-D36 PolarHBondContact OD1-N 3.36Å; D34-V37 HydrophobicContact CB-CB 4.06Å; D34-V37 PolarHBondContact OD1-N 3.25Å; D34-V40 HydrophobicContact CB-CB 4.2Å; D34-V40 HydrophobicContact CB-CG1 4.48Å; D34-V40 PolarHBondContact N-O 3.02Å; D34-V91 WeakPolarHBondContact OD2-CG1 3.34Å; D34-R107 IonicContact OD1-CZ 2.83Å; D34-R107 IonicContact OD1-NH1 2.67Å; D34-R107 PolarHBondContact OD1-NH1 2.84Å; D34-R107 VanDerWaalsContact OD2-CD 3.32Å; D34-R107 WeakPolarHBondContact OD2-CD 3.34Å; D34-R107 IonicContact OD2-CZ 2.88Å; D34-R107 IonicContact OD2-NE 3.09Å; D34-R107 IonicContact OD2-NH1 3.4Å; D34-R107 PolarHBondContact OD2-NH1 3.22Å; D34-Y118 VanDerWaalsContact OD2-CE1 3.3Å; D34-Y118 WeakPolarHBondContact OD2-CE1 3.07Å; D34-Y118 PolarHBondContact OD2-OH 3.48Å
35	P	82.9	Confident	82.2	Confident	48 Å²	48	38.4 Å²	38.4	31%	0.312	20%	0.197	S	C	.	.	S	Bend	trans	-70.6	-23.7	-174.4	28.7	-35.8	0	0	0	114.5	P4	P4-P35 HydrophobicContact CG-CB 4.04Å; P4-P35 WeakPolarHBondContact O-CB 3.41Å; P4-P35 WeakPolarHBondContact O-CG 3.47Å
36	D	82.7	Confident	82.9	Confident	41 Å²	41	36.5 Å²	36.5	22%	0.219	19%	0.187	C	C	.	.	S	Bend	trans	-112.9	-8.6	-176.2	-55	-56.5	0	0	0	113	D34 I81 R107	D34-D36 VanDerWaalsContact C-N 3.33Å; D34-D36 PolarHBondContact O-N 3.14Å; D34-D36 PolarHBondContact OD1-N 3.36Å; D36-I81 HydrophobicContact CB-CD1 3.95Å; D36-R107 IonicContact OD2-CZ 2.74Å; D36-R107 IonicContact OD2-NH1 3.67Å; D36-R107 IonicContact OD2-NH2 3.66Å; D36-R107 PolarHBondContact OD2-NH2 3.11Å
37	V	86.3	Confident	82.8	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	105.3	176.6	-174.6	0	0	0	0	109.3	D34 V40 I75 L77 I81 L116	D34-V37 HydrophobicContact CB-CB 4.06Å; D34-V37 PolarHBondContact OD1-N 3.25Å; V37-V40 HydrophobicContact CB-CG2 4.39Å; V37-V40 HydrophobicContact CG1-CB 4.33Å; V37-V40 HydrophobicContact CG1-CG2 3.6Å; V37-I75 HydrophobicContact CG1-CG2 3.63Å; V37-L77 HydrophobicContact CG1-CD2 4.35Å; V37-L77 HydrophobicContact CG2-CD2 4.25Å; V37-I81 HydrophobicContact CG2-CD1 3.45Å; V37-I81 VanDerWaalsContact CG2-CD1 3.45Å; V37-L116 HydrophobicContact CB-CD1 4.32Å; V37-L116 HydrophobicContact CG1-CD1 3.6Å; V37-L116 HydrophobicContact CG2-CD1 3.97Å
38	K	85.2	Confident	82.4	Confident	127 Å²	127	37.8 Å²	37.8	55%	0.552	20%	0.204	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	144.9	175.5	-67.4	-169.2	-165.4	153.6	0	111.1	V40 E76	K38-V40 VanDerWaalsContact C-N 3.34Å; K38-E76 HydrophobicContact CB-CB 4.36Å; K38-E76 WeakPolarHBondContact CD-OE2 3.39Å; K38-E76 WeakPolarHBondContact CE-OE2 3.48Å; K38-E76 IonicContact NZ-OE2 2.74Å; K38-E76 PolarHBondContact NZ-OE2 2.76Å
39	N	89.6	Confident	81.5	Confident	65 Å²	65	41 Å²	41	35%	0.348	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	66.6	29.4	173.5	-53.1	-44.8	0	0	0	114.7	V72 P74	N39-V72 HydrophobicContact CB-CG2 4.19Å; N39-V72 WeakPolarHBondContact O-CG2 3.22Å; N39-V72 PolarHBondContact O-N 2.87Å; N39-P74 PolarHBondContact ND2-O 3.4Å
40	V	90.3	Very high	79.7	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.036	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	122.2	166.2	178.3	0	0	0	0	109.6	D33 D34 V37 K38 C69 Q70 I75 L116 Y118	D33-V40 WeakPolarHBondContact CA-O 3.23Å; D34-V40 HydrophobicContact CB-CB 4.2Å; D34-V40 HydrophobicContact CB-CG1 4.48Å; D34-V40 PolarHBondContact N-O 3.02Å; V37-V40 HydrophobicContact CB-CG2 4.39Å; V37-V40 HydrophobicContact CG1-CB 4.33Å; V37-V40 HydrophobicContact CG1-CG2 3.6Å; K38-V40 VanDerWaalsContact C-N 3.34Å; V40-C69 HydrophobicContact CG1-CB 4.22Å; V40-Q70 WeakPolarHBondContact CA-O 3.01Å; V40-I75 HydrophobicContact CG2-CD1 3.99Å; V40-I75 HydrophobicContact CG2-CG1 4.07Å; V40-L116 HydrophobicContact CG2-CD1 4.36Å; V40-Y118 HydrophobicContact CG1-CE2 3.91Å; V40-Y118 WeakPolarHBondContact CG1-OH 3.41Å
41	T	90.5	Very high	77.7	Confident	17 Å²	17	43.1 Å²	43.1	10%	0.104	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129.1	175.9	-55.4	0	0	0	0	109.1	A31 D33 Y43 C69 Q70	A31-T41 HydrophobicContact CB-CG2 4.31Å; D33-T41 WeakPolarHBondContact OD1-CB 3.28Å; D33-T41 WeakPolarHBondContact OD1-CG2 3.3Å; D33-T41 PolarHBondContact OD1-OG1 3.49Å; T41-Y43 HydrophobicContact CG2-CE1 4.37Å; T41-Y43 HydrophobicContact CG2-CE2 4.41Å; T41-C69 CarbonylContact O-C 3.58Å; T41-C69 WeakPolarHBondContact O-CA 3.41Å; T41-Q70 PolarHBondContact N-O 2.91Å; T41-Q70 PolarHBondContact O-N 3.39Å
42	C	90.3	Very high	75.5	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129.1	-179	-70.3	0	0	0	0	111.2	A31 F32 I67 C69	A31-C42 CarbonylContact C-O 3.55Å; A31-C42 VanDerWaalsContact CA-O 3.31Å; A31-C42 WeakPolarHBondContact CA-O 3.27Å; F32-C42 HydrophobicContact CD1-CB 3.98Å; F32-C42 HydrophobicContact CD2-CB 4.34Å; F32-C42 HydrophobicContact CE1-CB 3.42Å; F32-C42 VanDerWaalsContact CE1-CB 3.42Å; F32-C42 HydrophobicContact CE2-CB 3.83Å; F32-C42 HydrophobicContact CG-CB 4.41Å; F32-C42 HydrophobicContact CZ-CB 3.34Å; F32-C42 PolarHBondContact N-O 3.44Å; F32-C42 PolarHBondContact O-N 2.94Å; C42-I67 HydrophobicContact CB-CD1 4.34Å; C42-C69 HydrophobicContact CB-CB 4.11Å; C42-C69 WeakPolarHBondContact CB-SG 3.17Å; C42-C69 WeakPolarHBondContact SG-CB 3.36Å; C42-C69 CovalentContact SG-SG 2.04Å; C42-C69 PolarHBondContact SG-SG 3.13Å
43	Y	88.8	Confident	73.1	Confident	69 Å²	69	59 Å²	59	27%	0.271	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	128.7	175.2	-55.2	-80.7	0	0	0	109.6	I11 E30 A31 T41 I67 S68 Q70	I11-Y43 HydrophobicContact CD1-CD1 3.48Å; I11-Y43 VanDerWaalsContact CD1-CD1 3.48Å; I11-Y43 HydrophobicContact CD1-CE1 3.71Å; E30-Y43 CarbonylContact O-C 3.3Å; E30-Y43 WeakPolarHBondContact O-CA 3.44Å; A31-Y43 HydrophobicContact CB-CD1 3.78Å; A31-Y43 HydrophobicContact CB-CE1 3.83Å; T41-Y43 HydrophobicContact CG2-CE1 4.37Å; T41-Y43 HydrophobicContact CG2-CE2 4.41Å; Y43-I67 CarbonylContact O-C 3.57Å; Y43-I67 WeakPolarHBondContact O-CA 3.34Å; Y43-S68 WeakPolarHBondContact CD2-O 3.24Å; Y43-S68 PolarHBondContact N-O 2.79Å; Y43-S68 PolarHBondContact O-N 2.87Å; Y43-Q70 HydrophobicContact CD2-CG 4.43Å; Y43-Q70 HydrophobicContact CE2-CB 4.32Å; Y43-Q70 HydrophobicContact CE2-CG 4.08Å
44	V	81.9	Confident	70.5	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.012	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	120.9	-178.9	177.8	0	0	0	0	108.7	V29 E30 F32 A66 I67 L103 V105	V29-V44 WeakPolarHBondContact CA-O 3.43Å; E30-V44 PolarHBondContact N-O 2.95Å; E30-V44 PolarHBondContact O-N 3.33Å; F32-V44 HydrophobicContact CD1-CG2 4.28Å; F32-V44 HydrophobicContact CE1-CG2 3.74Å; V44-A66 WeakPolarHBondContact CA-O 3.33Å; V44-I67 HydrophobicContact CG2-CD1 4.27Å; V44-I67 HydrophobicContact CG2-CG1 4.22Å; V44-L103 HydrophobicContact CG1-CD2 3.27Å; V44-V105 HydrophobicContact CG2-CG2 4.19Å
45	S	77.8	Confident	68	Low	34 Å²	34	60.5 Å²	60.5	24%	0.238	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	141.4	173.6	67	0	0	0	0	110.9	V28 A65 A66	V28-S45 CarbonylContact O-C 3.57Å; V28-S45 WeakPolarHBondContact O-CA 3.27Å; S45-A65 WeakPolarHBondContact O-CA 3.39Å; S45-A66 PolarHBondContact N-O 3.32Å; S45-A66 WeakPolarHBondContact OG-CB 3.34Å; S45-A66 PolarHBondContact OG-N 3Å
46	R	69.6	Low	65.8	Low	39 Å²	39	64.6 Å²	64.6	15%	0.147	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	146.7	177.1	64	179.3	-176.6	155.9	2.9	111.9	I27 V28 E30	I27-R46 CarbonylContact C-O 3.58Å; I27-R46 WeakPolarHBondContact CA-O 3.4Å; V28-R46 HydrophobicContact CB-CG 4.27Å; V28-R46 PolarHBondContact N-O 3.33Å; V28-R46 PolarHBondContact O-N 3.32Å; E30-R46 IonicContact OE1-CZ 2.78Å; E30-R46 IonicContact OE1-NE 2.88Å; E30-R46 PolarHBondContact OE1-NE 3.43Å; E30-R46 IonicContact OE1-NH2 2.64Å; E30-R46 PolarHBondContact OE1-NH2 3.05Å; E30-R46 IonicContact OE2-CZ 3.44Å; E30-R46 IonicContact OE2-NE 3.67Å; E30-R46 IonicContact OE2-NH2 2.81Å
47	A	64.5	Low	63.5	Low	75 Å²	75	65 Å²	65	62%	0.62	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	137.4	168.4	0	0	0	0	0	111.4	K26	K26-A47 CarbonylContact O-C 3.46Å; K26-A47 WeakPolarHBondContact O-CA 3.31Å
48	K	61	Low	60.9	Low	92 Å²	92	70.1 Å²	70.1	40%	0.4	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	117.2	177.2	-170.2	-178.6	-176.8	-177.1	0	108.4	E10 K26 V28	E10-K48 IonicContact OE1-NZ 2.74Å; E10-K48 IonicContact OE2-NZ 3.33Å; E10-K48 PolarHBondContact OE2-NZ 3.3Å; K26-K48 PolarHBondContact N-O 3.32Å; K26-K48 PolarHBondContact O-N 3.06Å; V28-K48 HydrophobicContact CB-CD 4.48Å; V28-K48 HydrophobicContact CG2-CB 3.71Å; V28-K48 HydrophobicContact CG2-CD 3.47Å; V28-K48 VanDerWaalsContact CG2-CD 3.47Å; V28-K48 HydrophobicContact CG2-CG 4.27Å
49	T	55.5	Low	58.8	Low	69 Å²	69	65.7 Å²	65.7	42%	0.423	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.6	178.6	25.5	0	0	0	0	111.3	H25	H25-T49 WeakPolarHBondContact CD2-CG2 3.18Å; H25-T49 WeakPolarHBondContact NE2-CG2 3.19Å
50	G	42.7	Very low	56.2	Low	42 Å²	42	69.8 Å²	69.8	43%	0.433	43%	0.433	S	S	.	.			trans	-108.4	124.4	178.9	0	0	0	0	0	113.1	P23 D24	P23-G50 WeakPolarHBondContact CA-O 3.23Å; P23-G50 WeakPolarHBondContact CB-O 3.26Å; D24-G50 PolarHBondContact O-N 3.19Å; D24-G50 VanDerWaalsContact O-N 3.08Å
51	G	41.1	Very low	54.1	Low	47 Å²	47	76 Å²	76	49%	0.485	47%	0.466	S	S	.	.	S	Bend	trans	156.6	165.3	169.7	0	0	0	0	0	115.3	K53 G54	G51-K53 PolarHBondContact O-N 3.32Å; G51-G54 WeakPolarHBondContact O-CA 3.36Å; G51-G54 PolarHBondContact O-N 3.45Å
52	I	40.4	Very low	51.8	Low	178 Å²	178	79.9 Å²	79.9	91%	0.913	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-63.8	-11.7	-167.8	-58.8	169.6	0	0	0	113.9	G54	I52-G54 VanDerWaalsContact C-N 3.35Å
53	K	38.7	Very low	49.7	Very low	175 Å²	175	84.1 Å²	84.1	76%	0.761	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-79.2	-10.6	165.8	-80.5	-173.4	174.4	-177.3	0	114.4	G51 G55 L56	G51-K53 PolarHBondContact O-N 3.32Å; K53-G55 PolarHBondContact O-N 3.05Å; K53-L56 CarbonylContact O-C 3.47Å; K53-L56 WeakPolarHBondContact O-CA 3.42Å; K53-L56 PolarHBondContact O-N 3.42Å
54	G	34.6	Very low	48.1	Very low	68 Å²	68	87.2 Å²	87.2	70%	0.701	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-69	-10.4	174.2	0	0	0	0	0	114.5	G51 I52 L56	G51-G54 WeakPolarHBondContact O-CA 3.36Å; G51-G54 PolarHBondContact O-N 3.45Å; I52-G54 VanDerWaalsContact C-N 3.35Å; G54-L56 VanDerWaalsContact C-N 3.26Å
55	G	34.6	Very low	47.2	Very low	76 Å²	76	88.6 Å²	88.6	78%	0.784	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-78.7	-8.4	164.6	0	0	0	0	0	113.9	K53	K53-G55 PolarHBondContact O-N 3.05Å
56	L	35.1	Very low	47	Very low	134 Å²	134	89.8 Å²	89.8	70%	0.702	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.4	41.2	-173.4	-130.7	96.5	0	0	0	112	K53 G54 L58	K53-L56 CarbonylContact O-C 3.47Å; K53-L56 WeakPolarHBondContact O-CA 3.42Å; K53-L56 PolarHBondContact O-N 3.42Å; G54-L56 VanDerWaalsContact C-N 3.26Å; L56-L58 WeakPolarHBondContact O-CG 3.28Å; L56-L58 PolarHBondContact O-N 2.88Å
57	G	34.5	Very low	47.7	Very low	49 Å²	49	90 Å²	90	51%	0.505	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	61.6	-4.4	153.4	0	0	0	0	0	120.7	Q144	G57-Q144 PolarHBondContact O-OE1 2.74Å
58	L	32.4	Very low	48.9	Very low	108 Å²	108	89.3 Å²	89.3	57%	0.565	56%	0.558	S	S	*	*			trans	-99.4	94.3	-173.4	-67.1	155	0	0	0	110	L56 Y140	L56-L58 WeakPolarHBondContact O-CG 3.28Å; L56-L58 PolarHBondContact O-N 2.88Å; L58-Y140 HydrophobicContact CD2-CE1 4.19Å; L58-Y140 WeakPolarHBondContact CD2-OH 3.36Å
59	A	40.4	Very low	50.3	Low	35 Å²	35	86.8 Å²	86.8	29%	0.289	55%	0.552	S	S	.	*			trans	-125.3	110.8	166.9	0	0	0	0	0	109
60	E	36.6	Very low	52	Low	151 Å²	151	88.5 Å²	88.5	71%	0.706	56%	0.555	S	S	*	*			trans	-76.6	140.9	171.2	-76	169.3	159.1	0	0	110.9
61	D	45.2	Very low	54.3	Low	137 Å²	137	92.5 Å²	92.5	73%	0.733	56%	0.563	S	S	*	*			trans	61.4	138.6	166.2	-85	-7.9	0	0	0	120.4
62	T	43.1	Very low	56.6	Low	98 Å²	98	94.2 Å²	94.2	60%	0.601	56%	0.563	S	S	*	*			cis	-152.5	159.1	-8.1	28.6	0	0	0	0	106.9	D64	T62-D64 PolarHBondContact O-N 2.97Å
63	S	44.7	Very low	58.9	Low	88 Å²	88	86.7 Å²	86.7	62%	0.615	53%	0.53	S	S	*	.			trans	-63.2	17.6	-171.2	38.7	0	0	0	0	118.6	A65	S63-A65 PolarHBondContact O-N 3.2Å
64	D	55	Low	61.2	Low	134 Å²	134	83.2 Å²	83.2	72%	0.717	53%	0.525	S	S	*	.			trans	-103.3	87.3	-171.2	-68.5	-14.2	0	0	0	112.3	T62	T62-D64 PolarHBondContact O-N 2.97Å
65	A	63.5	Low	63.7	Low	31 Å²	31	83.3 Å²	83.3	26%	0.256	51%	0.509	S	S	.	.			trans	-84.4	119.1	160.8	0	0	0	0	0	108.9	S45 S63 L103	S45-A65 WeakPolarHBondContact O-CA 3.39Å; S63-A65 PolarHBondContact O-N 3.2Å; A65-L103 HydrophobicContact CB-CD1 3.4Å; A65-L103 VanDerWaalsContact CB-CD1 3.4Å; A65-L103 HydrophobicContact CB-CD2 3.63Å; A65-L103 HydrophobicContact CB-CG 4.17Å
66	A	74.7	Confident	66	Low	59 Å²	59	84.8 Å²	84.8	49%	0.488	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	143.3	171.9	0	0	0	0	0	109.7	V44 S45	V44-A66 WeakPolarHBondContact CA-O 3.33Å; S45-A66 PolarHBondContact N-O 3.32Å; S45-A66 WeakPolarHBondContact OG-CB 3.34Å; S45-A66 PolarHBondContact OG-N 3Å
67	I	84.3	Confident	68.3	Low	44 Å²	44	79.9 Å²	79.9	23%	0.226	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	137.3	173.5	-175.8	166.7	0	0	0	110.6	C42 Y43 V44 V105 A120	C42-I67 HydrophobicContact CB-CD1 4.34Å; Y43-I67 CarbonylContact O-C 3.57Å; Y43-I67 WeakPolarHBondContact O-CA 3.34Å; V44-I67 HydrophobicContact CG2-CD1 4.27Å; V44-I67 HydrophobicContact CG2-CG1 4.22Å; I67-V105 HydrophobicContact CD1-CB 4.01Å; I67-V105 HydrophobicContact CD1-CG1 3.19Å; I67-V105 HydrophobicContact CD1-CG2 3.57Å; I67-A120 HydrophobicContact CB-CB 4.24Å; I67-A120 HydrophobicContact CG2-CB 3.95Å
68	S	89.5	Confident	70.4	Confident	61 Å²	61	79.8 Å²	79.8	43%	0.427	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	116.2	170	-173.9	0	0	0	0	108.9	Y43	Y43-S68 WeakPolarHBondContact CD2-O 3.24Å; Y43-S68 PolarHBondContact N-O 2.79Å; Y43-S68 PolarHBondContact O-N 2.87Å
69	C	89.4	Confident	72.5	Confident	38 Å²	38	80 Å²	80	26%	0.257	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	133.2	175.5	-58.8	0	0	0	0	110.3	V40 T41 C42 Y118	V40-C69 HydrophobicContact CG1-CB 4.22Å; T41-C69 CarbonylContact O-C 3.58Å; T41-C69 WeakPolarHBondContact O-CA 3.41Å; C42-C69 HydrophobicContact CB-CB 4.11Å; C42-C69 WeakPolarHBondContact CB-SG 3.17Å; C42-C69 WeakPolarHBondContact SG-CB 3.36Å; C42-C69 CovalentContact SG-SG 2.04Å; C42-C69 PolarHBondContact SG-SG 3.13Å; C69-Y118 HydrophobicContact CB-CD2 3.67Å; C69-Y118 HydrophobicContact CB-CE2 4.07Å; C69-Y118 HydrophobicContact CB-CG 4.1Å; C69-Y118 WeakPolarHBondContact SG-CB 3.28Å; C69-Y118 VanDerWaalsContact SG-CD2 3.56Å
70	Q	91	Very high	74.2	Confident	105 Å²	105	82.4 Å²	82.4	49%	0.491	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	144	-178	-63	-165.1	-0.8	0	0	111.2	V40 T41 Y43 V72	V40-Q70 WeakPolarHBondContact CA-O 3.01Å; T41-Q70 PolarHBondContact N-O 2.91Å; T41-Q70 PolarHBondContact O-N 3.39Å; Y43-Q70 HydrophobicContact CD2-CG 4.43Å; Y43-Q70 HydrophobicContact CE2-CB 4.32Å; Y43-Q70 HydrophobicContact CE2-CG 4.08Å; Q70-V72 PolarHBondContact O-N 3.34Å
71	Q	91.6	Very high	76.1	Confident	127 Å²	127	75.6 Å²	75.6	59%	0.593	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	114.9	169.9	179.3	178.1	-2.7	0	0	109	G73 I75	Q71-G73 WeakPolarHBondContact CG-O 3.42Å; Q71-G73 PolarHBondContact NE2-O 3.35Å; Q71-I75 HydrophobicContact CB-CD1 4.27Å; Q71-I75 HydrophobicContact CG-CD1 3.95Å; Q71-I75 HydrophobicContact CG-CG1 3.79Å
72	V	89.8	Confident	77.6	Confident	82 Å²	82	74 Å²	74	50%	0.497	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	2.1	-179.4	-63.3	0	0	0	0	113.1	N39 Q70	N39-V72 HydrophobicContact CB-CG2 4.19Å; N39-V72 WeakPolarHBondContact O-CG2 3.22Å; N39-V72 PolarHBondContact O-N 2.87Å; Q70-V72 PolarHBondContact O-N 3.34Å
73	G	87.8	Confident	79	Confident	21 Å²	21	75.7 Å²	75.7	22%	0.216	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.9	-173.1	-179.2	0	0	0	0	0	111.7	Q71 I75	Q71-G73 WeakPolarHBondContact CG-O 3.42Å; Q71-G73 PolarHBondContact NE2-O 3.35Å; G73-I75 PolarHBondContact O-N 3.17Å
74	P	87	Confident	79.9	Confident	102 Å²	102	73.5 Å²	73.5	66%	0.662	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	122.1	178.7	-22.1	33.6	0	0	0	111.9	N39 E76	N39-P74 PolarHBondContact ND2-O 3.4Å; P74-E76 PolarHBondContact O-N 2.66Å
75	I	87	Confident	80	Confident	70 Å²	70	75.7 Å²	75.7	36%	0.359	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	126.1	-178.7	-65.2	177.9	0	0	0	110.2	V37 V40 Q71 G73 L77 L116	V37-I75 HydrophobicContact CG1-CG2 3.63Å; V40-I75 HydrophobicContact CG2-CD1 3.99Å; V40-I75 HydrophobicContact CG2-CG1 4.07Å; Q71-I75 HydrophobicContact CB-CD1 4.27Å; Q71-I75 HydrophobicContact CG-CD1 3.95Å; Q71-I75 HydrophobicContact CG-CG1 3.79Å; G73-I75 PolarHBondContact O-N 3.17Å; I75-L77 HydrophobicContact CG2-CD2 4.22Å; I75-L77 HydrophobicContact CG2-CG 4.15Å; I75-L116 HydrophobicContact CG2-CD1 4.3Å
76	E	84.1	Confident	79.6	Confident	106 Å²	106	78.5 Å²	78.5	50%	0.495	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	109.1	172.2	-69.5	179.4	-174	0	0	110	K38 P74	K38-E76 HydrophobicContact CB-CB 4.36Å; K38-E76 WeakPolarHBondContact CD-OE2 3.39Å; K38-E76 WeakPolarHBondContact CE-OE2 3.48Å; K38-E76 IonicContact NZ-OE2 2.74Å; K38-E76 PolarHBondContact NZ-OE2 2.76Å; P74-E76 PolarHBondContact O-N 2.66Å
77	L	82.4	Confident	79	Confident	31 Å²	31	83.1 Å²	83.1	16%	0.162	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	122	174.8	-66.8	173.6	0	0	0	110.5	V37 I75 I81 K82 Y109 L116	V37-L77 HydrophobicContact CG1-CD2 4.35Å; V37-L77 HydrophobicContact CG2-CD2 4.25Å; I75-L77 HydrophobicContact CG2-CD2 4.22Å; I75-L77 HydrophobicContact CG2-CG 4.15Å; L77-I81 HydrophobicContact CD2-CD1 4.49Å; L77-I81 HydrophobicContact CD2-CG2 4.11Å; L77-K82 HydrophobicContact CB-CG 4.2Å; L77-K82 WeakPolarHBondContact O-CE 3.36Å; L77-Y109 HydrophobicContact CD1-CD2 4.1Å; L77-Y109 HydrophobicContact CD1-CE2 3.39Å; L77-L116 HydrophobicContact CD2-CD1 4.01Å; L77-L116 HydrophobicContact CD2-CD2 4.06Å; L77-L116 HydrophobicContact CD2-CG 4.31Å
78	S	79.9	Confident	78.2	Confident	47 Å²	47	82.4 Å²	82.4	33%	0.329	46%	0.457	S	S	.	.			trans	-66.4	152.8	171.2	66.9	0	0	0	0	111.7	R80 I81 K82	S78-R80 PolarHBondContact O-N 2.84Å; S78-R80 VanDerWaalsContact O-N 3.14Å; S78-I81 PolarHBondContact O-N 3.31Å; S78-K82 PolarHBondContact O-N 2.81Å
79	D	76.6	Confident	77.6	Confident	112 Å²	112	82.3 Å²	82.3	60%	0.599	45%	0.45	S	S	*	.	H	α-helix	trans	-59	-26.7	175.2	-68.9	-26.6	0	0	0	112.2	I81 K82 N83	D79-I81 PolarHBondContact O-N 3.26Å; D79-K82 PolarHBondContact O-N 2.86Å; D79-N83 WeakPolarHBondContact O-CB 3.44Å; D79-N83 VanDerWaalsContact O-CG 3.23Å; D79-N83 PolarHBondContact O-N 3.17Å; D79-N83 PolarHBondContact O-ND2 2.82Å; D79-N83 VanDerWaalsContact O-ND2 3.11Å
80	R	74.8	Confident	76.9	Confident	86 Å²	86	83.3 Å²	83.3	33%	0.325	46%	0.455	S	S	.	.	H	α-helix	trans	-59.9	-43.4	173.1	178.5	-173.5	154.3	165	-2.8	112	M1 S78 G84 E89	M1-R80 PolarHBondContact O-NH2 2.78Å; S78-R80 PolarHBondContact O-N 2.84Å; S78-R80 VanDerWaalsContact O-N 3.14Å; R80-G84 WeakPolarHBondContact O-CA 3.49Å; R80-G84 PolarHBondContact O-N 3.28Å; R80-E89 IonicContact CZ-OE1 3.07Å; R80-E89 IonicContact NE-OE1 3.52Å; R80-E89 PolarHBondContact NE-OE1 3.47Å; R80-E89 IonicContact NH2-OE1 2.88Å; R80-E89 PolarHBondContact NH2-OE1 3.32Å
81	I	76.8	Confident	76.3	Confident	9 Å²	9	78.4 Å²	78.4	5%	0.046	43%	0.432	C	S	.	.	H	α-helix	trans	-74.2	-42.3	-179.5	-64.2	173.4	0	0	0	110.1	D36 V37 L77 S78 D79 N83 G84 Y109	D36-I81 HydrophobicContact CB-CD1 3.95Å; V37-I81 HydrophobicContact CG2-CD1 3.45Å; V37-I81 VanDerWaalsContact CG2-CD1 3.45Å; L77-I81 HydrophobicContact CD2-CD1 4.49Å; L77-I81 HydrophobicContact CD2-CG2 4.11Å; S78-I81 PolarHBondContact O-N 3.31Å; D79-I81 PolarHBondContact O-N 3.26Å; I81-N83 VanDerWaalsContact C-N 3.29Å; I81-N83 PolarHBondContact O-N 2.92Å; I81-G84 PolarHBondContact O-N 2.83Å; I81-Y109 HydrophobicContact CG2-CD1 4.23Å; I81-Y109 HydrophobicContact CG2-CD2 4.47Å; I81-Y109 HydrophobicContact CG2-CG 3.92Å
82	K	77.6	Confident	75.7	Confident	104 Å²	104	72.5 Å²	72.5	45%	0.452	40%	0.404	S	S	.	.	H	α-helix	trans	-62.1	-36.6	178.5	-66.2	177.4	-173.9	167.4	0	112.8	L77 S78 D79	L77-K82 HydrophobicContact CB-CG 4.2Å; L77-K82 WeakPolarHBondContact O-CE 3.36Å; S78-K82 PolarHBondContact O-N 2.81Å; D79-K82 PolarHBondContact O-N 2.86Å
83	N	71.9	Confident	74.8	Confident	133 Å²	133	72.9 Å²	72.9	71%	0.711	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	0.2	-178.5	-59	-31.4	0	0	0	113.1	D79 I81	D79-N83 WeakPolarHBondContact O-CB 3.44Å; D79-N83 VanDerWaalsContact O-CG 3.23Å; D79-N83 PolarHBondContact O-N 3.17Å; D79-N83 PolarHBondContact O-ND2 2.82Å; D79-N83 VanDerWaalsContact O-ND2 3.11Å; I81-N83 VanDerWaalsContact C-N 3.29Å; I81-N83 PolarHBondContact O-N 2.92Å
84	G	63.3	Low	73.7	Confident	41 Å²	41	74.5 Å²	74.5	42%	0.423	40%	0.401	S	S	.	.	S	Bend	trans	-69	144.6	179.6	0	0	0	0	0	111.3	R80 I81	R80-G84 WeakPolarHBondContact O-CA 3.49Å; R80-G84 PolarHBondContact O-N 3.28Å; I81-G84 PolarHBondContact O-N 2.83Å
85	K	57.4	Low	72.4	Confident	180 Å²	180	77.1 Å²	77.1	78%	0.783	40%	0.397	S	S	*	.			trans	-62	144.2	169.5	-68.3	-175.8	177.6	-177.9	0	108.4	Q87	K85-Q87 PolarHBondContact O-N 3.38Å
86	A	55.4	Low	70.8	Confident	91 Å²	91	76 Å²	76	75%	0.752	39%	0.394	S	S	*	.	S	Bend	trans	-64.5	22.2	-178.2	0	0	0	0	0	115.5
87	Q	61.3	Low	68.9	Low	156 Å²	156	73.2 Å²	73.2	73%	0.729	39%	0.386	S	S	*	.	S	Bend	trans	-91.8	109.7	175.7	-65.3	-177.5	-26	0	0	106.6	K85	K85-Q87 PolarHBondContact O-N 3.38Å
88	G	67.1	Low	66.9	Low	29 Å²	29	80.2 Å²	80.2	30%	0.299	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-51.7	148.5	-171.1	0	0	0	0	0	114.2	V106 R107	G88-V106 VanDerWaalsContact C-CG1 3.41Å; G88-R107 CarbonylContact C-O 3.51Å; G88-R107 WeakPolarHBondContact CA-O 3.47Å
89	E	76.8	Confident	64.8	Low	58 Å²	58	81.3 Å²	81.3	27%	0.271	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132.7	-177.9	-70.4	-175.7	131.7	0	0	110.6	R80 V91 V106 R107	R80-E89 IonicContact CZ-OE1 3.07Å; R80-E89 IonicContact NE-OE1 3.52Å; R80-E89 PolarHBondContact NE-OE1 3.47Å; R80-E89 IonicContact NH2-OE1 2.88Å; R80-E89 PolarHBondContact NH2-OE1 3.32Å; E89-V91 PolarHBondContact O-N 2.87Å; E89-V106 CarbonylContact O-C 3.57Å; E89-V106 WeakPolarHBondContact O-CA 3.11Å; E89-R107 PolarHBondContact N-O 3.01Å; E89-R107 PolarHBondContact O-N 3.26Å; E89-R107 IonicContact OE2-CZ 2.66Å; E89-R107 IonicContact OE2-NE 3.73Å; E89-R107 IonicContact OE2-NH2 2.8Å; E89-R107 PolarHBondContact OE2-NH2 3.42Å
90	V	74.8	Confident	63.2	Low	59 Å²	59	80.1 Å²	80.1	36%	0.358	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	116.8	176.5	-176.6	0	0	0	0	109.5	L5 K93 V105 V106	L5-V90 HydrophobicContact CD2-CG1 3.95Å; V90-K93 HydrophobicContact CG1-CB 4.47Å; V90-V105 WeakPolarHBondContact CA-O 3.48Å; V90-V106 HydrophobicContact CG2-CG2 4.34Å
91	V	79.7	Confident	62.1	Low	2 Å²	2	79.3 Å²	79.3	1%	0.012	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-26.5	-177.2	-64.5	0	0	0	0	112.9	A6 F32 D34 E89 V105 R107 Y118	A6-V91 PolarHBondContact N-O 2.99Å; A6-V91 VanDerWaalsContact N-O 3.16Å; F32-V91 HydrophobicContact CE2-CB 4.46Å; F32-V91 HydrophobicContact CE2-CG2 3.92Å; F32-V91 HydrophobicContact CZ-CG2 4.11Å; D34-V91 WeakPolarHBondContact OD2-CG1 3.34Å; E89-V91 PolarHBondContact O-N 2.87Å; V91-V105 HydrophobicContact CG2-CB 4Å; V91-V105 HydrophobicContact CG2-CG1 3.72Å; V91-V105 WeakPolarHBondContact CG2-O 3.37Å; V91-V105 PolarHBondContact N-O 2.81Å; V91-R107 HydrophobicContact CG1-CB 3.55Å; V91-R107 HydrophobicContact CG2-CB 4.47Å; V91-Y118 HydrophobicContact CG2-CD1 4.13Å; V91-Y118 HydrophobicContact CG2-CE1 4.17Å
92	F	77.5	Confident	61.2	Low	3 Å²	3	80.4 Å²	80.4	1%	0.013	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	139.5	178.5	172.9	-98.2	0	0	0	110.8	A6 A8 F32 K94 Q104 V105	A6-F92 WeakPolarHBondContact O-CD2 3.3Å; A8-F92 HydrophobicContact CB-CD2 4.21Å; A8-F92 HydrophobicContact CB-CE2 3.26Å; A8-F92 HydrophobicContact CB-CZ 3.61Å; F32-F92 HydrophobicContact CB-CD2 4.22Å; F32-F92 HydrophobicContact CD1-CB 4.02Å; F32-F92 HydrophobicContact CD1-CD1 4.35Å; F32-F92 AromaticContact CD1-CD2 3.74Å; F32-F92 HydrophobicContact CD1-CD2 3.74Å; F32-F92 HydrophobicContact CD1-CE2 4.23Å; F32-F92 AromaticContact CD1-CG 3.78Å; F32-F92 HydrophobicContact CD1-CG 3.78Å; F32-F92 HydrophobicContact CD2-CB 3.96Å; F32-F92 HydrophobicContact CD2-CD2 4.32Å; F32-F92 HydrophobicContact CD2-CG 4.44Å; F32-F92 HydrophobicContact CE1-CB 3.62Å; F32-F92 HydrophobicContact CE1-CD1 4.08Å; F32-F92 HydrophobicContact CE1-CD2 4.16Å; F32-F92 AromaticContact CE1-CG 3.7Å; F32-F92 HydrophobicContact CE1-CG 3.7Å; F32-F92 HydrophobicContact CE2-CB 3.58Å; F32-F92 HydrophobicContact CE2-CG 4.39Å; F32-F92 HydrophobicContact CG-CB 4.18Å; F32-F92 AromaticContact CG-CD2 3.82Å; F32-F92 HydrophobicContact CG-CD2 3.82Å; F32-F92 HydrophobicContact CG-CE2 4.48Å; F32-F92 HydrophobicContact CG-CG 4.16Å; F32-F92 HydrophobicContact CZ-CB 3.39Å; F32-F92 HydrophobicContact CZ-CG 4.03Å; F92-K94 HydrophobicContact CE1-CB 3.7Å; F92-K94 HydrophobicContact CE2-CB 3.87Å; F92-K94 HydrophobicContact CE2-CD 4.1Å; F92-K94 HydrophobicContact CZ-CB 3.26Å; F92-K94 HydrophobicContact CZ-CD 3.62Å; F92-K94 HydrophobicContact CZ-CG 4.1Å; F92-Q104 WeakPolarHBondContact O-CA 3.12Å; F92-V105 HydrophobicContact CB-CB 4.03Å; F92-V105 HydrophobicContact CB-CG2 4.17Å; F92-V105 HydrophobicContact CD1-CG2 3.9Å; F92-V105 HydrophobicContact CG-CG2 4.48Å; F92-V105 PolarHBondContact O-N 3.22Å
93	K	71.5	Confident	60.7	Low	90 Å²	90	76.2 Å²	76.2	39%	0.391	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	116.7	174.7	-175.9	170.8	-174.6	171	0	109	L5 V90 L103 Q104	L5-K93 HydrophobicContact CD1-CB 4.21Å; L5-K93 HydrophobicContact CD2-CB 3.97Å; V90-K93 HydrophobicContact CG1-CB 4.47Å; K93-L103 WeakPolarHBondContact CA-O 3.18Å; K93-Q104 HydrophobicContact CB-CG 4.41Å; K93-Q104 HydrophobicContact CD-CG 4.17Å; K93-Q104 HydrophobicContact CG-CG 3.98Å
94	K	65.6	Low	60.9	Low	56 Å²	56	70.8 Å²	70.8	24%	0.243	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.5	179.5	-168.7	168.1	-177.2	177.9	0	111.3	A8 E30 F92 S102 L103	A8-K94 HydrophobicContact CB-CD 4.48Å; A8-K94 PolarHBondContact O-NZ 3.38Å; E30-K94 IonicContact OE1-NZ 3.48Å; E30-K94 PolarHBondContact OE1-NZ 2.84Å; E30-K94 VanDerWaalsContact OE2-CD 3.26Å; E30-K94 WeakPolarHBondContact OE2-CD 3.4Å; E30-K94 WeakPolarHBondContact OE2-CE 3.31Å; E30-K94 IonicContact OE2-NZ 3.58Å; E30-K94 PolarHBondContact OE2-NZ 3.44Å; F92-K94 HydrophobicContact CE1-CB 3.7Å; F92-K94 HydrophobicContact CE2-CB 3.87Å; F92-K94 HydrophobicContact CE2-CD 4.1Å; F92-K94 HydrophobicContact CZ-CB 3.26Å; F92-K94 HydrophobicContact CZ-CD 3.62Å; F92-K94 HydrophobicContact CZ-CG 4.1Å; K94-S102 WeakPolarHBondContact O-CA 3.28Å; K94-L103 PolarHBondContact N-O 3.43Å; K94-L103 PolarHBondContact O-N 3.21Å
95	R	58.9	Low	61.6	Low	157 Å²	157	68.8 Å²	68.8	59%	0.592	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	122.5	174	-127.2	-168.5	-156.7	160	11.5	108.7	K101	R95-K101 CarbonylContact C-O 3.39Å; R95-K101 VanDerWaalsContact CA-O 3.3Å; R95-K101 WeakPolarHBondContact CA-O 3.25Å
96	T	53.7	Low	62.8	Low	47 Å²	47	61.4 Å²	61.4	29%	0.288	33%	0.326	S	S	.	.			trans	-92.7	-10.1	-171.5	-3.2	0	0	0	0	112.8	K101	T96-K101 VanDerWaalsContact CB-CB 3.47Å; T96-K101 PolarHBondContact N-O 2.81Å; T96-K101 WeakPolarHBondContact OG1-CB 3.05Å; T96-K101 PolarHBondContact OG1-O 2.89Å
97	S	44.8	Very low	64.4	Low	46 Å²	46	57.3 Å²	57.3	32%	0.322	29%	0.291	S	S	.	.	S	Bend	trans	-161.9	167.4	178.5	60.8	0	0	0	0	113.3	V99 F100 K101	S97-V99 PolarHBondContact O-N 3.36Å; S97-V99 VanDerWaalsContact O-N 3.14Å; S97-V99 PolarHBondContact OG-N 2.83Å; S97-V99 PolarHBondContact OG-O 2.95Å; S97-F100 PolarHBondContact O-N 3.2Å; S97-K101 PolarHBondContact OG-N 3.17Å
98	L	39.4	Very low	65.6	Low	179 Å²	179	53.4 Å²	53.4	94%	0.937	27%	0.272	S	S	*	.	S	Bend	trans	-57.9	-18.2	168.3	-121	89.1	0	0	0	112.2
99	V	36.9	Very low	66.4	Low	70 Å²	70	54.4 Å²	54.4	42%	0.424	27%	0.267	S	S	.	.	S	Bend	trans	-117.9	67.4	178.8	-170.4	0	0	0	0	108.6	S97 K101 E145	S97-V99 PolarHBondContact O-N 3.36Å; S97-V99 VanDerWaalsContact O-N 3.14Å; S97-V99 PolarHBondContact OG-N 2.83Å; S97-V99 PolarHBondContact OG-O 2.95Å; V99-K101 PolarHBondContact O-N 2.95Å; V99-E145 WeakPolarHBondContact CG1-OE1 3.32Å
100	F	42.2	Very low	66.8	Low	86 Å²	86	54 Å²	54	38%	0.377	27%	0.267	S	S	.	.			trans	43.2	25.9	155.9	-69.8	-100.9	0	0	0	122.1	S97 S102 E145	S97-F100 PolarHBondContact O-N 3.2Å; F100-S102 PolarHBondContact O-N 2.88Å; F100-E145 CarbonylContact C-O 3.53Å
101	K	50.9	Low	67.1	Low	70 Å²	70	54.5 Å²	54.5	30%	0.304	28%	0.277	S	S	.	.			trans	-62.2	125.5	160.3	-66.6	-172.1	176.6	-174.1	0	108.5	R95 T96 S97 V99 Q144	R95-K101 CarbonylContact C-O 3.39Å; R95-K101 VanDerWaalsContact CA-O 3.3Å; R95-K101 WeakPolarHBondContact CA-O 3.25Å; T96-K101 VanDerWaalsContact CB-CB 3.47Å; T96-K101 PolarHBondContact N-O 2.81Å; T96-K101 WeakPolarHBondContact OG1-CB 3.05Å; T96-K101 PolarHBondContact OG1-O 2.89Å; S97-K101 PolarHBondContact OG-N 3.17Å; V99-K101 PolarHBondContact O-N 2.95Å; K101-Q144 WeakPolarHBondContact CE-O 3.41Å
102	S	58.5	Low	67.2	Low	31 Å²	31	63.2 Å²	63.2	22%	0.217	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	109.8	171.7	79.8	0	0	0	0	111.3	K94 F100	K94-S102 WeakPolarHBondContact O-CA 3.28Å; F100-S102 PolarHBondContact O-N 2.88Å
103	L	68	Low	67.6	Low	16 Å²	16	71.6 Å²	71.6	8%	0.084	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	134.6	171	-175.7	69.9	0	0	0	109.2	V44 A65 K93 K94 A120	V44-L103 HydrophobicContact CG1-CD2 3.27Å; A65-L103 HydrophobicContact CB-CD1 3.4Å; A65-L103 VanDerWaalsContact CB-CD1 3.4Å; A65-L103 HydrophobicContact CB-CD2 3.63Å; A65-L103 HydrophobicContact CB-CG 4.17Å; K93-L103 WeakPolarHBondContact CA-O 3.18Å; K94-L103 PolarHBondContact N-O 3.43Å; K94-L103 PolarHBondContact O-N 3.21Å; L103-A120 HydrophobicContact CD1-CB 4.32Å
104	Q	75.7	Confident	68.2	Low	19 Å²	19	72.9 Å²	72.9	9%	0.089	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	141.8	175.9	-67.1	175.1	74.1	0	0	110.2	F92 K93 A120 Y121 D123	F92-Q104 WeakPolarHBondContact O-CA 3.12Å; K93-Q104 HydrophobicContact CB-CG 4.41Å; K93-Q104 HydrophobicContact CD-CG 4.17Å; K93-Q104 HydrophobicContact CG-CG 3.98Å; Q104-A120 CarbonylContact O-C 3.51Å; Q104-A120 WeakPolarHBondContact O-CA 3.42Å; Q104-Y121 PolarHBondContact N-O 3.37Å; Q104-Y121 PolarHBondContact O-N 3.49Å; Q104-D123 PolarHBondContact NE2-OD1 2.83Å
105	V	78.6	Confident	69.2	Low	0 Å²	0	72.2 Å²	72.2	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.9	169.2	179.4	0	0	0	0	108.7	F32 V44 I67 V90 V91 F92 Y118 L119	F32-V105 HydrophobicContact CE1-CG2 4.07Å; F32-V105 HydrophobicContact CZ-CB 4.04Å; F32-V105 HydrophobicContact CZ-CG1 4.05Å; F32-V105 HydrophobicContact CZ-CG2 4.06Å; V44-V105 HydrophobicContact CG2-CG2 4.19Å; I67-V105 HydrophobicContact CD1-CB 4.01Å; I67-V105 HydrophobicContact CD1-CG1 3.19Å; I67-V105 HydrophobicContact CD1-CG2 3.57Å; V90-V105 WeakPolarHBondContact CA-O 3.48Å; V91-V105 HydrophobicContact CG2-CB 4Å; V91-V105 HydrophobicContact CG2-CG1 3.72Å; V91-V105 WeakPolarHBondContact CG2-O 3.37Å; V91-V105 PolarHBondContact N-O 2.81Å; F92-V105 HydrophobicContact CB-CB 4.03Å; F92-V105 HydrophobicContact CB-CG2 4.17Å; F92-V105 HydrophobicContact CD1-CG2 3.9Å; F92-V105 HydrophobicContact CG-CG2 4.48Å; F92-V105 PolarHBondContact O-N 3.22Å; V105-Y118 HydrophobicContact CG1-CD1 4.12Å; V105-L119 CarbonylContact C-O 3.51Å; V105-L119 WeakPolarHBondContact CA-O 3.3Å
106	V	81.9	Confident	70.6	Confident	24 Å²	24	66.5 Å²	66.5	15%	0.145	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.3	179.5	-171.4	0	0	0	0	109.3	G88 E89 V90 F108 Y118 L119	G88-V106 VanDerWaalsContact C-CG1 3.41Å; E89-V106 CarbonylContact O-C 3.57Å; E89-V106 WeakPolarHBondContact O-CA 3.11Å; V90-V106 HydrophobicContact CG2-CG2 4.34Å; V106-F108 HydrophobicContact CB-CE2 3.87Å; V106-F108 HydrophobicContact CB-CZ 4.49Å; V106-F108 HydrophobicContact CG1-CD2 4.17Å; V106-F108 HydrophobicContact CG1-CE2 3.49Å; V106-F108 VanDerWaalsContact CG1-CE2 3.49Å; V106-F108 HydrophobicContact CG1-CZ 3.78Å; V106-Y118 WeakPolarHBondContact O-CA 3.5Å; V106-L119 PolarHBondContact N-O 3.49Å; V106-L119 PolarHBondContact O-N 2.84Å
107	R	89.1	Confident	72.2	Confident	6 Å²	6	66.5 Å²	66.5	2%	0.023	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	134.4	172.5	175.3	-175.7	63.7	-136.5	4.9	110.3	D34 D36 G88 E89 V91 L116 A117 Y118	D34-R107 IonicContact OD1-CZ 2.83Å; D34-R107 IonicContact OD1-NH1 2.67Å; D34-R107 PolarHBondContact OD1-NH1 2.84Å; D34-R107 VanDerWaalsContact OD2-CD 3.32Å; D34-R107 WeakPolarHBondContact OD2-CD 3.34Å; D34-R107 IonicContact OD2-CZ 2.88Å; D34-R107 IonicContact OD2-NE 3.09Å; D34-R107 IonicContact OD2-NH1 3.4Å; D34-R107 PolarHBondContact OD2-NH1 3.22Å; D36-R107 IonicContact OD2-CZ 2.74Å; D36-R107 IonicContact OD2-NH1 3.67Å; D36-R107 IonicContact OD2-NH2 3.66Å; D36-R107 PolarHBondContact OD2-NH2 3.11Å; G88-R107 CarbonylContact C-O 3.51Å; G88-R107 WeakPolarHBondContact CA-O 3.47Å; E89-R107 PolarHBondContact N-O 3.01Å; E89-R107 PolarHBondContact O-N 3.26Å; E89-R107 IonicContact OE2-CZ 2.66Å; E89-R107 IonicContact OE2-NE 3.73Å; E89-R107 IonicContact OE2-NH2 2.8Å; E89-R107 PolarHBondContact OE2-NH2 3.42Å; V91-R107 HydrophobicContact CG1-CB 3.55Å; V91-R107 HydrophobicContact CG2-CB 4.47Å; R107-L116 HydrophobicContact CG-CD2 4.07Å; R107-A117 CarbonylContact C-O 3.44Å; R107-A117 WeakPolarHBondContact CA-O 3.25Å; R107-Y118 HydrophobicContact CB-CD1 3.99Å; R107-Y118 HydrophobicContact CB-CE1 3.72Å; R107-Y118 HydrophobicContact CG-CD1 4.41Å; R107-Y118 HydrophobicContact CG-CE1 3.82Å
108	F	85.6	Confident	74.2	Confident	73 Å²	73	65.9 Å²	65.9	32%	0.32	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	143.3	169.3	-64.1	-97.7	0	0	0	109.3	V106 L116 A117 L119	V106-F108 HydrophobicContact CB-CE2 3.87Å; V106-F108 HydrophobicContact CB-CZ 4.49Å; V106-F108 HydrophobicContact CG1-CD2 4.17Å; V106-F108 HydrophobicContact CG1-CE2 3.49Å; V106-F108 VanDerWaalsContact CG1-CE2 3.49Å; V106-F108 HydrophobicContact CG1-CZ 3.78Å; F108-L116 CarbonylContact O-C 3.56Å; F108-L116 WeakPolarHBondContact O-CA 3.49Å; F108-A117 HydrophobicContact CB-CB 4.29Å; F108-A117 PolarHBondContact N-O 2.91Å; F108-A117 PolarHBondContact O-N 3.13Å; F108-L119 HydrophobicContact CD2-CD1 3.86Å; F108-L119 HydrophobicContact CE2-CB 4.45Å; F108-L119 HydrophobicContact CE2-CD1 3.59Å; F108-L119 HydrophobicContact CZ-CD1 4.43Å
109	Y	85.1	Confident	76.2	Confident	51 Å²	51	62 Å²	62	20%	0.2	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	112.9	171.5	176.9	-118.8	0	0	0	109.4	L77 I81 A111 N114 L116	L77-Y109 HydrophobicContact CD1-CD2 4.1Å; L77-Y109 HydrophobicContact CD1-CE2 3.39Å; I81-Y109 HydrophobicContact CG2-CD1 4.23Å; I81-Y109 HydrophobicContact CG2-CD2 4.47Å; I81-Y109 HydrophobicContact CG2-CG 3.92Å; Y109-A111 HydrophobicContact CD1-CB 4.34Å; Y109-A111 HydrophobicContact CE1-CB 3.82Å; Y109-A111 PolarHBondContact O-N 2.84Å; Y109-N114 PolarHBondContact OH-OD1 3.05Å; Y109-L116 HydrophobicContact CD2-CD2 3.87Å; Y109-L116 HydrophobicContact CD2-CG 4.48Å; Y109-L116 HydrophobicContact CG-CD2 4.41Å
110	D	84.2	Confident	78	Confident	49 Å²	49	60.1 Å²	60.1	26%	0.262	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	93.9	171.6	-179	-6.3	0	0	0	109	K112 R113 N114 A115	D110-K112 PolarHBondContact O-N 3.48Å; D110-K112 WeakPolarHBondContact OD1-CB 3.38Å; D110-K112 PolarHBondContact OD1-N 2.83Å; D110-R113 PolarHBondContact O-N 3.18Å; D110-R113 PolarHBondContact OD1-N 2.86Å; D110-R113 VanDerWaalsContact OD2-CD 3.24Å; D110-R113 WeakPolarHBondContact OD2-CD 3.23Å; D110-R113 VanDerWaalsContact OD2-CG 3.3Å; D110-R113 WeakPolarHBondContact OD2-CG 3.35Å; D110-R113 IonicContact OD2-CZ 2.66Å; D110-R113 IonicContact OD2-NE 2.82Å; D110-R113 IonicContact OD2-NH1 3.51Å; D110-R113 PolarHBondContact OD2-NH1 2.73Å; D110-N114 WeakPolarHBondContact O-CA 3.29Å; D110-N114 PolarHBondContact O-N 3.07Å; D110-A115 PolarHBondContact N-O 2.85Å; D110-A115 PolarHBondContact O-N 2.83Å; D110-A115 VanDerWaalsContact O-N 3.11Å
111	A	80.7	Confident	79.2	Confident	70 Å²	70	59.8 Å²	59.8	58%	0.579	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-30.6	179.1	0	0	0	0	0	113.2	Y109	Y109-A111 HydrophobicContact CD1-CB 4.34Å; Y109-A111 HydrophobicContact CE1-CB 3.82Å; Y109-A111 PolarHBondContact O-N 2.84Å
112	K	82.9	Confident	80	Confident	185 Å²	185	57.8 Å²	57.8	80%	0.804	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-38.4	-178.5	-177.8	-179.7	179	178.3	0	111.5	D110	D110-K112 PolarHBondContact O-N 3.48Å; D110-K112 WeakPolarHBondContact OD1-CB 3.38Å; D110-K112 PolarHBondContact OD1-N 2.83Å
113	R	86.4	Confident	80.4	Confident	178 Å²	178	57.1 Å²	57.1	67%	0.672	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-1.6	179.8	-62.7	-178.1	-177.9	82.5	-5	113.1	D110 A115	D110-R113 PolarHBondContact O-N 3.18Å; D110-R113 PolarHBondContact OD1-N 2.86Å; D110-R113 VanDerWaalsContact OD2-CD 3.24Å; D110-R113 WeakPolarHBondContact OD2-CD 3.23Å; D110-R113 VanDerWaalsContact OD2-CG 3.3Å; D110-R113 WeakPolarHBondContact OD2-CG 3.35Å; D110-R113 IonicContact OD2-CZ 2.66Å; D110-R113 IonicContact OD2-NE 2.82Å; D110-R113 IonicContact OD2-NH1 3.51Å; D110-R113 PolarHBondContact OD2-NH1 2.73Å; R113-A115 HydrophobicContact CB-CB 4.09Å; R113-A115 PolarHBondContact O-N 2.86Å
114	N	83.8	Confident	80.7	Confident	117 Å²	117	57.4 Å²	57.4	63%	0.626	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	45.3	-171.8	-167.2	37.9	0	0	0	111.7	Y109 D110	Y109-N114 PolarHBondContact OH-OD1 3.05Å; D110-N114 WeakPolarHBondContact O-CA 3.29Å; D110-N114 PolarHBondContact O-N 3.07Å
115	A	86.4	Confident	80.8	Confident	42 Å²	42	56.5 Å²	56.5	35%	0.347	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.3	-171.4	0	0	0	0	0	111.4	D110 R113	D110-A115 PolarHBondContact N-O 2.85Å; D110-A115 PolarHBondContact O-N 2.83Å; D110-A115 VanDerWaalsContact O-N 3.11Å; R113-A115 HydrophobicContact CB-CB 4.09Å; R113-A115 PolarHBondContact O-N 2.86Å
116	L	87.6	Confident	80.9	Confident	38 Å²	38	56.7 Å²	56.7	20%	0.199	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	127.6	169.6	-68.2	168	0	0	0	109.1	V37 V40 I75 L77 R107 F108 Y109 Y118	V37-L116 HydrophobicContact CB-CD1 4.32Å; V37-L116 HydrophobicContact CG1-CD1 3.6Å; V37-L116 HydrophobicContact CG2-CD1 3.97Å; V40-L116 HydrophobicContact CG2-CD1 4.36Å; I75-L116 HydrophobicContact CG2-CD1 4.3Å; L77-L116 HydrophobicContact CD2-CD1 4.01Å; L77-L116 HydrophobicContact CD2-CD2 4.06Å; L77-L116 HydrophobicContact CD2-CG 4.31Å; R107-L116 HydrophobicContact CG-CD2 4.07Å; F108-L116 CarbonylContact O-C 3.56Å; F108-L116 WeakPolarHBondContact O-CA 3.49Å; Y109-L116 HydrophobicContact CD2-CD2 3.87Å; Y109-L116 HydrophobicContact CD2-CG 4.48Å; Y109-L116 HydrophobicContact CG-CD2 4.41Å; L116-Y118 HydrophobicContact CB-CE2 3.75Å
117	A	86.8	Confident	80.9	Confident	47 Å²	47	55.6 Å²	55.6	39%	0.388	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.6	174.8	0	0	0	0	0	109.7	R107 F108	R107-A117 CarbonylContact C-O 3.44Å; R107-A117 WeakPolarHBondContact CA-O 3.25Å; F108-A117 HydrophobicContact CB-CB 4.29Å; F108-A117 PolarHBondContact N-O 2.91Å; F108-A117 PolarHBondContact O-N 3.13Å
118	Y	88	Confident	80.4	Confident	32 Å²	32	55.3 Å²	55.3	13%	0.125	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	130.5	179.1	-64.8	-95.2	0	0	0	109.4	D34 V40 C69 V91 V105 V106 R107 L116	D34-Y118 VanDerWaalsContact OD2-CE1 3.3Å; D34-Y118 WeakPolarHBondContact OD2-CE1 3.07Å; D34-Y118 PolarHBondContact OD2-OH 3.48Å; V40-Y118 HydrophobicContact CG1-CE2 3.91Å; V40-Y118 WeakPolarHBondContact CG1-OH 3.41Å; C69-Y118 HydrophobicContact CB-CD2 3.67Å; C69-Y118 HydrophobicContact CB-CE2 4.07Å; C69-Y118 HydrophobicContact CB-CG 4.1Å; C69-Y118 WeakPolarHBondContact SG-CB 3.28Å; C69-Y118 VanDerWaalsContact SG-CD2 3.56Å; V91-Y118 HydrophobicContact CG2-CD1 4.13Å; V91-Y118 HydrophobicContact CG2-CE1 4.17Å; V105-Y118 HydrophobicContact CG1-CD1 4.12Å; V106-Y118 WeakPolarHBondContact O-CA 3.5Å; R107-Y118 HydrophobicContact CB-CD1 3.99Å; R107-Y118 HydrophobicContact CB-CE1 3.72Å; R107-Y118 HydrophobicContact CG-CD1 4.41Å; R107-Y118 HydrophobicContact CG-CE1 3.82Å; L116-Y118 HydrophobicContact CB-CE2 3.75Å
119	L	80.9	Confident	80.2	Confident	98 Å²	98	51.9 Å²	51.9	51%	0.513	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	129.1	-177.8	-76.3	151.6	0	0	0	109.4	V105 V106 F108	V105-L119 CarbonylContact C-O 3.51Å; V105-L119 WeakPolarHBondContact CA-O 3.3Å; V106-L119 PolarHBondContact N-O 3.49Å; V106-L119 PolarHBondContact O-N 2.84Å; F108-L119 HydrophobicContact CD2-CD1 3.86Å; F108-L119 HydrophobicContact CE2-CB 4.45Å; F108-L119 HydrophobicContact CE2-CD1 3.59Å; F108-L119 HydrophobicContact CZ-CD1 4.43Å
120	A	75.3	Confident	80.1	Confident	31 Å²	31	52.9 Å²	52.9	26%	0.256	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	133.2	168.1	0	0	0	0	0	109	I67 L103 Q104	I67-A120 HydrophobicContact CB-CB 4.24Å; I67-A120 HydrophobicContact CG2-CB 3.95Å; L103-A120 HydrophobicContact CD1-CB 4.32Å; Q104-A120 CarbonylContact O-C 3.51Å; Q104-A120 WeakPolarHBondContact O-CA 3.42Å
121	Y	67.9	Low	80	Confident	79 Å²	79	55.8 Å²	55.8	31%	0.31	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	145.1	-177.7	-172.7	-100.6	0	0	0	111.7	Q104 K124 D168	Q104-Y121 PolarHBondContact N-O 3.37Å; Q104-Y121 PolarHBondContact O-N 3.49Å; Y121-K124 WeakPolarHBondContact OH-CB 3.32Å; Y121-D168 WeakPolarHBondContact CE1-OD2 3.2Å; Y121-D168 PolarHBondContact OH-OD2 2.91Å
122	S	67	Low	79.7	Confident	28 Å²	28	58 Å²	58	20%	0.196	29%	0.29	C	S	.	.			trans	-122.9	141.1	171.9	-63.8	0	0	0	0	108.2	K124	S122-K124 PolarHBondContact O-N 2.92Å
123	D	67.3	Low	79.1	Confident	16 Å²	16	51.3 Å²	51.3	9%	0.086	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-59.9	126.9	-175.7	-63.3	-24.7	0	0	0	110.2	Q104 F147 A148 D168 L238 K242	Q104-D123 PolarHBondContact NE2-OD1 2.83Å; D123-F147 HydrophobicContact CB-CD1 3.87Å; D123-F147 HydrophobicContact CB-CE1 4.06Å; D123-F147 WeakPolarHBondContact O-CA 3.44Å; D123-A148 PolarHBondContact O-N 3.2Å; D123-D168 VanDerWaalsContact CA-OD2 3.26Å; D123-D168 WeakPolarHBondContact CA-OD2 3.48Å; D123-L238 HydrophobicContact CB-CD1 4.19Å; D123-K242 IonicContact OD1-NZ 2.72Å; D123-K242 PolarHBondContact OD1-NZ 3.49Å; D123-K242 IonicContact OD2-NZ 2.92Å; D123-K242 PolarHBondContact OD2-NZ 2.94Å
124	K	73.3	Confident	78.6	Confident	23 Å²	23	44.4 Å²	44.4	10%	0.1	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	119	-176	-170.9	-178.8	-178.5	-174.2	0	111	Y121 S122 A148 E150 D168 V169	Y121-K124 WeakPolarHBondContact OH-CB 3.32Å; S122-K124 PolarHBondContact O-N 2.92Å; K124-A148 CarbonylContact C-O 3.23Å; K124-A148 VanDerWaalsContact CA-O 3.3Å; K124-A148 WeakPolarHBondContact CA-O 3.3Å; K124-E150 WeakPolarHBondContact CE-OE2 3.43Å; K124-E150 IonicContact NZ-OE2 2.72Å; K124-E150 PolarHBondContact NZ-OE2 3.14Å; K124-D168 PolarHBondContact N-OD2 2.84Å; K124-D168 PolarHBondContact O-N 2.79Å; K124-V169 PolarHBondContact O-N 2.79Å
125	V	79.2	Confident	78.2	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	128.7	174.3	-179.2	0	0	0	0	108.2	L142 F147 A148 V149 E150 V169 I171 V234	V125-L142 HydrophobicContact CG1-CD1 3.85Å; V125-F147 HydrophobicContact CB-CB 4.42Å; V125-F147 HydrophobicContact CG2-CB 3.62Å; V125-F147 HydrophobicContact CG2-CD1 3.67Å; V125-F147 HydrophobicContact CG2-CD2 4.33Å; V125-F147 HydrophobicContact CG2-CE1 4.49Å; V125-F147 HydrophobicContact CG2-CG 3.6Å; V125-A148 PolarHBondContact N-O 3.44Å; V125-V149 HydrophobicContact CB-CG2 4.48Å; V125-V149 VanDerWaalsContact O-CA 3.29Å; V125-V149 WeakPolarHBondContact O-CA 3.26Å; V125-E150 PolarHBondContact O-N 2.85Å; V125-V169 HydrophobicContact CB-CG1 4Å; V125-V169 HydrophobicContact CG1-CG1 3.64Å; V125-V169 HydrophobicContact CG2-CG1 3.69Å; V125-I171 HydrophobicContact CG1-CD1 3.74Å; V125-I171 HydrophobicContact CG1-CG1 4.05Å; V125-V234 HydrophobicContact CG2-CG1 4.3Å
126	V	79.7	Confident	77.5	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.024	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130.1	168.8	175.1	0	0	0	0	108.2	V128 E150 F152 V158 P167 V169 M170 I171	V126-V128 HydrophobicContact CG1-CG2 4.37Å; V126-E150 WeakPolarHBondContact CA-O 3.36Å; V126-E150 HydrophobicContact CG2-CB 4.29Å; V126-F152 HydrophobicContact CG1-CD2 3.74Å; V126-F152 HydrophobicContact CG1-CE2 3.78Å; V126-V158 HydrophobicContact CG1-CG1 4.23Å; V126-P167 HydrophobicContact CB-CB 4.06Å; V126-P167 HydrophobicContact CB-CG 4.21Å; V126-P167 HydrophobicContact CG2-CB 3.56Å; V126-P167 HydrophobicContact CG2-CG 3.97Å; V126-V169 PolarHBondContact N-O 3.14Å; V126-V169 VanDerWaalsContact N-O 3.13Å; V126-M170 HydrophobicContact CB-CE 3.86Å; V126-M170 HydrophobicContact CB-SD 3.63Å; V126-M170 HydrophobicContact CG1-CE 3.78Å; V126-M170 HydrophobicContact CG1-SD 3.5Å; V126-M170 WeakPolarHBondContact CG1-SD 3.48Å; V126-I171 PolarHBondContact O-N 2.78Å
127	E	81.4	Confident	76.7	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136.9	177.2	178.5	175.6	-171.9	0	0	109.8	E129 A135 L138 E150 V151 F152 I171	E127-E129 HydrophobicContact CG-CB 4.27Å; E127-A135 WeakPolarHBondContact OE1-CA 3.43Å; E127-L138 VanDerWaalsContact CD-CD2 3.48Å; E127-L138 HydrophobicContact CG-CD2 4.31Å; E127-L138 WeakPolarHBondContact OE1-CB 3.14Å; E127-L138 WeakPolarHBondContact OE1-CD2 3.3Å; E127-E150 PolarHBondContact N-O 3.01Å; E127-V151 CarbonylContact O-C 3.49Å; E127-V151 WeakPolarHBondContact O-CA 3.48Å; E127-F152 PolarHBondContact O-N 2.68Å; E127-I171 WeakPolarHBondContact CA-O 3.44Å
128	V	79.4	Confident	76.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	106.8	176.4	-162.9	0	0	0	0	108.6	V126 F152 V158 M170 I171 L172 D173 L176 L184	V126-V128 HydrophobicContact CG1-CG2 4.37Å; V128-F152 VanDerWaalsContact CA-O 3.28Å; V128-F152 WeakPolarHBondContact CA-O 3.49Å; V128-F152 HydrophobicContact CG1-CB 4.25Å; V128-F152 WeakPolarHBondContact CG1-O 3.23Å; V128-F152 HydrophobicContact CG2-CB 4.48Å; V128-V158 HydrophobicContact CG1-CG2 4.15Å; V128-V158 HydrophobicContact CG2-CG1 4.29Å; V128-V158 HydrophobicContact CG2-CG2 3.56Å; V128-M170 HydrophobicContact CG2-SD 4Å; V128-I171 PolarHBondContact N-O 2.89Å; V128-L172 HydrophobicContact CB-CD2 3.85Å; V128-L172 HydrophobicContact CG2-CD2 3.52Å; V128-D173 PolarHBondContact O-N 3.17Å; V128-L176 HydrophobicContact CB-CD1 4.27Å; V128-L176 HydrophobicContact CG1-CD1 3.53Å; V128-L176 HydrophobicContact CG1-CD2 3.75Å; V128-L176 HydrophobicContact CG1-CG 4.29Å; V128-L184 HydrophobicContact CG1-CD2 4.41Å
129	E	81.1	Confident	75.8	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	23%	0.227	C	C	.	.			trans	-150.9	127	-170.9	175.5	65.4	-120.5	0	0	108	E127 E131 I134 A135 F152 E153 K223	E127-E129 HydrophobicContact CG-CB 4.27Å; E129-E131 WeakPolarHBondContact OE1-CB 3.49Å; E129-E131 PolarHBondContact OE1-N 3.31Å; E129-I134 HydrophobicContact CG-CB 4.02Å; E129-I134 HydrophobicContact CG-CG2 4.04Å; E129-A135 HydrophobicContact CB-CB 4.19Å; E129-A135 HydrophobicContact CG-CB 4.1Å; E129-F152 PolarHBondContact N-O 2.81Å; E129-F152 VanDerWaalsContact N-O 3.1Å; E129-E153 WeakPolarHBondContact O-CA 3.34Å; E129-K223 IonicContact OE1-NZ 3.63Å; E129-K223 PolarHBondContact OE1-NZ 3.27Å; E129-K223 WeakPolarHBondContact OE2-CE 3.48Å; E129-K223 IonicContact OE2-NZ 3.87Å; E129-K223 PolarHBondContact OE2-NZ 2.93Å
130	D	82.5	Confident	75.1	Confident	72 Å²	72	40.6 Å²	40.6	39%	0.385	22%	0.218	S	C	.	.	S	Bend	trans	-84	-23.7	-179	69.1	-44.5	0	0	0	112.2	Q132 P177	D130-Q132 PolarHBondContact O-N 3.38Å; D130-P177 HydrophobicContact CB-CG 4.3Å
131	E	82	Confident	74.9	Confident	110 Å²	110	41.2 Å²	41.2	51%	0.514	22%	0.217	S	C	.	.			trans	-85.4	97.7	175.5	-164.8	178.3	162.1	0	0	111.8	E129 G133 I134 A135	E129-E131 WeakPolarHBondContact OE1-CB 3.49Å; E129-E131 PolarHBondContact OE1-N 3.31Å; E131-G133 PolarHBondContact O-N 3.47Å; E131-I134 HydrophobicContact CB-CB 4.4Å; E131-I134 HydrophobicContact CB-CD1 4.12Å; E131-I134 HydrophobicContact CB-CG1 4.21Å; E131-I134 HydrophobicContact CG-CD1 4.26Å; E131-I134 HydrophobicContact CG-CG1 4.12Å; E131-I134 PolarHBondContact O-N 3.44Å; E131-I134 WeakPolarHBondContact OE2-CD1 3.42Å; E131-A135 PolarHBondContact O-N 2.78Å; E131-A135 VanDerWaalsContact O-N 3.13Å
132	Q	74	Confident	75.4	Confident	117 Å²	117	37.5 Å²	37.5	55%	0.547	20%	0.202	S	C	.	.	H	α-helix	trans	-49.7	-37.3	-178.8	-76.8	-174.4	-15.7	0	0	114.2	D130 I134 A135 D136 E153	D130-Q132 PolarHBondContact O-N 3.38Å; Q132-I134 VanDerWaalsContact C-N 3.33Å; Q132-I134 PolarHBondContact O-N 3.04Å; Q132-A135 PolarHBondContact O-N 3.28Å; Q132-D136 WeakPolarHBondContact O-CB 3.26Å; Q132-D136 VanDerWaalsContact O-CG 3.31Å; Q132-D136 PolarHBondContact O-N 2.64Å; Q132-E153 PolarHBondContact NE2-OE1 3.11Å
133	G	70.5	Confident	75.6	Confident	44 Å²	44	40.6 Å²	40.6	45%	0.454	21%	0.213	S	C	.	.	H	α-helix	trans	-65.4	-33.8	179.7	0	0	0	0	0	113.9	E131 T137	E131-G133 PolarHBondContact O-N 3.47Å; G133-T137 PolarHBondContact O-N 3.12Å; G133-T137 PolarHBondContact O-OG1 2.83Å
134	I	77.2	Confident	75.3	Confident	33 Å²	33	41.4 Å²	41.4	17%	0.169	22%	0.217	C	C	.	.	H	α-helix	trans	-72.3	-47.1	173.9	-64	-178.6	0	0	0	109.3	E129 E131 Q132 T137 L138 K223 F225	E129-I134 HydrophobicContact CG-CB 4.02Å; E129-I134 HydrophobicContact CG-CG2 4.04Å; E131-I134 HydrophobicContact CB-CB 4.4Å; E131-I134 HydrophobicContact CB-CD1 4.12Å; E131-I134 HydrophobicContact CB-CG1 4.21Å; E131-I134 HydrophobicContact CG-CD1 4.26Å; E131-I134 HydrophobicContact CG-CG1 4.12Å; E131-I134 PolarHBondContact O-N 3.44Å; E131-I134 WeakPolarHBondContact OE2-CD1 3.42Å; Q132-I134 VanDerWaalsContact C-N 3.33Å; Q132-I134 PolarHBondContact O-N 3.04Å; I134-T137 PolarHBondContact O-N 2.72Å; I134-L138 PolarHBondContact O-N 2.87Å; I134-K223 HydrophobicContact CD1-CD 4.22Å; I134-F225 HydrophobicContact CG2-CE2 4.27Å; I134-F225 HydrophobicContact CG2-CZ 3.6Å
135	A	75	Confident	74.8	Confident	4 Å²	4	41.5 Å²	41.5	3%	0.033	22%	0.217	C	C	.	.	H	α-helix	trans	-57.9	-51.8	179.8	0	0	0	0	0	112	E127 E129 E131 Q132 T137 L138 V139 V151	E127-A135 WeakPolarHBondContact OE1-CA 3.43Å; E129-A135 HydrophobicContact CB-CB 4.19Å; E129-A135 HydrophobicContact CG-CB 4.1Å; E131-A135 PolarHBondContact O-N 2.78Å; E131-A135 VanDerWaalsContact O-N 3.13Å; Q132-A135 PolarHBondContact O-N 3.28Å; A135-T137 VanDerWaalsContact C-N 3.25Å; A135-T137 PolarHBondContact O-N 2.86Å; A135-L138 PolarHBondContact O-N 2.96Å; A135-V139 WeakPolarHBondContact O-CB 3.47Å; A135-V139 WeakPolarHBondContact O-CG2 3.21Å; A135-V139 PolarHBondContact O-N 2.98Å; A135-V151 HydrophobicContact CB-CG1 4.06Å
136	D	71.8	Confident	73.9	Confident	111 Å²	111	42.5 Å²	42.5	59%	0.594	23%	0.228	S	C	*	.	H	α-helix	trans	-56.5	-41.6	179.7	-75.3	-17.9	0	0	0	112	Q132 Y140	Q132-D136 WeakPolarHBondContact O-CB 3.26Å; Q132-D136 VanDerWaalsContact O-CG 3.31Å; Q132-D136 PolarHBondContact O-N 2.64Å; D136-Y140 VanDerWaalsContact O-CB 3.28Å; D136-Y140 WeakPolarHBondContact O-CB 3.12Å; D136-Y140 PolarHBondContact O-N 2.82Å
137	T	70.6	Confident	73.6	Confident	73 Å²	73	43.1 Å²	43.1	45%	0.448	23%	0.23	S	C	.	.	H	α-helix	trans	-65.9	-41.1	178.8	-57.7	0	0	0	0	111.4	G133 I134 A135 M141 P227	G133-T137 PolarHBondContact O-N 3.12Å; G133-T137 PolarHBondContact O-OG1 2.83Å; I134-T137 PolarHBondContact O-N 2.72Å; A135-T137 VanDerWaalsContact C-N 3.25Å; A135-T137 PolarHBondContact O-N 2.86Å; T137-M141 PolarHBondContact O-N 3.02Å; T137-P227 HydrophobicContact CG2-CB 4.44Å; T137-P227 HydrophobicContact CG2-CG 3.58Å
138	L	79.1	Confident	73.3	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-75.1	-43.6	-178.4	-169.7	65	0	0	0	111.8	E127 I134 A135 Y140 M141 L142 I171 V230	E127-L138 VanDerWaalsContact CD-CD2 3.48Å; E127-L138 HydrophobicContact CG-CD2 4.31Å; E127-L138 WeakPolarHBondContact OE1-CB 3.14Å; E127-L138 WeakPolarHBondContact OE1-CD2 3.3Å; I134-L138 PolarHBondContact O-N 2.87Å; A135-L138 PolarHBondContact O-N 2.96Å; L138-Y140 VanDerWaalsContact C-N 3.31Å; L138-Y140 PolarHBondContact O-N 2.6Å; L138-M141 PolarHBondContact O-N 2.54Å; L138-M141 VanDerWaalsContact O-N 3.16Å; L138-L142 HydrophobicContact CD1-CD1 4.35Å; L138-L142 HydrophobicContact CD1-CG 4.34Å; L138-L142 HydrophobicContact CD2-CD1 4.13Å; L138-L142 HydrophobicContact CG-CD1 3.73Å; L138-L142 HydrophobicContact CG-CG 4.18Å; L138-L142 WeakPolarHBondContact O-CB 3.43Å; L138-L142 WeakPolarHBondContact O-CG 3.38Å; L138-L142 PolarHBondContact O-N 2.87Å; L138-I171 HydrophobicContact CD2-CD1 3.79Å; L138-I171 HydrophobicContact CD2-CG2 4.14Å; L138-V230 HydrophobicContact CD1-CB 3.65Å; L138-V230 HydrophobicContact CD1-CG1 3.52Å; L138-V230 HydrophobicContact CD1-CG2 4.17Å; L138-V230 HydrophobicContact CD2-CG1 3.9Å; L138-V230 HydrophobicContact CG-CG1 4.36Å
139	V	75.9	Confident	73.4	Confident	22 Å²	22	46 Å²	46	13%	0.133	25%	0.251	C	S	.	.	H	α-helix	trans	-51.2	-52.3	171.9	170.8	0	0	0	0	110.3	A135 M141 L142 Q143 V149 V151	A135-V139 WeakPolarHBondContact O-CB 3.47Å; A135-V139 WeakPolarHBondContact O-CG2 3.21Å; A135-V139 PolarHBondContact O-N 2.98Å; V139-M141 VanDerWaalsContact C-N 3.31Å; V139-M141 PolarHBondContact O-N 3.34Å; V139-L142 PolarHBondContact O-N 3.35Å; V139-Q143 HydrophobicContact CG1-CG 4.18Å; V139-Q143 VanDerWaalsContact O-CB 3.28Å; V139-Q143 WeakPolarHBondContact O-CB 3.26Å; V139-Q143 VanDerWaalsContact O-CG 3.25Å; V139-Q143 WeakPolarHBondContact O-CG 3.38Å; V139-Q143 PolarHBondContact O-N 2.89Å; V139-V149 HydrophobicContact CG2-CG1 4.01Å; V139-V151 HydrophobicContact CG2-CG2 3.18Å
140	Y	67.3	Low	73.8	Confident	84 Å²	84	48.3 Å²	48.3	33%	0.329	26%	0.262	S	S	.	.	H	α-helix	trans	-54.9	-48.1	179.4	-178.7	-101.2	0	0	0	111.6	L58 D136 L138 Q144	L58-Y140 HydrophobicContact CD2-CE1 4.19Å; L58-Y140 WeakPolarHBondContact CD2-OH 3.36Å; D136-Y140 VanDerWaalsContact O-CB 3.28Å; D136-Y140 WeakPolarHBondContact O-CB 3.12Å; D136-Y140 PolarHBondContact O-N 2.82Å; L138-Y140 VanDerWaalsContact C-N 3.31Å; L138-Y140 PolarHBondContact O-N 2.6Å; Y140-Q144 HydrophobicContact CE1-CG 4.45Å; Y140-Q144 WeakPolarHBondContact O-CB 3.37Å; Y140-Q144 WeakPolarHBondContact O-CG 3.3Å; Y140-Q144 PolarHBondContact O-N 3.05Å; Y140-Q144 PolarHBondContact OH-NE2 3.49Å
141	M	71.2	Confident	74	Confident	44 Å²	44	47.7 Å²	47.7	22%	0.217	26%	0.261	C	S	.	.	H	α-helix	trans	-71.5	-38	-178.5	-72.7	-61.4	-83	0	0	113.5	T137 L138 V139 Q144 E145 P227 R228	T137-M141 PolarHBondContact O-N 3.02Å; L138-M141 PolarHBondContact O-N 2.54Å; L138-M141 VanDerWaalsContact O-N 3.16Å; V139-M141 VanDerWaalsContact C-N 3.31Å; V139-M141 PolarHBondContact O-N 3.34Å; M141-Q144 PolarHBondContact O-N 3.43Å; M141-E145 WeakPolarHBondContact O-CG 3.07Å; M141-E145 PolarHBondContact O-N 3.26Å; M141-E145 VanDerWaalsContact O-N 3.12Å; M141-P227 HydrophobicContact CB-CB 4.16Å; M141-P227 HydrophobicContact CG-CB 3.77Å; M141-R228 HydrophobicContact CE-CG 3.79Å
142	L	77.5	Confident	74.4	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-68.1	-42	176.6	-74.1	170.4	0	0	0	111.6	V125 L138 V139 Q144 E145 G146 F147 V149 I171 V234	V125-L142 HydrophobicContact CG1-CD1 3.85Å; L138-L142 HydrophobicContact CD1-CD1 4.35Å; L138-L142 HydrophobicContact CD1-CG 4.34Å; L138-L142 HydrophobicContact CD2-CD1 4.13Å; L138-L142 HydrophobicContact CG-CD1 3.73Å; L138-L142 HydrophobicContact CG-CG 4.18Å; L138-L142 WeakPolarHBondContact O-CB 3.43Å; L138-L142 WeakPolarHBondContact O-CG 3.38Å; L138-L142 PolarHBondContact O-N 2.87Å; V139-L142 PolarHBondContact O-N 3.35Å; L142-Q144 VanDerWaalsContact C-N 3.31Å; L142-Q144 PolarHBondContact O-N 3.1Å; L142-E145 PolarHBondContact O-N 2.86Å; L142-G146 PolarHBondContact O-N 2.87Å; L142-F147 HydrophobicContact CB-CB 4.39Å; L142-F147 HydrophobicContact CB-CD2 4.24Å; L142-F147 HydrophobicContact CD2-CD2 3.76Å; L142-F147 HydrophobicContact CD2-CE2 4.2Å; L142-F147 WeakPolarHBondContact O-CB 3.3Å; L142-F147 VanDerWaalsContact O-CD2 3.3Å; L142-F147 WeakPolarHBondContact O-CD2 3.46Å; L142-F147 PolarHBondContact O-N 3.01Å; L142-F147 VanDerWaalsContact O-N 3.08Å; L142-V149 HydrophobicContact CB-CG2 3.48Å; L142-V149 VanDerWaalsContact CB-CG2 3.48Å; L142-V149 HydrophobicContact CD1-CG1 4.33Å; L142-V149 HydrophobicContact CD1-CG2 4.17Å; L142-V149 HydrophobicContact CG-CG2 4.49Å; L142-I171 HydrophobicContact CD1-CD1 3.78Å; L142-V234 HydrophobicContact CD2-CG1 4.43Å; L142-V234 HydrophobicContact CD2-CG2 4.38Å
143	Q	72.1	Confident	74.9	Confident	94 Å²	94	43.3 Å²	43.3	44%	0.439	24%	0.24	S	C	.	.	H	α-helix	trans	-63.7	-37.7	173.9	-72.5	177.8	-16	0	0	111.4	V139 E145 G146 V149	V139-Q143 HydrophobicContact CG1-CG 4.18Å; V139-Q143 VanDerWaalsContact O-CB 3.28Å; V139-Q143 WeakPolarHBondContact O-CB 3.26Å; V139-Q143 VanDerWaalsContact O-CG 3.25Å; V139-Q143 WeakPolarHBondContact O-CG 3.38Å; V139-Q143 PolarHBondContact O-N 2.89Å; Q143-E145 VanDerWaalsContact C-N 3.3Å; Q143-E145 PolarHBondContact O-N 3.02Å; Q143-G146 WeakPolarHBondContact O-CA 3.44Å; Q143-G146 PolarHBondContact O-N 2.92Å; Q143-V149 HydrophobicContact CG-CB 4.33Å; Q143-V149 HydrophobicContact CG-CG2 3.89Å
144	Q	61.1	Low	75.7	Confident	33 Å²	33	48.4 Å²	48.4	15%	0.154	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-36.5	172.6	-81.7	-163.3	1.9	0	0	113.4	G57 K101 Y140 M141 L142 G146	G57-Q144 PolarHBondContact O-OE1 2.74Å; K101-Q144 WeakPolarHBondContact CE-O 3.41Å; Y140-Q144 HydrophobicContact CE1-CG 4.45Å; Y140-Q144 WeakPolarHBondContact O-CB 3.37Å; Y140-Q144 WeakPolarHBondContact O-CG 3.3Å; Y140-Q144 PolarHBondContact O-N 3.05Å; Y140-Q144 PolarHBondContact OH-NE2 3.49Å; M141-Q144 PolarHBondContact O-N 3.43Å; L142-Q144 VanDerWaalsContact C-N 3.31Å; L142-Q144 PolarHBondContact O-N 3.1Å; Q144-G146 PolarHBondContact O-N 3.48Å
145	E	63	Low	76.2	Confident	24 Å²	24	46.8 Å²	46.8	11%	0.112	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-7.2	173.2	-68.6	-81.9	160.7	0	0	113	V99 F100 M141 L142 Q143 F147 C231 R235	V99-E145 WeakPolarHBondContact CG1-OE1 3.32Å; F100-E145 CarbonylContact C-O 3.53Å; M141-E145 WeakPolarHBondContact O-CG 3.07Å; M141-E145 PolarHBondContact O-N 3.26Å; M141-E145 VanDerWaalsContact O-N 3.12Å; L142-E145 PolarHBondContact O-N 2.86Å; Q143-E145 VanDerWaalsContact C-N 3.3Å; Q143-E145 PolarHBondContact O-N 3.02Å; E145-F147 HydrophobicContact CB-CD2 3.77Å; E145-F147 HydrophobicContact CB-CE2 3.64Å; E145-C231 HydrophobicContact CG-CB 4.23Å; E145-R235 IonicContact OE2-NE 3.4Å
146	G	60.7	Low	76.9	Confident	21 Å²	21	50.9 Å²	50.9	22%	0.216	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.3	17.5	175.9	0	0	0	0	0	115	L142 Q143 Q144	L142-G146 PolarHBondContact O-N 2.87Å; Q143-G146 WeakPolarHBondContact O-CA 3.44Å; Q143-G146 PolarHBondContact O-N 2.92Å; Q144-G146 PolarHBondContact O-N 3.48Å
147	F	73.3	Confident	77.8	Confident	18 Å²	18	47.8 Å²	47.8	8%	0.079	24%	0.244	C	C	.	.			trans	-80.1	144.6	172.3	-62.6	-65.5	0	0	0	111.3	D123 V125 L142 E145 V149 V234 R235 L238	D123-F147 HydrophobicContact CB-CD1 3.87Å; D123-F147 HydrophobicContact CB-CE1 4.06Å; D123-F147 WeakPolarHBondContact O-CA 3.44Å; V125-F147 HydrophobicContact CB-CB 4.42Å; V125-F147 HydrophobicContact CG2-CB 3.62Å; V125-F147 HydrophobicContact CG2-CD1 3.67Å; V125-F147 HydrophobicContact CG2-CD2 4.33Å; V125-F147 HydrophobicContact CG2-CE1 4.49Å; V125-F147 HydrophobicContact CG2-CG 3.6Å; L142-F147 HydrophobicContact CB-CB 4.39Å; L142-F147 HydrophobicContact CB-CD2 4.24Å; L142-F147 HydrophobicContact CD2-CD2 3.76Å; L142-F147 HydrophobicContact CD2-CE2 4.2Å; L142-F147 WeakPolarHBondContact O-CB 3.3Å; L142-F147 VanDerWaalsContact O-CD2 3.3Å; L142-F147 WeakPolarHBondContact O-CD2 3.46Å; L142-F147 PolarHBondContact O-N 3.01Å; L142-F147 VanDerWaalsContact O-N 3.08Å; E145-F147 HydrophobicContact CB-CD2 3.77Å; E145-F147 HydrophobicContact CB-CE2 3.64Å; F147-V149 HydrophobicContact CB-CG2 4.19Å; F147-V234 HydrophobicContact CE1-CG1 4.39Å; F147-V234 HydrophobicContact CE2-CG1 4.2Å; F147-V234 HydrophobicContact CZ-CG1 4.01Å; F147-R235 HydrophobicContact CZ-CG 4.12Å; F147-L238 HydrophobicContact CD1-CD1 4.15Å; F147-L238 HydrophobicContact CE1-CD1 3.33Å; F147-L238 HydrophobicContact CZ-CD1 3.95Å
148	A	73.9	Confident	78.8	Confident	33 Å²	33	44.4 Å²	44.4	27%	0.273	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	112.6	164.8	0	0	0	0	0	108.1	D123 K124 V125	D123-A148 PolarHBondContact O-N 3.2Å; K124-A148 CarbonylContact C-O 3.23Å; K124-A148 VanDerWaalsContact CA-O 3.3Å; K124-A148 WeakPolarHBondContact CA-O 3.3Å; V125-A148 PolarHBondContact N-O 3.44Å
149	V	82.3	Confident	79.2	Confident	27 Å²	27	44.7 Å²	44.7	16%	0.164	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.5	-173.6	-169.2	0	0	0	0	110.4	V125 V139 L142 Q143 F147 V151	V125-V149 HydrophobicContact CB-CG2 4.48Å; V125-V149 VanDerWaalsContact O-CA 3.29Å; V125-V149 WeakPolarHBondContact O-CA 3.26Å; V139-V149 HydrophobicContact CG2-CG1 4.01Å; L142-V149 HydrophobicContact CB-CG2 3.48Å; L142-V149 VanDerWaalsContact CB-CG2 3.48Å; L142-V149 HydrophobicContact CD1-CG1 4.33Å; L142-V149 HydrophobicContact CD1-CG2 4.17Å; L142-V149 HydrophobicContact CG-CG2 4.49Å; Q143-V149 HydrophobicContact CG-CB 4.33Å; Q143-V149 HydrophobicContact CG-CG2 3.89Å; F147-V149 HydrophobicContact CB-CG2 4.19Å; V149-V151 HydrophobicContact CG1-CG2 4.2Å
150	E	88.1	Confident	79.8	Confident	49 Å²	49	47.9 Å²	47.9	23%	0.229	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	128.1	170.6	-170.2	176	-173.4	0	0	108.4	K124 V125 V126 E127 F152 K161	K124-E150 WeakPolarHBondContact CE-OE2 3.43Å; K124-E150 IonicContact NZ-OE2 2.72Å; K124-E150 PolarHBondContact NZ-OE2 3.14Å; V125-E150 PolarHBondContact O-N 2.85Å; V126-E150 WeakPolarHBondContact CA-O 3.36Å; V126-E150 HydrophobicContact CG2-CB 4.29Å; E127-E150 PolarHBondContact N-O 3.01Å; E150-F152 HydrophobicContact CB-CE2 4.41Å; E150-F152 HydrophobicContact CG-CE2 3.67Å; E150-F152 HydrophobicContact CG-CZ 4.01Å; E150-K161 VanDerWaalsContact OE1-CE 3.25Å; E150-K161 WeakPolarHBondContact OE1-CE 3.31Å; E150-K161 IonicContact OE1-NZ 2.65Å; E150-K161 PolarHBondContact OE1-NZ 3.27Å; E150-K161 VanDerWaalsContact OE2-CE 3.29Å; E150-K161 WeakPolarHBondContact OE2-CE 3.43Å; E150-K161 IonicContact OE2-NZ 3.23Å; E150-K161 PolarHBondContact OE2-NZ 3.12Å
151	V	87.6	Confident	80.7	Confident	60 Å²	60	46.8 Å²	46.8	36%	0.364	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	141.1	-171.7	-174.1	0	0	0	0	110.7	E127 A135 V139 V149	E127-V151 CarbonylContact O-C 3.49Å; E127-V151 WeakPolarHBondContact O-CA 3.48Å; A135-V151 HydrophobicContact CB-CG1 4.06Å; V139-V151 HydrophobicContact CG2-CG2 3.18Å; V149-V151 HydrophobicContact CG1-CG2 4.2Å
152	F	89.9	Confident	81.4	Confident	32 Å²	32	44.8 Å²	44.8	14%	0.14	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	131.1	173.7	-64	-95.3	0	0	0	110.9	V126 E127 V128 E129 E150 R154 P157 V158 K161	V126-F152 HydrophobicContact CG1-CD2 3.74Å; V126-F152 HydrophobicContact CG1-CE2 3.78Å; E127-F152 PolarHBondContact O-N 2.68Å; V128-F152 VanDerWaalsContact CA-O 3.28Å; V128-F152 WeakPolarHBondContact CA-O 3.49Å; V128-F152 HydrophobicContact CG1-CB 4.25Å; V128-F152 WeakPolarHBondContact CG1-O 3.23Å; V128-F152 HydrophobicContact CG2-CB 4.48Å; E129-F152 PolarHBondContact N-O 2.81Å; E129-F152 VanDerWaalsContact N-O 3.1Å; E150-F152 HydrophobicContact CB-CE2 4.41Å; E150-F152 HydrophobicContact CG-CE2 3.67Å; E150-F152 HydrophobicContact CG-CZ 4.01Å; F152-R154 PolarHBondContact O-N 2.94Å; F152-P157 HydrophobicContact CD1-CB 3.98Å; F152-P157 HydrophobicContact CE1-CB 4.23Å; F152-V158 HydrophobicContact CB-CG2 3.65Å; F152-V158 HydrophobicContact CD1-CG2 4.05Å; F152-V158 HydrophobicContact CD2-CG2 3.77Å; F152-V158 HydrophobicContact CE2-CG2 4.43Å; F152-V158 HydrophobicContact CG-CG2 3.55Å; F152-K161 HydrophobicContact CZ-CB 4.11Å; F152-K161 HydrophobicContact CZ-CG 4.11Å
153	E	85.7	Confident	81.8	Confident	103 Å²	103	52.3 Å²	52.3	48%	0.481	26%	0.256	S	S	.	.	S	Bend	trans	-78.8	-8.5	175.3	-60.4	176.5	170	0	0	112.9	E129 Q132	E129-E153 WeakPolarHBondContact O-CA 3.34Å; Q132-E153 PolarHBondContact NE2-OE1 3.11Å
154	R	87.3	Confident	82.4	Confident	150 Å²	150	55.4 Å²	55.4	57%	0.566	27%	0.271	S	S	*	.	S	Bend	trans	-142.8	146.8	-173.7	-71.2	-172.4	-64.4	-172	-0.3	110.3	F152 P157 P177	F152-R154 PolarHBondContact O-N 2.94Å; R154-P157 HydrophobicContact CB-CG 4.33Å; R154-P157 WeakPolarHBondContact O-CD 3.46Å; R154-P177 HydrophobicContact CG-CG 4.3Å
155	G	87	Confident	83.2	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.284	C	S	.	.	S	Bend	trans	-77.6	-37.6	-175.5	0	0	0	0	0	115.1	V158 D178 L184	G155-V158 VanDerWaalsContact O-CB 3.25Å; G155-V158 WeakPolarHBondContact O-CB 3.21Å; G155-V158 WeakPolarHBondContact O-CG2 3.31Å; G155-V158 PolarHBondContact O-N 3.3Å; G155-V158 VanDerWaalsContact O-N 3.15Å; G155-D178 PolarHBondContact N-OD1 3.03Å; G155-D178 PolarHBondContact N-OD2 3.35Å; G155-D178 VanDerWaalsContact N-OD2 3.13Å; G155-L184 WeakPolarHBondContact O-CD1 3.09Å
156	L	89.6	Confident	84	Confident	89 Å²	89	59 Å²	59	47%	0.466	30%	0.295	S	S	.	.	H	α-helix	trans	-60.1	-43.5	-175	-69.3	169.2	0	0	0	114.4	V158 L159 D178 I179	L156-V158 PolarHBondContact O-N 3.1Å; L156-V158 VanDerWaalsContact O-N 3.17Å; L156-L159 HydrophobicContact CD2-CD1 4.41Å; L156-L159 PolarHBondContact O-N 2.89Å; L156-D178 WeakPolarHBondContact CB-OD2 3.19Å; L156-D178 HydrophobicContact CD1-CB 4.23Å; L156-D178 VanDerWaalsContact CG-OD2 3.25Å; L156-D178 WeakPolarHBondContact CG-OD2 3.29Å; L156-D178 PolarHBondContact N-OD2 2.97Å; L156-I179 HydrophobicContact CD2-CD1 4.2Å
157	P	90.7	Very high	85.2	Confident	46 Å²	46	58.5 Å²	58.5	30%	0.299	29%	0.288	S	S	.	.	H	α-helix	trans	-59.7	-25.7	176.9	-24.7	35.2	0	0	0	114.3	F152 R154 L159 D160 K161	F152-P157 HydrophobicContact CD1-CB 3.98Å; F152-P157 HydrophobicContact CE1-CB 4.23Å; R154-P157 HydrophobicContact CB-CG 4.33Å; R154-P157 WeakPolarHBondContact O-CD 3.46Å; P157-L159 VanDerWaalsContact C-N 3.29Å; P157-L159 PolarHBondContact O-N 3.3Å; P157-D160 PolarHBondContact O-N 3.25Å; P157-K161 PolarHBondContact O-N 3.03Å
158	V	91	Very high	85.7	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.012	30%	0.297	C	S	.	.	H	α-helix	trans	-66.8	-33.9	-179.3	-175.6	0	0	0	0	110.8	V126 V128 F152 G155 L156 K161 A162 M170 L188	V126-V158 HydrophobicContact CG1-CG1 4.23Å; V128-V158 HydrophobicContact CG1-CG2 4.15Å; V128-V158 HydrophobicContact CG2-CG1 4.29Å; V128-V158 HydrophobicContact CG2-CG2 3.56Å; F152-V158 HydrophobicContact CB-CG2 3.65Å; F152-V158 HydrophobicContact CD1-CG2 4.05Å; F152-V158 HydrophobicContact CD2-CG2 3.77Å; F152-V158 HydrophobicContact CE2-CG2 4.43Å; F152-V158 HydrophobicContact CG-CG2 3.55Å; G155-V158 VanDerWaalsContact O-CB 3.25Å; G155-V158 WeakPolarHBondContact O-CB 3.21Å; G155-V158 WeakPolarHBondContact O-CG2 3.31Å; G155-V158 PolarHBondContact O-N 3.3Å; G155-V158 VanDerWaalsContact O-N 3.15Å; L156-V158 PolarHBondContact O-N 3.1Å; L156-V158 VanDerWaalsContact O-N 3.17Å; V158-K161 PolarHBondContact O-N 3.29Å; V158-A162 VanDerWaalsContact O-CB 3.27Å; V158-A162 WeakPolarHBondContact O-CB 2.95Å; V158-A162 PolarHBondContact O-N 2.98Å; V158-M170 HydrophobicContact CG1-CE 3.49Å; V158-M170 VanDerWaalsContact CG1-CE 3.49Å; V158-M170 HydrophobicContact CG1-SD 4.24Å; V158-L188 HydrophobicContact CG1-CD2 4.41Å
159	L	89.1	Confident	86.5	Confident	7 Å²	7	58.5 Å²	58.5	4%	0.037	28%	0.284	C	S	.	.	H	α-helix	trans	-65.2	-41.1	177.7	-67.2	169	0	0	0	111.8	L156 P157 K161 A162 R163 L184 Q187 L188 L191	L156-L159 HydrophobicContact CD2-CD1 4.41Å; L156-L159 PolarHBondContact O-N 2.89Å; P157-L159 VanDerWaalsContact C-N 3.29Å; P157-L159 PolarHBondContact O-N 3.3Å; L159-K161 VanDerWaalsContact C-N 3.31Å; L159-K161 PolarHBondContact O-N 2.64Å; L159-A162 PolarHBondContact O-N 3.43Å; L159-R163 WeakPolarHBondContact O-CG 3.49Å; L159-R163 PolarHBondContact O-N 3.49Å; L159-R163 VanDerWaalsContact O-N 3.08Å; L159-L184 HydrophobicContact CD1-CD1 4.29Å; L159-L184 HydrophobicContact CD2-CD1 3.88Å; L159-L184 HydrophobicContact CG-CD1 3.79Å; L159-Q187 HydrophobicContact CD1-CB 4.49Å; L159-Q187 HydrophobicContact CD2-CB 3.71Å; L159-L188 HydrophobicContact CD2-CD2 4.03Å; L159-L188 HydrophobicContact CD2-CG 4.12Å; L159-L191 HydrophobicContact CD2-CD1 4.37Å
160	D	87.2	Confident	87	Confident	89 Å²	89	57.3 Å²	57.3	48%	0.476	28%	0.276	S	S	.	.	H	α-helix	trans	-64.8	-39.6	176.5	-68.1	-26.9	0	0	0	110.9	P157 R163	P157-D160 PolarHBondContact O-N 3.25Å; D160-R163 IonicContact OD1-CZ 3.03Å; D160-R163 IonicContact OD1-NH1 2.96Å; D160-R163 PolarHBondContact OD1-NH1 2.86Å
161	K	86.9	Confident	87.2	Confident	62 Å²	62	55 Å²	55	27%	0.27	27%	0.266	S	S	.	.	H	α-helix	trans	-66.4	-46	174.9	-169.1	71.7	179.6	-137.3	0	112.1	E150 F152 P157 V158 L159 R163 Q164 Q165	E150-K161 VanDerWaalsContact OE1-CE 3.25Å; E150-K161 WeakPolarHBondContact OE1-CE 3.31Å; E150-K161 IonicContact OE1-NZ 2.65Å; E150-K161 PolarHBondContact OE1-NZ 3.27Å; E150-K161 VanDerWaalsContact OE2-CE 3.29Å; E150-K161 WeakPolarHBondContact OE2-CE 3.43Å; E150-K161 IonicContact OE2-NZ 3.23Å; E150-K161 PolarHBondContact OE2-NZ 3.12Å; F152-K161 HydrophobicContact CZ-CB 4.11Å; F152-K161 HydrophobicContact CZ-CG 4.11Å; P157-K161 PolarHBondContact O-N 3.03Å; V158-K161 PolarHBondContact O-N 3.29Å; L159-K161 VanDerWaalsContact C-N 3.31Å; L159-K161 PolarHBondContact O-N 2.64Å; K161-R163 PolarHBondContact O-N 3.44Å; K161-Q164 WeakPolarHBondContact O-CB 3.48Å; K161-Q164 PolarHBondContact O-N 2.83Å; K161-Q165 PolarHBondContact O-N 2.94Å
162	A	85.9	Confident	87.4	Confident	2 Å²	2	52.1 Å²	52.1	2%	0.017	25%	0.248	C	C	.	.	H	α-helix	trans	-62.5	-29.2	-179.6	0	0	0	0	0	112.4	V158 L159 Q164 L188 H192	V158-A162 VanDerWaalsContact O-CB 3.27Å; V158-A162 WeakPolarHBondContact O-CB 2.95Å; V158-A162 PolarHBondContact O-N 2.98Å; L159-A162 PolarHBondContact O-N 3.43Å; A162-Q164 VanDerWaalsContact C-N 3.31Å; A162-L188 HydrophobicContact CB-CD2 3.53Å; A162-H192 PolarHBondContact O-NE2 3.23Å
163	R	86.2	Confident	87.3	Confident	157 Å²	157	51 Å²	51	59%	0.592	24%	0.244	S	C	*	.	H	α-helix	trans	-66.4	-31	171.6	-72.8	-179.9	-160.9	127.6	8	113.2	L159 D160 K161 L191	L159-R163 WeakPolarHBondContact O-CG 3.49Å; L159-R163 PolarHBondContact O-N 3.49Å; L159-R163 VanDerWaalsContact O-N 3.08Å; D160-R163 IonicContact OD1-CZ 3.03Å; D160-R163 IonicContact OD1-NH1 2.96Å; D160-R163 PolarHBondContact OD1-NH1 2.86Å; K161-R163 PolarHBondContact O-N 3.44Å; R163-L191 HydrophobicContact CG-CD1 4.06Å; R163-L191 HydrophobicContact CG-CD2 4.41Å
164	Q	83.2	Confident	87.2	Confident	159 Å²	159	47.1 Å²	47.1	74%	0.743	23%	0.227	S	C	*	.	H	α-helix	trans	-83.3	-43.8	178.5	-61.9	174.9	12	0	0	111.5	K161 A162	K161-Q164 WeakPolarHBondContact O-CB 3.48Å; K161-Q164 PolarHBondContact O-N 2.83Å; A162-Q164 VanDerWaalsContact C-N 3.31Å
165	Q	78.6	Confident	86.9	Confident	93 Å²	93	42.3 Å²	42.3	44%	0.435	23%	0.225	S	C	.	.			trans	-152.6	123.1	-177.3	-172.7	-178	15.9	0	0	110.5	K161	K161-Q165 PolarHBondContact O-N 2.94Å
166	A	80.1	Confident	86.7	Confident	40 Å²	40	43 Å²	43	33%	0.331	23%	0.228	S	C	.	.			trans	-69.9	137	173	0	0	0	0	0	110.9
167	P	86.3	Confident	86.2	Confident	11 Å²	11	43.1 Å²	43.1	7%	0.071	23%	0.234	C	C	.	.			trans	-75	162.4	166.4	26.5	-24.4	0	0	0	111.9	V126 M170 L195	V126-P167 HydrophobicContact CB-CB 4.06Å; V126-P167 HydrophobicContact CB-CG 4.21Å; V126-P167 HydrophobicContact CG2-CB 3.56Å; V126-P167 HydrophobicContact CG2-CG 3.97Å; P167-M170 HydrophobicContact CG-CE 3.59Å; P167-L195 HydrophobicContact CB-CD1 4.46Å; P167-L195 HydrophobicContact CG-CD1 3.79Å; P167-L195 HydrophobicContact CG-CD2 4.33Å; P167-L195 WeakPolarHBondContact O-CD1 3.24Å
168	D	83.9	Confident	86.1	Confident	51 Å²	51	43.5 Å²	43.5	27%	0.273	23%	0.234	S	C	.	.	S	Bend	trans	-80.8	-25.6	175.3	-64.6	-59.5	0	0	0	112.3	Y121 D123 K124 P196 L238	Y121-D168 WeakPolarHBondContact CE1-OD2 3.2Å; Y121-D168 PolarHBondContact OH-OD2 2.91Å; D123-D168 VanDerWaalsContact CA-OD2 3.26Å; D123-D168 WeakPolarHBondContact CA-OD2 3.48Å; K124-D168 PolarHBondContact N-OD2 2.84Å; K124-D168 PolarHBondContact O-N 2.79Å; D168-P196 WeakPolarHBondContact O-CD 3.3Å; D168-L238 HydrophobicContact CB-CD2 3.65Å; D168-L238 WeakPolarHBondContact O-CD2 3.3Å
169	V	90.4	Very high	86	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	147.3	173.4	92.3	0	0	0	0	109	K124 V125 V126 P196 V234 L237 L238	K124-V169 PolarHBondContact O-N 2.79Å; V125-V169 HydrophobicContact CB-CG1 4Å; V125-V169 HydrophobicContact CG1-CG1 3.64Å; V125-V169 HydrophobicContact CG2-CG1 3.69Å; V126-V169 PolarHBondContact N-O 3.14Å; V126-V169 VanDerWaalsContact N-O 3.13Å; V169-P196 HydrophobicContact CG2-CB 4.01Å; V169-P196 HydrophobicContact CG2-CG 4.48Å; V169-V234 HydrophobicContact CG1-CG1 3.94Å; V169-V234 HydrophobicContact CG1-CG2 4.46Å; V169-L237 HydrophobicContact CG2-CB 4.11Å; V169-L237 HydrophobicContact CG2-CD1 4Å; V169-L238 HydrophobicContact CB-CD2 4.09Å; V169-L238 HydrophobicContact CB-CG 4.36Å
170	M	91.8	Very high	85.7	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	133.3	174.9	-172.8	64.8	74	0	0	110.4	V126 V128 V158 P167 L172 L188 L195 P196 V197 L198	V126-M170 HydrophobicContact CB-CE 3.86Å; V126-M170 HydrophobicContact CB-SD 3.63Å; V126-M170 HydrophobicContact CG1-CE 3.78Å; V126-M170 HydrophobicContact CG1-SD 3.5Å; V126-M170 WeakPolarHBondContact CG1-SD 3.48Å; V128-M170 HydrophobicContact CG2-SD 4Å; V158-M170 HydrophobicContact CG1-CE 3.49Å; V158-M170 VanDerWaalsContact CG1-CE 3.49Å; V158-M170 HydrophobicContact CG1-SD 4.24Å; P167-M170 HydrophobicContact CG-CE 3.59Å; M170-L172 HydrophobicContact CG-CD1 4.15Å; M170-L172 HydrophobicContact CG-CD2 3.37Å; M170-L172 HydrophobicContact CG-CG 3.57Å; M170-L172 HydrophobicContact SD-CD2 3.75Å; M170-L188 HydrophobicContact CE-CD1 3.79Å; M170-L188 HydrophobicContact CE-CD2 4.3Å; M170-L188 HydrophobicContact CG-CD1 4.12Å; M170-L195 HydrophobicContact CB-CD1 4.46Å; M170-L195 HydrophobicContact CB-CD2 4.22Å; M170-L195 HydrophobicContact CB-CG 4.42Å; M170-L195 HydrophobicContact CE-CD2 4.49Å; M170-P196 PolarHBondContact N-O 2.93Å; M170-V197 HydrophobicContact CB-CG2 4.26Å; M170-V197 CarbonylContact O-C 3.59Å; M170-V197 WeakPolarHBondContact O-CA 3.26Å; M170-L198 PolarHBondContact O-N 2.8Å
171	I	92.6	Very high	85.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	119.1	170.5	-52.4	178.5	0	0	0	107.3	V125 V126 E127 V128 L138 L142 L198 L200 V230 V234	V125-I171 HydrophobicContact CG1-CD1 3.74Å; V125-I171 HydrophobicContact CG1-CG1 4.05Å; V126-I171 PolarHBondContact O-N 2.78Å; E127-I171 WeakPolarHBondContact CA-O 3.44Å; V128-I171 PolarHBondContact N-O 2.89Å; L138-I171 HydrophobicContact CD2-CD1 3.79Å; L138-I171 HydrophobicContact CD2-CG2 4.14Å; L142-I171 HydrophobicContact CD1-CD1 3.78Å; I171-L198 CarbonylContact C-O 3.59Å; I171-L198 WeakPolarHBondContact CA-O 3.47Å; I171-L198 HydrophobicContact CG1-CB 4.5Å; I171-L198 HydrophobicContact CG1-CD2 4.4Å; I171-L200 HydrophobicContact CG2-CD1 3.77Å; I171-L200 HydrophobicContact CG2-CD2 3.99Å; I171-L200 HydrophobicContact CG2-CG 3.73Å; I171-V230 HydrophobicContact CD1-CG1 4.02Å; I171-V234 HydrophobicContact CD1-CG2 3.77Å; I171-V234 HydrophobicContact CG1-CG2 4.21Å
172	L	91.4	Very high	85.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.8	-174.7	-62	-177.8	0	0	0	110.7	V128 M170 L184 C185 L188 V197 L198 F199 L200	V128-L172 HydrophobicContact CB-CD2 3.85Å; V128-L172 HydrophobicContact CG2-CD2 3.52Å; M170-L172 HydrophobicContact CG-CD1 4.15Å; M170-L172 HydrophobicContact CG-CD2 3.37Å; M170-L172 HydrophobicContact CG-CG 3.57Å; M170-L172 HydrophobicContact SD-CD2 3.75Å; L172-L184 HydrophobicContact CD1-CD2 4.44Å; L172-L184 HydrophobicContact CD1-CG 4.43Å; L172-L184 HydrophobicContact CD2-CD2 3.68Å; L172-L184 HydrophobicContact CD2-CG 4.4Å; L172-C185 HydrophobicContact CD1-CB 3.86Å; L172-L188 HydrophobicContact CD1-CD1 4.35Å; L172-V197 HydrophobicContact CD1-CG1 3.67Å; L172-V197 HydrophobicContact CG-CG1 4.04Å; L172-L198 PolarHBondContact N-O 3.19Å; L172-F199 HydrophobicContact CB-CD1 3.8Å; L172-F199 HydrophobicContact CB-CE1 3.8Å; L172-F199 HydrophobicContact CD1-CE1 3.92Å; L172-F199 HydrophobicContact CD1-CZ 4.4Å; L172-F199 HydrophobicContact CG-CE1 4.48Å; L172-F199 CarbonylContact O-C 3.58Å; L172-F199 WeakPolarHBondContact O-CA 3.25Å; L172-L200 PolarHBondContact O-N 3.1Å
173	D	88.4	Confident	85.3	Confident	10 Å²	10	42.8 Å²	42.8	5%	0.053	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	142.7	156.9	-164.6	3.7	0	0	0	110.4	V128 G175 L176 G181 L200 K223	V128-D173 PolarHBondContact O-N 3.17Å; D173-G175 PolarHBondContact OD1-N 3.2Å; D173-L176 HydrophobicContact CB-CD2 4.11Å; D173-L176 HydrophobicContact CB-CG 4.36Å; D173-L176 WeakPolarHBondContact O-CG 3.37Å; D173-G181 WeakPolarHBondContact O-CA 3.27Å; D173-L200 VanDerWaalsContact OD1-O 3.11Å; D173-K223 IonicContact OD1-NZ 3.69Å; D173-K223 IonicContact OD2-NZ 3.41Å; D173-K223 PolarHBondContact OD2-NZ 2.85Å
174	V	83.6	Confident	85.5	Confident	20 Å²	20	35.3 Å²	35.3	12%	0.121	21%	0.206	C	C	.	.	S	Bend	trans	-72.3	-36.7	171.6	173.6	0	0	0	0	110.6	L176 G181 F182 F199 L200 T201	V174-L176 VanDerWaalsContact C-N 3.32Å; V174-L176 PolarHBondContact O-N 2.78Å; V174-G181 PolarHBondContact O-N 2.9Å; V174-G181 VanDerWaalsContact O-N 3.1Å; V174-F182 HydrophobicContact CB-CE2 4.42Å; V174-F182 HydrophobicContact CG1-CD2 3.92Å; V174-F182 HydrophobicContact CG1-CE2 3.42Å; V174-F182 VanDerWaalsContact CG1-CE2 3.42Å; V174-F182 HydrophobicContact CG1-CZ 3.94Å; V174-F182 HydrophobicContact CG2-CE1 4.12Å; V174-F182 HydrophobicContact CG2-CE2 4.06Å; V174-F182 HydrophobicContact CG2-CZ 3.7Å; V174-F199 HydrophobicContact CG2-CB 4.49Å; V174-F199 HydrophobicContact CG2-CD1 3.81Å; V174-F199 HydrophobicContact CG2-CE1 4.36Å; V174-F199 HydrophobicContact CG2-CG 4.32Å; V174-L200 PolarHBondContact N-O 3.43Å; V174-L200 VanDerWaalsContact N-O 3.15Å; V174-T201 HydrophobicContact CG2-CG2 3.89Å
175	G	80.2	Confident	85.7	Confident	50 Å²	50	27.8 Å²	27.8	52%	0.515	17%	0.17	S	C	.	.			trans	-84.1	26.8	-169.1	0	0	0	0	0	117	D173	D173-G175 PolarHBondContact OD1-N 3.2Å
176	L	83.6	Confident	86.1	Confident	14 Å²	14	30.3 Å²	30.3	7%	0.073	18%	0.176	C	C	.	.			trans	-65.9	147.2	-175.2	-63.1	170.9	0	0	0	113.4	V128 D173 V174 D178 I179 L184	V128-L176 HydrophobicContact CB-CD1 4.27Å; V128-L176 HydrophobicContact CG1-CD1 3.53Å; V128-L176 HydrophobicContact CG1-CD2 3.75Å; V128-L176 HydrophobicContact CG1-CG 4.29Å; D173-L176 HydrophobicContact CB-CD2 4.11Å; D173-L176 HydrophobicContact CB-CG 4.36Å; D173-L176 WeakPolarHBondContact O-CG 3.37Å; V174-L176 VanDerWaalsContact C-N 3.32Å; V174-L176 PolarHBondContact O-N 2.78Å; L176-D178 PolarHBondContact O-N 2.73Å; L176-I179 VanDerWaalsContact CB-O 3.27Å; L176-I179 WeakPolarHBondContact CB-O 3.26Å; L176-L184 HydrophobicContact CD1-CD2 3.93Å
177	P	79.9	Confident	86.5	Confident	92 Å²	92	31.6 Å²	31.6	60%	0.597	18%	0.175	S	C	*	.	S	Bend	trans	-76.3	-21.2	-170.2	28.3	-36.6	0	0	0	115.3	D130 R154	D130-P177 HydrophobicContact CB-CG 4.3Å; R154-P177 HydrophobicContact CG-CG 4.3Å
178	D	87.8	Confident	86.6	Confident	53 Å²	53	31 Å²	31	28%	0.283	17%	0.172	S	C	.	.	S	Bend	trans	-109.5	-28.5	-172.9	64.6	-38.3	0	0	0	114.4	G155 L156 L176	G155-D178 PolarHBondContact N-OD1 3.03Å; G155-D178 PolarHBondContact N-OD2 3.35Å; G155-D178 VanDerWaalsContact N-OD2 3.13Å; L156-D178 WeakPolarHBondContact CB-OD2 3.19Å; L156-D178 HydrophobicContact CD1-CB 4.23Å; L156-D178 VanDerWaalsContact CG-OD2 3.25Å; L156-D178 WeakPolarHBondContact CG-OD2 3.29Å; L156-D178 PolarHBondContact N-OD2 2.97Å; L176-D178 PolarHBondContact O-N 2.73Å
179	I	88.4	Confident	86.7	Confident	23 Å²	23	30.1 Å²	30.1	12%	0.118	17%	0.166	C	C	.	.	S	Bend	trans	-153.7	140.3	178.4	-169.9	172.2	0	0	0	108.4	L156 L176 G181 E183 L184	L156-I179 HydrophobicContact CD2-CD1 4.2Å; L176-I179 VanDerWaalsContact CB-O 3.27Å; L176-I179 WeakPolarHBondContact CB-O 3.26Å; I179-G181 PolarHBondContact O-N 3.37Å; I179-E183 HydrophobicContact CD1-CB 4.31Å; I179-E183 HydrophobicContact CD1-CG 3.81Å; I179-E183 HydrophobicContact CG1-CB 3.94Å; I179-E183 HydrophobicContact CG1-CG 3.82Å; I179-L184 HydrophobicContact CD1-CB 4.49Å; I179-L184 HydrophobicContact CG2-CB 4.15Å
180	S	83.2	Confident	86.5	Confident	53 Å²	53	34 Å²	34	37%	0.371	20%	0.199	S	C	.	.			trans	-60.4	139.9	174	171.8	0	0	0	0	110.6	F182 E183 L184	S180-F182 PolarHBondContact O-N 3.43Å; S180-F182 VanDerWaalsContact O-N 3.11Å; S180-F182 PolarHBondContact OG-N 3.24Å; S180-E183 PolarHBondContact O-N 3.17Å; S180-L184 PolarHBondContact O-N 3.31Å
181	G	83.4	Confident	86.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-54.4	-31.8	175.8	0	0	0	0	0	113.2	D173 V174 I179 C185 F199	D173-G181 WeakPolarHBondContact O-CA 3.27Å; V174-G181 PolarHBondContact O-N 2.9Å; V174-G181 VanDerWaalsContact O-N 3.1Å; I179-G181 PolarHBondContact O-N 3.37Å; G181-C185 WeakPolarHBondContact O-CB 3.29Å; G181-C185 PolarHBondContact O-N 3.01Å; G181-F199 WeakPolarHBondContact O-CE1 3.29Å
182	F	83.2	Confident	85.8	Confident	16 Å²	16	40.1 Å²	40.1	7%	0.07	23%	0.229	C	C	.	.	H	α-helix	trans	-65.2	-45.5	174.4	-68.3	-50.6	0	0	0	113.1	V174 S180 C185 R186 F199 D208 I215	V174-F182 HydrophobicContact CB-CE2 4.42Å; V174-F182 HydrophobicContact CG1-CD2 3.92Å; V174-F182 HydrophobicContact CG1-CE2 3.42Å; V174-F182 VanDerWaalsContact CG1-CE2 3.42Å; V174-F182 HydrophobicContact CG1-CZ 3.94Å; V174-F182 HydrophobicContact CG2-CE1 4.12Å; V174-F182 HydrophobicContact CG2-CE2 4.06Å; V174-F182 HydrophobicContact CG2-CZ 3.7Å; S180-F182 PolarHBondContact O-N 3.43Å; S180-F182 VanDerWaalsContact O-N 3.11Å; S180-F182 PolarHBondContact OG-N 3.24Å; F182-C185 WeakPolarHBondContact O-CB 3.31Å; F182-C185 PolarHBondContact O-N 2.96Å; F182-R186 PolarHBondContact O-N 2.93Å; F182-F199 HydrophobicContact CD1-CE1 4.13Å; F182-F199 AromaticContact CD1-CE2 3.75Å; F182-F199 HydrophobicContact CD1-CE2 3.75Å; F182-F199 AromaticContact CD1-CZ 3.56Å; F182-F199 HydrophobicContact CD1-CZ 3.56Å; F182-F199 HydrophobicContact CE1-CD2 4.14Å; F182-F199 HydrophobicContact CE1-CE1 4.36Å; F182-F199 AromaticContact CE1-CE2 3.82Å; F182-F199 HydrophobicContact CE1-CE2 3.82Å; F182-F199 AromaticContact CE1-CZ 3.97Å; F182-F199 HydrophobicContact CE1-CZ 3.97Å; F182-F199 HydrophobicContact CG-CZ 4.49Å; F182-D208 HydrophobicContact CE2-CB 4.16Å; F182-D208 HydrophobicContact CZ-CB 3.92Å; F182-D208 WeakPolarHBondContact CZ-O 2.85Å; F182-I215 HydrophobicContact CB-CD1 3.62Å; F182-I215 HydrophobicContact CD1-CD1 4.07Å; F182-I215 HydrophobicContact CG-CD1 4.04Å
183	E	85.2	Confident	85.4	Confident	56 Å²	56	45.4 Å²	45.4	26%	0.262	26%	0.264	S	S	.	.	H	α-helix	trans	-68.2	-38.9	178.5	179	55.2	-142.6	0	0	111	I179 S180 R186 Q187	I179-E183 HydrophobicContact CD1-CB 4.31Å; I179-E183 HydrophobicContact CD1-CG 3.81Å; I179-E183 HydrophobicContact CG1-CB 3.94Å; I179-E183 HydrophobicContact CG1-CG 3.82Å; S180-E183 PolarHBondContact O-N 3.17Å; E183-R186 PolarHBondContact O-N 3.12Å; E183-R186 IonicContact OE1-CZ 3.7Å; E183-R186 VanDerWaalsContact OE1-CZ 3.31Å; E183-R186 IonicContact OE1-NE 3.91Å; E183-R186 PolarHBondContact OE1-NE 3.21Å; E183-R186 IonicContact OE1-NH2 2.97Å; E183-R186 PolarHBondContact OE1-NH2 2.88Å; E183-R186 IonicContact OE2-CZ 2.61Å; E183-R186 IonicContact OE2-NE 3.69Å; E183-R186 PolarHBondContact OE2-NE 3.47Å; E183-R186 IonicContact OE2-NH1 3.84Å; E183-R186 IonicContact OE2-NH2 2.93Å; E183-R186 PolarHBondContact OE2-NH2 3.34Å; E183-Q187 WeakPolarHBondContact O-CG 3.39Å; E183-Q187 PolarHBondContact O-N 3.45Å; E183-Q187 VanDerWaalsContact O-N 3.14Å; E183-Q187 PolarHBondContact OE1-NE2 3.22Å
184	L	89.4	Confident	85	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60	-46.8	172.4	178.3	59.7	0	0	0	111.7	V128 G155 L159 L172 L176 I179 S180 R186 Q187 L188	V128-L184 HydrophobicContact CG1-CD2 4.41Å; G155-L184 WeakPolarHBondContact O-CD1 3.09Å; L159-L184 HydrophobicContact CD1-CD1 4.29Å; L159-L184 HydrophobicContact CD2-CD1 3.88Å; L159-L184 HydrophobicContact CG-CD1 3.79Å; L172-L184 HydrophobicContact CD1-CD2 4.44Å; L172-L184 HydrophobicContact CD1-CG 4.43Å; L172-L184 HydrophobicContact CD2-CD2 3.68Å; L172-L184 HydrophobicContact CD2-CG 4.4Å; L176-L184 HydrophobicContact CD1-CD2 3.93Å; I179-L184 HydrophobicContact CD1-CB 4.49Å; I179-L184 HydrophobicContact CG2-CB 4.15Å; S180-L184 PolarHBondContact O-N 3.31Å; L184-R186 PolarHBondContact O-N 2.98Å; L184-Q187 PolarHBondContact O-N 3.42Å; L184-L188 HydrophobicContact CD1-CD1 4.09Å; L184-L188 HydrophobicContact CD1-CG 4.18Å; L184-L188 HydrophobicContact CG-CD1 3.89Å; L184-L188 HydrophobicContact CG-CG 4.42Å; L184-L188 WeakPolarHBondContact O-CB 3.36Å; L184-L188 WeakPolarHBondContact O-CG 3.35Å; L184-L188 PolarHBondContact O-N 3.16Å
185	C	88.4	Confident	85	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57.6	-47	176.3	178.8	0	0	0	0	111.7	L172 G181 F182 Q187 L188 L189 F199 I215	L172-C185 HydrophobicContact CD1-CB 3.86Å; G181-C185 WeakPolarHBondContact O-CB 3.29Å; G181-C185 PolarHBondContact O-N 3.01Å; F182-C185 WeakPolarHBondContact O-CB 3.31Å; F182-C185 PolarHBondContact O-N 2.96Å; C185-Q187 VanDerWaalsContact C-N 3.29Å; C185-Q187 PolarHBondContact O-N 3.07Å; C185-L188 PolarHBondContact O-N 2.94Å; C185-L189 WeakPolarHBondContact O-CB 3.41Å; C185-L189 WeakPolarHBondContact O-CG 3.42Å; C185-L189 PolarHBondContact O-N 3.16Å; C185-F199 HydrophobicContact CB-CE1 4.3Å; C185-F199 HydrophobicContact CB-CE2 4.34Å; C185-F199 HydrophobicContact CB-CZ 3.53Å; C185-I215 HydrophobicContact CB-CG2 4.29Å
186	R	86.2	Confident	85.3	Confident	146 Å²	146	46.4 Å²	46.4	55%	0.551	27%	0.269	S	S	*	.	H	α-helix	trans	-55.5	-44.5	177.1	-172.8	-179.1	72.5	158.5	3.9	112.1	F182 E183 L184 A190 I215	F182-R186 PolarHBondContact O-N 2.93Å; E183-R186 PolarHBondContact O-N 3.12Å; E183-R186 IonicContact OE1-CZ 3.7Å; E183-R186 VanDerWaalsContact OE1-CZ 3.31Å; E183-R186 IonicContact OE1-NE 3.91Å; E183-R186 PolarHBondContact OE1-NE 3.21Å; E183-R186 IonicContact OE1-NH2 2.97Å; E183-R186 PolarHBondContact OE1-NH2 2.88Å; E183-R186 IonicContact OE2-CZ 2.61Å; E183-R186 IonicContact OE2-NE 3.69Å; E183-R186 PolarHBondContact OE2-NE 3.47Å; E183-R186 IonicContact OE2-NH1 3.84Å; E183-R186 IonicContact OE2-NH2 2.93Å; E183-R186 PolarHBondContact OE2-NH2 3.34Å; L184-R186 PolarHBondContact O-N 2.98Å; R186-A190 WeakPolarHBondContact O-CB 3.41Å; R186-A190 PolarHBondContact O-N 3.25Å; R186-A190 VanDerWaalsContact O-N 3.08Å; R186-I215 HydrophobicContact CB-CG2 4.05Å
187	Q	90.2	Very high	85.6	Confident	67 Å²	67	45.8 Å²	45.8	31%	0.313	27%	0.266	S	S	.	.	H	α-helix	trans	-71.6	-38	179.4	-67.5	-176	34.4	0	0	112.4	L159 E183 L184 C185 A190 L191	L159-Q187 HydrophobicContact CD1-CB 4.49Å; L159-Q187 HydrophobicContact CD2-CB 3.71Å; E183-Q187 WeakPolarHBondContact O-CG 3.39Å; E183-Q187 PolarHBondContact O-N 3.45Å; E183-Q187 VanDerWaalsContact O-N 3.14Å; E183-Q187 PolarHBondContact OE1-NE2 3.22Å; L184-Q187 PolarHBondContact O-N 3.42Å; C185-Q187 VanDerWaalsContact C-N 3.29Å; C185-Q187 PolarHBondContact O-N 3.07Å; Q187-A190 PolarHBondContact O-N 2.96Å; Q187-L191 WeakPolarHBondContact O-CG 3.28Å; Q187-L191 PolarHBondContact O-N 3.03Å
188	L	88.3	Confident	86	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-43.6	174.8	-73.8	169.5	0	0	0	112	V158 L159 A162 M170 L172 L184 C185 A190 L191 H192 L195	V158-L188 HydrophobicContact CG1-CD2 4.41Å; L159-L188 HydrophobicContact CD2-CD2 4.03Å; L159-L188 HydrophobicContact CD2-CG 4.12Å; A162-L188 HydrophobicContact CB-CD2 3.53Å; M170-L188 HydrophobicContact CE-CD1 3.79Å; M170-L188 HydrophobicContact CE-CD2 4.3Å; M170-L188 HydrophobicContact CG-CD1 4.12Å; L172-L188 HydrophobicContact CD1-CD1 4.35Å; L184-L188 HydrophobicContact CD1-CD1 4.09Å; L184-L188 HydrophobicContact CD1-CG 4.18Å; L184-L188 HydrophobicContact CG-CD1 3.89Å; L184-L188 HydrophobicContact CG-CG 4.42Å; L184-L188 WeakPolarHBondContact O-CB 3.36Å; L184-L188 WeakPolarHBondContact O-CG 3.35Å; L184-L188 PolarHBondContact O-N 3.16Å; C185-L188 PolarHBondContact O-N 2.94Å; L188-A190 VanDerWaalsContact C-N 3.3Å; L188-A190 PolarHBondContact O-N 3.05Å; L188-L191 PolarHBondContact O-N 3.1Å; L188-L191 VanDerWaalsContact O-N 3.12Å; L188-H192 PolarHBondContact O-N 3.45Å; L188-L195 HydrophobicContact CB-CD2 4.15Å
189	L	85.3	Confident	86	Confident	31 Å²	31	38.9 Å²	38.9	16%	0.162	22%	0.224	C	C	.	.	H	α-helix	trans	-69.9	-26.1	177.7	-69.2	177.6	0	0	0	112.6	C185 L191 H192 P193 L195 V197 I215	C185-L189 WeakPolarHBondContact O-CB 3.41Å; C185-L189 WeakPolarHBondContact O-CG 3.42Å; C185-L189 PolarHBondContact O-N 3.16Å; L189-L191 VanDerWaalsContact C-N 3.33Å; L189-H192 CarbonylContact O-C 3.46Å; L189-P193 VanDerWaalsContact O-CA 3.27Å; L189-P193 WeakPolarHBondContact O-CA 3.31Å; L189-L195 HydrophobicContact CD2-CB 4.5Å; L189-L195 WeakPolarHBondContact CD2-O 3.39Å; L189-V197 HydrophobicContact CD2-CG2 4.31Å; L189-I215 WeakPolarHBondContact CD1-O 3.42Å
190	A	85.7	Confident	85.9	Confident	83 Å²	83	37.8 Å²	37.8	69%	0.686	22%	0.218	S	C	*	.	H	α-helix	trans	-68	-32.7	169.5	0	0	0	0	0	112.5	R186 Q187 L188	R186-A190 WeakPolarHBondContact O-CB 3.41Å; R186-A190 PolarHBondContact O-N 3.25Å; R186-A190 VanDerWaalsContact O-N 3.08Å; Q187-A190 PolarHBondContact O-N 2.96Å; L188-A190 VanDerWaalsContact C-N 3.3Å; L188-A190 PolarHBondContact O-N 3.05Å
191	L	86	Confident	85.4	Confident	72 Å²	72	35.7 Å²	35.7	38%	0.377	20%	0.203	S	C	.	.	H	α-helix	trans	-81.1	-43.3	175.4	-66.1	171.4	0	0	0	112.2	L159 R163 Q187 L188 L189	L159-L191 HydrophobicContact CD2-CD1 4.37Å; R163-L191 HydrophobicContact CG-CD1 4.06Å; R163-L191 HydrophobicContact CG-CD2 4.41Å; Q187-L191 WeakPolarHBondContact O-CG 3.28Å; Q187-L191 PolarHBondContact O-N 3.03Å; L188-L191 PolarHBondContact O-N 3.1Å; L188-L191 VanDerWaalsContact O-N 3.12Å; L189-L191 VanDerWaalsContact C-N 3.33Å
192	H	85.2	Confident	84.8	Confident	56 Å²	56	38.6 Å²	38.6	26%	0.259	23%	0.227	S	C	.	.			trans	-133.2	84	-175.1	-62.3	-62	0	0	0	110.6	A162 L188 L189 A194 L195	A162-H192 PolarHBondContact O-NE2 3.23Å; L188-H192 PolarHBondContact O-N 3.45Å; L189-H192 CarbonylContact O-C 3.46Å; H192-A194 PolarHBondContact O-N 3.49Å; H192-L195 HydrophobicContact CB-CB 3.91Å; H192-L195 VanDerWaalsContact O-CB 3.31Å; H192-L195 WeakPolarHBondContact O-CB 3.18Å; H192-L195 PolarHBondContact O-N 3.31Å
193	P	82.3	Confident	83.3	Confident	112 Å²	112	47.2 Å²	47.2	73%	0.727	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-13.6	-174.3	-25.8	34.4	0	0	0	116	L189	L189-P193 VanDerWaalsContact O-CA 3.27Å; L189-P193 WeakPolarHBondContact O-CA 3.31Å
194	A	78.8	Confident	81.6	Confident	88 Å²	88	49.6 Å²	49.6	73%	0.727	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	4.2	-179.8	0	0	0	0	0	113.3	H192 P196	H192-A194 PolarHBondContact O-N 3.49Å; A194-P196 WeakPolarHBondContact O-CD 3.17Å
195	L	84.1	Confident	79.9	Confident	8 Å²	8	55.3 Å²	55.3	4%	0.042	31%	0.308	C	S	.	.			trans	-70	121.2	179.5	173.6	64	0	0	0	109.9	P167 M170 L188 L189 H192 V197	P167-L195 HydrophobicContact CB-CD1 4.46Å; P167-L195 HydrophobicContact CG-CD1 3.79Å; P167-L195 HydrophobicContact CG-CD2 4.33Å; P167-L195 WeakPolarHBondContact O-CD1 3.24Å; M170-L195 HydrophobicContact CB-CD1 4.46Å; M170-L195 HydrophobicContact CB-CD2 4.22Å; M170-L195 HydrophobicContact CB-CG 4.42Å; M170-L195 HydrophobicContact CE-CD2 4.49Å; L188-L195 HydrophobicContact CB-CD2 4.15Å; L189-L195 HydrophobicContact CD2-CB 4.5Å; L189-L195 WeakPolarHBondContact CD2-O 3.39Å; H192-L195 HydrophobicContact CB-CB 3.91Å; H192-L195 VanDerWaalsContact O-CB 3.31Å; H192-L195 WeakPolarHBondContact O-CB 3.18Å; H192-L195 PolarHBondContact O-N 3.31Å; L195-V197 HydrophobicContact CG-CG2 4.36Å
196	P	87.1	Confident	78.1	Confident	5 Å²	5	62.9 Å²	62.9	3%	0.032	34%	0.344	C	S	.	.			trans	-78.2	134.1	177	-7.2	23.9	0	0	0	111.3	D168 V169 M170 A194 D218 L237 V241	D168-P196 WeakPolarHBondContact O-CD 3.3Å; V169-P196 HydrophobicContact CG2-CB 4.01Å; V169-P196 HydrophobicContact CG2-CG 4.48Å; M170-P196 PolarHBondContact N-O 2.93Å; A194-P196 WeakPolarHBondContact O-CD 3.17Å; P196-D218 WeakPolarHBondContact CA-OD2 3.2Å; P196-L237 HydrophobicContact CB-CB 4.17Å; P196-L237 HydrophobicContact CB-CD1 4.48Å; P196-V241 HydrophobicContact CB-CG2 4.32Å; P196-V241 HydrophobicContact CG-CG2 3.23Å
197	V	89	Confident	76.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.4	-175.8	-174.6	0	0	0	0	110.9	M170 L172 L189 L195 A217 D218 D219	M170-V197 HydrophobicContact CB-CG2 4.26Å; M170-V197 CarbonylContact O-C 3.59Å; M170-V197 WeakPolarHBondContact O-CA 3.26Å; L172-V197 HydrophobicContact CD1-CG1 3.67Å; L172-V197 HydrophobicContact CG-CG1 4.04Å; L189-V197 HydrophobicContact CD2-CG2 4.31Å; L195-V197 HydrophobicContact CG-CG2 4.36Å; V197-A217 HydrophobicContact CB-CB 4.41Å; V197-A217 HydrophobicContact CG1-CB 4.47Å; V197-D218 PolarHBondContact N-OD2 3.04Å; V197-D218 PolarHBondContact O-N 2.87Å; V197-D219 PolarHBondContact O-N 3.34Å
198	L	89.4	Confident	74.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.4	173.3	178.6	66	0	0	0	109.6	M170 I171 L172 D219 V221 V230 R233 V234 L237	M170-L198 PolarHBondContact O-N 2.8Å; I171-L198 CarbonylContact C-O 3.59Å; I171-L198 WeakPolarHBondContact CA-O 3.47Å; I171-L198 HydrophobicContact CG1-CB 4.5Å; I171-L198 HydrophobicContact CG1-CD2 4.4Å; L172-L198 PolarHBondContact N-O 3.19Å; L198-D219 HydrophobicContact CD1-CB 3.72Å; L198-V221 HydrophobicContact CD1-CG2 4.06Å; L198-V230 HydrophobicContact CD2-CG1 3.74Å; L198-R233 HydrophobicContact CD1-CB 4.19Å; L198-R233 HydrophobicContact CD2-CB 4.23Å; L198-V234 HydrophobicContact CD2-CG2 3.93Å; L198-L237 HydrophobicContact CB-CD1 3.97Å
199	F	88.4	Confident	72.9	Confident	1 Å²	1	65.1 Å²	65.1	0%	0.004	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	138.8	175	-81.1	-62.4	0	0	0	112.9	L172 V174 G181 F182 C185 T201 A217 D219 Y220 V221	L172-F199 HydrophobicContact CB-CD1 3.8Å; L172-F199 HydrophobicContact CB-CE1 3.8Å; L172-F199 HydrophobicContact CD1-CE1 3.92Å; L172-F199 HydrophobicContact CD1-CZ 4.4Å; L172-F199 HydrophobicContact CG-CE1 4.48Å; L172-F199 CarbonylContact O-C 3.58Å; L172-F199 WeakPolarHBondContact O-CA 3.25Å; V174-F199 HydrophobicContact CG2-CB 4.49Å; V174-F199 HydrophobicContact CG2-CD1 3.81Å; V174-F199 HydrophobicContact CG2-CE1 4.36Å; V174-F199 HydrophobicContact CG2-CG 4.32Å; G181-F199 WeakPolarHBondContact O-CE1 3.29Å; F182-F199 HydrophobicContact CD1-CE1 4.13Å; F182-F199 AromaticContact CD1-CE2 3.75Å; F182-F199 HydrophobicContact CD1-CE2 3.75Å; F182-F199 AromaticContact CD1-CZ 3.56Å; F182-F199 HydrophobicContact CD1-CZ 3.56Å; F182-F199 HydrophobicContact CE1-CD2 4.14Å; F182-F199 HydrophobicContact CE1-CE1 4.36Å; F182-F199 AromaticContact CE1-CE2 3.82Å; F182-F199 HydrophobicContact CE1-CE2 3.82Å; F182-F199 AromaticContact CE1-CZ 3.97Å; F182-F199 HydrophobicContact CE1-CZ 3.97Å; F182-F199 HydrophobicContact CG-CZ 4.49Å; C185-F199 HydrophobicContact CB-CE1 4.3Å; C185-F199 HydrophobicContact CB-CE2 4.34Å; C185-F199 HydrophobicContact CB-CZ 3.53Å; F199-T201 HydrophobicContact CB-CG2 4.02Å; F199-A217 HydrophobicContact CD2-CB 3.26Å; F199-A217 HydrophobicContact CE2-CB 3.25Å; F199-A217 HydrophobicContact CG-CB 4.47Å; F199-A217 HydrophobicContact CZ-CB 4.43Å; F199-D219 PolarHBondContact N-O 2.88Å; F199-Y220 HydrophobicContact CD2-CD1 4.48Å; F199-Y220 CarbonylContact O-C 3.55Å; F199-Y220 WeakPolarHBondContact O-CA 3.49Å; F199-V221 PolarHBondContact O-N 2.69Å
200	L	85.3	Confident	71.5	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	124	162.1	-52	-178.6	0	0	0	107.4	I171 L172 D173 V174 V221 F225 V230	I171-L200 HydrophobicContact CG2-CD1 3.77Å; I171-L200 HydrophobicContact CG2-CD2 3.99Å; I171-L200 HydrophobicContact CG2-CG 3.73Å; L172-L200 PolarHBondContact O-N 3.1Å; D173-L200 VanDerWaalsContact OD1-O 3.11Å; V174-L200 PolarHBondContact N-O 3.43Å; V174-L200 VanDerWaalsContact N-O 3.15Å; L200-V221 CarbonylContact C-O 3.54Å; L200-V221 WeakPolarHBondContact CA-O 3.39Å; L200-V221 HydrophobicContact CD2-CB 4.03Å; L200-V221 HydrophobicContact CD2-CG1 4.4Å; L200-F225 HydrophobicContact CB-CE1 4.17Å; L200-F225 HydrophobicContact CD1-CE1 3.99Å; L200-F225 HydrophobicContact CD1-CZ 3.84Å; L200-F225 HydrophobicContact CD2-CD1 4.31Å; L200-F225 HydrophobicContact CD2-CE1 3.78Å; L200-F225 HydrophobicContact CD2-CZ 4.06Å; L200-F225 HydrophobicContact CG-CE1 4.19Å; L200-F225 HydrophobicContact CG-CZ 4.45Å; L200-V230 HydrophobicContact CD2-CG2 4.26Å
201	T	73.6	Confident	70.1	Confident	9 Å²	9	67.3 Å²	67.3	6%	0.055	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	143.6	-169	59.9	0	0	0	0	110.6	V174 F199 V221 A222 K223	V174-T201 HydrophobicContact CG2-CG2 3.89Å; F199-T201 HydrophobicContact CB-CG2 4.02Å; T201-V221 PolarHBondContact N-O 2.8Å; T201-V221 PolarHBondContact OG1-O 3.19Å; T201-A222 CarbonylContact O-C 3.52Å; T201-A222 WeakPolarHBondContact O-CA 3.39Å; T201-K223 WeakPolarHBondContact O-CB 3.45Å; T201-K223 PolarHBondContact O-N 2.92Å
202	A	69.3	Low	68.4	Low	60 Å²	60	63.9 Å²	63.9	50%	0.496	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	142.5	170.3	0	0	0	0	0	110.8	S204	A202-S204 VanDerWaalsContact C-N 3.33Å; A202-S204 PolarHBondContact O-N 3.31Å
203	R	52.6	Low	66.9	Low	198 Å²	198	66.2 Å²	66.2	75%	0.747	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	84.9	171	-100	-173.4	171.5	-176.7	-2.5	110.2	A222 K223	R203-A222 HydrophobicContact CG-CB 4.1Å; R203-K223 WeakPolarHBondContact CB-O 3.37Å; R203-K223 WeakPolarHBondContact CG-O 3.45Å; R203-K223 PolarHBondContact N-O 3.5Å
204	S	50.3	Low	65.7	Low	106 Å²	106	68.6 Å²	68.6	74%	0.741	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-169.1	-10.7	160.4	34.8	0	0	0	0	119.8	A202	A202-S204 VanDerWaalsContact C-N 3.33Å; A202-S204 PolarHBondContact O-N 3.31Å
205	E	52.6	Low	64.9	Low	119 Å²	119	66.6 Å²	66.6	56%	0.556	34%	0.335	S	S	*	.			trans	-130.2	117.5	-180	-64.9	-163.3	-179.5	0	0	113.9	V207 D208	E205-V207 HydrophobicContact CB-CB 4.31Å; E205-V207 PolarHBondContact O-N 3.46Å; E205-V207 VanDerWaalsContact O-N 3.11Å; E205-D208 PolarHBondContact O-N 2.79Å; E205-D208 VanDerWaalsContact O-N 3.14Å
206	E	50.2	Low	63.6	Low	159 Å²	159	68 Å²	68	74%	0.743	35%	0.351	S	S	*	.	H	α-helix	trans	-52	-26.9	168.8	-161.7	167.8	-154.7	0	0	111.6	L210	E206-L210 PolarHBondContact O-N 3.43Å
207	V	52	Low	62.5	Low	78 Å²	78	68.2 Å²	68.2	47%	0.473	35%	0.353	S	S	.	.	H	α-helix	trans	-64	-42.7	178	-176.2	0	0	0	0	112.6	E205 R209 L210 L211	E205-V207 HydrophobicContact CB-CB 4.31Å; E205-V207 PolarHBondContact O-N 3.46Å; E205-V207 VanDerWaalsContact O-N 3.11Å; V207-R209 VanDerWaalsContact C-N 3.35Å; V207-R209 PolarHBondContact O-N 3Å; V207-L210 PolarHBondContact O-N 3.21Å; V207-L211 HydrophobicContact CG1-CD1 3.6Å; V207-L211 PolarHBondContact O-N 2.82Å
208	D	52	Low	61.8	Low	44 Å²	44	71.7 Å²	71.7	24%	0.235	37%	0.372	C	S	.	.	H	α-helix	trans	-68.3	-34.5	-177.7	-76.4	-20	0	0	0	112.2	F182 E205 G212	F182-D208 HydrophobicContact CE2-CB 4.16Å; F182-D208 HydrophobicContact CZ-CB 3.92Å; F182-D208 WeakPolarHBondContact CZ-O 2.85Å; E205-D208 PolarHBondContact O-N 2.79Å; E205-D208 VanDerWaalsContact O-N 3.14Å; D208-G212 PolarHBondContact O-N 3.2Å
209	R	52.5	Low	61.3	Low	139 Å²	139	73 Å²	73	53%	0.525	38%	0.379	S	S	.	.	H	α-helix	trans	-67	-41.2	173.8	-99.9	-179.5	174.2	-175.4	-2	112.1	V207 L213	V207-R209 VanDerWaalsContact C-N 3.35Å; V207-R209 PolarHBondContact O-N 3Å; R209-L213 WeakPolarHBondContact O-CB 3.41Å; R209-L213 WeakPolarHBondContact O-CD1 3.38Å; R209-L213 WeakPolarHBondContact O-CG 3.33Å; R209-L213 PolarHBondContact O-N 3.26Å; R209-L213 VanDerWaalsContact O-N 3.17Å
210	L	54.4	Low	61	Low	85 Å²	85	74.6 Å²	74.6	45%	0.445	39%	0.385	S	S	.	.	H	α-helix	trans	-65.5	-45.9	177.7	-101.9	140.1	0	0	0	111.7	E206 V207 L213 E214	E206-L210 PolarHBondContact O-N 3.43Å; V207-L210 PolarHBondContact O-N 3.21Å; L210-L213 PolarHBondContact O-N 2.81Å; L210-E214 PolarHBondContact O-N 2.75Å; L210-E214 VanDerWaalsContact O-N 3.17Å
211	L	56.4	Low	60.9	Low	74 Å²	74	74.7 Å²	74.7	39%	0.387	39%	0.385	S	S	.	.	H	α-helix	trans	-64.7	-42.4	176	-95.5	125	0	0	0	112.5	V207 L213 E214 I215	V207-L211 HydrophobicContact CG1-CD1 3.6Å; V207-L211 PolarHBondContact O-N 2.82Å; L211-L213 VanDerWaalsContact C-N 3.29Å; L211-L213 PolarHBondContact O-N 3.46Å; L211-E214 PolarHBondContact O-N 3.29Å; L211-I215 HydrophobicContact CD2-CD1 4.17Å; L211-I215 WeakPolarHBondContact O-CB 3.41Å; L211-I215 WeakPolarHBondContact O-CD1 3.27Å; L211-I215 WeakPolarHBondContact O-CG1 3.33Å; L211-I215 PolarHBondContact O-N 3.33Å
212	G	51.9	Low	61.1	Low	0 Å²	0	75.7 Å²	75.7	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-62	-34.8	177.6	0	0	0	0	0	113.8	D208 G216 A217	D208-G212 PolarHBondContact O-N 3.2Å; G212-G216 PolarHBondContact O-N 3.44Å; G212-A217 PolarHBondContact O-N 3.25Å; G212-A217 VanDerWaalsContact O-N 3.13Å
213	L	53.7	Low	61.4	Low	105 Å²	105	74.4 Å²	74.4	55%	0.55	38%	0.378	S	S	.	.	H	α-helix	trans	-68.3	-41.7	174.2	-88.6	160.8	0	0	0	112.9	R209 L210 L211 Y220	R209-L213 WeakPolarHBondContact O-CB 3.41Å; R209-L213 WeakPolarHBondContact O-CD1 3.38Å; R209-L213 WeakPolarHBondContact O-CG 3.33Å; R209-L213 PolarHBondContact O-N 3.26Å; R209-L213 VanDerWaalsContact O-N 3.17Å; L210-L213 PolarHBondContact O-N 2.81Å; L211-L213 VanDerWaalsContact C-N 3.29Å; L211-L213 PolarHBondContact O-N 3.46Å; L213-Y220 WeakPolarHBondContact CD2-OH 3.46Å; L213-Y220 HydrophobicContact CG-CE1 4.15Å; L213-Y220 HydrophobicContact CG-CE2 4.4Å; L213-Y220 WeakPolarHBondContact CG-OH 3.3Å
214	E	56.7	Low	62.4	Low	163 Å²	163	70.3 Å²	70.3	76%	0.762	38%	0.377	S	S	*	.	H	α-helix	trans	-72.2	-29.2	179.3	-72.9	-170.2	160.5	0	0	113.1	L210 L211	L210-E214 PolarHBondContact O-N 2.75Å; L210-E214 VanDerWaalsContact O-N 3.17Å; L211-E214 PolarHBondContact O-N 3.29Å
215	I	61	Low	63.8	Low	45 Å²	45	67.1 Å²	67.1	23%	0.231	35%	0.35	C	S	.	.	H	α-helix	trans	-82.5	-15.8	-177.9	-65.9	169.6	0	0	0	112.5	F182 C185 R186 L189 L211	F182-I215 HydrophobicContact CB-CD1 3.62Å; F182-I215 HydrophobicContact CD1-CD1 4.07Å; F182-I215 HydrophobicContact CG-CD1 4.04Å; C185-I215 HydrophobicContact CB-CG2 4.29Å; R186-I215 HydrophobicContact CB-CG2 4.05Å; L189-I215 WeakPolarHBondContact CD1-O 3.42Å; L211-I215 HydrophobicContact CD2-CD1 4.17Å; L211-I215 WeakPolarHBondContact O-CB 3.41Å; L211-I215 WeakPolarHBondContact O-CD1 3.27Å; L211-I215 WeakPolarHBondContact O-CG1 3.33Å; L211-I215 PolarHBondContact O-N 3.33Å
216	G	57.8	Low	65	Low	38 Å²	38	64.2 Å²	64.2	39%	0.392	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.1	22.3	171.1	0	0	0	0	0	115.5	G212	G212-G216 PolarHBondContact O-N 3.44Å
217	A	64.4	Low	66.3	Low	9 Å²	9	58.1 Å²	58.1	7%	0.074	32%	0.317	C	S	.	.			trans	-72.4	144.1	170.5	0	0	0	0	0	112.6	V197 F199 G212 Y220	V197-A217 HydrophobicContact CB-CB 4.41Å; V197-A217 HydrophobicContact CG1-CB 4.47Å; F199-A217 HydrophobicContact CD2-CB 3.26Å; F199-A217 HydrophobicContact CE2-CB 3.25Å; F199-A217 HydrophobicContact CG-CB 4.47Å; F199-A217 HydrophobicContact CZ-CB 4.43Å; G212-A217 PolarHBondContact O-N 3.25Å; G212-A217 VanDerWaalsContact O-N 3.13Å; A217-Y220 HydrophobicContact CB-CE1 4.38Å
218	D	73.3	Confident	67.4	Low	73 Å²	73	63.3 Å²	63.3	39%	0.39	33%	0.328	S	S	.	.	S	Bend	trans	-82.8	-26.8	-174.1	-61	-96.5	0	0	0	113.6	P196 V197 L237	P196-D218 WeakPolarHBondContact CA-OD2 3.2Å; V197-D218 PolarHBondContact N-OD2 3.04Å; V197-D218 PolarHBondContact O-N 2.87Å; D218-L237 HydrophobicContact CB-CD1 4.44Å; D218-L237 HydrophobicContact CB-CD2 3.3Å; D218-L237 HydrophobicContact CB-CG 4.49Å
219	D	79.2	Confident	68.9	Low	27 Å²	27	64.8 Å²	64.8	14%	0.144	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	168.2	-179.4	-158.2	3.9	0	0	0	112.5	V197 L198 F199 R233 L237	V197-D219 PolarHBondContact O-N 3.34Å; L198-D219 HydrophobicContact CD1-CB 3.72Å; F199-D219 PolarHBondContact N-O 2.88Å; D219-R233 IonicContact OD1-CZ 3.45Å; D219-R233 IonicContact OD1-NH1 2.89Å; D219-R233 PolarHBondContact OD1-NH1 2.84Å; D219-R233 WeakPolarHBondContact OD2-CD 3.15Å; D219-R233 VanDerWaalsContact OD2-CG 3.29Å; D219-R233 WeakPolarHBondContact OD2-CG 3.3Å; D219-R233 IonicContact OD2-CZ 3.56Å; D219-R233 IonicContact OD2-NE 2.68Å; D219-R233 IonicContact OD2-NH1 3.64Å; D219-R233 PolarHBondContact OD2-NH1 3.12Å; D219-L237 HydrophobicContact CB-CD2 4.31Å
220	Y	82.1	Confident	70.4	Confident	36 Å²	36	58.2 Å²	58.2	14%	0.141	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150	-178.9	-11.6	-90.8	0	0	0	111.9	F199 L213 A217	F199-Y220 HydrophobicContact CD2-CD1 4.48Å; F199-Y220 CarbonylContact O-C 3.55Å; F199-Y220 WeakPolarHBondContact O-CA 3.49Å; L213-Y220 WeakPolarHBondContact CD2-OH 3.46Å; L213-Y220 HydrophobicContact CG-CE1 4.15Å; L213-Y220 HydrophobicContact CG-CE2 4.4Å; L213-Y220 WeakPolarHBondContact CG-OH 3.3Å; A217-Y220 HydrophobicContact CB-CE1 4.38Å
221	V	82	Confident	71.8	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.2	172.9	174.9	0	0	0	0	109	L198 F199 L200 T201 F225 V230	L198-V221 HydrophobicContact CD1-CG2 4.06Å; F199-V221 PolarHBondContact O-N 2.69Å; L200-V221 CarbonylContact C-O 3.54Å; L200-V221 WeakPolarHBondContact CA-O 3.39Å; L200-V221 HydrophobicContact CD2-CB 4.03Å; L200-V221 HydrophobicContact CD2-CG1 4.4Å; T201-V221 PolarHBondContact N-O 2.8Å; T201-V221 PolarHBondContact OG1-O 3.19Å; V221-F225 HydrophobicContact CG1-CB 3.21Å; V221-F225 HydrophobicContact CG1-CD1 3.61Å; V221-F225 HydrophobicContact CG1-CD2 4.46Å; V221-F225 HydrophobicContact CG1-CG 3.53Å; V221-V230 HydrophobicContact CG1-CG2 4.08Å; V221-V230 HydrophobicContact CG2-CG2 4.31Å
222	A	79.4	Confident	72.8	Confident	30 Å²	30	52.3 Å²	52.3	25%	0.248	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	133.6	179.3	0	0	0	0	0	111.4	T201 R203 P224 F225	T201-A222 CarbonylContact O-C 3.52Å; T201-A222 WeakPolarHBondContact O-CA 3.39Å; R203-A222 HydrophobicContact CG-CB 4.1Å; A222-P224 CarbonylContact O-C 3.48Å; A222-P224 VanDerWaalsContact O-C 3.23Å; A222-F225 WeakPolarHBondContact O-CB 3.36Å; A222-F225 PolarHBondContact O-N 3.43Å
223	K	75	Confident	74.4	Confident	34 Å²	34	55.6 Å²	55.6	15%	0.148	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	131.6	170.7	-68	179.1	178.4	-170.4	0	109	E129 I134 D173 T201 R203 F225	E129-K223 IonicContact OE1-NZ 3.63Å; E129-K223 PolarHBondContact OE1-NZ 3.27Å; E129-K223 WeakPolarHBondContact OE2-CE 3.48Å; E129-K223 IonicContact OE2-NZ 3.87Å; E129-K223 PolarHBondContact OE2-NZ 2.93Å; I134-K223 HydrophobicContact CD1-CD 4.22Å; D173-K223 IonicContact OD1-NZ 3.69Å; D173-K223 IonicContact OD2-NZ 3.41Å; D173-K223 PolarHBondContact OD2-NZ 2.85Å; T201-K223 WeakPolarHBondContact O-CB 3.45Å; T201-K223 PolarHBondContact O-N 2.92Å; R203-K223 WeakPolarHBondContact CB-O 3.37Å; R203-K223 WeakPolarHBondContact CG-O 3.45Å; R203-K223 PolarHBondContact N-O 3.5Å; K223-F225 HydrophobicContact CB-CD1 4.41Å; K223-F225 HydrophobicContact CD-CE1 4.38Å; K223-F225 HydrophobicContact CG-CD1 3.76Å; K223-F225 HydrophobicContact CG-CE1 3.5Å; K223-F225 VanDerWaalsContact CG-CE1 3.5Å
224	P	73.8	Confident	75.9	Confident	111 Å²	111	50.6 Å²	50.6	72%	0.721	27%	0.269	S	S	*	.	S	Bend	cis	-79.6	138.5	-2.2	32.6	-33.1	0	0	0	112	A222	A222-P224 CarbonylContact O-C 3.48Å; A222-P224 VanDerWaalsContact O-C 3.23Å
225	F	79.4	Confident	76.9	Confident	39 Å²	39	46.7 Å²	46.7	17%	0.171	25%	0.247	C	C	.	.			trans	-118.7	163.6	179.9	50.7	-105.9	0	0	0	112.6	I134 L200 V221 A222 K223 V230	I134-F225 HydrophobicContact CG2-CE2 4.27Å; I134-F225 HydrophobicContact CG2-CZ 3.6Å; L200-F225 HydrophobicContact CB-CE1 4.17Å; L200-F225 HydrophobicContact CD1-CE1 3.99Å; L200-F225 HydrophobicContact CD1-CZ 3.84Å; L200-F225 HydrophobicContact CD2-CD1 4.31Å; L200-F225 HydrophobicContact CD2-CE1 3.78Å; L200-F225 HydrophobicContact CD2-CZ 4.06Å; L200-F225 HydrophobicContact CG-CE1 4.19Å; L200-F225 HydrophobicContact CG-CZ 4.45Å; V221-F225 HydrophobicContact CG1-CB 3.21Å; V221-F225 HydrophobicContact CG1-CD1 3.61Å; V221-F225 HydrophobicContact CG1-CD2 4.46Å; V221-F225 HydrophobicContact CG1-CG 3.53Å; A222-F225 WeakPolarHBondContact O-CB 3.36Å; A222-F225 PolarHBondContact O-N 3.43Å; K223-F225 HydrophobicContact CB-CD1 4.41Å; K223-F225 HydrophobicContact CD-CE1 4.38Å; K223-F225 HydrophobicContact CG-CD1 3.76Å; K223-F225 HydrophobicContact CG-CE1 3.5Å; K223-F225 VanDerWaalsContact CG-CE1 3.5Å; F225-V230 HydrophobicContact CD2-CG2 3.63Å; F225-V230 HydrophobicContact CE2-CG2 3.88Å; F225-V230 HydrophobicContact CG-CG2 4.13Å
226	S	78.8	Confident	77.6	Confident	58 Å²	58	46.6 Å²	46.6	41%	0.406	25%	0.249	S	C	.	.			trans	-86.1	131.4	166.3	-176.5	0	0	0	0	110	R228 E229 V230	S226-R228 PolarHBondContact O-N 2.96Å; S226-R228 VanDerWaalsContact O-N 3.1Å; S226-E229 WeakPolarHBondContact O-CA 3.32Å; S226-E229 VanDerWaalsContact O-CB 3.25Å; S226-E229 WeakPolarHBondContact O-CB 3.47Å; S226-E229 PolarHBondContact O-N 2.92Å; S226-V230 PolarHBondContact O-N 3.42Å
227	P	76.7	Confident	78.8	Confident	31 Å²	31	44.9 Å²	44.9	20%	0.201	23%	0.231	C	C	.	.	H	α-helix	trans	-53	-33.6	172.9	-28.9	35.5	0	0	0	113.1	T137 M141 E229 V230 C231	T137-P227 HydrophobicContact CG2-CB 4.44Å; T137-P227 HydrophobicContact CG2-CG 3.58Å; M141-P227 HydrophobicContact CB-CB 4.16Å; M141-P227 HydrophobicContact CG-CB 3.77Å; P227-E229 VanDerWaalsContact C-N 3.29Å; P227-E229 PolarHBondContact O-N 2.85Å; P227-V230 PolarHBondContact O-N 2.93Å; P227-C231 PolarHBondContact O-N 3.37Å; P227-C231 PolarHBondContact O-SG 3.14Å
228	R	75.3	Confident	79.5	Confident	188 Å²	188	45 Å²	45	71%	0.709	23%	0.23	S	C	*	.	H	α-helix	trans	-64.5	-31.5	176.3	-63	-179.3	74.4	179.6	3.8	112.9	M141 S226 A232	M141-R228 HydrophobicContact CE-CG 3.79Å; S226-R228 PolarHBondContact O-N 2.96Å; S226-R228 VanDerWaalsContact O-N 3.1Å; R228-A232 WeakPolarHBondContact O-CB 3.24Å; R228-A232 PolarHBondContact O-N 2.99Å; R228-A232 VanDerWaalsContact O-N 3.1Å
229	E	82.2	Confident	79.3	Confident	75 Å²	75	49.5 Å²	49.5	35%	0.35	24%	0.241	S	C	.	.	H	α-helix	trans	-67.2	-47.1	175.4	-175.4	-178	168.7	0	0	110.4	S226 P227 C231 A232 R233	S226-E229 WeakPolarHBondContact O-CA 3.32Å; S226-E229 VanDerWaalsContact O-CB 3.25Å; S226-E229 WeakPolarHBondContact O-CB 3.47Å; S226-E229 PolarHBondContact O-N 2.92Å; P227-E229 VanDerWaalsContact C-N 3.29Å; P227-E229 PolarHBondContact O-N 2.85Å; E229-C231 PolarHBondContact O-N 3.06Å; E229-A232 WeakPolarHBondContact O-CB 3.49Å; E229-A232 PolarHBondContact O-N 2.74Å; E229-A232 VanDerWaalsContact O-N 3.1Å; E229-R233 WeakPolarHBondContact O-CG 3.37Å; E229-R233 PolarHBondContact O-N 2.89Å; E229-R233 IonicContact OE1-CZ 2.78Å; E229-R233 IonicContact OE1-NE 2.6Å; E229-R233 PolarHBondContact OE1-NE 3.42Å; E229-R233 VanDerWaalsContact OE1-NE 3.08Å; E229-R233 IonicContact OE1-NH2 3.77Å; E229-R233 PolarHBondContact OE1-NH2 2.77Å
230	V	85.5	Confident	78.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59	-48.8	177.6	-177.3	0	0	0	0	110.4	L138 I171 L198 L200 V221 F225 S226 P227 A232 R233 V234	L138-V230 HydrophobicContact CD1-CB 3.65Å; L138-V230 HydrophobicContact CD1-CG1 3.52Å; L138-V230 HydrophobicContact CD1-CG2 4.17Å; L138-V230 HydrophobicContact CD2-CG1 3.9Å; L138-V230 HydrophobicContact CG-CG1 4.36Å; I171-V230 HydrophobicContact CD1-CG1 4.02Å; L198-V230 HydrophobicContact CD2-CG1 3.74Å; L200-V230 HydrophobicContact CD2-CG2 4.26Å; V221-V230 HydrophobicContact CG1-CG2 4.08Å; V221-V230 HydrophobicContact CG2-CG2 4.31Å; F225-V230 HydrophobicContact CD2-CG2 3.63Å; F225-V230 HydrophobicContact CE2-CG2 3.88Å; F225-V230 HydrophobicContact CG-CG2 4.13Å; S226-V230 PolarHBondContact O-N 3.42Å; P227-V230 PolarHBondContact O-N 2.93Å; V230-A232 VanDerWaalsContact C-N 3.28Å; V230-A232 PolarHBondContact O-N 2.76Å; V230-R233 PolarHBondContact O-N 2.82Å; V230-R233 VanDerWaalsContact O-N 3.13Å; V230-V234 HydrophobicContact CG1-CG2 4.37Å; V230-V234 WeakPolarHBondContact O-CG2 3.39Å; V230-V234 PolarHBondContact O-N 3.4Å
231	C	83.1	Confident	77.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.9	-35.7	175.3	-61.5	0	0	0	0	113.1	E145 P227 E229 R235	E145-C231 HydrophobicContact CG-CB 4.23Å; P227-C231 PolarHBondContact O-N 3.37Å; P227-C231 PolarHBondContact O-SG 3.14Å; E229-C231 PolarHBondContact O-N 3.06Å; C231-R235 WeakPolarHBondContact O-CB 3.3Å; C231-R235 VanDerWaalsContact O-CG 3.31Å; C231-R235 WeakPolarHBondContact O-CG 3.35Å; C231-R235 PolarHBondContact O-N 3.49Å; C231-R235 VanDerWaalsContact O-N 3.08Å; C231-R235 PolarHBondContact O-NE 2.88Å
232	A	77	Confident	76.8	Confident	35 Å²	35	58.3 Å²	58.3	29%	0.289	28%	0.281	S	S	.	.	H	α-helix	trans	-69.1	-37.8	177.1	0	0	0	0	0	112.5	R228 E229 V230 T236	R228-A232 WeakPolarHBondContact O-CB 3.24Å; R228-A232 PolarHBondContact O-N 2.99Å; R228-A232 VanDerWaalsContact O-N 3.1Å; E229-A232 WeakPolarHBondContact O-CB 3.49Å; E229-A232 PolarHBondContact O-N 2.74Å; E229-A232 VanDerWaalsContact O-N 3.1Å; V230-A232 VanDerWaalsContact C-N 3.28Å; V230-A232 PolarHBondContact O-N 2.76Å; A232-T236 PolarHBondContact O-N 2.83Å; A232-T236 VanDerWaalsContact O-N 3.07Å; A232-T236 PolarHBondContact O-OG1 3.18Å
233	R	85	Confident	75.2	Confident	69 Å²	69	64.7 Å²	64.7	26%	0.26	30%	0.302	S	S	.	.	H	α-helix	trans	-71.2	-46.1	176.8	-69.7	175.9	-176.4	-86.4	9.7	111.7	L198 D219 E229 V230 R235 T236 L237	L198-R233 HydrophobicContact CD1-CB 4.19Å; L198-R233 HydrophobicContact CD2-CB 4.23Å; D219-R233 IonicContact OD1-CZ 3.45Å; D219-R233 IonicContact OD1-NH1 2.89Å; D219-R233 PolarHBondContact OD1-NH1 2.84Å; D219-R233 WeakPolarHBondContact OD2-CD 3.15Å; D219-R233 VanDerWaalsContact OD2-CG 3.29Å; D219-R233 WeakPolarHBondContact OD2-CG 3.3Å; D219-R233 IonicContact OD2-CZ 3.56Å; D219-R233 IonicContact OD2-NE 2.68Å; D219-R233 IonicContact OD2-NH1 3.64Å; D219-R233 PolarHBondContact OD2-NH1 3.12Å; E229-R233 WeakPolarHBondContact O-CG 3.37Å; E229-R233 PolarHBondContact O-N 2.89Å; E229-R233 IonicContact OE1-CZ 2.78Å; E229-R233 IonicContact OE1-NE 2.6Å; E229-R233 PolarHBondContact OE1-NE 3.42Å; E229-R233 VanDerWaalsContact OE1-NE 3.08Å; E229-R233 IonicContact OE1-NH2 3.77Å; E229-R233 PolarHBondContact OE1-NH2 2.77Å; V230-R233 PolarHBondContact O-N 2.82Å; V230-R233 VanDerWaalsContact O-N 3.13Å; R233-R235 VanDerWaalsContact C-N 3.31Å; R233-R235 PolarHBondContact O-N 3.32Å; R233-T236 CarbonylContact O-C 3.58Å; R233-T236 WeakPolarHBondContact O-CA 3.39Å; R233-T236 WeakPolarHBondContact O-CB 3.24Å; R233-T236 PolarHBondContact O-N 2.92Å; R233-L237 WeakPolarHBondContact O-CG 3.3Å; R233-L237 PolarHBondContact O-N 3.33Å
234	V	86	Confident	73.9	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-52.7	-48.6	171.8	167.8	0	0	0	0	111.3	V125 L142 F147 V169 I171 L198 V230 T236 L237 L238	V125-V234 HydrophobicContact CG2-CG1 4.3Å; L142-V234 HydrophobicContact CD2-CG1 4.43Å; L142-V234 HydrophobicContact CD2-CG2 4.38Å; F147-V234 HydrophobicContact CE1-CG1 4.39Å; F147-V234 HydrophobicContact CE2-CG1 4.2Å; F147-V234 HydrophobicContact CZ-CG1 4.01Å; V169-V234 HydrophobicContact CG1-CG1 3.94Å; V169-V234 HydrophobicContact CG1-CG2 4.46Å; I171-V234 HydrophobicContact CD1-CG2 3.77Å; I171-V234 HydrophobicContact CG1-CG2 4.21Å; L198-V234 HydrophobicContact CD2-CG2 3.93Å; V230-V234 HydrophobicContact CG1-CG2 4.37Å; V230-V234 WeakPolarHBondContact O-CG2 3.39Å; V230-V234 PolarHBondContact O-N 3.4Å; V234-T236 VanDerWaalsContact C-N 3.27Å; V234-T236 PolarHBondContact O-N 3.26Å; V234-L237 PolarHBondContact O-N 3.08Å; V234-L238 HydrophobicContact CG1-CD1 3.92Å; V234-L238 HydrophobicContact CG1-CG 4.49Å; V234-L238 WeakPolarHBondContact O-CG 3.36Å; V234-L238 PolarHBondContact O-N 3.31Å
235	R	78.3	Confident	72.3	Confident	81 Å²	81	67.3 Å²	67.3	31%	0.306	31%	0.314	S	S	.	.	H	α-helix	trans	-59.1	-38.4	175	-78.8	-177	-64.6	155.3	-4.6	112.7	E145 F147 C231 R233 R239	E145-R235 IonicContact OE2-NE 3.4Å; F147-R235 HydrophobicContact CZ-CG 4.12Å; C231-R235 WeakPolarHBondContact O-CB 3.3Å; C231-R235 VanDerWaalsContact O-CG 3.31Å; C231-R235 WeakPolarHBondContact O-CG 3.35Å; C231-R235 PolarHBondContact O-N 3.49Å; C231-R235 VanDerWaalsContact O-N 3.08Å; C231-R235 PolarHBondContact O-NE 2.88Å; R233-R235 VanDerWaalsContact C-N 3.31Å; R233-R235 PolarHBondContact O-N 3.32Å; R235-R239 WeakPolarHBondContact O-CB 3.37Å; R235-R239 PolarHBondContact O-N 3.48Å
236	T	75.7	Confident	70.3	Confident	44 Å²	44	67.7 Å²	67.7	27%	0.27	32%	0.321	S	S	.	.	H	α-helix	trans	-68	-42.1	179.1	-62.1	0	0	0	0	111.4	A232 R233 V234 R239 R240	A232-T236 PolarHBondContact O-N 2.83Å; A232-T236 VanDerWaalsContact O-N 3.07Å; A232-T236 PolarHBondContact O-OG1 3.18Å; R233-T236 CarbonylContact O-C 3.58Å; R233-T236 WeakPolarHBondContact O-CA 3.39Å; R233-T236 WeakPolarHBondContact O-CB 3.24Å; R233-T236 PolarHBondContact O-N 2.92Å; V234-T236 VanDerWaalsContact C-N 3.27Å; V234-T236 PolarHBondContact O-N 3.26Å; T236-R239 PolarHBondContact O-N 2.84Å; T236-R240 WeakPolarHBondContact O-CG 3.28Å; T236-R240 PolarHBondContact O-N 2.97Å
237	L	83.2	Confident	68.3	Low	2 Å²	2	69.2 Å²	69.2	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-54.8	175.3	-67.2	179.5	0	0	0	111.4	V169 P196 L198 D218 D219 R233 V234 R239 R240 V241	V169-L237 HydrophobicContact CG2-CB 4.11Å; V169-L237 HydrophobicContact CG2-CD1 4Å; P196-L237 HydrophobicContact CB-CB 4.17Å; P196-L237 HydrophobicContact CB-CD1 4.48Å; L198-L237 HydrophobicContact CB-CD1 3.97Å; D218-L237 HydrophobicContact CB-CD1 4.44Å; D218-L237 HydrophobicContact CB-CD2 3.3Å; D218-L237 HydrophobicContact CB-CG 4.49Å; D219-L237 HydrophobicContact CB-CD2 4.31Å; R233-L237 WeakPolarHBondContact O-CG 3.3Å; R233-L237 PolarHBondContact O-N 3.33Å; V234-L237 PolarHBondContact O-N 3.08Å; L237-R239 VanDerWaalsContact C-N 3.27Å; L237-R239 PolarHBondContact O-N 2.83Å; L237-R240 WeakPolarHBondContact O-CA 2.98Å; L237-R240 WeakPolarHBondContact O-CB 3.08Å; L237-R240 PolarHBondContact O-N 2.9Å; L237-V241 PolarHBondContact O-N 2.7Å
238	L	77.4	Confident	66.8	Low	11 Å²	11	70.8 Å²	70.8	6%	0.058	34%	0.341	C	S	.	.	H	α-helix	trans	-59.7	-37.6	178.5	-70.6	173.1	0	0	0	112.4	D123 F147 D168 V169 V234 R240 V241 K242	D123-L238 HydrophobicContact CB-CD1 4.19Å; F147-L238 HydrophobicContact CD1-CD1 4.15Å; F147-L238 HydrophobicContact CE1-CD1 3.33Å; F147-L238 HydrophobicContact CZ-CD1 3.95Å; D168-L238 HydrophobicContact CB-CD2 3.65Å; D168-L238 WeakPolarHBondContact O-CD2 3.3Å; V169-L238 HydrophobicContact CB-CD2 4.09Å; V169-L238 HydrophobicContact CB-CG 4.36Å; V234-L238 HydrophobicContact CG1-CD1 3.92Å; V234-L238 HydrophobicContact CG1-CG 4.49Å; V234-L238 WeakPolarHBondContact O-CG 3.36Å; V234-L238 PolarHBondContact O-N 3.31Å; L238-R240 VanDerWaalsContact C-N 3.35Å; L238-V241 PolarHBondContact O-N 3.24Å; L238-K242 WeakPolarHBondContact O-CB 3.31Å; L238-K242 WeakPolarHBondContact O-CG 3.39Å; L238-K242 PolarHBondContact O-N 2.86Å
239	R	69.2	Low	65.9	Low	167 Å²	167	67.1 Å²	67.1	63%	0.63	34%	0.342	S	S	*	.	H	α-helix	trans	-64.8	-38.3	174.4	-174.1	180	67.9	173.4	-1.3	111.7	R235 T236 L237 K243	R235-R239 WeakPolarHBondContact O-CB 3.37Å; R235-R239 PolarHBondContact O-N 3.48Å; T236-R239 PolarHBondContact O-N 2.84Å; L237-R239 VanDerWaalsContact C-N 3.27Å; L237-R239 PolarHBondContact O-N 2.83Å; R239-K243 WeakPolarHBondContact O-CB 3.28Å; R239-K243 PolarHBondContact O-N 2.97Å
240	R	66	Low	65.1	Low	128 Å²	128	66.9 Å²	66.9	48%	0.483	35%	0.346	S	S	.	.	H	α-helix	trans	-62.4	-51.4	176.2	-75.6	171.5	179	177	1.5	109.8	T236 L237 L238 K242 K243 F244	T236-R240 WeakPolarHBondContact O-CG 3.28Å; T236-R240 PolarHBondContact O-N 2.97Å; L237-R240 WeakPolarHBondContact O-CA 2.98Å; L237-R240 WeakPolarHBondContact O-CB 3.08Å; L237-R240 PolarHBondContact O-N 2.9Å; L238-R240 VanDerWaalsContact C-N 3.35Å; R240-K242 VanDerWaalsContact C-N 3.34Å; R240-K242 PolarHBondContact O-N 3.15Å; R240-K243 PolarHBondContact O-N 3.21Å; R240-K243 VanDerWaalsContact O-N 3.11Å; R240-F244 HydrophobicContact CB-CE2 4.29Å; R240-F244 WeakPolarHBondContact O-CD2 3.32Å; R240-F244 PolarHBondContact O-N 3.4Å
241	V	67.7	Low	64.6	Low	58 Å²	58	70.2 Å²	70.2	35%	0.352	36%	0.362	S	S	.	.	H	α-helix	trans	-55	-47.8	176.9	-178	0	0	0	0	111.9	P196 L237 L238 K243 F244 S245	P196-V241 HydrophobicContact CB-CG2 4.32Å; P196-V241 HydrophobicContact CG-CG2 3.23Å; L237-V241 PolarHBondContact O-N 2.7Å; L238-V241 PolarHBondContact O-N 3.24Å; V241-K243 VanDerWaalsContact C-N 3.35Å; V241-K243 PolarHBondContact O-N 3.11Å; V241-F244 WeakPolarHBondContact O-CB 3.33Å; V241-F244 PolarHBondContact O-N 3.49Å; V241-S245 PolarHBondContact O-N 2.92Å; V241-S245 PolarHBondContact O-OG 2.72Å
242	K	58.5	Low	64.5	Low	64 Å²	64	79 Å²	79	28%	0.278	40%	0.396	S	S	.	.	H	α-helix	trans	-68.4	-30.2	179.8	-72.6	178.9	179.1	177.6	0	113.5	D123 L238 R240 F244 S245	D123-K242 IonicContact OD1-NZ 2.72Å; D123-K242 PolarHBondContact OD1-NZ 3.49Å; D123-K242 IonicContact OD2-NZ 2.92Å; D123-K242 PolarHBondContact OD2-NZ 2.94Å; L238-K242 WeakPolarHBondContact O-CB 3.31Å; L238-K242 WeakPolarHBondContact O-CG 3.39Å; L238-K242 PolarHBondContact O-N 2.86Å; R240-K242 VanDerWaalsContact C-N 3.34Å; R240-K242 PolarHBondContact O-N 3.15Å; K242-F244 VanDerWaalsContact C-N 3.33Å; K242-S245 WeakPolarHBondContact CA-OG 3.35Å; K242-S245 PolarHBondContact O-N 3.14Å; K242-S245 PolarHBondContact O-OG 3.49Å
243	K	45.1	Very low	64.3	Low	163 Å²	163	79 Å²	79	71%	0.709	39%	0.391	S	S	*	.	H	α-helix	trans	-74.6	-27.4	176.9	-155.4	177.9	-174.2	-171.9	0	111.6	R239 R240 V241 S245	R239-K243 WeakPolarHBondContact O-CB 3.28Å; R239-K243 PolarHBondContact O-N 2.97Å; R240-K243 PolarHBondContact O-N 3.21Å; R240-K243 VanDerWaalsContact O-N 3.11Å; V241-K243 VanDerWaalsContact C-N 3.35Å; V241-K243 PolarHBondContact O-N 3.11Å; K243-S245 PolarHBondContact O-N 3.18Å
244	F	47.2	Very low	63.9	Low	115 Å²	115	78.2 Å²	78.2	50%	0.504	40%	0.404	S	S	.	.	H	α-helix	trans	-71.4	-13.7	169.4	-72.8	-60.8	0	0	0	113.1	R240 V241 K242 P261	R240-F244 HydrophobicContact CB-CE2 4.29Å; R240-F244 WeakPolarHBondContact O-CD2 3.32Å; R240-F244 PolarHBondContact O-N 3.4Å; V241-F244 WeakPolarHBondContact O-CB 3.33Å; V241-F244 PolarHBondContact O-N 3.49Å; K242-F244 VanDerWaalsContact C-N 3.33Å; F244-P261 WeakPolarHBondContact CB-O 3.33Å; F244-P261 WeakPolarHBondContact CD1-O 3.41Å; F244-P261 WeakPolarHBondContact CG-O 3.46Å; F244-P261 CarbonylContact O-C 3.51Å; F244-P261 WeakPolarHBondContact O-CB 3.35Å
245	S	41.2	Very low	63.9	Low	86 Å²	86	82.7 Å²	82.7	60%	0.601	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-3	179.2	-17.5	0	0	0	0	115.2	V241 K242 K243	V241-S245 PolarHBondContact O-N 2.92Å; V241-S245 PolarHBondContact O-OG 2.72Å; K242-S245 WeakPolarHBondContact CA-OG 3.35Å; K242-S245 PolarHBondContact O-N 3.14Å; K242-S245 PolarHBondContact O-OG 3.49Å; K243-S245 PolarHBondContact O-N 3.18Å
246	S	36.6	Very low	64.4	Low	46 Å²	46	79 Å²	79	32%	0.322	41%	0.411	S	S	.	.	S	Bend	trans	-88.4	129.4	176.1	-67.5	0	0	0	0	110.4	S248 P261	S246-S248 PolarHBondContact O-N 3.33Å; S246-P261 WeakPolarHBondContact O-CB 2.98Å; S246-P261 WeakPolarHBondContact O-CG 3.34Å
247	P	37.5	Very low	65	Low	90 Å²	90	78.8 Å²	78.8	58%	0.584	41%	0.406	S	S	*	.			trans	-71.8	93.7	-177.9	29.2	-31.3	0	0	0	109.1
248	S	44.5	Very low	65.2	Low	65 Å²	65	78.7 Å²	78.7	46%	0.455	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-70	143.7	153.8	-61.3	0	0	0	0	107.5	S246 V250 P261	S246-S248 PolarHBondContact O-N 3.33Å; S248-V250 PolarHBondContact O-N 2.9Å; S248-P261 VanDerWaalsContact CB-CG 3.45Å
249	P	56.1	Low	65.5	Low	111 Å²	111	80.2 Å²	80.2	72%	0.721	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-55.4	128.1	-177.1	21.9	-31.9	0	0	0	109.8	I251	P249-I251 WeakPolarHBondContact O-CG1 3.12Å; P249-I251 PolarHBondContact O-N 3.48Å; P249-I251 VanDerWaalsContact O-N 3.15Å
250	V	66.6	Low	65.9	Low	70 Å²	70	74.7 Å²	74.7	42%	0.424	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-58	118.2	167.7	176.2	0	0	0	0	106.8	S248 E257 L258 N259	S248-V250 PolarHBondContact O-N 2.9Å; V250-E257 HydrophobicContact CG1-CB 3.89Å; V250-L258 WeakPolarHBondContact CA-O 3.11Å; V250-N259 HydrophobicContact CG2-CB 4.3Å
251	I	75.3	Confident	65.8	Low	69 Å²	69	69.1 Å²	69.1	35%	0.354	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	114.7	-177.7	-50.8	176.7	0	0	0	107.3	P249 I253 L258	P249-I251 WeakPolarHBondContact O-CG1 3.12Å; P249-I251 PolarHBondContact O-N 3.48Å; P249-I251 VanDerWaalsContact O-N 3.15Å; I251-I253 HydrophobicContact CG2-CD1 3.84Å; I251-I253 HydrophobicContact CG2-CG1 3.91Å; I251-L258 HydrophobicContact CB-CB 4.35Å; I251-L258 HydrophobicContact CD1-CD2 4.4Å; I251-L258 PolarHBondContact N-O 3.36Å; I251-L258 PolarHBondContact O-N 2.93Å
252	R	79.5	Confident	66	Low	185 Å²	185	68.8 Å²	68.8	70%	0.698	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	123.1	173.2	-72.5	-173.6	171.3	179.2	-7.2	110.6	F256 E257	R252-F256 CarbonylContact C-O 3.6Å; R252-F256 WeakPolarHBondContact CA-O 3.47Å; R252-E257 HydrophobicContact CG-CG 4.18Å; R252-E257 IonicContact CZ-OE1 3.19Å; R252-E257 IonicContact NE-OE1 3.87Å; R252-E257 PolarHBondContact NE-OE1 3.2Å; R252-E257 IonicContact NH2-OE1 2.69Å; R252-E257 PolarHBondContact NH2-OE1 2.97Å
253	I	73.7	Confident	66.9	Low	36 Å²	36	68.4 Å²	68.4	19%	0.185	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	98.1	179.6	-59.9	149.3	0	0	0	108.3	I251 H255 F256 L286 P289	I251-I253 HydrophobicContact CG2-CD1 3.84Å; I251-I253 HydrophobicContact CG2-CG1 3.91Å; I253-H255 PolarHBondContact O-N 3.09Å; I253-F256 PolarHBondContact N-O 2.82Å; I253-F256 WeakPolarHBondContact O-CB 3.48Å; I253-F256 PolarHBondContact O-N 3.32Å; I253-L286 HydrophobicContact CB-CD2 4.02Å; I253-L286 HydrophobicContact CD1-CB 3.86Å; I253-L286 HydrophobicContact CD1-CD2 3.9Å; I253-L286 HydrophobicContact CD1-CG 4.45Å; I253-L286 VanDerWaalsContact CD1-O 3.28Å; I253-L286 WeakPolarHBondContact CD1-O 3.43Å; I253-L286 HydrophobicContact CG2-CD2 4.13Å; I253-P289 HydrophobicContact CG2-CB 4.49Å; I253-P289 HydrophobicContact CG2-CG 4.39Å
254	G	76.5	Confident	68.9	Low	52 Å²	52	64.3 Å²	64.3	54%	0.536	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	-126.7	-168.9	0	0	0	0	0	110.6	F256	G254-F256 VanDerWaalsContact C-N 3.32Å
255	H	85.7	Confident	70.9	Confident	94 Å²	94	58.9 Å²	58.9	44%	0.435	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	8.6	174.2	-53.3	-74.1	0	0	0	113.8	I253 W267 F268	I253-H255 PolarHBondContact O-N 3.09Å; H255-W267 VanDerWaalsContact C-CE3 3.46Å; H255-W267 HydrophobicContact CB-CE3 3.83Å; H255-W267 HydrophobicContact CB-CH2 3.98Å; H255-W267 HydrophobicContact CB-CZ3 3.5Å; H255-F268 HydrophobicContact CB-CD1 4.07Å; H255-F268 HydrophobicContact CB-CD2 4.07Å; H255-F268 HydrophobicContact CB-CE1 3.94Å; H255-F268 HydrophobicContact CB-CE2 3.94Å; H255-F268 HydrophobicContact CB-CG 4.12Å; H255-F268 HydrophobicContact CB-CZ 3.86Å; H255-F268 AromaticContact CD2-CE1 3.67Å; H255-F268 AromaticContact CD2-CZ 3.35Å; H255-F268 WeakPolarHBondContact CD2-CZ 3.34Å; H255-F268 AromaticContact CE1-CE1 3.67Å; H255-F268 AromaticContact CG-CD1 3.96Å; H255-F268 AromaticContact CG-CE1 3.41Å; H255-F268 VanDerWaalsContact CG-CE1 3.41Å; H255-F268 AromaticContact CG-CZ 3.46Å; H255-F268 VanDerWaalsContact CG-CZ 3.46Å; H255-F268 AromaticContact ND1-CD1 3.9Å; H255-F268 AromaticContact ND1-CE1 3.42Å; H255-F268 WeakPolarHBondContact ND1-CE1 3.5Å; H255-F268 AromaticContact ND1-CZ 3.94Å; H255-F268 AromaticContact NE2-CE1 3.84Å; H255-F268 AromaticContact NE2-CZ 3.81Å; H255-F268 PolarHBondContact O-N 3.34Å
256	F	89.5	Confident	73.3	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.018	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	139.6	172.5	-71.5	-77.3	0	0	0	111.4	R252 I253 G254 I265 S266 W267 L272 L282 L286 L325 P334 L345	R252-F256 CarbonylContact C-O 3.6Å; R252-F256 WeakPolarHBondContact CA-O 3.47Å; I253-F256 PolarHBondContact N-O 2.82Å; I253-F256 WeakPolarHBondContact O-CB 3.48Å; I253-F256 PolarHBondContact O-N 3.32Å; G254-F256 VanDerWaalsContact C-N 3.32Å; F256-I265 HydrophobicContact CD1-CG2 3.82Å; F256-I265 HydrophobicContact CE1-CG2 4.45Å; F256-S266 VanDerWaalsContact CA-O 3.3Å; F256-S266 WeakPolarHBondContact CA-O 3.42Å; F256-W267 HydrophobicContact CB-CE3 4.31Å; F256-W267 HydrophobicContact CD1-CB 4.32Å; F256-W267 HydrophobicContact CD1-CD2 4.16Å; F256-W267 AromaticContact CD1-CE3 3.39Å; F256-W267 HydrophobicContact CD1-CE3 3.39Å; F256-W267 HydrophobicContact CD1-CZ3 4.04Å; F256-W267 AromaticContact CD2-CE3 3.46Å; F256-W267 HydrophobicContact CD2-CE3 3.46Å; F256-W267 VanDerWaalsContact CD2-CE3 3.46Å; F256-W267 HydrophobicContact CD2-CH2 4.17Å; F256-W267 AromaticContact CD2-CZ3 3.15Å; F256-W267 HydrophobicContact CD2-CZ3 3.15Å; F256-W267 HydrophobicContact CE1-CB 4.18Å; F256-W267 AromaticContact CE1-CD2 3.8Å; F256-W267 HydrophobicContact CE1-CD2 3.8Å; F256-W267 AromaticContact CE1-CE3 3.37Å; F256-W267 HydrophobicContact CE1-CE3 3.37Å; F256-W267 HydrophobicContact CE1-CG 4.17Å; F256-W267 AromaticContact CE1-CZ3 3.99Å; F256-W267 HydrophobicContact CE1-CZ3 3.99Å; F256-W267 HydrophobicContact CE2-CD2 4.31Å; F256-W267 AromaticContact CE2-CE3 3.44Å; F256-W267 HydrophobicContact CE2-CE3 3.44Å; F256-W267 VanDerWaalsContact CE2-CE3 3.44Å; F256-W267 AromaticContact CE2-CH2 3.74Å; F256-W267 HydrophobicContact CE2-CH2 3.74Å; F256-W267 AromaticContact CE2-CZ3 3.09Å; F256-W267 HydrophobicContact CE2-CZ3 3.09Å; F256-W267 AromaticContact CG-CE3 3.43Å; F256-W267 HydrophobicContact CG-CE3 3.43Å; F256-W267 VanDerWaalsContact CG-CE3 3.43Å; F256-W267 AromaticContact CG-CZ3 3.65Å; F256-W267 HydrophobicContact CG-CZ3 3.65Å; F256-W267 AromaticContact CZ-CD2 3.87Å; F256-W267 HydrophobicContact CZ-CD2 3.87Å; F256-W267 AromaticContact CZ-CE3 3.39Å; F256-W267 HydrophobicContact CZ-CE3 3.39Å; F256-W267 HydrophobicContact CZ-CH2 4.14Å; F256-W267 AromaticContact CZ-CZ3 3.54Å; F256-W267 HydrophobicContact CZ-CZ3 3.54Å; F256-L272 HydrophobicContact CE1-CD1 4.38Å; F256-L282 HydrophobicContact CE1-CD1 4.33Å; F256-L282 HydrophobicContact CE1-CD2 4.11Å; F256-L282 HydrophobicContact CZ-CD1 4.34Å; F256-L286 HydrophobicContact CB-CD1 4.39Å; F256-L286 HydrophobicContact CB-CD2 3.57Å; F256-L286 HydrophobicContact CD1-CD1 4.4Å; F256-L286 HydrophobicContact CD1-CD2 4.27Å; F256-L286 HydrophobicContact CD2-CD2 3.57Å; F256-L286 HydrophobicContact CE2-CD2 4.31Å; F256-L286 HydrophobicContact CG-CD1 4.39Å; F256-L286 HydrophobicContact CG-CD2 3.55Å; F256-L325 HydrophobicContact CE1-CD2 3.55Å; F256-L325 HydrophobicContact CZ-CD1 4.29Å; F256-L325 HydrophobicContact CZ-CD2 3.73Å; F256-P334 HydrophobicContact CE2-CB 4.09Å; F256-P334 HydrophobicContact CE2-CG 4.02Å; F256-P334 HydrophobicContact CZ-CB 4.43Å; F256-P334 HydrophobicContact CZ-CG 3.85Å; F256-L345 HydrophobicContact CD2-CD2 4.4Å; F256-L345 HydrophobicContact CE2-CD1 4.05Å; F256-L345 HydrophobicContact CE2-CD2 4.28Å; F256-L345 HydrophobicContact CZ-CD1 4.48Å
257	E	88.7	Confident	75.9	Confident	38 Å²	38	53.5 Å²	53.5	18%	0.178	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	120.4	164.3	-50.9	-161	132.7	0	0	109.4	V250 R252 I265 S266	V250-E257 HydrophobicContact CG1-CB 3.89Å; R252-E257 HydrophobicContact CG-CG 4.18Å; R252-E257 IonicContact CZ-OE1 3.19Å; R252-E257 IonicContact NE-OE1 3.87Å; R252-E257 PolarHBondContact NE-OE1 3.2Å; R252-E257 IonicContact NH2-OE1 2.69Å; R252-E257 PolarHBondContact NH2-OE1 2.97Å; E257-I265 CarbonylContact O-C 3.52Å; E257-I265 VanDerWaalsContact O-CA 3.28Å; E257-I265 WeakPolarHBondContact O-CA 3.49Å; E257-S266 PolarHBondContact N-O 2.91Å; E257-S266 PolarHBondContact O-N 3.31Å
258	L	86.9	Confident	78.4	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	112.8	177	171.6	64.4	0	0	0	109.7	V250 I251 E260 I265 F279 K283	V250-L258 WeakPolarHBondContact CA-O 3.11Å; I251-L258 HydrophobicContact CB-CB 4.35Å; I251-L258 HydrophobicContact CD1-CD2 4.4Å; I251-L258 PolarHBondContact N-O 3.36Å; I251-L258 PolarHBondContact O-N 2.93Å; L258-E260 HydrophobicContact CD1-CG 3.97Å; L258-E260 HydrophobicContact CD2-CG 3.8Å; L258-E260 HydrophobicContact CG-CG 3.75Å; L258-I265 HydrophobicContact CD1-CD1 4.1Å; L258-I265 HydrophobicContact CD1-CG1 3.64Å; L258-F279 HydrophobicContact CD1-CE2 4.02Å; L258-F279 HydrophobicContact CD1-CZ 4.23Å; L258-K283 HydrophobicContact CD2-CG 4.35Å
259	N	83.5	Confident	80.2	Confident	43 Å²	43	54.9 Å²	54.9	23%	0.23	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	86.8	169	-173.2	-16.6	0	0	0	108.5	V250 P261 A262 A263 Q264	V250-N259 HydrophobicContact CG2-CB 4.3Å; N259-P261 VanDerWaalsContact OD1-CD 3.28Å; N259-P261 WeakPolarHBondContact OD1-CD 3.34Å; N259-A262 HydrophobicContact CB-CB 4.08Å; N259-A262 VanDerWaalsContact ND2-CB 3.35Å; N259-A262 WeakPolarHBondContact ND2-CB 3.34Å; N259-A262 PolarHBondContact O-N 3.47Å; N259-A262 WeakPolarHBondContact OD1-CB 3.08Å; N259-A262 PolarHBondContact OD1-N 3.01Å; N259-A263 PolarHBondContact O-N 2.88Å; N259-A263 VanDerWaalsContact O-N 3.08Å; N259-Q264 HydrophobicContact CB-CB 4.38Å; N259-Q264 PolarHBondContact N-O 2.9Å; N259-Q264 PolarHBondContact O-N 2.91Å; N259-Q264 VanDerWaalsContact O-N 3.08Å
260	E	77.4	Confident	81.8	Confident	50 Å²	50	52.8 Å²	52.8	23%	0.234	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-42.4	-179.1	-66.9	-167.6	-137	0	0	113.5	L258 A263 K283 K287	L258-E260 HydrophobicContact CD1-CG 3.97Å; L258-E260 HydrophobicContact CD2-CG 3.8Å; L258-E260 HydrophobicContact CG-CG 3.75Å; E260-A263 PolarHBondContact O-N 3.35Å; E260-K283 WeakPolarHBondContact OE2-CE 3.35Å; E260-K283 IonicContact OE2-NZ 2.69Å; E260-K283 PolarHBondContact OE2-NZ 2.88Å; E260-K287 VanDerWaalsContact CD-CE 3.47Å; E260-K287 WeakPolarHBondContact OE1-CE 3.35Å; E260-K287 IonicContact OE1-NZ 2.79Å; E260-K287 PolarHBondContact OE1-NZ 3.21Å; E260-K287 IonicContact OE2-NZ 3.87Å; E260-K287 PolarHBondContact OE2-NZ 2.83Å
261	P	63.6	Low	82.8	Confident	11 Å²	11	52.8 Å²	52.8	7%	0.071	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-38.8	174.9	-21.9	30.6	0	0	0	113.6	F244 S246 S248 N259 A263	F244-P261 WeakPolarHBondContact CB-O 3.33Å; F244-P261 WeakPolarHBondContact CD1-O 3.41Å; F244-P261 WeakPolarHBondContact CG-O 3.46Å; F244-P261 CarbonylContact O-C 3.51Å; F244-P261 WeakPolarHBondContact O-CB 3.35Å; S246-P261 WeakPolarHBondContact O-CB 2.98Å; S246-P261 WeakPolarHBondContact O-CG 3.34Å; S248-P261 VanDerWaalsContact CB-CG 3.45Å; N259-P261 VanDerWaalsContact OD1-CD 3.28Å; N259-P261 WeakPolarHBondContact OD1-CD 3.34Å; P261-A263 PolarHBondContact O-N 3.35Å
262	A	72.1	Confident	83.6	Confident	52 Å²	52	50.3 Å²	50.3	43%	0.43	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	1	177.2	0	0	0	0	0	113.6	N259 Q264	N259-A262 HydrophobicContact CB-CB 4.08Å; N259-A262 VanDerWaalsContact ND2-CB 3.35Å; N259-A262 WeakPolarHBondContact ND2-CB 3.34Å; N259-A262 PolarHBondContact O-N 3.47Å; N259-A262 WeakPolarHBondContact OD1-CB 3.08Å; N259-A262 PolarHBondContact OD1-N 3.01Å; A262-Q264 HydrophobicContact CB-CB 4.06Å; A262-Q264 PolarHBondContact O-N 3.21Å; A262-Q264 VanDerWaalsContact O-N 3.13Å
263	A	78.7	Confident	84	Confident	55 Å²	55	47.5 Å²	47.5	46%	0.455	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	36.4	-169.5	0	0	0	0	0	113.2	N259 E260 P261 F279	N259-A263 PolarHBondContact O-N 2.88Å; N259-A263 VanDerWaalsContact O-N 3.08Å; E260-A263 PolarHBondContact O-N 3.35Å; P261-A263 PolarHBondContact O-N 3.35Å; A263-F279 HydrophobicContact CB-CE1 4.26Å; A263-F279 HydrophobicContact CB-CE2 4.33Å; A263-F279 HydrophobicContact CB-CZ 4.11Å; A263-F279 VanDerWaalsContact O-CD2 3.29Å; A263-F279 WeakPolarHBondContact O-CD2 3.45Å; A263-F279 WeakPolarHBondContact O-CE2 3.48Å
264	Q	85.5	Confident	84.7	Confident	78 Å²	78	47.5 Å²	47.5	36%	0.364	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	135.1	-171.9	-167.3	177.4	17.7	0	0	110.5	N259 A262	N259-Q264 HydrophobicContact CB-CB 4.38Å; N259-Q264 PolarHBondContact N-O 2.9Å; N259-Q264 PolarHBondContact O-N 2.91Å; N259-Q264 VanDerWaalsContact O-N 3.08Å; A262-Q264 HydrophobicContact CB-CB 4.06Å; A262-Q264 PolarHBondContact O-N 3.21Å; A262-Q264 VanDerWaalsContact O-N 3.13Å
265	I	91.2	Very high	85.1	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.6	170.4	-60	170.7	0	0	0	107.6	F256 E257 L258 L272 L274 F279 L282 L286	F256-I265 HydrophobicContact CD1-CG2 3.82Å; F256-I265 HydrophobicContact CE1-CG2 4.45Å; E257-I265 CarbonylContact O-C 3.52Å; E257-I265 VanDerWaalsContact O-CA 3.28Å; E257-I265 WeakPolarHBondContact O-CA 3.49Å; L258-I265 HydrophobicContact CD1-CD1 4.1Å; L258-I265 HydrophobicContact CD1-CG1 3.64Å; I265-L272 HydrophobicContact CB-CD1 4.43Å; I265-L272 HydrophobicContact CG2-CD1 4.01Å; I265-L272 VanDerWaalsContact O-CB 3.31Å; I265-L272 WeakPolarHBondContact O-CB 3.37Å; I265-L272 PolarHBondContact O-N 3.47Å; I265-L274 HydrophobicContact CB-CD1 4.08Å; I265-L274 HydrophobicContact CD1-CD1 3.98Å; I265-L274 HydrophobicContact CG1-CD1 4.38Å; I265-F279 HydrophobicContact CD1-CD2 3.68Å; I265-F279 HydrophobicContact CD1-CE2 3.93Å; I265-F279 HydrophobicContact CG1-CD2 3.8Å; I265-F279 HydrophobicContact CG1-CE2 3.74Å; I265-L282 HydrophobicContact CB-CD2 4.39Å; I265-L282 HydrophobicContact CD1-CB 3.91Å; I265-L282 HydrophobicContact CD1-CD2 3.83Å; I265-L282 HydrophobicContact CD1-CG 3.85Å; I265-L282 HydrophobicContact CG2-CD2 3.84Å; I265-L286 HydrophobicContact CD1-CD1 3.95Å; I265-L286 HydrophobicContact CG1-CD1 4.38Å; I265-L286 HydrophobicContact CG2-CD1 3.96Å
266	S	91.4	Very high	85	Confident	12 Å²	12	52.4 Å²	52.4	8%	0.084	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	149.8	171.8	-53.9	0	0	0	0	110.1	F256 E257 T270	F256-S266 VanDerWaalsContact CA-O 3.3Å; F256-S266 WeakPolarHBondContact CA-O 3.42Å; E257-S266 PolarHBondContact N-O 2.91Å; E257-S266 PolarHBondContact O-N 3.31Å; S266-T270 CarbonylContact C-O 3.48Å; S266-T270 WeakPolarHBondContact CA-O 3.26Å
267	W	91.4	Very high	84.7	Confident	7 Å²	7	55.5 Å²	55.5	3%	0.027	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	122.5	173.7	-178.8	-124.1	0	0	0	108.1	H255 F256 D269 T270 L272 L325 I328 L332 P334	H255-W267 VanDerWaalsContact C-CE3 3.46Å; H255-W267 HydrophobicContact CB-CE3 3.83Å; H255-W267 HydrophobicContact CB-CH2 3.98Å; H255-W267 HydrophobicContact CB-CZ3 3.5Å; F256-W267 HydrophobicContact CB-CE3 4.31Å; F256-W267 HydrophobicContact CD1-CB 4.32Å; F256-W267 HydrophobicContact CD1-CD2 4.16Å; F256-W267 AromaticContact CD1-CE3 3.39Å; F256-W267 HydrophobicContact CD1-CE3 3.39Å; F256-W267 HydrophobicContact CD1-CZ3 4.04Å; F256-W267 AromaticContact CD2-CE3 3.46Å; F256-W267 HydrophobicContact CD2-CE3 3.46Å; F256-W267 VanDerWaalsContact CD2-CE3 3.46Å; F256-W267 HydrophobicContact CD2-CH2 4.17Å; F256-W267 AromaticContact CD2-CZ3 3.15Å; F256-W267 HydrophobicContact CD2-CZ3 3.15Å; F256-W267 HydrophobicContact CE1-CB 4.18Å; F256-W267 AromaticContact CE1-CD2 3.8Å; F256-W267 HydrophobicContact CE1-CD2 3.8Å; F256-W267 AromaticContact CE1-CE3 3.37Å; F256-W267 HydrophobicContact CE1-CE3 3.37Å; F256-W267 HydrophobicContact CE1-CG 4.17Å; F256-W267 AromaticContact CE1-CZ3 3.99Å; F256-W267 HydrophobicContact CE1-CZ3 3.99Å; F256-W267 HydrophobicContact CE2-CD2 4.31Å; F256-W267 AromaticContact CE2-CE3 3.44Å; F256-W267 HydrophobicContact CE2-CE3 3.44Å; F256-W267 VanDerWaalsContact CE2-CE3 3.44Å; F256-W267 AromaticContact CE2-CH2 3.74Å; F256-W267 HydrophobicContact CE2-CH2 3.74Å; F256-W267 AromaticContact CE2-CZ3 3.09Å; F256-W267 HydrophobicContact CE2-CZ3 3.09Å; F256-W267 AromaticContact CG-CE3 3.43Å; F256-W267 HydrophobicContact CG-CE3 3.43Å; F256-W267 VanDerWaalsContact CG-CE3 3.43Å; F256-W267 AromaticContact CG-CZ3 3.65Å; F256-W267 HydrophobicContact CG-CZ3 3.65Å; F256-W267 AromaticContact CZ-CD2 3.87Å; F256-W267 HydrophobicContact CZ-CD2 3.87Å; F256-W267 AromaticContact CZ-CE3 3.39Å; F256-W267 HydrophobicContact CZ-CE3 3.39Å; F256-W267 HydrophobicContact CZ-CH2 4.14Å; F256-W267 AromaticContact CZ-CZ3 3.54Å; F256-W267 HydrophobicContact CZ-CZ3 3.54Å; W267-D269 VanDerWaalsContact C-N 3.33Å; W267-D269 PolarHBondContact O-N 2.84Å; W267-T270 PolarHBondContact N-O 3.46Å; W267-T270 WeakPolarHBondContact O-CB 3.3Å; W267-T270 PolarHBondContact O-N 2.99Å; W267-L272 HydrophobicContact CB-CD1 4.14Å; W267-L272 HydrophobicContact CB-CD2 4.29Å; W267-L272 HydrophobicContact CB-CG 4.19Å; W267-L325 HydrophobicContact CB-CD2 4.18Å; W267-L325 HydrophobicContact CD2-CD2 4.22Å; W267-L325 HydrophobicContact CG-CD2 3.85Å; W267-I328 HydrophobicContact CB-CD1 4.25Å; W267-L332 HydrophobicContact CZ2-CB 4.44Å; W267-P334 HydrophobicContact CH2-CB 4.21Å; W267-P334 HydrophobicContact CH2-CG 4.13Å; W267-P334 HydrophobicContact CZ2-CB 4.46Å; W267-P334 HydrophobicContact CZ2-CG 3.99Å
268	F	88.1	Confident	84.8	Confident	63 Å²	63	54.1 Å²	54.1	28%	0.276	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	52.4	-170.5	-70.6	-85.4	0	0	0	112.6	H255 T270 I328 N329 L332	H255-F268 HydrophobicContact CB-CD1 4.07Å; H255-F268 HydrophobicContact CB-CD2 4.07Å; H255-F268 HydrophobicContact CB-CE1 3.94Å; H255-F268 HydrophobicContact CB-CE2 3.94Å; H255-F268 HydrophobicContact CB-CG 4.12Å; H255-F268 HydrophobicContact CB-CZ 3.86Å; H255-F268 AromaticContact CD2-CE1 3.67Å; H255-F268 AromaticContact CD2-CZ 3.35Å; H255-F268 WeakPolarHBondContact CD2-CZ 3.34Å; H255-F268 AromaticContact CE1-CE1 3.67Å; H255-F268 AromaticContact CG-CD1 3.96Å; H255-F268 AromaticContact CG-CE1 3.41Å; H255-F268 VanDerWaalsContact CG-CE1 3.41Å; H255-F268 AromaticContact CG-CZ 3.46Å; H255-F268 VanDerWaalsContact CG-CZ 3.46Å; H255-F268 AromaticContact ND1-CD1 3.9Å; H255-F268 AromaticContact ND1-CE1 3.42Å; H255-F268 WeakPolarHBondContact ND1-CE1 3.5Å; H255-F268 AromaticContact ND1-CZ 3.94Å; H255-F268 AromaticContact NE2-CE1 3.84Å; H255-F268 AromaticContact NE2-CZ 3.81Å; H255-F268 PolarHBondContact O-N 3.34Å; F268-T270 PolarHBondContact O-N 3.3Å; F268-T270 PolarHBondContact O-OG1 2.94Å; F268-I328 HydrophobicContact CB-CG2 4.33Å; F268-N329 HydrophobicContact CD2-CB 4.08Å; F268-N329 HydrophobicContact CE2-CB 3.91Å; F268-N329 WeakPolarHBondContact CE2-ND2 3.39Å; F268-N329 WeakPolarHBondContact CZ-ND2 3.12Å; F268-L332 HydrophobicContact CE2-CD1 3.77Å; F268-L332 HydrophobicContact CZ-CD1 3.48Å; F268-L332 VanDerWaalsContact CZ-CD1 3.48Å
269	D	83.3	Confident	84.9	Confident	121 Å²	121	55 Å²	55	65%	0.647	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	8.4	-178.2	-55.6	-42.8	0	0	0	115.3	W267	W267-D269 VanDerWaalsContact C-N 3.33Å; W267-D269 PolarHBondContact O-N 2.84Å
270	T	88.8	Confident	85.2	Confident	66 Å²	66	55.1 Å²	55.1	41%	0.405	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	117.1	177.8	-54.6	0	0	0	0	109.2	S266 W267 F268 L272 I328	S266-T270 CarbonylContact C-O 3.48Å; S266-T270 WeakPolarHBondContact CA-O 3.26Å; W267-T270 PolarHBondContact N-O 3.46Å; W267-T270 WeakPolarHBondContact O-CB 3.3Å; W267-T270 PolarHBondContact O-N 2.99Å; F268-T270 PolarHBondContact O-N 3.3Å; F268-T270 PolarHBondContact O-OG1 2.94Å; T270-L272 PolarHBondContact O-N 2.73Å; T270-I328 HydrophobicContact CG2-CD1 3.92Å; T270-I328 HydrophobicContact CG2-CG1 4.19Å
271	P	89	Confident	85.8	Confident	70 Å²	70	52.7 Å²	52.7	46%	0.455	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	133.4	177.2	-28.4	37.1	0	0	0	113.3
272	L	90.6	Very high	87.1	Confident	17 Å²	17	52.2 Å²	52.2	9%	0.089	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-87	127.6	172.9	-64.7	167.5	0	0	0	110.6	F256 I265 W267 T270 L274 L282 K324 L325 I328	F256-L272 HydrophobicContact CE1-CD1 4.38Å; I265-L272 HydrophobicContact CB-CD1 4.43Å; I265-L272 HydrophobicContact CG2-CD1 4.01Å; I265-L272 VanDerWaalsContact O-CB 3.31Å; I265-L272 WeakPolarHBondContact O-CB 3.37Å; I265-L272 PolarHBondContact O-N 3.47Å; W267-L272 HydrophobicContact CB-CD1 4.14Å; W267-L272 HydrophobicContact CB-CD2 4.29Å; W267-L272 HydrophobicContact CB-CG 4.19Å; T270-L272 PolarHBondContact O-N 2.73Å; L272-L274 HydrophobicContact CB-CD1 4.06Å; L272-L274 HydrophobicContact CB-CD2 3.87Å; L272-L274 HydrophobicContact CB-CG 3.71Å; L272-L274 HydrophobicContact CD1-CD1 4.34Å; L272-L274 HydrophobicContact CD1-CD2 4.48Å; L272-L274 PolarHBondContact O-N 3.27Å; L272-L282 HydrophobicContact CD1-CD2 3.79Å; L272-K324 HydrophobicContact CD2-CB 4.41Å; L272-L325 HydrophobicContact CD1-CD2 3.77Å; L272-L325 HydrophobicContact CD2-CD2 4.16Å; L272-I328 HydrophobicContact CD2-CD1 3.45Å; L272-I328 VanDerWaalsContact CD2-CD1 3.45Å; L272-I328 HydrophobicContact CG-CD1 4.37Å
273	T	89.3	Confident	88	Confident	127 Å²	127	51.7 Å²	51.7	78%	0.779	27%	0.271	S	S	*	.			trans	-78.7	95.6	169	-44.6	0	0	0	0	109.5	K324	T273-K324 WeakPolarHBondContact O-CD 3.43Å; T273-K324 WeakPolarHBondContact O-CE 3.41Å; T273-K324 PolarHBondContact O-NZ 3.37Å
274	L	87.9	Confident	88.5	Confident	36 Å²	36	50 Å²	50	19%	0.188	26%	0.255	C	S	.	.			trans	-109.9	144.4	-174.6	-59.2	178.6	0	0	0	111.7	I265 L272 E278 F279 L282 L321 K324	I265-L274 HydrophobicContact CB-CD1 4.08Å; I265-L274 HydrophobicContact CD1-CD1 3.98Å; I265-L274 HydrophobicContact CG1-CD1 4.38Å; L272-L274 HydrophobicContact CB-CD1 4.06Å; L272-L274 HydrophobicContact CB-CD2 3.87Å; L272-L274 HydrophobicContact CB-CG 3.71Å; L272-L274 HydrophobicContact CD1-CD1 4.34Å; L272-L274 HydrophobicContact CD1-CD2 4.48Å; L272-L274 PolarHBondContact O-N 3.27Å; L274-E278 HydrophobicContact CB-CB 4.13Å; L274-E278 HydrophobicContact CD2-CB 4.23Å; L274-F279 HydrophobicContact CB-CB 4.19Å; L274-F279 HydrophobicContact CD1-CB 4.36Å; L274-L282 HydrophobicContact CD1-CD2 4Å; L274-L321 HydrophobicContact CD2-CD2 3.65Å; L274-K324 HydrophobicContact CD2-CD 3.93Å
275	T	85	Confident	88.7	Confident	70 Å²	70	46.2 Å²	46.2	43%	0.429	24%	0.237	S	C	.	.			trans	-72.7	166.2	164.4	71.3	0	0	0	0	110.3	Y277 E278 F279	T275-Y277 VanDerWaalsContact C-N 3.34Å; T275-Y277 PolarHBondContact O-N 3.39Å; T275-E278 PolarHBondContact N-OE2 2.94Å; T275-E278 PolarHBondContact O-N 3.25Å; T275-E278 VanDerWaalsContact OG1-CG 3.26Å; T275-E278 WeakPolarHBondContact OG1-CG 3.24Å; T275-E278 PolarHBondContact OG1-N 3.39Å; T275-E278 PolarHBondContact OG1-OE2 2.92Å; T275-F279 WeakPolarHBondContact O-CB 3.48Å; T275-F279 PolarHBondContact O-N 2.99Å
276	R	82.7	Confident	88.6	Confident	179 Å²	179	46.2 Å²	46.2	68%	0.675	24%	0.237	S	C	*	.	H	α-helix	trans	-49.9	-52.4	177.1	175.6	177.6	172.1	141.3	-4.7	112.3	F279 L280	R276-F279 PolarHBondContact O-N 3.42Å; R276-L280 HydrophobicContact CG-CD1 4.01Å; R276-L280 VanDerWaalsContact O-CG 3.3Å; R276-L280 WeakPolarHBondContact O-CG 3.3Å; R276-L280 PolarHBondContact O-N 3.45Å
277	Y	84.3	Confident	88.2	Confident	69 Å²	69	50.8 Å²	50.8	27%	0.271	26%	0.256	S	S	.	.	H	α-helix	trans	-70.2	-33.6	-177.5	-66.5	-60	0	0	0	112.7	T275 L281 V302 W303	T275-Y277 VanDerWaalsContact C-N 3.34Å; T275-Y277 PolarHBondContact O-N 3.39Å; Y277-L281 WeakPolarHBondContact O-CB 3.28Å; Y277-L281 PolarHBondContact O-N 3.11Å; Y277-V302 HydrophobicContact CD1-CG1 4.05Å; Y277-W303 AromaticContact CD1-CD1 3.76Å; Y277-W303 HydrophobicContact CD1-CD2 4.26Å; Y277-W303 AromaticContact CD1-CE2 3.67Å; Y277-W303 HydrophobicContact CD1-CG 4.3Å; Y277-W303 HydrophobicContact CD1-CZ2 4.15Å; Y277-W303 AromaticContact CD1-NE1 3.33Å; Y277-W303 VanDerWaalsContact CD1-NE1 3.33Å; Y277-W303 AromaticContact CD2-NE1 3.9Å; Y277-W303 AromaticContact CE1-CD1 3.38Å; Y277-W303 HydrophobicContact CE1-CG 4.08Å; Y277-W303 AromaticContact CE1-NE1 3.41Å; Y277-W303 AromaticContact CE2-NE1 3.97Å; Y277-W303 AromaticContact CG-CE2 3.94Å; Y277-W303 HydrophobicContact CG-CZ2 4.08Å; Y277-W303 AromaticContact CG-NE1 3.59Å; Y277-W303 AromaticContact CZ-CD1 3.73Å; Y277-W303 AromaticContact CZ-NE1 3.73Å
278	E	89.7	Confident	87.5	Confident	8 Å²	8	52.2 Å²	52.2	4%	0.037	27%	0.267	C	S	.	.	H	α-helix	trans	-65.9	-42.1	172.9	-71.9	173.4	159.8	0	0	112.1	L274 T275 L282 T320 L321 K324	L274-E278 HydrophobicContact CB-CB 4.13Å; L274-E278 HydrophobicContact CD2-CB 4.23Å; T275-E278 PolarHBondContact N-OE2 2.94Å; T275-E278 PolarHBondContact O-N 3.25Å; T275-E278 VanDerWaalsContact OG1-CG 3.26Å; T275-E278 WeakPolarHBondContact OG1-CG 3.24Å; T275-E278 PolarHBondContact OG1-N 3.39Å; T275-E278 PolarHBondContact OG1-OE2 2.92Å; E278-L282 VanDerWaalsContact O-CB 3.32Å; E278-L282 WeakPolarHBondContact O-CB 3.47Å; E278-L282 PolarHBondContact O-N 3.48Å; E278-T320 VanDerWaalsContact OE1-CB 3.24Å; E278-T320 WeakPolarHBondContact OE1-CB 2.96Å; E278-T320 PolarHBondContact OE1-OG1 2.98Å; E278-L321 HydrophobicContact CB-CD2 3.85Å; E278-L321 HydrophobicContact CB-CG 4.26Å; E278-L321 HydrophobicContact CG-CD2 4.3Å; E278-L321 HydrophobicContact CG-CG 4.3Å; E278-K324 IonicContact OE1-NZ 2.7Å; E278-K324 PolarHBondContact OE1-NZ 2.95Å; E278-K324 IonicContact OE2-NZ 2.7Å; E278-K324 PolarHBondContact OE2-NZ 3.2Å
279	F	90.3	Very high	86.9	Confident	20 Å²	20	52.2 Å²	52.2	9%	0.088	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-50.1	174.2	170.4	-96.2	0	0	0	110.9	L258 A263 I265 L274 T275 R276 L281 L282 K283	L258-F279 HydrophobicContact CD1-CE2 4.02Å; L258-F279 HydrophobicContact CD1-CZ 4.23Å; A263-F279 HydrophobicContact CB-CE1 4.26Å; A263-F279 HydrophobicContact CB-CE2 4.33Å; A263-F279 HydrophobicContact CB-CZ 4.11Å; A263-F279 VanDerWaalsContact O-CD2 3.29Å; A263-F279 WeakPolarHBondContact O-CD2 3.45Å; A263-F279 WeakPolarHBondContact O-CE2 3.48Å; I265-F279 HydrophobicContact CD1-CD2 3.68Å; I265-F279 HydrophobicContact CD1-CE2 3.93Å; I265-F279 HydrophobicContact CG1-CD2 3.8Å; I265-F279 HydrophobicContact CG1-CE2 3.74Å; L274-F279 HydrophobicContact CB-CB 4.19Å; L274-F279 HydrophobicContact CD1-CB 4.36Å; T275-F279 WeakPolarHBondContact O-CB 3.48Å; T275-F279 PolarHBondContact O-N 2.99Å; R276-F279 PolarHBondContact O-N 3.42Å; F279-L281 PolarHBondContact O-N 3.3Å; F279-L282 PolarHBondContact O-N 3.33Å; F279-K283 HydrophobicContact CE1-CD 3.93Å; F279-K283 HydrophobicContact CZ-CD 4.15Å; F279-K283 WeakPolarHBondContact O-CB 3.47Å; F279-K283 PolarHBondContact O-N 2.74Å
280	L	88.1	Confident	86.2	Confident	45 Å²	45	47.6 Å²	47.6	24%	0.236	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-41	179.5	-69.6	174.7	0	0	0	112.1	R276 T284 V302	R276-L280 HydrophobicContact CG-CD1 4.01Å; R276-L280 VanDerWaalsContact O-CG 3.3Å; R276-L280 WeakPolarHBondContact O-CG 3.3Å; R276-L280 PolarHBondContact O-N 3.45Å; L280-T284 WeakPolarHBondContact O-CB 3.29Å; L280-T284 PolarHBondContact O-N 2.81Å; L280-T284 PolarHBondContact O-OG1 3.46Å; L280-V302 HydrophobicContact CB-CG1 3.68Å; L280-V302 HydrophobicContact CB-CG2 4.4Å; L280-V302 HydrophobicContact CD1-CG1 4.42Å
281	L	90.5	Very high	85.6	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-50	176.6	-177.7	61.7	0	0	0	111.7	Y277 F279 T284 L285 L298 H317 I318 L321	Y277-L281 WeakPolarHBondContact O-CB 3.28Å; Y277-L281 PolarHBondContact O-N 3.11Å; F279-L281 PolarHBondContact O-N 3.3Å; L281-T284 PolarHBondContact O-N 3.47Å; L281-L285 WeakPolarHBondContact O-CG 3.22Å; L281-L285 PolarHBondContact O-N 2.87Å; L281-L285 VanDerWaalsContact O-N 3.08Å; L281-L298 HydrophobicContact CD1-CB 4.24Å; L281-L298 HydrophobicContact CD1-CD1 4.04Å; L281-L298 HydrophobicContact CD1-CD2 3.87Å; L281-L298 HydrophobicContact CD1-CG 4.25Å; L281-H317 HydrophobicContact CD2-CB 3.58Å; L281-I318 HydrophobicContact CD2-CD1 3.83Å; L281-I318 HydrophobicContact CD2-CG1 4.11Å; L281-I318 HydrophobicContact CG-CD1 4.29Å; L281-L321 HydrophobicContact CB-CD1 4.26Å; L281-L321 HydrophobicContact CD2-CD1 3.74Å; L281-L321 HydrophobicContact CG-CD1 3.99Å
282	L	92.3	Very high	85.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.9	-38.9	179.1	-174.3	58.8	0	0	0	111.7	F256 I265 L272 L274 E278 F279 T284 L285 L286 L321	F256-L282 HydrophobicContact CE1-CD1 4.33Å; F256-L282 HydrophobicContact CE1-CD2 4.11Å; F256-L282 HydrophobicContact CZ-CD1 4.34Å; I265-L282 HydrophobicContact CB-CD2 4.39Å; I265-L282 HydrophobicContact CD1-CB 3.91Å; I265-L282 HydrophobicContact CD1-CD2 3.83Å; I265-L282 HydrophobicContact CD1-CG 3.85Å; I265-L282 HydrophobicContact CG2-CD2 3.84Å; L272-L282 HydrophobicContact CD1-CD2 3.79Å; L274-L282 HydrophobicContact CD1-CD2 4Å; E278-L282 VanDerWaalsContact O-CB 3.32Å; E278-L282 WeakPolarHBondContact O-CB 3.47Å; E278-L282 PolarHBondContact O-N 3.48Å; F279-L282 PolarHBondContact O-N 3.33Å; L282-T284 VanDerWaalsContact C-N 3.33Å; L282-T284 PolarHBondContact O-N 2.87Å; L282-L285 PolarHBondContact O-N 3.06Å; L282-L286 HydrophobicContact CD1-CG 4.49Å; L282-L286 HydrophobicContact CG-CD1 3.97Å; L282-L286 HydrophobicContact CG-CG 4.44Å; L282-L286 WeakPolarHBondContact O-CB 2.98Å; L282-L286 VanDerWaalsContact O-CG 3.27Å; L282-L286 WeakPolarHBondContact O-CG 3.17Å; L282-L286 PolarHBondContact O-N 3.41Å; L282-L321 HydrophobicContact CB-CD1 4.18Å; L282-L321 HydrophobicContact CB-CD2 4.19Å; L282-L321 HydrophobicContact CD2-CD2 4.26Å
283	K	90.6	Very high	84.9	Confident	42 Å²	42	48.9 Å²	48.9	18%	0.183	25%	0.246	C	C	.	.	H	α-helix	trans	-56.8	-45.4	171.8	173.8	-177	176.3	169.2	0	111.5	L258 E260 F279 L286 K287	L258-K283 HydrophobicContact CD2-CG 4.35Å; E260-K283 WeakPolarHBondContact OE2-CE 3.35Å; E260-K283 IonicContact OE2-NZ 2.69Å; E260-K283 PolarHBondContact OE2-NZ 2.88Å; F279-K283 HydrophobicContact CE1-CD 3.93Å; F279-K283 HydrophobicContact CZ-CD 4.15Å; F279-K283 WeakPolarHBondContact O-CB 3.47Å; F279-K283 PolarHBondContact O-N 2.74Å; K283-L286 PolarHBondContact O-N 3.05Å; K283-K287 VanDerWaalsContact CE-CE 3.45Å; K283-K287 WeakPolarHBondContact O-CG 3.45Å; K283-K287 PolarHBondContact O-N 3.08Å
284	T	89.1	Confident	84.6	Confident	18 Å²	18	44.6 Å²	44.6	11%	0.11	22%	0.221	C	C	.	.	H	α-helix	trans	-62.6	-44.2	179.3	-58.8	0	0	0	0	111.1	L280 L281 L282 K287 W293 L298	L280-T284 WeakPolarHBondContact O-CB 3.29Å; L280-T284 PolarHBondContact O-N 2.81Å; L280-T284 PolarHBondContact O-OG1 3.46Å; L281-T284 PolarHBondContact O-N 3.47Å; L282-T284 VanDerWaalsContact C-N 3.33Å; L282-T284 PolarHBondContact O-N 2.87Å; T284-K287 PolarHBondContact O-N 2.88Å; T284-W293 HydrophobicContact CG2-CD2 4.3Å; T284-W293 HydrophobicContact CG2-CE3 4.36Å; T284-W293 HydrophobicContact CG2-CH2 3.89Å; T284-W293 HydrophobicContact CG2-CZ2 3.82Å; T284-W293 HydrophobicContact CG2-CZ3 4.17Å; T284-L298 HydrophobicContact CG2-CD2 4.19Å
285	L	89.8	Confident	84.4	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.1	-39.1	174.4	-68.7	177.3	0	0	0	112.7	L281 L282 S288 W293 I318 I335 L345	L281-L285 WeakPolarHBondContact O-CG 3.22Å; L281-L285 PolarHBondContact O-N 2.87Å; L281-L285 VanDerWaalsContact O-N 3.08Å; L282-L285 PolarHBondContact O-N 3.06Å; L285-S288 CarbonylContact O-C 3.58Å; L285-S288 PolarHBondContact O-N 3.2Å; L285-W293 HydrophobicContact CD2-CG 4.36Å; L285-I318 HydrophobicContact CD1-CD1 4.1Å; L285-I335 HydrophobicContact CD1-CD1 4.31Å; L285-I335 HydrophobicContact CD1-CG1 4.39Å; L285-I335 HydrophobicContact CD1-CG2 4.39Å; L285-L345 HydrophobicContact CB-CB 4.22Å
286	L	88.7	Confident	84.1	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-68.2	-37	178.3	-80.4	167.6	0	0	0	113.2	I253 F256 I265 L282 K283 S288 P289 L345	I253-L286 HydrophobicContact CB-CD2 4.02Å; I253-L286 HydrophobicContact CD1-CB 3.86Å; I253-L286 HydrophobicContact CD1-CD2 3.9Å; I253-L286 HydrophobicContact CD1-CG 4.45Å; I253-L286 VanDerWaalsContact CD1-O 3.28Å; I253-L286 WeakPolarHBondContact CD1-O 3.43Å; I253-L286 HydrophobicContact CG2-CD2 4.13Å; F256-L286 HydrophobicContact CB-CD1 4.39Å; F256-L286 HydrophobicContact CB-CD2 3.57Å; F256-L286 HydrophobicContact CD1-CD1 4.4Å; F256-L286 HydrophobicContact CD1-CD2 4.27Å; F256-L286 HydrophobicContact CD2-CD2 3.57Å; F256-L286 HydrophobicContact CE2-CD2 4.31Å; F256-L286 HydrophobicContact CG-CD1 4.39Å; F256-L286 HydrophobicContact CG-CD2 3.55Å; I265-L286 HydrophobicContact CD1-CD1 3.95Å; I265-L286 HydrophobicContact CG1-CD1 4.38Å; I265-L286 HydrophobicContact CG2-CD1 3.96Å; L282-L286 HydrophobicContact CD1-CG 4.49Å; L282-L286 HydrophobicContact CG-CD1 3.97Å; L282-L286 HydrophobicContact CG-CG 4.44Å; L282-L286 WeakPolarHBondContact O-CB 2.98Å; L282-L286 VanDerWaalsContact O-CG 3.27Å; L282-L286 WeakPolarHBondContact O-CG 3.17Å; L282-L286 PolarHBondContact O-N 3.41Å; K283-L286 PolarHBondContact O-N 3.05Å; L286-S288 PolarHBondContact O-N 3.18Å; L286-P289 WeakPolarHBondContact O-CD 3.43Å; L286-L345 HydrophobicContact CD2-CD2 3.48Å; L286-L345 VanDerWaalsContact CD2-CD2 3.48Å; L286-L345 HydrophobicContact CG-CD2 4.02Å
287	K	82.5	Confident	84.1	Confident	107 Å²	107	44.3 Å²	44.3	47%	0.465	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-14.3	178.3	-76	-168.1	178.1	-162.5	0	113.8	E260 K283 T284	E260-K287 VanDerWaalsContact CD-CE 3.47Å; E260-K287 WeakPolarHBondContact OE1-CE 3.35Å; E260-K287 IonicContact OE1-NZ 2.79Å; E260-K287 PolarHBondContact OE1-NZ 3.21Å; E260-K287 IonicContact OE2-NZ 3.87Å; E260-K287 PolarHBondContact OE2-NZ 2.83Å; K283-K287 VanDerWaalsContact CE-CE 3.45Å; K283-K287 WeakPolarHBondContact O-CG 3.45Å; K283-K287 PolarHBondContact O-N 3.08Å; T284-K287 PolarHBondContact O-N 2.88Å
288	S	76.3	Confident	84.2	Confident	37 Å²	37	41 Å²	41	26%	0.259	21%	0.205	S	C	.	.	S	Bend	trans	-143.5	68.4	179	-63.5	0	0	0	0	110.9	L285 L286 R291	L285-S288 CarbonylContact O-C 3.58Å; L285-S288 PolarHBondContact O-N 3.2Å; L286-S288 PolarHBondContact O-N 3.18Å; S288-R291 VanDerWaalsContact O-CB 3.29Å; S288-R291 WeakPolarHBondContact O-CB 3.37Å; S288-R291 PolarHBondContact O-N 2.78Å
289	P	76.5	Confident	83.8	Confident	63 Å²	63	42.9 Å²	42.9	41%	0.409	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	140.5	-179.1	27.7	-31.4	0	0	0	110.3	I253 L286 R291	I253-P289 HydrophobicContact CG2-CB 4.49Å; I253-P289 HydrophobicContact CG2-CG 4.39Å; L286-P289 WeakPolarHBondContact O-CD 3.43Å; P289-R291 PolarHBondContact O-N 3.45Å
290	G	67.9	Low	83.2	Confident	25 Å²	25	45.9 Å²	45.9	26%	0.258	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	-21.7	-174.5	0	0	0	0	0	114.9	V292 L345	G290-V292 PolarHBondContact O-N 2.95Å; G290-L345 VanDerWaalsContact CA-O 3.31Å; G290-L345 WeakPolarHBondContact CA-O 3.36Å; G290-L345 PolarHBondContact N-O 3.11Å
291	R	77.4	Confident	82.7	Confident	112 Å²	112	46.7 Å²	46.7	42%	0.423	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-68.7	130	178.6	-174.4	176.1	180	-178.3	-0.3	110.6	S288 P289 S344	S288-R291 VanDerWaalsContact O-CB 3.29Å; S288-R291 WeakPolarHBondContact O-CB 3.37Å; S288-R291 PolarHBondContact O-N 2.78Å; P289-R291 PolarHBondContact O-N 3.45Å; R291-S344 WeakPolarHBondContact O-CA 3.15Å; R291-S344 WeakPolarHBondContact O-CB 3.44Å
292	V	80.1	Confident	82.2	Confident	44 Å²	44	47.2 Å²	47.2	27%	0.267	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-81.5	118.3	169.9	-174.5	0	0	0	0	108	G290 H338 M341	G290-V292 PolarHBondContact O-N 2.95Å; V292-H338 HydrophobicContact CG1-CB 4.21Å; V292-M341 HydrophobicContact CG1-CB 4.04Å
293	W	83.3	Confident	81.6	Confident	24 Å²	24	48.3 Å²	48.3	9%	0.091	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-100.7	125.3	173.9	-66	86.4	0	0	0	109.4	T284 L285 Q297 L298 G342 Y343	T284-W293 HydrophobicContact CG2-CD2 4.3Å; T284-W293 HydrophobicContact CG2-CE3 4.36Å; T284-W293 HydrophobicContact CG2-CH2 3.89Å; T284-W293 HydrophobicContact CG2-CZ2 3.82Å; T284-W293 HydrophobicContact CG2-CZ3 4.17Å; L285-W293 HydrophobicContact CD2-CG 4.36Å; W293-Q297 HydrophobicContact CE3-CB 4.01Å; W293-L298 HydrophobicContact CB-CD1 3.93Å; W293-L298 HydrophobicContact CB-CD2 3.55Å; W293-L298 HydrophobicContact CB-CG 3.6Å; W293-L298 HydrophobicContact CD2-CD2 4.06Å; W293-L298 HydrophobicContact CE3-CD2 4.24Å; W293-L298 HydrophobicContact CG-CD2 3.79Å; W293-L298 HydrophobicContact CG-CG 4.37Å; W293-G342 CarbonylContact O-C 3.55Å; W293-G342 VanDerWaalsContact O-CA 3.3Å; W293-G342 WeakPolarHBondContact O-CA 3.44Å; W293-Y343 PolarHBondContact N-O 2.89Å; W293-Y343 PolarHBondContact O-N 2.68Å
294	S	83.5	Confident	79.9	Confident	36 Å²	36	54.2 Å²	54.2	25%	0.252	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-67.3	156.6	170.8	68.8	0	0	0	0	111.4	Q296 Q297 L298 M341	S294-Q296 PolarHBondContact O-N 3.23Å; S294-Q297 PolarHBondContact O-N 2.82Å; S294-Q297 WeakPolarHBondContact OG-CB 3.3Å; S294-Q297 VanDerWaalsContact OG-CD 3.29Å; S294-Q297 WeakPolarHBondContact OG-CG 3.32Å; S294-Q297 PolarHBondContact OG-N 3.37Å; S294-Q297 VanDerWaalsContact OG-N 3.14Å; S294-Q297 PolarHBondContact OG-OE1 2.82Å; S294-L298 WeakPolarHBondContact O-CG 3.38Å; S294-L298 PolarHBondContact O-N 3.29Å; S294-M341 VanDerWaalsContact CA-O 3.24Å; S294-M341 WeakPolarHBondContact CA-O 3.09Å
295	R	84.4	Confident	78.2	Confident	86 Å²	86	60.5 Å²	60.5	33%	0.325	31%	0.31	S	S	.	.	H	α-helix	trans	-56.1	-42.7	175.8	-70.8	176.4	173.6	81.9	-1.3	111.2	L298 M299 D315 Y343	R295-L298 PolarHBondContact O-N 2.99Å; R295-M299 WeakPolarHBondContact O-CG 3.15Å; R295-M299 PolarHBondContact O-N 2.95Å; R295-D315 IonicContact CZ-OD1 3.86Å; R295-D315 IonicContact CZ-OD2 3.99Å; R295-D315 IonicContact NE-OD1 2.8Å; R295-D315 PolarHBondContact NE-OD1 2.85Å; R295-D315 IonicContact NE-OD2 3.19Å; R295-D315 PolarHBondContact NE-OD2 2.81Å; R295-D315 IonicContact NH2-OD1 2.93Å; R295-D315 PolarHBondContact NH2-OD1 3.37Å; R295-D315 IonicContact NH2-OD2 3.39Å; R295-D315 PolarHBondContact NH2-OD2 2.61Å; R295-Y343 HydrophobicContact CG-CE2 4.33Å; R295-Y343 PolarHBondContact NH2-OH 3.43Å
296	Q	78.9	Confident	76.5	Confident	120 Å²	120	61.9 Å²	61.9	56%	0.561	32%	0.321	S	S	*	.	H	α-helix	trans	-63	-46.3	177.2	-167.6	62	38.1	0	0	111.9	S294 L298 M299 D300	S294-Q296 PolarHBondContact O-N 3.23Å; Q296-L298 VanDerWaalsContact C-N 3.28Å; Q296-L298 PolarHBondContact O-N 2.85Å; Q296-M299 WeakPolarHBondContact O-CA 3.48Å; Q296-M299 WeakPolarHBondContact O-CB 3.48Å; Q296-M299 PolarHBondContact O-N 3.27Å; Q296-M299 VanDerWaalsContact O-N 3.09Å; Q296-D300 PolarHBondContact NE2-OD1 2.76Å; Q296-D300 PolarHBondContact O-N 2.74Å
297	Q	83.2	Confident	74.3	Confident	74 Å²	74	70.8 Å²	70.8	35%	0.346	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-35.4	177.6	-73.6	165.6	-37.2	0	0	112.9	W293 S294 S301	W293-Q297 HydrophobicContact CE3-CB 4.01Å; S294-Q297 PolarHBondContact O-N 2.82Å; S294-Q297 WeakPolarHBondContact OG-CB 3.3Å; S294-Q297 VanDerWaalsContact OG-CD 3.29Å; S294-Q297 WeakPolarHBondContact OG-CG 3.32Å; S294-Q297 PolarHBondContact OG-N 3.37Å; S294-Q297 VanDerWaalsContact OG-N 3.14Å; S294-Q297 PolarHBondContact OG-OE1 2.82Å; Q297-S301 WeakPolarHBondContact O-CB 3.38Å; Q297-S301 PolarHBondContact O-N 3.3Å
298	L	86	Confident	72.5	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-69.4	-39.2	174.1	-68.5	173.6	0	0	0	111.3	L281 T284 W293 S294 R295 Q296 V302 V314 Y343	L281-L298 HydrophobicContact CD1-CB 4.24Å; L281-L298 HydrophobicContact CD1-CD1 4.04Å; L281-L298 HydrophobicContact CD1-CD2 3.87Å; L281-L298 HydrophobicContact CD1-CG 4.25Å; T284-L298 HydrophobicContact CG2-CD2 4.19Å; W293-L298 HydrophobicContact CB-CD1 3.93Å; W293-L298 HydrophobicContact CB-CD2 3.55Å; W293-L298 HydrophobicContact CB-CG 3.6Å; W293-L298 HydrophobicContact CD2-CD2 4.06Å; W293-L298 HydrophobicContact CE3-CD2 4.24Å; W293-L298 HydrophobicContact CG-CD2 3.79Å; W293-L298 HydrophobicContact CG-CG 4.37Å; S294-L298 WeakPolarHBondContact O-CG 3.38Å; S294-L298 PolarHBondContact O-N 3.29Å; R295-L298 PolarHBondContact O-N 2.99Å; Q296-L298 VanDerWaalsContact C-N 3.28Å; Q296-L298 PolarHBondContact O-N 2.85Å; L298-V302 VanDerWaalsContact O-CB 3.3Å; L298-V302 WeakPolarHBondContact O-CB 3.48Å; L298-V302 PolarHBondContact O-N 3.38Å; L298-V302 VanDerWaalsContact O-N 3.1Å; L298-V314 HydrophobicContact CB-CG1 4.14Å; L298-V314 HydrophobicContact CB-CG2 4.08Å; L298-V314 HydrophobicContact CD1-CG1 3.66Å; L298-Y343 HydrophobicContact CD1-CD2 4.05Å
299	M	81.5	Confident	70.9	Confident	46 Å²	46	73.1 Å²	73.1	23%	0.227	38%	0.38	C	S	.	.	H	α-helix	trans	-58.1	-56.8	172.2	-72.9	-62	-63.1	0	0	110.6	R295 Q296 S301 V302 W303 V314	R295-M299 WeakPolarHBondContact O-CG 3.15Å; R295-M299 PolarHBondContact O-N 2.95Å; Q296-M299 WeakPolarHBondContact O-CA 3.48Å; Q296-M299 WeakPolarHBondContact O-CB 3.48Å; Q296-M299 PolarHBondContact O-N 3.27Å; Q296-M299 VanDerWaalsContact O-N 3.09Å; M299-S301 VanDerWaalsContact C-N 3.3Å; M299-S301 PolarHBondContact O-N 2.93Å; M299-V302 PolarHBondContact O-N 3.43Å; M299-W303 WeakPolarHBondContact O-CA 3.5Å; M299-W303 WeakPolarHBondContact O-CB 3.47Å; M299-W303 PolarHBondContact O-N 2.88Å; M299-W303 HydrophobicContact SD-CD2 4.25Å; M299-W303 HydrophobicContact SD-CE3 3.9Å; M299-W303 HydrophobicContact SD-CZ3 4.19Å; M299-V314 HydrophobicContact CG-CG2 3.7Å; M299-V314 HydrophobicContact SD-CG2 3.61Å
300	D	76	Confident	69.5	Low	84 Å²	84	80.2 Å²	80.2	45%	0.449	40%	0.4	S	S	.	.	H	α-helix	trans	-60.5	-39.8	-176.7	-58.4	-17.4	0	0	0	111.7	Q296 E304	Q296-D300 PolarHBondContact NE2-OD1 2.76Å; Q296-D300 PolarHBondContact O-N 2.74Å; D300-E304 WeakPolarHBondContact O-CB 3.43Å
301	S	78.2	Confident	68.2	Low	62 Å²	62	85.6 Å²	85.6	43%	0.434	42%	0.423	S	S	.	.	H	α-helix	trans	-79.9	-24.8	-175.8	-177.2	0	0	0	0	114.7	Q297 M299	Q297-S301 WeakPolarHBondContact O-CB 3.38Å; Q297-S301 PolarHBondContact O-N 3.3Å; M299-S301 VanDerWaalsContact C-N 3.3Å; M299-S301 PolarHBondContact O-N 2.93Å
302	V	81	Confident	67	Low	11 Å²	11	90.4 Å²	90.4	7%	0.067	44%	0.441	C	S	.	.	H	α-helix	trans	-109.5	-24.1	-172.9	171.6	0	0	0	0	112	Y277 L280 L298 M299	Y277-V302 HydrophobicContact CD1-CG1 4.05Å; L280-V302 HydrophobicContact CB-CG1 3.68Å; L280-V302 HydrophobicContact CB-CG2 4.4Å; L280-V302 HydrophobicContact CD1-CG1 4.42Å; L298-V302 VanDerWaalsContact O-CB 3.3Å; L298-V302 WeakPolarHBondContact O-CB 3.48Å; L298-V302 PolarHBondContact O-N 3.38Å; L298-V302 VanDerWaalsContact O-N 3.1Å; M299-V302 PolarHBondContact O-N 3.43Å
303	W	78.1	Confident	66.5	Low	22 Å²	22	91.1 Å²	91.1	8%	0.083	45%	0.446	C	S	.	.	S	Bend	trans	-117	18.2	-176.3	-70.9	-94.3	0	0	0	114.1	Y277 M299 D305 A306 V314 H317	Y277-W303 AromaticContact CD1-CD1 3.76Å; Y277-W303 HydrophobicContact CD1-CD2 4.26Å; Y277-W303 AromaticContact CD1-CE2 3.67Å; Y277-W303 HydrophobicContact CD1-CG 4.3Å; Y277-W303 HydrophobicContact CD1-CZ2 4.15Å; Y277-W303 AromaticContact CD1-NE1 3.33Å; Y277-W303 VanDerWaalsContact CD1-NE1 3.33Å; Y277-W303 AromaticContact CD2-NE1 3.9Å; Y277-W303 AromaticContact CE1-CD1 3.38Å; Y277-W303 HydrophobicContact CE1-CG 4.08Å; Y277-W303 AromaticContact CE1-NE1 3.41Å; Y277-W303 AromaticContact CE2-NE1 3.97Å; Y277-W303 AromaticContact CG-CE2 3.94Å; Y277-W303 HydrophobicContact CG-CZ2 4.08Å; Y277-W303 AromaticContact CG-NE1 3.59Å; Y277-W303 AromaticContact CZ-CD1 3.73Å; Y277-W303 AromaticContact CZ-NE1 3.73Å; M299-W303 WeakPolarHBondContact O-CA 3.5Å; M299-W303 WeakPolarHBondContact O-CB 3.47Å; M299-W303 PolarHBondContact O-N 2.88Å; M299-W303 HydrophobicContact SD-CD2 4.25Å; M299-W303 HydrophobicContact SD-CE3 3.9Å; M299-W303 HydrophobicContact SD-CZ3 4.19Å; W303-D305 PolarHBondContact O-N 2.95Å; W303-A306 HydrophobicContact CB-CB 4.21Å; W303-A306 WeakPolarHBondContact O-CB 3.38Å; W303-A306 PolarHBondContact O-N 3.28Å; W303-V314 HydrophobicContact CZ3-CG2 4.23Å; W303-H317 AromaticContact CH2-CD2 3.83Å; W303-H317 AromaticContact CZ2-CD2 3.42Å; W303-H317 VanDerWaalsContact CZ2-CD2 3.42Å; W303-H317 WeakPolarHBondContact CZ2-CD2 3.38Å; W303-H317 AromaticContact CZ2-NE2 3.67Å
304	E	56	Low	66.5	Low	167 Å²	167	90.1 Å²	90.1	78%	0.78	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-30.5	-174.8	-145.5	174.3	-174.7	0	0	115	D300	D300-E304 WeakPolarHBondContact O-CB 3.43Å
305	D	52.7	Low	66.5	Low	150 Å²	150	91.2 Å²	91.2	80%	0.802	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	2.9	179.7	-68.5	-38.5	0	0	0	113.9	W303 Q307	W303-D305 PolarHBondContact O-N 2.95Å; D305-Q307 PolarHBondContact O-N 2.85Å; D305-Q307 VanDerWaalsContact O-N 3.13Å
306	A	53.5	Low	66.5	Low	29 Å²	29	90.5 Å²	90.5	24%	0.24	45%	0.451	C	S	.	.			trans	-88.3	76.2	-177.2	0	0	0	0	0	110.3	W303 D308	W303-A306 HydrophobicContact CB-CB 4.21Å; W303-A306 WeakPolarHBondContact O-CB 3.38Å; W303-A306 PolarHBondContact O-N 3.28Å; A306-D308 PolarHBondContact O-N 3.43Å
307	Q	44.2	Very low	66.9	Low	187 Å²	187	86.6 Å²	86.6	87%	0.874	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-10.5	-175.7	-78.2	-176.2	-25.6	0	0	115.2	D305	D305-Q307 PolarHBondContact O-N 2.85Å; D305-Q307 VanDerWaalsContact O-N 3.13Å
308	D	43	Very low	67.2	Low	113 Å²	113	83.1 Å²	83.1	60%	0.604	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.2	15.2	-173.9	-70.6	-49.5	0	0	0	116.8	A306 Y310	A306-D308 PolarHBondContact O-N 3.43Å; D308-Y310 PolarHBondContact O-N 2.9Å
309	T	44.5	Very low	67.3	Low	80 Å²	80	90.8 Å²	90.8	49%	0.491	45%	0.45	S	S	.	.			trans	-91.8	95.5	179.7	-42.4	0	0	0	0	112.9	D311	T309-D311 PolarHBondContact O-N 3.36Å; T309-D311 VanDerWaalsContact O-N 3.15Å
310	Y	45.3	Very low	67.7	Low	212 Å²	212	90.9 Å²	90.9	83%	0.831	45%	0.453	S	S	*	.			trans	-58.3	107.6	168.3	-76.2	-95.8	0	0	0	112	D308 R312	D308-Y310 PolarHBondContact O-N 2.9Å; Y310-R312 PolarHBondContact O-N 3.1Å
311	D	41.3	Very low	68.5	Low	139 Å²	139	87 Å²	87	74%	0.743	43%	0.432	S	S	*	.	S	Bend	trans	38.7	46.3	142.8	-133.6	4.3	0	0	0	119.2	T309	T309-D311 PolarHBondContact O-N 3.36Å; T309-D311 VanDerWaalsContact O-N 3.15Å
312	R	52.8	Low	69.2	Low	212 Å²	212	86.4 Å²	86.4	80%	0.8	42%	0.42	S	S	*	.			trans	-127.2	130.1	163.7	-90.9	-177.6	172	175.1	-0.3	111.2	Y310	Y310-R312 PolarHBondContact O-N 3.1Å
313	T	70.1	Confident	69.6	Low	60 Å²	60	88.8 Å²	88.8	37%	0.368	44%	0.441	S	S	.	.				-121.4	141.9	-99	24.9	0	0	0	0	103	D315 T316	T313-D315 PolarHBondContact O-N 3.43Å; T313-T316 WeakPolarHBondContact O-CB 3.3Å; T313-T316 PolarHBondContact O-N 2.91Å
314	V	81.7	Confident	70.3	Confident	3 Å²	3	90.9 Å²	90.9	2%	0.018	45%	0.451	C	S	.	.	H	α-helix	trans	-38.4	-38	179.1	174.3	0	0	0	0	112.9	L298 M299 W303 T316 H317 I318 Y343	L298-V314 HydrophobicContact CB-CG1 4.14Å; L298-V314 HydrophobicContact CB-CG2 4.08Å; L298-V314 HydrophobicContact CD1-CG1 3.66Å; M299-V314 HydrophobicContact CG-CG2 3.7Å; M299-V314 HydrophobicContact SD-CG2 3.61Å; W303-V314 HydrophobicContact CZ3-CG2 4.23Å; V314-T316 VanDerWaalsContact C-N 3.3Å; V314-T316 PolarHBondContact O-N 2.92Å; V314-H317 PolarHBondContact O-N 3.2Å; V314-I318 HydrophobicContact CG1-CG1 4.07Å; V314-I318 WeakPolarHBondContact O-CG1 3.42Å; V314-I318 PolarHBondContact O-N 3Å; V314-Y343 HydrophobicContact CG1-CD2 3.97Å; V314-Y343 HydrophobicContact CG1-CE2 3.87Å
315	D	84.6	Confident	72	Confident	58 Å²	58	83 Å²	83	31%	0.31	41%	0.414	S	S	.	.	H	α-helix	trans	-54.9	-37	177.3	-63.6	25.5	0	0	0	114.1	R295 T313 K319 Y343	R295-D315 IonicContact CZ-OD1 3.86Å; R295-D315 IonicContact CZ-OD2 3.99Å; R295-D315 IonicContact NE-OD1 2.8Å; R295-D315 PolarHBondContact NE-OD1 2.85Å; R295-D315 IonicContact NE-OD2 3.19Å; R295-D315 PolarHBondContact NE-OD2 2.81Å; R295-D315 IonicContact NH2-OD1 2.93Å; R295-D315 PolarHBondContact NH2-OD1 3.37Å; R295-D315 IonicContact NH2-OD2 3.39Å; R295-D315 PolarHBondContact NH2-OD2 2.61Å; T313-D315 PolarHBondContact O-N 3.43Å; D315-K319 WeakPolarHBondContact O-CB 3.34Å; D315-K319 PolarHBondContact O-N 3.13Å; D315-Y343 WeakPolarHBondContact CA-OH 3.38Å; D315-Y343 PolarHBondContact OD1-OH 3.17Å; D315-Y343 PolarHBondContact OD2-OH 2.64Å
316	T	83.3	Confident	73.7	Confident	72 Å²	72	81.9 Å²	81.9	44%	0.442	40%	0.399	S	S	.	.	H	α-helix	trans	-66.8	-48.2	177	-59	0	0	0	0	110.8	T313 V314 I318 K319 T320	T313-T316 WeakPolarHBondContact O-CB 3.3Å; T313-T316 PolarHBondContact O-N 2.91Å; V314-T316 VanDerWaalsContact C-N 3.3Å; V314-T316 PolarHBondContact O-N 2.92Å; T316-I318 PolarHBondContact O-N 3.49Å; T316-K319 WeakPolarHBondContact O-CB 3.17Å; T316-K319 PolarHBondContact O-N 3.47Å; T316-K319 VanDerWaalsContact O-N 3.17Å; T316-T320 PolarHBondContact O-N 3.19Å
317	H	87.6	Confident	75.4	Confident	37 Å²	37	84.7 Å²	84.7	17%	0.171	42%	0.422	C	S	.	.	H	α-helix	trans	-67.6	-35.2	177	-68.7	-67.4	0	0	0	112.3	L281 W303 V314 K319 T320 L321	L281-H317 HydrophobicContact CD2-CB 3.58Å; W303-H317 AromaticContact CH2-CD2 3.83Å; W303-H317 AromaticContact CZ2-CD2 3.42Å; W303-H317 VanDerWaalsContact CZ2-CD2 3.42Å; W303-H317 WeakPolarHBondContact CZ2-CD2 3.38Å; W303-H317 AromaticContact CZ2-NE2 3.67Å; V314-H317 PolarHBondContact O-N 3.2Å; H317-K319 VanDerWaalsContact C-N 3.32Å; H317-K319 PolarHBondContact O-N 2.87Å; H317-T320 WeakPolarHBondContact CA-OG1 3.43Å; H317-T320 PolarHBondContact O-N 2.91Å; H317-T320 PolarHBondContact O-OG1 2.67Å; H317-L321 VanDerWaalsContact O-CB 3.3Å; H317-L321 WeakPolarHBondContact O-CB 3.48Å; H317-L321 VanDerWaalsContact O-CG 3.28Å; H317-L321 WeakPolarHBondContact O-CG 3.4Å; H317-L321 PolarHBondContact O-N 3.01Å
318	I	90	Very high	77.5	Confident	1 Å²	1	78.3 Å²	78.3	1%	0.005	39%	0.393	C	S	.	.	H	α-helix	trans	-64.5	-39.2	172	-66	-70.5	0	0	0	111	L281 L285 V314 T316 R322 I335 Y343	L281-I318 HydrophobicContact CD2-CD1 3.83Å; L281-I318 HydrophobicContact CD2-CG1 4.11Å; L281-I318 HydrophobicContact CG-CD1 4.29Å; L285-I318 HydrophobicContact CD1-CD1 4.1Å; V314-I318 HydrophobicContact CG1-CG1 4.07Å; V314-I318 WeakPolarHBondContact O-CG1 3.42Å; V314-I318 PolarHBondContact O-N 3Å; T316-I318 PolarHBondContact O-N 3.49Å; I318-R322 HydrophobicContact CG2-CG 4.42Å; I318-R322 WeakPolarHBondContact O-CB 3.39Å; I318-R322 VanDerWaalsContact O-CG 3.3Å; I318-R322 WeakPolarHBondContact O-CG 3.4Å; I318-R322 PolarHBondContact O-N 3.49Å; I318-I335 HydrophobicContact CD1-CG2 4.08Å; I318-I335 HydrophobicContact CG2-CG2 4.07Å; I318-Y343 HydrophobicContact CB-CD1 4.37Å; I318-Y343 HydrophobicContact CB-CE1 4Å; I318-Y343 HydrophobicContact CD1-CD1 4.18Å; I318-Y343 HydrophobicContact CD1-CD2 4.29Å; I318-Y343 HydrophobicContact CD1-CG 3.98Å; I318-Y343 HydrophobicContact CG1-CD1 3.99Å; I318-Y343 HydrophobicContact CG1-CD2 3.89Å; I318-Y343 HydrophobicContact CG1-CE1 3.96Å; I318-Y343 HydrophobicContact CG1-CE2 3.9Å; I318-Y343 HydrophobicContact CG1-CG 3.94Å; I318-Y343 HydrophobicContact CG2-CD1 3.75Å; I318-Y343 HydrophobicContact CG2-CE1 3.48Å; I318-Y343 VanDerWaalsContact CG2-CE1 3.48Å
319	K	89	Confident	79.5	Confident	162 Å²	162	74.6 Å²	74.6	70%	0.704	37%	0.373	S	S	*	.	H	α-helix	trans	-63	-44.8	176.8	-174.8	-176.5	177.4	-174.7	0	111.3	D315 T316 H317 R322 A323	D315-K319 WeakPolarHBondContact O-CB 3.34Å; D315-K319 PolarHBondContact O-N 3.13Å; T316-K319 WeakPolarHBondContact O-CB 3.17Å; T316-K319 PolarHBondContact O-N 3.47Å; T316-K319 VanDerWaalsContact O-N 3.17Å; H317-K319 VanDerWaalsContact C-N 3.32Å; H317-K319 PolarHBondContact O-N 2.87Å; K319-R322 PolarHBondContact O-N 3.46Å; K319-A323 PolarHBondContact O-N 3.37Å; K319-A323 VanDerWaalsContact O-N 3.13Å
320	T	89.9	Confident	81.3	Confident	48 Å²	48	75.4 Å²	75.4	29%	0.294	38%	0.38	S	S	.	.	H	α-helix	trans	-68.2	-43.6	178.1	59.7	0	0	0	0	111.8	E278 T316 H317 R322 A323 K324	E278-T320 VanDerWaalsContact OE1-CB 3.24Å; E278-T320 WeakPolarHBondContact OE1-CB 2.96Å; E278-T320 PolarHBondContact OE1-OG1 2.98Å; T316-T320 PolarHBondContact O-N 3.19Å; H317-T320 WeakPolarHBondContact CA-OG1 3.43Å; H317-T320 PolarHBondContact O-N 2.91Å; H317-T320 PolarHBondContact O-OG1 2.67Å; T320-R322 VanDerWaalsContact C-N 3.33Å; T320-R322 PolarHBondContact O-N 3.12Å; T320-A323 WeakPolarHBondContact O-CB 3.42Å; T320-A323 PolarHBondContact O-N 3.36Å; T320-A323 VanDerWaalsContact O-N 3.12Å; T320-K324 WeakPolarHBondContact O-CG 3.37Å; T320-K324 PolarHBondContact O-N 3.19Å
321	L	92.3	Very high	82.7	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-56.4	-46.2	173.9	-79.2	176.1	0	0	0	111.7	L274 E278 L281 L282 H317 A323 K324 L325 I335	L274-L321 HydrophobicContact CD2-CD2 3.65Å; E278-L321 HydrophobicContact CB-CD2 3.85Å; E278-L321 HydrophobicContact CB-CG 4.26Å; E278-L321 HydrophobicContact CG-CD2 4.3Å; E278-L321 HydrophobicContact CG-CG 4.3Å; L281-L321 HydrophobicContact CB-CD1 4.26Å; L281-L321 HydrophobicContact CD2-CD1 3.74Å; L281-L321 HydrophobicContact CG-CD1 3.99Å; L282-L321 HydrophobicContact CB-CD1 4.18Å; L282-L321 HydrophobicContact CB-CD2 4.19Å; L282-L321 HydrophobicContact CD2-CD2 4.26Å; H317-L321 VanDerWaalsContact O-CB 3.3Å; H317-L321 WeakPolarHBondContact O-CB 3.48Å; H317-L321 VanDerWaalsContact O-CG 3.28Å; H317-L321 WeakPolarHBondContact O-CG 3.4Å; H317-L321 PolarHBondContact O-N 3.01Å; L321-A323 VanDerWaalsContact C-N 3.31Å; L321-A323 PolarHBondContact O-N 3.4Å; L321-K324 PolarHBondContact O-N 3.5Å; L321-L325 VanDerWaalsContact O-CG 3.24Å; L321-L325 WeakPolarHBondContact O-CG 3.37Å; L321-L325 PolarHBondContact O-N 3Å; L321-I335 HydrophobicContact CB-CD1 4.09Å; L321-I335 HydrophobicContact CD1-CD1 4.44Å
322	R	92.5	Very high	84.4	Confident	50 Å²	50	69.1 Å²	69.1	19%	0.189	36%	0.36	C	S	.	.	H	α-helix	trans	-59.8	-40.5	176.3	-79.9	174.7	167.1	160.4	-0.7	112.7	I318 K319 T320 R326 I335 T337	I318-R322 HydrophobicContact CG2-CG 4.42Å; I318-R322 WeakPolarHBondContact O-CB 3.39Å; I318-R322 VanDerWaalsContact O-CG 3.3Å; I318-R322 WeakPolarHBondContact O-CG 3.4Å; I318-R322 PolarHBondContact O-N 3.49Å; K319-R322 PolarHBondContact O-N 3.46Å; T320-R322 VanDerWaalsContact C-N 3.33Å; T320-R322 PolarHBondContact O-N 3.12Å; R322-R326 WeakPolarHBondContact O-CB 3.35Å; R322-R326 VanDerWaalsContact O-CG 3.3Å; R322-R326 WeakPolarHBondContact O-CG 3.3Å; R322-R326 PolarHBondContact O-N 2.94Å; R322-I335 PolarHBondContact NE-O 3.3Å; R322-I335 PolarHBondContact NH2-O 2.79Å; R322-T337 PolarHBondContact NH1-OG1 2.83Å; R322-T337 PolarHBondContact NH2-OG1 2.87Å
323	A	89.7	Confident	85.7	Confident	61 Å²	61	61 Å²	61	50%	0.504	34%	0.336	S	S	.	.	H	α-helix	trans	-63.2	-45.1	177.2	0	0	0	0	0	111.3	K319 T320 L321 L325 R326 A327	K319-A323 PolarHBondContact O-N 3.37Å; K319-A323 VanDerWaalsContact O-N 3.13Å; T320-A323 WeakPolarHBondContact O-CB 3.42Å; T320-A323 PolarHBondContact O-N 3.36Å; T320-A323 VanDerWaalsContact O-N 3.12Å; L321-A323 VanDerWaalsContact C-N 3.31Å; L321-A323 PolarHBondContact O-N 3.4Å; A323-L325 PolarHBondContact O-N 2.86Å; A323-R326 PolarHBondContact O-N 3.13Å; A323-A327 WeakPolarHBondContact O-CB 3.38Å; A323-A327 PolarHBondContact O-N 3.08Å
324	K	91.9	Very high	86.3	Confident	66 Å²	66	58.8 Å²	58.8	29%	0.287	32%	0.323	S	S	.	.	H	α-helix	trans	-63.7	-40.8	177.9	-67.3	-179.8	-179.5	-173.8	0	112.6	L272 T273 L274 E278 T320 L321 A327	L272-K324 HydrophobicContact CD2-CB 4.41Å; T273-K324 WeakPolarHBondContact O-CD 3.43Å; T273-K324 WeakPolarHBondContact O-CE 3.41Å; T273-K324 PolarHBondContact O-NZ 3.37Å; L274-K324 HydrophobicContact CD2-CD 3.93Å; E278-K324 IonicContact OE1-NZ 2.7Å; E278-K324 PolarHBondContact OE1-NZ 2.95Å; E278-K324 IonicContact OE2-NZ 2.7Å; E278-K324 PolarHBondContact OE2-NZ 3.2Å; T320-K324 WeakPolarHBondContact O-CG 3.37Å; T320-K324 PolarHBondContact O-N 3.19Å; L321-K324 PolarHBondContact O-N 3.5Å; K324-A327 PolarHBondContact O-N 3.45Å
325	L	91.6	Very high	86.6	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-67.7	-42.3	177.3	-66	169.6	0	0	0	112.3	F256 W267 L272 L321 A323 A327 I328 N329 P334 I335	F256-L325 HydrophobicContact CE1-CD2 3.55Å; F256-L325 HydrophobicContact CZ-CD1 4.29Å; F256-L325 HydrophobicContact CZ-CD2 3.73Å; W267-L325 HydrophobicContact CB-CD2 4.18Å; W267-L325 HydrophobicContact CD2-CD2 4.22Å; W267-L325 HydrophobicContact CG-CD2 3.85Å; L272-L325 HydrophobicContact CD1-CD2 3.77Å; L272-L325 HydrophobicContact CD2-CD2 4.16Å; L321-L325 VanDerWaalsContact O-CG 3.24Å; L321-L325 WeakPolarHBondContact O-CG 3.37Å; L321-L325 PolarHBondContact O-N 3Å; A323-L325 PolarHBondContact O-N 2.86Å; L325-A327 VanDerWaalsContact C-N 3.31Å; L325-A327 PolarHBondContact O-N 3.27Å; L325-I328 PolarHBondContact O-N 3.05Å; L325-N329 PolarHBondContact O-N 3.44Å; L325-N329 VanDerWaalsContact O-N 3.11Å; L325-P334 HydrophobicContact CD1-CG 3.86Å; L325-I335 HydrophobicContact CD1-CD1 3.86Å; L325-I335 HydrophobicContact CD1-CG1 4.22Å
326	R	90.1	Very high	86.6	Confident	126 Å²	126	58.7 Å²	58.7	48%	0.475	32%	0.322	S	S	.	.	H	α-helix	trans	-68.2	-28.7	177.4	-75.1	178.1	-172.9	163.4	2.4	113.3	R322 A323 I328 N329 P330 S333	R322-R326 WeakPolarHBondContact O-CB 3.35Å; R322-R326 VanDerWaalsContact O-CG 3.3Å; R322-R326 WeakPolarHBondContact O-CG 3.3Å; R322-R326 PolarHBondContact O-N 2.94Å; A323-R326 PolarHBondContact O-N 3.13Å; R326-I328 PolarHBondContact O-N 3.24Å; R326-N329 CarbonylContact O-C 3.51Å; R326-P330 WeakPolarHBondContact O-CA 3.26Å; R326-S333 PolarHBondContact NH2-OG 3.19Å
327	A	88.8	Confident	86.7	Confident	87 Å²	87	58 Å²	58	72%	0.719	32%	0.318	S	S	*	.	H	α-helix	trans	-63	-27.7	175.9	0	0	0	0	0	112.6	A323 K324 L325	A323-A327 WeakPolarHBondContact O-CB 3.38Å; A323-A327 PolarHBondContact O-N 3.08Å; K324-A327 PolarHBondContact O-N 3.45Å; L325-A327 VanDerWaalsContact C-N 3.31Å; L325-A327 PolarHBondContact O-N 3.27Å
328	I	88.4	Confident	86.3	Confident	54 Å²	54	57.8 Å²	57.8	28%	0.277	32%	0.317	S	S	.	.	H	α-helix	trans	-90.3	-44.5	176.4	-63.1	169.3	0	0	0	110.9	W267 F268 T270 L272 L325 R326	W267-I328 HydrophobicContact CB-CD1 4.25Å; F268-I328 HydrophobicContact CB-CG2 4.33Å; T270-I328 HydrophobicContact CG2-CD1 3.92Å; T270-I328 HydrophobicContact CG2-CG1 4.19Å; L272-I328 HydrophobicContact CD2-CD1 3.45Å; L272-I328 VanDerWaalsContact CD2-CD1 3.45Å; L272-I328 HydrophobicContact CG-CD1 4.37Å; L325-I328 PolarHBondContact O-N 3.05Å; R326-I328 PolarHBondContact O-N 3.24Å
329	N	84.4	Confident	85.4	Confident	34 Å²	34	68.8 Å²	68.8	18%	0.182	36%	0.358	C	S	.	.			trans	-137.1	102	176.8	-168.9	-36.3	0	0	0	110.6	F268 L325 R326 D331	F268-N329 HydrophobicContact CD2-CB 4.08Å; F268-N329 HydrophobicContact CE2-CB 3.91Å; F268-N329 WeakPolarHBondContact CE2-ND2 3.39Å; F268-N329 WeakPolarHBondContact CZ-ND2 3.12Å; L325-N329 PolarHBondContact O-N 3.44Å; L325-N329 VanDerWaalsContact O-N 3.11Å; R326-N329 CarbonylContact O-C 3.51Å; N329-D331 VanDerWaalsContact C-N 3.28Å; N329-D331 PolarHBondContact O-N 2.73Å; N329-D331 PolarHBondContact OD1-N 3.16Å
330	P	81.6	Confident	84.6	Confident	98 Å²	98	64.9 Å²	64.9	64%	0.636	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-29.8	-176	-23.4	33.6	0	0	0	114.3	R326 L332	R326-P330 WeakPolarHBondContact O-CA 3.26Å; P330-L332 VanDerWaalsContact C-N 3.33Å; P330-L332 PolarHBondContact O-N 3.45Å
331	D	76.4	Confident	83.6	Confident	149 Å²	149	66 Å²	66	80%	0.797	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-12.8	-170.8	-60.8	-34.8	0	0	0	112.8	N329	N329-D331 VanDerWaalsContact C-N 3.28Å; N329-D331 PolarHBondContact O-N 2.73Å; N329-D331 PolarHBondContact OD1-N 3.16Å
332	L	75.4	Confident	83.2	Confident	69 Å²	69	65.9 Å²	65.9	36%	0.361	37%	0.366	S	S	.	.			trans	-116.9	125.8	-175.9	-67.7	174.6	0	0	0	112.3	W267 F268 P330	W267-L332 HydrophobicContact CZ2-CB 4.44Å; F268-L332 HydrophobicContact CE2-CD1 3.77Å; F268-L332 HydrophobicContact CZ-CD1 3.48Å; F268-L332 VanDerWaalsContact CZ-CD1 3.48Å; P330-L332 VanDerWaalsContact C-N 3.33Å; P330-L332 PolarHBondContact O-N 3.45Å
333	S	79.9	Confident	82.9	Confident	42 Å²	42	64 Å²	64	29%	0.294	36%	0.359	S	S	.	.			trans	-120.7	88.8	172	-151	0	0	0	0	109.7	R326 I335	R326-S333 PolarHBondContact NH2-OG 3.19Å; S333-I335 VanDerWaalsContact C-N 3.28Å; S333-I335 PolarHBondContact O-N 2.9Å
334	P	84.5	Confident	82.6	Confident	14 Å²	14	61.3 Å²	61.3	9%	0.091	34%	0.337	C	S	.	.			trans	-74.4	-15.4	-170.1	29.3	-36	0	0	0	113.9	F256 W267 L325 L345 R346	F256-P334 HydrophobicContact CE2-CB 4.09Å; F256-P334 HydrophobicContact CE2-CG 4.02Å; F256-P334 HydrophobicContact CZ-CB 4.43Å; F256-P334 HydrophobicContact CZ-CG 3.85Å; W267-P334 HydrophobicContact CH2-CB 4.21Å; W267-P334 HydrophobicContact CH2-CG 4.13Å; W267-P334 HydrophobicContact CZ2-CB 4.46Å; W267-P334 HydrophobicContact CZ2-CG 3.99Å; L325-P334 HydrophobicContact CD1-CG 3.86Å; P334-L345 HydrophobicContact CB-CD1 4.13Å; P334-R346 PolarHBondContact O-N 2.87Å
335	I	88.1	Confident	82.3	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	112.2	178	-57.3	174.6	0	0	0	109.2	L285 I318 L321 R322 L325 S333 Y343 S344 L345	L285-I335 HydrophobicContact CD1-CD1 4.31Å; L285-I335 HydrophobicContact CD1-CG1 4.39Å; L285-I335 HydrophobicContact CD1-CG2 4.39Å; I318-I335 HydrophobicContact CD1-CG2 4.08Å; I318-I335 HydrophobicContact CG2-CG2 4.07Å; L321-I335 HydrophobicContact CB-CD1 4.09Å; L321-I335 HydrophobicContact CD1-CD1 4.44Å; R322-I335 PolarHBondContact NE-O 3.3Å; R322-I335 PolarHBondContact NH2-O 2.79Å; L325-I335 HydrophobicContact CD1-CD1 3.86Å; L325-I335 HydrophobicContact CD1-CG1 4.22Å; S333-I335 VanDerWaalsContact C-N 3.28Å; S333-I335 PolarHBondContact O-N 2.9Å; I335-Y343 HydrophobicContact CG2-CD1 4.31Å; I335-S344 CarbonylContact C-O 3.53Å; I335-S344 WeakPolarHBondContact CA-O 3.18Å; I335-L345 HydrophobicContact CG1-CD1 4.02Å
336	N	82.9	Confident	81.3	Confident	57 Å²	57	63 Å²	63	31%	0.305	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	139.4	176.9	-70.9	-26.4	0	0	0	111.2	Y343 S344	N336-Y343 WeakPolarHBondContact O-CA 3.46Å; N336-S344 PolarHBondContact N-O 3.32Å; N336-S344 PolarHBondContact O-N 3Å; N336-S344 VanDerWaalsContact O-N 3.12Å
337	T	85.5	Confident	79.9	Confident	57 Å²	57	57.4 Å²	57.4	35%	0.35	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	120.3	168.9	-68.3	0	0	0	0	109.3	R322 Y343	R322-T337 PolarHBondContact NH1-OG1 2.83Å; R322-T337 PolarHBondContact NH2-OG1 2.87Å; T337-Y343 HydrophobicContact CG2-CE1 4.2Å; T337-Y343 WeakPolarHBondContact OG1-CE1 3.35Å
338	H	79	Confident	78.4	Confident	32 Å²	32	57.9 Å²	57.9	15%	0.148	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	101.1	170.8	-61.5	-80.8	0	0	0	107.5	V292 G340 M341 G342 S344	V292-H338 HydrophobicContact CG1-CB 4.21Å; H338-G340 PolarHBondContact O-N 2.79Å; H338-M341 HydrophobicContact CB-CB 3.8Å; H338-M341 HydrophobicContact CB-CE 3.83Å; H338-M341 PolarHBondContact O-N 2.99Å; H338-G342 PolarHBondContact N-O 3.41Å; H338-G342 PolarHBondContact O-N 2.9Å; H338-S344 PolarHBondContact NE2-OG 3Å
339	R	71.8	Confident	76.8	Confident	233 Å²	233	59.2 Å²	59.2	88%	0.879	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	129.2	-177.5	-75.7	-172.7	178.9	-177.5	0.5	110	M341	R339-M341 PolarHBondContact O-N 2.72Å
340	G	71.7	Confident	75.9	Confident	80 Å²	80	60 Å²	60	83%	0.825	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	-17.3	-175.8	0	0	0	0	0	116	H338	H338-G340 PolarHBondContact O-N 2.79Å
341	M	69.4	Low	75.3	Confident	70 Å²	70	55.9 Å²	55.9	35%	0.345	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-39.4	-174.5	-65.6	179.5	-83.1	0	0	113.5	V292 S294 H338 R339 L449	V292-M341 HydrophobicContact CG1-CB 4.04Å; S294-M341 VanDerWaalsContact CA-O 3.24Å; S294-M341 WeakPolarHBondContact CA-O 3.09Å; H338-M341 HydrophobicContact CB-CB 3.8Å; H338-M341 HydrophobicContact CB-CE 3.83Å; H338-M341 PolarHBondContact O-N 2.99Å; R339-M341 PolarHBondContact O-N 2.72Å; M341-L449 HydrophobicContact CE-CD1 4.48Å; M341-L449 HydrophobicContact SD-CD1 3.82Å; M341-L449 HydrophobicContact SD-CD2 4.43Å; M341-L449 HydrophobicContact SD-CG 4.33Å
342	G	83.9	Confident	75.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	134.8	-136.5	180	0	0	0	0	0	113.6	W293 H338	W293-G342 CarbonylContact O-C 3.55Å; W293-G342 VanDerWaalsContact O-CA 3.3Å; W293-G342 WeakPolarHBondContact O-CA 3.44Å; H338-G342 PolarHBondContact N-O 3.41Å; H338-G342 PolarHBondContact O-N 2.9Å
343	Y	86.3	Confident	75.5	Confident	9 Å²	9	49.8 Å²	49.8	4%	0.035	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	148.4	-170.7	-59.6	-82.2	0	0	0	112.5	W293 R295 L298 V314 D315 I318 I335 N336 T337	W293-Y343 PolarHBondContact N-O 2.89Å; W293-Y343 PolarHBondContact O-N 2.68Å; R295-Y343 HydrophobicContact CG-CE2 4.33Å; R295-Y343 PolarHBondContact NH2-OH 3.43Å; L298-Y343 HydrophobicContact CD1-CD2 4.05Å; V314-Y343 HydrophobicContact CG1-CD2 3.97Å; V314-Y343 HydrophobicContact CG1-CE2 3.87Å; D315-Y343 WeakPolarHBondContact CA-OH 3.38Å; D315-Y343 PolarHBondContact OD1-OH 3.17Å; D315-Y343 PolarHBondContact OD2-OH 2.64Å; I318-Y343 HydrophobicContact CB-CD1 4.37Å; I318-Y343 HydrophobicContact CB-CE1 4Å; I318-Y343 HydrophobicContact CD1-CD1 4.18Å; I318-Y343 HydrophobicContact CD1-CD2 4.29Å; I318-Y343 HydrophobicContact CD1-CG 3.98Å; I318-Y343 HydrophobicContact CG1-CD1 3.99Å; I318-Y343 HydrophobicContact CG1-CD2 3.89Å; I318-Y343 HydrophobicContact CG1-CE1 3.96Å; I318-Y343 HydrophobicContact CG1-CE2 3.9Å; I318-Y343 HydrophobicContact CG1-CG 3.94Å; I318-Y343 HydrophobicContact CG2-CD1 3.75Å; I318-Y343 HydrophobicContact CG2-CE1 3.48Å; I318-Y343 VanDerWaalsContact CG2-CE1 3.48Å; I335-Y343 HydrophobicContact CG2-CD1 4.31Å; N336-Y343 WeakPolarHBondContact O-CA 3.46Å; T337-Y343 HydrophobicContact CG2-CE1 4.2Å; T337-Y343 WeakPolarHBondContact OG1-CE1 3.35Å
344	S	84.3	Confident	75.8	Confident	5 Å²	5	47.9 Å²	47.9	4%	0.035	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154.4	172.2	73.5	0	0	0	0	110.9	R291 I335 N336 H338	R291-S344 WeakPolarHBondContact O-CA 3.15Å; R291-S344 WeakPolarHBondContact O-CB 3.44Å; I335-S344 CarbonylContact C-O 3.53Å; I335-S344 WeakPolarHBondContact CA-O 3.18Å; N336-S344 PolarHBondContact N-O 3.32Å; N336-S344 PolarHBondContact O-N 3Å; N336-S344 VanDerWaalsContact O-N 3.12Å; H338-S344 PolarHBondContact NE2-OG 3Å
345	L	84.5	Confident	75.9	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	138.4	163.2	-157.4	71.5	0	0	0	109.5	F256 L285 L286 G290 P334 I335 G347	F256-L345 HydrophobicContact CD2-CD2 4.4Å; F256-L345 HydrophobicContact CE2-CD1 4.05Å; F256-L345 HydrophobicContact CE2-CD2 4.28Å; F256-L345 HydrophobicContact CZ-CD1 4.48Å; L285-L345 HydrophobicContact CB-CB 4.22Å; L286-L345 HydrophobicContact CD2-CD2 3.48Å; L286-L345 VanDerWaalsContact CD2-CD2 3.48Å; L286-L345 HydrophobicContact CG-CD2 4.02Å; G290-L345 VanDerWaalsContact CA-O 3.31Å; G290-L345 WeakPolarHBondContact CA-O 3.36Å; G290-L345 PolarHBondContact N-O 3.11Å; P334-L345 HydrophobicContact CB-CD1 4.13Å; I335-L345 HydrophobicContact CG1-CD1 4.02Å; L345-G347 PolarHBondContact O-N 3.26Å
346	R	70.5	Confident	75.9	Confident	100 Å²	100	54.5 Å²	54.5	38%	0.377	31%	0.308	S	S	.	.			trans	-63.1	123.4	178.3	-161.9	175.6	-166.4	159.3	4.8	110.8	P334 L348 E351	P334-R346 PolarHBondContact O-N 2.87Å; R346-L348 PolarHBondContact O-N 3.24Å; R346-E351 WeakPolarHBondContact CG-OE2 3.08Å; R346-E351 IonicContact CZ-OE1 3.25Å; R346-E351 IonicContact CZ-OE2 3Å; R346-E351 IonicContact NE-OE1 3.97Å; R346-E351 PolarHBondContact NE-OE1 2.92Å; R346-E351 IonicContact NE-OE2 3.81Å; R346-E351 PolarHBondContact NE-OE2 2.96Å; R346-E351 IonicContact NH2-OE1 3.94Å; R346-E351 PolarHBondContact NH2-OE1 3.33Å; R346-E351 IonicContact NH2-OE2 3.31Å
347	G	60.8	Low	76.3	Confident	10 Å²	10	53.7 Å²	53.7	10%	0.103	31%	0.305	C	S	.	.			trans	-85.3	89.7	-179.8	0	0	0	0	0	112.1	L345 A349 T350 E351	L345-G347 PolarHBondContact O-N 3.26Å; G347-A349 VanDerWaalsContact C-N 3.25Å; G347-A349 PolarHBondContact O-N 3.5Å; G347-T350 PolarHBondContact O-N 2.9Å; G347-T350 PolarHBondContact O-OG1 2.92Å; G347-E351 PolarHBondContact O-N 3.44Å
348	L	57	Low	76.6	Confident	97 Å²	97	51 Å²	51	51%	0.508	29%	0.288	S	S	.	.	H	α-helix	trans	-60	-29.9	-177	-74	156.3	0	0	0	113.7	R346 G352	R346-L348 PolarHBondContact O-N 3.24Å; L348-G352 PolarHBondContact O-N 3.06Å
349	A	55.9	Low	77.2	Confident	82 Å²	82	52.8 Å²	52.8	68%	0.678	30%	0.302	S	S	*	.	H	α-helix	trans	-71.8	-43.1	-177.1	0	0	0	0	0	113.5	G347 T353	G347-A349 VanDerWaalsContact C-N 3.25Å; G347-A349 PolarHBondContact O-N 3.5Å; A349-T353 PolarHBondContact O-N 2.92Å
350	T	65.4	Low	78.2	Confident	50 Å²	50	47 Å²	47	31%	0.307	29%	0.287	S	S	.	.	H	α-helix	trans	-71.2	-39.9	176.4	39.1	0	0	0	0	111.5	G347 G352 T353 L354	G347-T350 PolarHBondContact O-N 2.9Å; G347-T350 PolarHBondContact O-OG1 2.92Å; T350-G352 VanDerWaalsContact C-N 3.33Å; T350-G352 PolarHBondContact O-N 2.94Å; T350-T353 PolarHBondContact O-N 3.15Å; T350-T353 PolarHBondContact O-OG1 3.35Å; T350-L354 WeakPolarHBondContact O-CB 3.36Å; T350-L354 VanDerWaalsContact O-CG 3.3Å; T350-L354 WeakPolarHBondContact O-CG 3.28Å; T350-L354 PolarHBondContact O-N 2.99Å
351	E	69.2	Low	79.2	Confident	12 Å²	12	44.4 Å²	44.4	6%	0.056	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-43	177.1	-164	162.3	-169	0	0	111.1	R346 G347 L354 I355 Y443 M460 V462	R346-E351 WeakPolarHBondContact CG-OE2 3.08Å; R346-E351 IonicContact CZ-OE1 3.25Å; R346-E351 IonicContact CZ-OE2 3Å; R346-E351 IonicContact NE-OE1 3.97Å; R346-E351 PolarHBondContact NE-OE1 2.92Å; R346-E351 IonicContact NE-OE2 3.81Å; R346-E351 PolarHBondContact NE-OE2 2.96Å; R346-E351 IonicContact NH2-OE1 3.94Å; R346-E351 PolarHBondContact NH2-OE1 3.33Å; R346-E351 IonicContact NH2-OE2 3.31Å; G347-E351 PolarHBondContact O-N 3.44Å; E351-L354 PolarHBondContact O-N 3.32Å; E351-I355 WeakPolarHBondContact O-CG2 3.06Å; E351-I355 PolarHBondContact O-N 3.47Å; E351-Y443 HydrophobicContact CG-CE1 4.49Å; E351-Y443 WeakPolarHBondContact CG-OH 3.43Å; E351-Y443 WeakPolarHBondContact OE1-CE1 3.39Å; E351-Y443 PolarHBondContact OE1-OH 2.84Å; E351-M460 HydrophobicContact CB-CE 3.64Å; E351-M460 HydrophobicContact CG-CE 3.55Å; E351-V462 HydrophobicContact CG-CG2 4.29Å
352	G	73.3	Confident	80.3	Confident	27 Å²	27	41.1 Å²	41.1	28%	0.278	24%	0.239	S	C	.	.	H	α-helix	trans	-57.3	-52.6	173.3	0	0	0	0	0	113.3	L348 T350 L354 I355 D356	L348-G352 PolarHBondContact O-N 3.06Å; T350-G352 VanDerWaalsContact C-N 3.33Å; T350-G352 PolarHBondContact O-N 2.94Å; G352-L354 PolarHBondContact O-N 3.46Å; G352-I355 WeakPolarHBondContact O-CG2 3.33Å; G352-I355 PolarHBondContact O-N 2.88Å; G352-D356 VanDerWaalsContact O-CG 3.32Å; G352-D356 PolarHBondContact O-N 2.64Å; G352-D356 VanDerWaalsContact O-N 3.1Å
353	T	81.7	Confident	80.7	Confident	62 Å²	62	45.7 Å²	45.7	38%	0.38	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-32.6	178.9	60.1	0	0	0	0	113	A349 T350 T357	A349-T353 PolarHBondContact O-N 2.92Å; T350-T353 PolarHBondContact O-N 3.15Å; T350-T353 PolarHBondContact O-OG1 3.35Å; T353-T357 WeakPolarHBondContact O-CB 3.31Å; T353-T357 PolarHBondContact O-N 2.74Å; T353-T357 VanDerWaalsContact O-N 3.12Å; T353-T357 PolarHBondContact O-OG1 3.11Å
354	L	86.3	Confident	80.9	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-74.2	-40.1	179.3	-73.7	173.8	0	0	0	112	T350 E351 G352 T357 A358 Y405 M460 V462 V478 K480	T350-L354 WeakPolarHBondContact O-CB 3.36Å; T350-L354 VanDerWaalsContact O-CG 3.3Å; T350-L354 WeakPolarHBondContact O-CG 3.28Å; T350-L354 PolarHBondContact O-N 2.99Å; E351-L354 PolarHBondContact O-N 3.32Å; G352-L354 PolarHBondContact O-N 3.46Å; L354-T357 PolarHBondContact O-N 3.04Å; L354-A358 VanDerWaalsContact O-CB 3.29Å; L354-A358 WeakPolarHBondContact O-CB 3.4Å; L354-A358 PolarHBondContact O-N 2.96Å; L354-Y405 HydrophobicContact CD2-CD1 4.26Å; L354-Y405 HydrophobicContact CD2-CE1 3.82Å; L354-M460 HydrophobicContact CD1-CB 4.19Å; L354-M460 HydrophobicContact CD1-CG 3.92Å; L354-M460 HydrophobicContact CD1-SD 4.2Å; L354-V462 HydrophobicContact CB-CB 3.82Å; L354-V462 HydrophobicContact CB-CG2 3.63Å; L354-V462 HydrophobicContact CD1-CG2 3.97Å; L354-V462 HydrophobicContact CG-CG2 4.46Å; L354-V478 HydrophobicContact CD2-CB 4.45Å; L354-V478 HydrophobicContact CD2-CG1 3.82Å; L354-K480 HydrophobicContact CD1-CB 4.37Å; L354-K480 HydrophobicContact CD2-CB 3.81Å
355	I	86.7	Confident	81.2	Confident	42 Å²	42	49.5 Å²	49.5	22%	0.215	28%	0.28	C	S	.	.	H	α-helix	trans	-66.6	-40.3	176.3	-172.1	57.3	0	0	0	111.5	E351 G352 T357 A358 T359 Y443 V462	E351-I355 WeakPolarHBondContact O-CG2 3.06Å; E351-I355 PolarHBondContact O-N 3.47Å; G352-I355 WeakPolarHBondContact O-CG2 3.33Å; G352-I355 PolarHBondContact O-N 2.88Å; I355-T357 VanDerWaalsContact C-N 3.31Å; I355-T357 PolarHBondContact O-N 3.47Å; I355-A358 PolarHBondContact O-N 3Å; I355-T359 WeakPolarHBondContact O-CB 3.39Å; I355-T359 PolarHBondContact O-N 2.92Å; I355-T359 PolarHBondContact O-OG1 2.96Å; I355-Y443 HydrophobicContact CB-CE2 4.21Å; I355-Y443 HydrophobicContact CD1-CD2 4.28Å; I355-Y443 HydrophobicContact CD1-CE2 3.84Å; I355-Y443 HydrophobicContact CG1-CE2 3.98Å; I355-V462 HydrophobicContact CB-CG1 3.81Å; I355-V462 HydrophobicContact CD1-CG1 3.79Å; I355-V462 HydrophobicContact CG1-CG1 4.35Å
356	D	87.4	Confident	81.6	Confident	114 Å²	114	53.3 Å²	53.3	61%	0.61	29%	0.294	S	S	*	.	H	α-helix	trans	-61.2	-44.2	175.9	-67.1	-21.2	0	0	0	110.6	G352 L360	G352-D356 VanDerWaalsContact O-CG 3.32Å; G352-D356 PolarHBondContact O-N 2.64Å; G352-D356 VanDerWaalsContact O-N 3.1Å; D356-L360 WeakPolarHBondContact O-CB 3.3Å; D356-L360 PolarHBondContact O-N 2.95Å
357	T	91.4	Very high	82.5	Confident	40 Å²	40	51.3 Å²	51.3	25%	0.245	30%	0.295	C	S	.	.	H	α-helix	trans	-65.7	-44.3	177.3	-53.4	0	0	0	0	111.6	T353 L354 I355 L360 L361 V478	T353-T357 WeakPolarHBondContact O-CB 3.31Å; T353-T357 PolarHBondContact O-N 2.74Å; T353-T357 VanDerWaalsContact O-N 3.12Å; T353-T357 PolarHBondContact O-OG1 3.11Å; L354-T357 PolarHBondContact O-N 3.04Å; I355-T357 VanDerWaalsContact C-N 3.31Å; I355-T357 PolarHBondContact O-N 3.47Å; T357-L360 PolarHBondContact O-N 3.35Å; T357-L361 HydrophobicContact CG2-CD1 3.93Å; T357-L361 HydrophobicContact CG2-CG 4.34Å; T357-L361 WeakPolarHBondContact O-CB 3.24Å; T357-L361 VanDerWaalsContact O-CG 3.28Å; T357-L361 WeakPolarHBondContact O-CG 3.27Å; T357-L361 PolarHBondContact O-N 3.26Å; T357-V478 HydrophobicContact CG2-CG1 4.17Å; T357-V478 HydrophobicContact CG2-CG2 4.35Å
358	A	92.4	Very high	83.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.2	-42.1	179.3	0	0	0	0	0	111.7	L354 I355 L361 A362 A464 L476 V478	L354-A358 VanDerWaalsContact O-CB 3.29Å; L354-A358 WeakPolarHBondContact O-CB 3.4Å; L354-A358 PolarHBondContact O-N 2.96Å; I355-A358 PolarHBondContact O-N 3Å; A358-L361 PolarHBondContact O-N 3.21Å; A358-A362 VanDerWaalsContact O-CB 3.23Å; A358-A362 WeakPolarHBondContact O-CB 3.35Å; A358-A362 PolarHBondContact O-N 2.82Å; A358-A464 HydrophobicContact CB-CB 3.88Å; A358-L476 HydrophobicContact CB-CD2 4.45Å; A358-L476 WeakPolarHBondContact O-CD2 3.28Å; A358-V478 HydrophobicContact CB-CB 4.27Å; A358-V478 HydrophobicContact CB-CG2 3.72Å
359	T	92	Very high	85.4	Confident	69 Å²	69	47.8 Å²	47.8	42%	0.423	27%	0.273	S	S	.	.	H	α-helix	trans	-64.9	-45.6	178.4	-52	0	0	0	0	111	I355 A362 E363	I355-T359 WeakPolarHBondContact O-CB 3.39Å; I355-T359 PolarHBondContact O-N 2.92Å; I355-T359 PolarHBondContact O-OG1 2.96Å; T359-A362 PolarHBondContact O-N 2.64Å; T359-E363 PolarHBondContact O-N 3.41Å
360	L	92.5	Very high	87	Confident	111 Å²	111	48.2 Å²	48.2	58%	0.581	26%	0.264	S	S	*	.	H	α-helix	trans	-62	-45	176.6	-179.9	65.8	0	0	0	112.1	D356 T357 E363 L364	D356-L360 WeakPolarHBondContact O-CB 3.3Å; D356-L360 PolarHBondContact O-N 2.95Å; T357-L360 PolarHBondContact O-N 3.35Å; L360-E363 PolarHBondContact O-N 2.93Å; L360-L364 HydrophobicContact CG-CD1 4.38Å; L360-L364 WeakPolarHBondContact O-CG 3.32Å; L360-L364 PolarHBondContact O-N 2.87Å
361	L	93.1	Very high	88	Confident	26 Å²	26	49.8 Å²	49.8	14%	0.136	28%	0.277	C	S	.	.	H	α-helix	trans	-70	-34	179.6	-70.8	179.4	0	0	0	112.1	T357 A358 E363 L364 A365 L379 F383 V407 L476 V478	T357-L361 HydrophobicContact CG2-CD1 3.93Å; T357-L361 HydrophobicContact CG2-CG 4.34Å; T357-L361 WeakPolarHBondContact O-CB 3.24Å; T357-L361 VanDerWaalsContact O-CG 3.28Å; T357-L361 WeakPolarHBondContact O-CG 3.27Å; T357-L361 PolarHBondContact O-N 3.26Å; A358-L361 PolarHBondContact O-N 3.21Å; L361-E363 VanDerWaalsContact C-N 3.32Å; L361-E363 PolarHBondContact O-N 2.71Å; L361-L364 HydrophobicContact CD2-CD1 4.31Å; L361-L364 PolarHBondContact O-N 3.02Å; L361-A365 VanDerWaalsContact O-CB 3.23Å; L361-A365 WeakPolarHBondContact O-CB 3.35Å; L361-A365 PolarHBondContact O-N 2.75Å; L361-L379 HydrophobicContact CD2-CD1 3.98Å; L361-F383 HydrophobicContact CD1-CE2 4.39Å; L361-F383 HydrophobicContact CD1-CZ 4.17Å; L361-V407 HydrophobicContact CD1-CG1 4.24Å; L361-V407 HydrophobicContact CD1-CG2 3.94Å; L361-L476 HydrophobicContact CB-CD1 3.96Å; L361-L476 HydrophobicContact CB-CD2 3.47Å; L361-L476 VanDerWaalsContact CB-CD2 3.47Å; L361-L476 HydrophobicContact CB-CG 4.38Å; L361-L476 HydrophobicContact CD1-CD2 4.36Å; L361-V478 HydrophobicContact CD1-CG2 3.92Å
362	A	92.9	Very high	88.7	Confident	2 Å²	2	52.2 Å²	52.2	2%	0.017	31%	0.306	C	S	.	.	H	α-helix	trans	-60.1	-41.9	174.4	0	0	0	0	0	111.7	A358 T359 A365 R366 A464 I466 L476	A358-A362 VanDerWaalsContact O-CB 3.23Å; A358-A362 WeakPolarHBondContact O-CB 3.35Å; A358-A362 PolarHBondContact O-N 2.82Å; T359-A362 PolarHBondContact O-N 2.64Å; A362-A365 PolarHBondContact O-N 2.95Å; A362-R366 PolarHBondContact O-N 2.82Å; A362-A464 HydrophobicContact CB-CB 4.06Å; A362-I466 HydrophobicContact CB-CG1 3.92Å; A362-L476 HydrophobicContact CB-CB 4.02Å
363	E	91.4	Very high	89.2	Confident	95 Å²	95	54.1 Å²	54.1	44%	0.444	31%	0.309	S	S	.	.	H	α-helix	trans	-63.6	-42	174.8	-76.9	-62.5	134.1	0	0	112.5	T359 L360 L361 A365 R366	T359-E363 PolarHBondContact O-N 3.41Å; L360-E363 PolarHBondContact O-N 2.93Å; L361-E363 VanDerWaalsContact C-N 3.32Å; L361-E363 PolarHBondContact O-N 2.71Å; E363-A365 VanDerWaalsContact C-N 3.32Å; E363-R366 IonicContact OE1-NH1 3.68Å; E363-R366 IonicContact OE2-CZ 3.64Å; E363-R366 IonicContact OE2-NH1 2.66Å; E363-R366 PolarHBondContact OE2-NH1 2.8Å; E363-R366 IonicContact OE2-NH2 3.92Å
364	L	90.6	Very high	89.2	Confident	95 Å²	95	51.9 Å²	51.9	50%	0.497	30%	0.296	S	S	.	.	H	α-helix	trans	-70.4	-28.4	177.3	-69.5	168.6	0	0	0	112.9	L360 L361 P367	L360-L364 HydrophobicContact CG-CD1 4.38Å; L360-L364 WeakPolarHBondContact O-CG 3.32Å; L360-L364 PolarHBondContact O-N 2.87Å; L361-L364 HydrophobicContact CD2-CD1 4.31Å; L361-L364 PolarHBondContact O-N 3.02Å; L364-P367 WeakPolarHBondContact O-CD 3.43Å
365	A	91.6	Very high	89	Confident	0 Å²	0	55 Å²	55	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-83.3	-17	-179.4	0	0	0	0	0	113.5	L361 A362 E363 D368 L369 L379 M409 I466 L476	L361-A365 VanDerWaalsContact O-CB 3.23Å; L361-A365 WeakPolarHBondContact O-CB 3.35Å; L361-A365 PolarHBondContact O-N 2.75Å; A362-A365 PolarHBondContact O-N 2.95Å; E363-A365 VanDerWaalsContact C-N 3.32Å; A365-D368 WeakPolarHBondContact O-CB 3.48Å; A365-D368 PolarHBondContact O-N 3.36Å; A365-D368 VanDerWaalsContact O-N 3.13Å; A365-L369 PolarHBondContact O-N 2.86Å; A365-L379 HydrophobicContact CB-CD2 3.87Å; A365-M409 HydrophobicContact CB-SD 3.62Å; A365-I466 HydrophobicContact CB-CD1 4.37Å; A365-L476 HydrophobicContact CB-CD1 3.74Å
366	R	91.6	Very high	88.8	Confident	83 Å²	83	59 Å²	59	31%	0.313	33%	0.332	S	S	.	.	H	α-helix	trans	-52.9	-47.9	-179.3	-178.8	-176.2	68	-126.9	-7.1	113.4	A362 E363 D368 L369 L370 I466 M467 I473	A362-R366 PolarHBondContact O-N 2.82Å; E363-R366 IonicContact OE1-NH1 3.68Å; E363-R366 IonicContact OE2-CZ 3.64Å; E363-R366 IonicContact OE2-NH1 2.66Å; E363-R366 PolarHBondContact OE2-NH1 2.8Å; E363-R366 IonicContact OE2-NH2 3.92Å; R366-D368 VanDerWaalsContact C-N 3.27Å; R366-D368 PolarHBondContact O-N 2.04Å; R366-L369 PolarHBondContact O-N 2.83Å; R366-L370 HydrophobicContact CG-CD1 3.92Å; R366-L370 HydrophobicContact CG-CG 4.39Å; R366-L370 WeakPolarHBondContact O-CG 3.39Å; R366-L370 PolarHBondContact O-N 3.25Å; R366-I466 HydrophobicContact CB-CG2 3.93Å; R366-I466 HydrophobicContact CG-CG2 4.32Å; R366-M467 WeakPolarHBondContact CD-O 3.44Å; R366-I473 HydrophobicContact CG-CD1 4.29Å
367	P	90.2	Very high	88.7	Confident	59 Å²	59	54 Å²	54	38%	0.383	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-34.6	179.3	-21.3	34.4	0	0	0	113.1	L364 L370 S371	L364-P367 WeakPolarHBondContact O-CD 3.43Å; P367-L370 PolarHBondContact O-N 2.98Å; P367-S371 WeakPolarHBondContact O-CB 3.43Å; P367-S371 PolarHBondContact O-N 2.93Å; P367-S371 PolarHBondContact O-OG 2.76Å
368	D	89.3	Confident	88.5	Confident	6 Å²	6	58.6 Å²	58.6	3%	0.032	33%	0.327	C	S	.	.	H	α-helix	trans	-70.1	-33.4	-179.1	-63.9	-17.2	0	0	0	112	A365 R366 S371 D373 G377 Q378 L379	A365-D368 WeakPolarHBondContact O-CB 3.48Å; A365-D368 PolarHBondContact O-N 3.36Å; A365-D368 VanDerWaalsContact O-N 3.13Å; R366-D368 VanDerWaalsContact C-N 3.27Å; R366-D368 PolarHBondContact O-N 2.04Å; D368-S371 PolarHBondContact O-OG 2.8Å; D368-S371 VanDerWaalsContact O-OG 3.05Å; D368-D373 CarbonylContact O-C 3.54Å; D368-G377 VanDerWaalsContact CG-CA 3.42Å; D368-G377 VanDerWaalsContact OD1-CA 3.3Å; D368-G377 WeakPolarHBondContact OD1-CA 3.4Å; D368-Q378 PolarHBondContact OD1-N 2.98Å; D368-Q378 PolarHBondContact OD2-N 3.35Å; D368-L379 VanDerWaalsContact OD2-CB 3.23Å; D368-L379 WeakPolarHBondContact OD2-CB 3.05Å; D368-L379 PolarHBondContact OD2-N 3.43Å
369	L	88.6	Confident	88.3	Confident	26 Å²	26	59.1 Å²	59.1	14%	0.136	33%	0.329	C	S	.	.	H	α-helix	trans	-71.7	-41	171	-100.5	154.6	0	0	0	112.2	A365 R366 G372 M409 L417 I466 I473	A365-L369 PolarHBondContact O-N 2.86Å; R366-L369 PolarHBondContact O-N 2.83Å; L369-G372 PolarHBondContact O-N 2.7Å; L369-M409 HydrophobicContact CD1-CE 4.12Å; L369-M409 HydrophobicContact CD1-CG 3.93Å; L369-M409 HydrophobicContact CD1-SD 3.31Å; L369-M409 WeakPolarHBondContact CD1-SD 3.09Å; L369-M409 HydrophobicContact CG-CE 3.97Å; L369-M409 HydrophobicContact CG-SD 3.84Å; L369-L417 HydrophobicContact CD2-CD1 3.49Å; L369-L417 VanDerWaalsContact CD2-CD1 3.49Å; L369-L417 HydrophobicContact CG-CD1 4.45Å; L369-I466 HydrophobicContact CD1-CB 4.13Å; L369-I466 HydrophobicContact CD1-CD1 3.24Å; L369-I466 HydrophobicContact CD1-CG1 4.28Å; L369-I466 HydrophobicContact CD1-CG2 3.83Å; L369-I473 HydrophobicContact CB-CD1 3.96Å; L369-I473 HydrophobicContact CD1-CD1 4.45Å
370	L	88.9	Confident	88	Confident	91 Å²	91	56.4 Å²	56.4	48%	0.476	31%	0.314	S	S	.	.	H	α-helix	trans	-70.2	-30.9	-179.1	-71.3	174.6	0	0	0	112.8	R366 P367 G372 D468 I473	R366-L370 HydrophobicContact CG-CD1 3.92Å; R366-L370 HydrophobicContact CG-CG 4.39Å; R366-L370 WeakPolarHBondContact O-CG 3.39Å; R366-L370 PolarHBondContact O-N 3.25Å; P367-L370 PolarHBondContact O-N 2.98Å; L370-G372 PolarHBondContact O-N 3.29Å; L370-D468 HydrophobicContact CD2-CB 4.24Å; L370-I473 HydrophobicContact CD2-CD1 4.04Å; L370-I473 HydrophobicContact CG-CD1 4.16Å
371	S	86.7	Confident	87.8	Confident	83 Å²	83	56.3 Å²	56.3	58%	0.58	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-16.6	176.2	69.8	0	0	0	0	113.4	P367 D368 D373	P367-S371 WeakPolarHBondContact O-CB 3.43Å; P367-S371 PolarHBondContact O-N 2.93Å; P367-S371 PolarHBondContact O-OG 2.76Å; D368-S371 PolarHBondContact O-OG 2.8Å; D368-S371 VanDerWaalsContact O-OG 3.05Å; S371-D373 VanDerWaalsContact C-N 3.28Å; S371-D373 PolarHBondContact OG-N 2.94Å
372	G	84.1	Confident	87.6	Confident	64 Å²	64	57.4 Å²	57.4	66%	0.66	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	7.1	-174.7	0	0	0	0	0	114.5	L369 L370 P374	L369-G372 PolarHBondContact O-N 2.7Å; L370-G372 PolarHBondContact O-N 3.29Å; G372-P374 WeakPolarHBondContact O-CD 3.2Å
373	D	85.1	Confident	87.3	Confident	66 Å²	66	58.6 Å²	58.6	35%	0.353	33%	0.328	S	S	.	.			trans	-125.2	64.7	176	-169.8	5	0	0	0	112.6	D368 S371 T375 H376 G377	D368-D373 CarbonylContact O-C 3.54Å; S371-D373 VanDerWaalsContact C-N 3.28Å; S371-D373 PolarHBondContact OG-N 2.94Å; D373-T375 PolarHBondContact O-N 3.49Å; D373-T375 PolarHBondContact OD1-OG1 3.49Å; D373-H376 PolarHBondContact O-N 2.95Å; D373-H376 IonicContact OD1-CE1 3.92Å; D373-H376 IonicContact OD1-CG 3.59Å; D373-H376 PolarHBondContact OD1-N 3.47Å; D373-H376 VanDerWaalsContact OD1-N 3.07Å; D373-H376 IonicContact OD1-ND1 2.85Å; D373-H376 PolarHBondContact OD1-ND1 3.5Å; D373-H376 WeakPolarHBondContact OD2-CB 3.27Å; D373-H376 IonicContact OD2-CG 3.72Å; D373-H376 IonicContact OD2-ND1 3.31Å; D373-H376 PolarHBondContact OD2-ND1 3.13Å; D373-G377 PolarHBondContact O-N 2.97Å
374	P	80.7	Confident	86.9	Confident	15 Å²	15	58.2 Å²	58.2	10%	0.097	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.6	178	27.3	-35	0	0	0	113.1	G372 M409 L417	G372-P374 WeakPolarHBondContact O-CD 3.2Å; P374-M409 HydrophobicContact CB-CE 3.4Å; P374-L417 HydrophobicContact CB-CB 4.18Å; P374-L417 HydrophobicContact CG-CB 3.72Å; P374-L417 HydrophobicContact CG-CD1 4.01Å; P374-L417 HydrophobicContact CG-CG 4.45Å
375	T	81.2	Confident	86.6	Confident	68 Å²	68	60.1 Å²	60.1	42%	0.417	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-31.5	179.3	39.4	0	0	0	0	113.5	D373 A380	D373-T375 PolarHBondContact O-N 3.49Å; D373-T375 PolarHBondContact OD1-OG1 3.49Å; T375-A380 WeakPolarHBondContact O-CB 3.35Å
376	H	82.9	Confident	86.2	Confident	125 Å²	125	63.4 Å²	63.4	58%	0.579	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	8.8	177.9	-47	92.6	0	0	0	113.5	D373 Q381	D373-H376 PolarHBondContact O-N 2.95Å; D373-H376 IonicContact OD1-CE1 3.92Å; D373-H376 IonicContact OD1-CG 3.59Å; D373-H376 PolarHBondContact OD1-N 3.47Å; D373-H376 VanDerWaalsContact OD1-N 3.07Å; D373-H376 IonicContact OD1-ND1 2.85Å; D373-H376 PolarHBondContact OD1-ND1 3.5Å; D373-H376 WeakPolarHBondContact OD2-CB 3.27Å; D373-H376 IonicContact OD2-CG 3.72Å; D373-H376 IonicContact OD2-ND1 3.31Å; D373-H376 PolarHBondContact OD2-ND1 3.13Å; H376-Q381 PolarHBondContact O-NE2 3.31Å
377	G	85.1	Confident	85.5	Confident	9 Å²	9	66.2 Å²	66.2	9%	0.093	37%	0.37	C	S	.	.	S	Bend	trans	-61.5	174.9	176	0	0	0	0	0	114.5	D368 D373 L379 A380 Q381	D368-G377 VanDerWaalsContact CG-CA 3.42Å; D368-G377 VanDerWaalsContact OD1-CA 3.3Å; D368-G377 WeakPolarHBondContact OD1-CA 3.4Å; D373-G377 PolarHBondContact O-N 2.97Å; G377-L379 VanDerWaalsContact C-N 3.29Å; G377-L379 PolarHBondContact O-N 2.79Å; G377-A380 PolarHBondContact O-N 3.12Å; G377-Q381 WeakPolarHBondContact O-CG 3.44Å; G377-Q381 PolarHBondContact O-N 2.84Å
378	Q	88.3	Confident	84.8	Confident	138 Å²	138	70 Å²	70	65%	0.645	38%	0.382	S	S	*	.	H	α-helix	trans	-59.7	-38.3	-176.6	-64.4	-174.4	17.8	0	0	112.4	D368 Q381 A382	D368-Q378 PolarHBondContact OD1-N 2.98Å; D368-Q378 PolarHBondContact OD2-N 3.35Å; Q378-Q381 PolarHBondContact O-N 2.89Å; Q378-A382 WeakPolarHBondContact O-CB 3.41Å; Q378-A382 PolarHBondContact O-N 3.07Å
379	L	87.9	Confident	84.3	Confident	10 Å²	10	79.1 Å²	79.1	5%	0.052	42%	0.416	C	S	.	.	H	α-helix	trans	-63.4	-47	177.5	-171.1	79.1	0	0	0	111	L361 A365 D368 G377 Q381 A382 F383 F418 L476	L361-L379 HydrophobicContact CD2-CD1 3.98Å; A365-L379 HydrophobicContact CB-CD2 3.87Å; D368-L379 VanDerWaalsContact OD2-CB 3.23Å; D368-L379 WeakPolarHBondContact OD2-CB 3.05Å; D368-L379 PolarHBondContact OD2-N 3.43Å; G377-L379 VanDerWaalsContact C-N 3.29Å; G377-L379 PolarHBondContact O-N 2.79Å; L379-Q381 VanDerWaalsContact C-N 3.32Å; L379-Q381 PolarHBondContact O-N 3.28Å; L379-A382 PolarHBondContact O-N 2.93Å; L379-F383 HydrophobicContact CD1-CD2 4.23Å; L379-F383 HydrophobicContact CD1-CE2 3.94Å; L379-F383 HydrophobicContact CG-CD2 4.09Å; L379-F383 HydrophobicContact CG-CE2 4.2Å; L379-F383 WeakPolarHBondContact O-CD2 3.38Å; L379-F383 PolarHBondContact O-N 2.97Å; L379-F418 HydrophobicContact CD2-CD1 3.92Å; L379-F418 HydrophobicContact CD2-CE1 3.87Å; L379-F418 HydrophobicContact CG-CE1 4.39Å; L379-L476 HydrophobicContact CD2-CD1 3.91Å
380	A	85.9	Confident	83.3	Confident	13 Å²	13	82.4 Å²	82.4	11%	0.107	44%	0.439	C	S	.	.	H	α-helix	trans	-62	-42.2	178.9	0	0	0	0	0	111.3	T375 G377 N384 F418	T375-A380 WeakPolarHBondContact O-CB 3.35Å; G377-A380 PolarHBondContact O-N 3.12Å; A380-N384 WeakPolarHBondContact O-CB 3.36Å; A380-N384 PolarHBondContact O-N 3.26Å; A380-F418 HydrophobicContact CB-CD2 3.82Å; A380-F418 HydrophobicContact CB-CE2 3.6Å
381	Q	87.8	Confident	82.6	Confident	108 Å²	108	81.9 Å²	81.9	51%	0.505	43%	0.433	S	S	.	.	H	α-helix	trans	-63.2	-42.4	174.3	-67.1	177.4	15.5	0	0	112.1	H376 G377 Q378 L379 N384 Q385	H376-Q381 PolarHBondContact O-NE2 3.31Å; G377-Q381 WeakPolarHBondContact O-CG 3.44Å; G377-Q381 PolarHBondContact O-N 2.84Å; Q378-Q381 PolarHBondContact O-N 2.89Å; L379-Q381 VanDerWaalsContact C-N 3.32Å; L379-Q381 PolarHBondContact O-N 3.28Å; Q381-N384 PolarHBondContact O-N 2.87Å; Q381-Q385 WeakPolarHBondContact O-CG 3.38Å; Q381-Q385 PolarHBondContact O-N 2.97Å
382	A	88.4	Confident	82	Confident	50 Å²	50	89.2 Å²	89.2	41%	0.413	45%	0.448	S	S	.	.	H	α-helix	trans	-63.5	-44.4	178.8	0	0	0	0	0	112.2	Q378 L379 Q385 L386	Q378-A382 WeakPolarHBondContact O-CB 3.41Å; Q378-A382 PolarHBondContact O-N 3.07Å; L379-A382 PolarHBondContact O-N 2.93Å; A382-Q385 PolarHBondContact O-N 3.48Å; A382-L386 VanDerWaalsContact O-CB 3.27Å; A382-L386 WeakPolarHBondContact O-CB 3.24Å; A382-L386 PolarHBondContact O-N 3.39Å
383	F	86.8	Confident	81.5	Confident	26 Å²	26	87.7 Å²	87.7	11%	0.114	43%	0.429	C	S	.	.	H	α-helix	trans	-66.5	-37.7	175.6	-88.8	-85.6	0	0	0	112.4	L361 L379 L386 Q387 V407 F418	L361-F383 HydrophobicContact CD1-CE2 4.39Å; L361-F383 HydrophobicContact CD1-CZ 4.17Å; L379-F383 HydrophobicContact CD1-CD2 4.23Å; L379-F383 HydrophobicContact CD1-CE2 3.94Å; L379-F383 HydrophobicContact CG-CD2 4.09Å; L379-F383 HydrophobicContact CG-CE2 4.2Å; L379-F383 WeakPolarHBondContact O-CD2 3.38Å; L379-F383 PolarHBondContact O-N 2.97Å; F383-L386 PolarHBondContact O-N 2.95Å; F383-Q387 WeakPolarHBondContact O-CB 3.4Å; F383-Q387 PolarHBondContact O-N 3.24Å; F383-V407 HydrophobicContact CE1-CB 4.1Å; F383-V407 HydrophobicContact CE1-CG2 3.79Å; F383-V407 HydrophobicContact CE2-CB 4.14Å; F383-V407 HydrophobicContact CE2-CG1 4.33Å; F383-V407 HydrophobicContact CE2-CG2 4.2Å; F383-V407 HydrophobicContact CZ-CB 3.68Å; F383-V407 HydrophobicContact CZ-CG1 4.27Å; F383-V407 HydrophobicContact CZ-CG2 3.34Å; F383-F418 HydrophobicContact CB-CZ 4.09Å; F383-F418 HydrophobicContact CD2-CE1 4.33Å; F383-F418 HydrophobicContact CD2-CZ 4.13Å; F383-F418 HydrophobicContact CG-CZ 4.21Å
384	N	83.3	Confident	80.8	Confident	88 Å²	88	89.8 Å²	89.8	47%	0.471	44%	0.44	S	S	.	.	H	α-helix	trans	-63.4	-44.7	175	-163.4	-4.1	0	0	0	111.2	A380 Q381 L386 Q387 H388	A380-N384 WeakPolarHBondContact O-CB 3.36Å; A380-N384 PolarHBondContact O-N 3.26Å; Q381-N384 PolarHBondContact O-N 2.87Å; N384-L386 PolarHBondContact O-N 3.48Å; N384-Q387 PolarHBondContact O-N 3.02Å; N384-H388 PolarHBondContact O-N 2.77Å; N384-H388 PolarHBondContact O-ND1 2.86Å; N384-H388 PolarHBondContact OD1-CE1 2.68Å; N384-H388 PolarHBondContact OD1-ND1 2.66Å
385	Q	85.1	Confident	79.7	Confident	135 Å²	135	94.2 Å²	94.2	63%	0.631	46%	0.462	S	S	*	.	H	α-helix	trans	-63.3	-41.9	173.9	-71.4	178.4	14.3	0	0	112.4	Q381 A382 Q387 H388 R389	Q381-Q385 WeakPolarHBondContact O-CG 3.38Å; Q381-Q385 PolarHBondContact O-N 2.97Å; A382-Q385 PolarHBondContact O-N 3.48Å; Q385-Q387 VanDerWaalsContact C-N 3.3Å; Q385-Q387 PolarHBondContact O-N 3.14Å; Q385-H388 PolarHBondContact O-N 3.48Å; Q385-H388 VanDerWaalsContact O-N 3.14Å; Q385-R389 WeakPolarHBondContact O-CB 2.84Å; Q385-R389 PolarHBondContact O-N 3.42Å
386	L	82.4	Confident	78.4	Confident	68 Å²	68	94.7 Å²	94.7	36%	0.356	48%	0.48	S	S	.	.	H	α-helix	trans	-64.7	-34.5	-180	-172.2	64.7	0	0	0	112.2	A382 F383 N384 H388 R389 N403	A382-L386 VanDerWaalsContact O-CB 3.27Å; A382-L386 WeakPolarHBondContact O-CB 3.24Å; A382-L386 PolarHBondContact O-N 3.39Å; F383-L386 PolarHBondContact O-N 2.95Å; N384-L386 PolarHBondContact O-N 3.48Å; L386-H388 VanDerWaalsContact C-N 3.29Å; L386-H388 PolarHBondContact O-N 3.22Å; L386-R389 PolarHBondContact O-N 2.96Å; L386-N403 HydrophobicContact CD2-CB 3.84Å; L386-N403 WeakPolarHBondContact CD2-ND2 3.39Å; L386-N403 HydrophobicContact CG-CB 4.03Å
387	Q	76.3	Confident	77	Confident	143 Å²	143	91.5 Å²	91.5	67%	0.668	48%	0.481	S	S	*	.	H	α-helix	trans	-66.4	-31.7	174.8	-171.6	174.6	-4.1	0	0	112.3	F383 N384 Q385	F383-Q387 WeakPolarHBondContact O-CB 3.4Å; F383-Q387 PolarHBondContact O-N 3.24Å; N384-Q387 PolarHBondContact O-N 3.02Å; Q385-Q387 VanDerWaalsContact C-N 3.3Å; Q385-Q387 PolarHBondContact O-N 3.14Å
388	H	76.3	Confident	75.7	Confident	137 Å²	137	93.5 Å²	93.5	63%	0.634	49%	0.489	S	S	*	.	H	α-helix	trans	-90.7	-8.9	179.8	-67.6	86.4	0	0	0	114	N384 Q385 L386 P390	N384-H388 PolarHBondContact O-N 2.77Å; N384-H388 PolarHBondContact O-ND1 2.86Å; N384-H388 PolarHBondContact OD1-CE1 2.68Å; N384-H388 PolarHBondContact OD1-ND1 2.66Å; Q385-H388 PolarHBondContact O-N 3.48Å; Q385-H388 VanDerWaalsContact O-N 3.14Å; L386-H388 VanDerWaalsContact C-N 3.29Å; L386-H388 PolarHBondContact O-N 3.22Å; H388-P390 WeakPolarHBondContact O-CD 3.1Å
389	R	77.7	Confident	74.6	Confident	199 Å²	199	92.5 Å²	92.5	75%	0.751	49%	0.488	S	S	*	.	S	Bend	trans	-107.5	89.4	-179.3	-166.6	175	-175.9	174.5	1.1	111	Q385 L386 F391	Q385-R389 WeakPolarHBondContact O-CB 2.84Å; Q385-R389 PolarHBondContact O-N 3.42Å; L386-R389 PolarHBondContact O-N 2.96Å; R389-F391 PolarHBondContact O-N 2.78Å
390	P	68.4	Low	73.8	Confident	94 Å²	94	94.7 Å²	94.7	61%	0.61	50%	0.497	S	S	*	.			trans	-64.4	129.4	177.2	26.8	-33.5	0	0	0	110.1	H388 V401	H388-P390 WeakPolarHBondContact O-CD 3.1Å; P390-V401 VanDerWaalsContact CA-O 3.27Å; P390-V401 WeakPolarHBondContact CA-O 3.47Å; P390-V401 VanDerWaalsContact CB-O 3.3Å; P390-V401 WeakPolarHBondContact CB-O 3.49Å
391	F	75	Confident	73.1	Confident	81 Å²	81	97.9 Å²	97.9	36%	0.355	52%	0.515	S	S	.	.			trans	-97.3	145.2	164.1	61	-89	0	0	0	108.3	R389 A393 K400 V401 R402 N403	R389-F391 PolarHBondContact O-N 2.78Å; F391-A393 HydrophobicContact CD2-CB 4.16Å; F391-A393 HydrophobicContact CE2-CB 4.44Å; F391-K400 HydrophobicContact CD2-CB 4.44Å; F391-K400 HydrophobicContact CE2-CB 3.59Å; F391-K400 HydrophobicContact CZ-CB 4.2Å; F391-K400 CarbonylContact O-C 3.52Å; F391-V401 CarbonylContact O-C 3.56Å; F391-V401 WeakPolarHBondContact O-CA 3.28Å; F391-R402 VanDerWaalsContact CZ-O 3.32Å; F391-R402 WeakPolarHBondContact CZ-O 3.16Å; F391-N403 HydrophobicContact CE1-CB 4.41Å
392	R	73.4	Confident	72.4	Confident	237 Å²	237	101.1 Å²	101.1	89%	0.894	52%	0.523	S	S	*	.			trans	-110.2	103.4	173.8	-68.4	-176.9	-173	168.7	2.9	108.5
393	A	72.7	Confident	71.8	Confident	31 Å²	31	100.9 Å²	100.9	26%	0.256	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	125.3	171.7	0	0	0	0	0	109.3	F391 I395 K400	F391-A393 HydrophobicContact CD2-CB 4.16Å; F391-A393 HydrophobicContact CE2-CB 4.44Å; A393-I395 HydrophobicContact CB-CD1 4.25Å; A393-I395 HydrophobicContact CB-CG1 4.18Å; A393-K400 PolarHBondContact N-O 2.86Å; A393-K400 VanDerWaalsContact N-O 3.14Å; A393-K400 PolarHBondContact O-N 2.96Å
394	N	70.6	Confident	71.4	Confident	110 Å²	110	103.3 Å²	103.3	59%	0.588	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	103	169.7	-177.6	0.5	0	0	0	108.1	G397 N399	N394-G397 WeakPolarHBondContact OD1-CA 3.48Å; N394-G397 PolarHBondContact OD1-N 3.2Å; N394-N399 WeakPolarHBondContact CB-OD1 3.17Å
395	I	59.2	Low	71.4	Confident	109 Å²	109	102.5 Å²	102.5	56%	0.559	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	106	179.9	-55.3	172.4	0	0	0	107	A393 G397 I398	A393-I395 HydrophobicContact CB-CD1 4.25Å; A393-I395 HydrophobicContact CB-CG1 4.18Å; I395-G397 VanDerWaalsContact C-N 3.27Å; I395-G397 PolarHBondContact O-N 2.96Å; I395-I398 PolarHBondContact N-O 2.88Å; I395-I398 VanDerWaalsContact N-O 3.12Å; I395-I398 PolarHBondContact O-N 2.87Å; I395-I398 VanDerWaalsContact O-N 3.11Å
396	G	52.3	Low	71.6	Confident	77 Å²	77	97.8 Å²	97.8	79%	0.794	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	29.3	179.1	0	0	0	0	0	114.8
397	G	53.4	Low	72.1	Confident	59 Å²	59	94.5 Å²	94.5	61%	0.608	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	-3	-177.7	0	0	0	0	0	114.7	N394 I395	N394-G397 WeakPolarHBondContact OD1-CA 3.48Å; N394-G397 PolarHBondContact OD1-N 3.2Å; I395-G397 VanDerWaalsContact C-N 3.27Å; I395-G397 PolarHBondContact O-N 2.96Å
398	I	59.6	Low	72.9	Confident	50 Å²	50	87.7 Å²	87.7	26%	0.256	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	109.4	174	-56.1	174.7	0	0	0	108	I395 K400 V488	I395-I398 PolarHBondContact N-O 2.88Å; I395-I398 VanDerWaalsContact N-O 3.12Å; I395-I398 PolarHBondContact O-N 2.87Å; I395-I398 VanDerWaalsContact O-N 3.11Å; I398-K400 HydrophobicContact CG2-CG 4.36Å; I398-K400 PolarHBondContact O-N 2.9Å; I398-K400 VanDerWaalsContact O-N 3.14Å; I398-V488 HydrophobicContact CD1-CG2 4.22Å; I398-V488 HydrophobicContact CG1-CG2 3.95Å
399	N	64.6	Low	73.8	Confident	117 Å²	117	81.2 Å²	81.2	63%	0.626	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	97.2	173.1	-76.3	-26.2	0	0	0	109.5	N394 V401	N394-N399 WeakPolarHBondContact CB-OD1 3.17Å; N399-V401 PolarHBondContact O-N 2.87Å
400	K	70.2	Confident	74.6	Confident	57 Å²	57	71.8 Å²	71.8	25%	0.248	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	122.1	170.9	-68.1	-154.8	168.1	-147.2	0	109.1	F391 A393 I398 E404	F391-K400 HydrophobicContact CD2-CB 4.44Å; F391-K400 HydrophobicContact CE2-CB 3.59Å; F391-K400 HydrophobicContact CZ-CB 4.2Å; F391-K400 CarbonylContact O-C 3.52Å; A393-K400 PolarHBondContact N-O 2.86Å; A393-K400 VanDerWaalsContact N-O 3.14Å; A393-K400 PolarHBondContact O-N 2.96Å; I398-K400 HydrophobicContact CG2-CG 4.36Å; I398-K400 PolarHBondContact O-N 2.9Å; I398-K400 VanDerWaalsContact O-N 3.14Å; K400-E404 IonicContact NZ-OE2 3.08Å; K400-E404 PolarHBondContact NZ-OE2 3.37Å
401	V	71.2	Confident	75.8	Confident	80 Å²	80	69.1 Å²	69.1	49%	0.485	36%	0.361	S	S	.	.			trans	-116.2	-11.7	-179	-68.1	0	0	0	0	113.8	P390 F391 N399	P390-V401 VanDerWaalsContact CA-O 3.27Å; P390-V401 WeakPolarHBondContact CA-O 3.47Å; P390-V401 VanDerWaalsContact CB-O 3.3Å; P390-V401 WeakPolarHBondContact CB-O 3.49Å; F391-V401 CarbonylContact O-C 3.56Å; F391-V401 WeakPolarHBondContact O-CA 3.28Å; N399-V401 PolarHBondContact O-N 2.87Å
402	R	74.3	Confident	76.7	Confident	176 Å²	176	67.6 Å²	67.6	66%	0.664	36%	0.361	S	S	*	.	S	Bend	trans	-148.7	158.8	-177	64.2	-179.3	178.7	-171.3	0.2	110.8	F391	F391-R402 VanDerWaalsContact CZ-O 3.32Å; F391-R402 WeakPolarHBondContact CZ-O 3.16Å
403	N	75.1	Confident	77.6	Confident	45 Å²	45	63.1 Å²	63.1	24%	0.241	35%	0.35	C	S	.	.			trans	-70.6	140.8	169.3	-172.6	22.3	0	0	0	109.8	L386 F391 Y405	L386-N403 HydrophobicContact CD2-CB 3.84Å; L386-N403 WeakPolarHBondContact CD2-ND2 3.39Å; L386-N403 HydrophobicContact CG-CB 4.03Å; F391-N403 HydrophobicContact CE1-CB 4.41Å; N403-Y405 WeakPolarHBondContact OD1-CD2 3.42Å; N403-Y405 PolarHBondContact OD1-N 2.87Å
404	E	77.7	Confident	78.6	Confident	76 Å²	76	61.7 Å²	61.7	36%	0.355	34%	0.338	S	S	.	.			trans	-114.3	-1.6	-178.7	-65.9	170.6	151.7	0	0	112.1	K400 H406 P481	K400-E404 IonicContact NZ-OE2 3.08Å; K400-E404 PolarHBondContact NZ-OE2 3.37Å; E404-H406 PolarHBondContact O-N 3.47Å; E404-P481 WeakPolarHBondContact O-CD 3.4Å
405	Y	84.8	Confident	79.7	Confident	71 Å²	71	61.5 Å²	61.5	28%	0.278	33%	0.332	S	S	.	.			trans	-65.8	133.2	173.1	-69.1	-62.9	0	0	0	110.6	L354 N403 V478 G479 K480	L354-Y405 HydrophobicContact CD2-CD1 4.26Å; L354-Y405 HydrophobicContact CD2-CE1 3.82Å; N403-Y405 WeakPolarHBondContact OD1-CD2 3.42Å; N403-Y405 PolarHBondContact OD1-N 2.87Å; Y405-V478 HydrophobicContact CD1-CG1 3.74Å; Y405-V478 HydrophobicContact CE1-CG1 4.31Å; Y405-V478 HydrophobicContact CG-CG1 4.31Å; Y405-G479 CarbonylContact C-O 3.5Å; Y405-G479 VanDerWaalsContact CA-O 3.3Å; Y405-G479 WeakPolarHBondContact CA-O 3.45Å; Y405-K480 HydrophobicContact CD1-CB 4.03Å; Y405-K480 HydrophobicContact CD1-CG 4.45Å; Y405-K480 HydrophobicContact CE1-CB 3.96Å; Y405-K480 HydrophobicContact CE1-CD 3.85Å; Y405-K480 HydrophobicContact CE1-CG 4.13Å
406	H	89.3	Confident	81.4	Confident	36 Å²	36	56.3 Å²	56.3	17%	0.167	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	103.8	171.9	178.8	-149.5	0	0	0	108.2	E404 D419 Y461 G479	E404-H406 PolarHBondContact O-N 3.47Å; H406-D419 IonicContact CD2-OD1 2.87Å; H406-D419 PolarHBondContact CD2-OD1 3.13Å; H406-D419 IonicContact NE2-OD1 3.97Å; H406-D419 PolarHBondContact NE2-OD1 3.44Å; H406-D419 IonicContact NE2-OD2 2.88Å; H406-Y461 HydrophobicContact CB-CE1 4.49Å; H406-Y461 PolarHBondContact CE1-OH 2.89Å; H406-Y461 AromaticContact ND1-CE1 3.48Å; H406-Y461 WeakPolarHBondContact ND1-CE1 3.33Å; H406-Y461 AromaticContact ND1-CZ 3.57Å; H406-Y461 PolarHBondContact ND1-OH 3.02Å; H406-G479 PolarHBondContact N-O 3.37Å; H406-G479 WeakPolarHBondContact O-CA 3.48Å; H406-G479 PolarHBondContact O-N 3.19Å
407	V	92.3	Very high	83.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	133	-178.8	-177.6	0	0	0	0	110	L361 F383 S420 L476 S477 V478	L361-V407 HydrophobicContact CD1-CG1 4.24Å; L361-V407 HydrophobicContact CD1-CG2 3.94Å; F383-V407 HydrophobicContact CE1-CB 4.1Å; F383-V407 HydrophobicContact CE1-CG2 3.79Å; F383-V407 HydrophobicContact CE2-CB 4.14Å; F383-V407 HydrophobicContact CE2-CG1 4.33Å; F383-V407 HydrophobicContact CE2-CG2 4.2Å; F383-V407 HydrophobicContact CZ-CB 3.68Å; F383-V407 HydrophobicContact CZ-CG1 4.27Å; F383-V407 HydrophobicContact CZ-CG2 3.34Å; V407-S420 PolarHBondContact N-OG 3.01Å; V407-S420 WeakPolarHBondContact O-CB 3.45Å; V407-S420 PolarHBondContact O-N 3.49Å; V407-S420 PolarHBondContact O-OG 3.48Å; V407-L476 HydrophobicContact CG1-CD1 4.13Å; V407-L476 HydrophobicContact CG1-CD2 4Å; V407-L476 HydrophobicContact CG1-CG 4.03Å; V407-S477 VanDerWaalsContact CA-O 3.31Å; V407-S477 WeakPolarHBondContact CA-O 3.07Å; V407-V478 HydrophobicContact CG2-CB 4.41Å; V407-V478 HydrophobicContact CG2-CG1 4.13Å; V407-V478 HydrophobicContact CG2-CG2 4.02Å
408	Y	93.7	Very high	85.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	158.5	169.5	64.1	-102.1	0	0	0	110.8	T410 F418 Y429 D434 V435 R446 Y461 S477	Y408-T410 HydrophobicContact CD2-CG2 4.34Å; Y408-T410 HydrophobicContact CE2-CG2 4.44Å; Y408-F418 CarbonylContact C-O 3.54Å; Y408-F418 WeakPolarHBondContact CA-O 3.46Å; Y408-F418 VanDerWaalsContact CB-O 3.3Å; Y408-F418 WeakPolarHBondContact CB-O 3.3Å; Y408-Y429 HydrophobicContact CD1-CE2 4.37Å; Y408-Y429 HydrophobicContact CD2-CD2 4.13Å; Y408-Y429 HydrophobicContact CD2-CE2 4.48Å; Y408-Y429 HydrophobicContact CE1-CD2 4.28Å; Y408-Y429 HydrophobicContact CE1-CE2 4.05Å; Y408-Y429 AromaticContact CE2-CD2 3.67Å; Y408-Y429 HydrophobicContact CE2-CD2 3.67Å; Y408-Y429 HydrophobicContact CE2-CE2 4.22Å; Y408-Y429 AromaticContact CZ-CD2 3.73Å; Y408-Y429 AromaticContact CZ-CE2 3.97Å; Y408-D434 VanDerWaalsContact OH-CG 3.31Å; Y408-D434 PolarHBondContact OH-OD1 3.31Å; Y408-D434 PolarHBondContact OH-OD2 3.12Å; Y408-V435 HydrophobicContact CE2-CG2 3.83Å; Y408-R446 PolarHBondContact OH-NH2 2.76Å; Y408-Y461 HydrophobicContact CD1-CD1 4.45Å; Y408-Y461 HydrophobicContact CD1-CE1 4.19Å; Y408-Y461 AromaticContact CE1-CD1 3.64Å; Y408-Y461 HydrophobicContact CE1-CD1 3.64Å; Y408-Y461 AromaticContact CE1-CE1 3.62Å; Y408-Y461 HydrophobicContact CE1-CE1 3.62Å; Y408-S477 PolarHBondContact N-O 2.88Å; Y408-S477 VanDerWaalsContact N-O 3.07Å; Y408-S477 PolarHBondContact O-N 3.22Å
409	M	94.1	Very high	86.6	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	138	-178	178.5	171.3	68.3	0	0	110.3	A365 L369 P374 V416 L417 F418 I466 V475	A365-M409 HydrophobicContact CB-SD 3.62Å; L369-M409 HydrophobicContact CD1-CE 4.12Å; L369-M409 HydrophobicContact CD1-CG 3.93Å; L369-M409 HydrophobicContact CD1-SD 3.31Å; L369-M409 WeakPolarHBondContact CD1-SD 3.09Å; L369-M409 HydrophobicContact CG-CE 3.97Å; L369-M409 HydrophobicContact CG-SD 3.84Å; P374-M409 HydrophobicContact CB-CE 3.4Å; M409-V416 CarbonylContact O-C 3.55Å; M409-V416 WeakPolarHBondContact O-CA 3.29Å; M409-L417 PolarHBondContact O-N 3.24Å; M409-F418 HydrophobicContact CB-CB 4.23Å; M409-F418 HydrophobicContact CE-CB 4.11Å; M409-F418 PolarHBondContact N-O 2.82Å; M409-F418 PolarHBondContact O-N 2.82Å; M409-I466 HydrophobicContact CG-CD1 3.54Å; M409-I466 HydrophobicContact SD-CD1 3.4Å; M409-I466 WeakPolarHBondContact SD-CD1 3.38Å; M409-V475 CarbonylContact C-O 3.55Å; M409-V475 VanDerWaalsContact CA-O 3.25Å; M409-V475 WeakPolarHBondContact CA-O 3.34Å
410	T	94.6	Very high	87.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	159.6	177	74.4	0	0	0	0	112.1	Y408 K415 V416 V435 G474 V475	Y408-T410 HydrophobicContact CD2-CG2 4.34Å; Y408-T410 HydrophobicContact CE2-CG2 4.44Å; T410-K415 CarbonylContact C-O 3.55Å; T410-K415 WeakPolarHBondContact CA-O 3.4Å; T410-K415 WeakPolarHBondContact CB-O 3.31Å; T410-V416 HydrophobicContact CG2-CG2 4.14Å; T410-V435 HydrophobicContact CG2-CG1 4.3Å; T410-V435 HydrophobicContact CG2-CG2 4.28Å; T410-G474 CarbonylContact O-C 3.57Å; T410-G474 WeakPolarHBondContact O-CA 3.47Å; T410-V475 PolarHBondContact N-O 3.02Å; T410-V475 PolarHBondContact O-N 3.33Å; T410-V475 VanDerWaalsContact O-N 3.13Å
411	D	93.7	Very high	88.4	Confident	38 Å²	38	45.6 Å²	45.6	20%	0.203	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	178.5	161.8	66.2	16.3	0	0	0	111.6	Q413 G414 K415 L417 I473	D411-Q413 PolarHBondContact O-N 3.17Å; D411-Q413 VanDerWaalsContact OD1-C 3.3Å; D411-Q413 VanDerWaalsContact OD1-CA 3.28Å; D411-Q413 WeakPolarHBondContact OD1-CA 3.44Å; D411-Q413 WeakPolarHBondContact OD1-CB 3.44Å; D411-Q413 PolarHBondContact OD1-N 3.3Å; D411-G414 PolarHBondContact O-N 3.24Å; D411-G414 PolarHBondContact OD1-N 3.4Å; D411-K415 PolarHBondContact N-O 3.08Å; D411-K415 PolarHBondContact OD1-N 3.49Å; D411-K415 WeakPolarHBondContact OD2-CB 3.46Å; D411-L417 HydrophobicContact CB-CD1 3.95Å; D411-L417 HydrophobicContact CB-CD2 4.29Å; D411-L417 HydrophobicContact CB-CG 4.19Å; D411-I473 CarbonylContact C-O 3.57Å
412	S	93.7	Very high	89.1	Confident	50 Å²	50	48.1 Å²	48.1	35%	0.35	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-9.8	174.6	59.4	0	0	0	0	114.8	I473	S412-I473 PolarHBondContact N-O 3.36Å
413	Q	93.4	Very high	89.6	Confident	143 Å²	143	47.3 Å²	47.3	67%	0.668	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-4.9	173.6	-58	-59.9	-65.1	0	0	112.2	D411 S430	D411-Q413 PolarHBondContact O-N 3.17Å; D411-Q413 VanDerWaalsContact OD1-C 3.3Å; D411-Q413 VanDerWaalsContact OD1-CA 3.28Å; D411-Q413 WeakPolarHBondContact OD1-CA 3.44Å; D411-Q413 WeakPolarHBondContact OD1-CB 3.44Å; D411-Q413 PolarHBondContact OD1-N 3.3Å; Q413-S430 WeakPolarHBondContact O-CB 3.4Å
414	G	91.9	Very high	90.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.227	C	C	.	.	S	Bend	trans	87.7	8.7	-178.2	0	0	0	0	0	114.4	D411 Y429 S430	D411-G414 PolarHBondContact O-N 3.24Å; D411-G414 PolarHBondContact OD1-N 3.4Å; G414-Y429 CarbonylContact O-C 3.54Å; G414-Y429 WeakPolarHBondContact O-CA 3.37Å; G414-Y429 WeakPolarHBondContact O-CB 3.31Å; G414-Y429 PolarHBondContact O-N 2.81Å; G414-S430 PolarHBondContact O-N 3.16Å
415	K	94.8	Very high	90.8	Very high	106 Å²	106	44.5 Å²	44.5	46%	0.461	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-80	128.6	175.7	-170.5	179	-179.3	-179.8	0	110.5	T410 D411 L417 G426 Q427	T410-K415 CarbonylContact C-O 3.55Å; T410-K415 WeakPolarHBondContact CA-O 3.4Å; T410-K415 WeakPolarHBondContact CB-O 3.31Å; D411-K415 PolarHBondContact N-O 3.08Å; D411-K415 PolarHBondContact OD1-N 3.49Å; D411-K415 WeakPolarHBondContact OD2-CB 3.46Å; K415-L417 PolarHBondContact O-N 2.85Å; K415-G426 VanDerWaalsContact CE-O 3.28Å; K415-G426 WeakPolarHBondContact CE-O 3.1Å; K415-Q427 WeakPolarHBondContact CA-O 3.36Å
416	V	94	Very high	91.1	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	120.5	-178	-178.1	0	0	0	0	110.4	M409 T410 F418 D419 A424 G426 Q427 Y429	M409-V416 CarbonylContact O-C 3.55Å; M409-V416 WeakPolarHBondContact O-CA 3.29Å; T410-V416 HydrophobicContact CG2-CG2 4.14Å; V416-F418 WeakPolarHBondContact CG1-O 3.15Å; V416-D419 HydrophobicContact CG1-CB 4.2Å; V416-A424 WeakPolarHBondContact CB-O 3.3Å; V416-A424 HydrophobicContact CG1-CB 4.21Å; V416-A424 HydrophobicContact CG2-CB 4.32Å; V416-G426 PolarHBondContact O-N 2.99Å; V416-Q427 PolarHBondContact N-O 3.42Å; V416-Y429 HydrophobicContact CG2-CD1 3.76Å; V416-Y429 HydrophobicContact CG2-CD2 3.63Å; V416-Y429 HydrophobicContact CG2-CE1 4.17Å; V416-Y429 HydrophobicContact CG2-CE2 4.05Å; V416-Y429 HydrophobicContact CG2-CG 3.48Å; V416-Y429 VanDerWaalsContact CG2-CG 3.48Å
417	L	92.5	Very high	91.3	Very high	42 Å²	42	46 Å²	46	22%	0.22	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	-30.4	177.5	-56.3	-176.8	0	0	0	112.6	L369 P374 M409 D411 K415	L369-L417 HydrophobicContact CD2-CD1 3.49Å; L369-L417 VanDerWaalsContact CD2-CD1 3.49Å; L369-L417 HydrophobicContact CG-CD1 4.45Å; P374-L417 HydrophobicContact CB-CB 4.18Å; P374-L417 HydrophobicContact CG-CB 3.72Å; P374-L417 HydrophobicContact CG-CD1 4.01Å; P374-L417 HydrophobicContact CG-CG 4.45Å; M409-L417 PolarHBondContact O-N 3.24Å; D411-L417 HydrophobicContact CB-CD1 3.95Å; D411-L417 HydrophobicContact CB-CD2 4.29Å; D411-L417 HydrophobicContact CB-CG 4.19Å; K415-L417 PolarHBondContact O-N 2.85Å
418	F	92.2	Very high	91.4	Very high	16 Å²	16	50.9 Å²	50.9	7%	0.07	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	141.2	177	166.9	-98.8	0	0	0	109.6	L379 A380 F383 Y408 M409 V416	L379-F418 HydrophobicContact CD2-CD1 3.92Å; L379-F418 HydrophobicContact CD2-CE1 3.87Å; L379-F418 HydrophobicContact CG-CE1 4.39Å; A380-F418 HydrophobicContact CB-CD2 3.82Å; A380-F418 HydrophobicContact CB-CE2 3.6Å; F383-F418 HydrophobicContact CB-CZ 4.09Å; F383-F418 HydrophobicContact CD2-CE1 4.33Å; F383-F418 HydrophobicContact CD2-CZ 4.13Å; F383-F418 HydrophobicContact CG-CZ 4.21Å; Y408-F418 CarbonylContact C-O 3.54Å; Y408-F418 WeakPolarHBondContact CA-O 3.46Å; Y408-F418 VanDerWaalsContact CB-O 3.3Å; Y408-F418 WeakPolarHBondContact CB-O 3.3Å; M409-F418 HydrophobicContact CB-CB 4.23Å; M409-F418 HydrophobicContact CE-CB 4.11Å; M409-F418 PolarHBondContact N-O 2.82Å; M409-F418 PolarHBondContact O-N 2.82Å; V416-F418 WeakPolarHBondContact CG1-O 3.15Å
419	D	91.2	Very high	91.4	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.027	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	119.5	173.2	172.5	8.6	0	0	0	108.3	H406 V416 A421 N422 K423 A424 V425	H406-D419 IonicContact CD2-OD1 2.87Å; H406-D419 PolarHBondContact CD2-OD1 3.13Å; H406-D419 IonicContact NE2-OD1 3.97Å; H406-D419 PolarHBondContact NE2-OD1 3.44Å; H406-D419 IonicContact NE2-OD2 2.88Å; V416-D419 HydrophobicContact CG1-CB 4.2Å; D419-A421 PolarHBondContact O-N 3.38Å; D419-A421 PolarHBondContact OD1-N 3.45Å; D419-N422 WeakPolarHBondContact O-CA 3.09Å; D419-N422 PolarHBondContact O-N 3.39Å; D419-K423 PolarHBondContact OD2-N 3.21Å; D419-A424 HydrophobicContact CB-CB 4.34Å; D419-A424 WeakPolarHBondContact OD2-CB 3.45Å; D419-A424 PolarHBondContact OD2-N 3.47Å; D419-V425 HydrophobicContact CB-CG2 3.91Å
420	S	89	Confident	91.3	Very high	26 Å²	26	53.4 Å²	53.4	18%	0.182	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-22	176.2	58.4	0	0	0	0	114.3	V407	V407-S420 PolarHBondContact N-OG 3.01Å; V407-S420 WeakPolarHBondContact O-CB 3.45Å; V407-S420 PolarHBondContact O-N 3.49Å; V407-S420 PolarHBondContact O-OG 3.48Å
421	A	83.7	Confident	91.2	Very high	46 Å²	46	64 Å²	64	38%	0.38	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-8.7	172.3	0	0	0	0	0	113.3	D419 K423	D419-A421 PolarHBondContact O-N 3.38Å; D419-A421 PolarHBondContact OD1-N 3.45Å; A421-K423 VanDerWaalsContact C-N 3.3Å; A421-K423 HydrophobicContact CB-CD 4.43Å; A421-K423 HydrophobicContact CB-CG 4.31Å; A421-K423 PolarHBondContact O-N 2.98Å
422	N	84	Confident	91.1	Very high	132 Å²	132	66.7 Å²	66.7	71%	0.706	34%	0.336	S	S	*	.	S	Bend	trans	53.2	38.8	-176.4	-160	35.6	0	0	0	114.2	D419	D419-N422 WeakPolarHBondContact O-CA 3.09Å; D419-N422 PolarHBondContact O-N 3.39Å
423	K	85	Confident	90.7	Very high	159 Å²	159	68.1 Å²	68.1	69%	0.691	34%	0.34	S	S	*	.	S	Bend	trans	-111.2	-30.9	-178.7	-67.6	-176.4	-178.5	-177.3	0	113.3	D419 A421 Q427	D419-K423 PolarHBondContact OD2-N 3.21Å; A421-K423 VanDerWaalsContact C-N 3.3Å; A421-K423 HydrophobicContact CB-CD 4.43Å; A421-K423 HydrophobicContact CB-CG 4.31Å; A421-K423 PolarHBondContact O-N 2.98Å; K423-Q427 PolarHBondContact O-NE2 2.82Å
424	A	88.7	Confident	90.7	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.008	31%	0.308	C	S	.	.	S	Bend	trans	-105.4	-5.4	-169.5	0	0	0	0	0	114.5	V416 D419 G426 Q427 Y429	V416-A424 WeakPolarHBondContact CB-O 3.3Å; V416-A424 HydrophobicContact CG1-CB 4.21Å; V416-A424 HydrophobicContact CG2-CB 4.32Å; D419-A424 HydrophobicContact CB-CB 4.34Å; D419-A424 WeakPolarHBondContact OD2-CB 3.45Å; D419-A424 PolarHBondContact OD2-N 3.47Å; A424-G426 PolarHBondContact O-N 3.03Å; A424-Q427 VanDerWaalsContact O-CB 3.24Å; A424-Q427 WeakPolarHBondContact O-CB 3.26Å; A424-Q427 WeakPolarHBondContact O-CG 3.39Å; A424-Q427 PolarHBondContact O-N 3.1Å; A424-Y429 HydrophobicContact CB-CE1 4.17Å; A424-Y429 HydrophobicContact CB-CE2 4.2Å; A424-Y429 WeakPolarHBondContact CB-OH 3.46Å
425	V	90.8	Very high	90.8	Very high	62 Å²	62	61.3 Å²	61.3	38%	0.376	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	127.7	-177.1	-174.8	0	0	0	0	110.6	D419	D419-V425 HydrophobicContact CB-CG2 3.91Å
426	G	90.4	Very high	90.6	Very high	41 Å²	41	60.9 Å²	60.9	42%	0.423	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	-11.1	-177.3	0	0	0	0	0	115.7	K415 V416 A424	K415-G426 VanDerWaalsContact CE-O 3.28Å; K415-G426 WeakPolarHBondContact CE-O 3.1Å; V416-G426 PolarHBondContact O-N 2.99Å; A424-G426 PolarHBondContact O-N 3.03Å
427	Q	93.8	Very high	90.4	Very high	96 Å²	96	62 Å²	62	45%	0.449	31%	0.31	S	S	.	.			trans	-76.6	151.1	177.6	-60.8	-178.9	17	0	0	111.7	K415 V416 K423 A424 Y429	K415-Q427 WeakPolarHBondContact CA-O 3.36Å; V416-Q427 PolarHBondContact N-O 3.42Å; K423-Q427 PolarHBondContact O-NE2 2.82Å; A424-Q427 VanDerWaalsContact O-CB 3.24Å; A424-Q427 WeakPolarHBondContact O-CB 3.26Å; A424-Q427 WeakPolarHBondContact O-CG 3.39Å; A424-Q427 PolarHBondContact O-N 3.1Å; Q427-Y429 HydrophobicContact CB-CD1 4.13Å; Q427-Y429 HydrophobicContact CB-CE1 3.92Å
428	D	94.2	Very high	90.5	Very high	104 Å²	104	60.2 Å²	60.2	56%	0.556	30%	0.3	S	S	*	.	B	Isolated β-bridge	trans	-85.3	111.3	174.7	177.7	7.7	0	0	0	110.3	S430	D428-S430 WeakPolarHBondContact OD1-CB 3.44Å; D428-S430 PolarHBondContact OD1-N 3.01Å; D428-S430 PolarHBondContact OD1-OG 3.26Å; D428-S430 PolarHBondContact OD2-OG 3.33Å
429	Y	94.6	Very high	90.5	Very high	26 Å²	26	61.6 Å²	61.6	10%	0.102	31%	0.308	C	S	.	.			trans	-104.1	8.2	177.9	-85.2	26.8	0	0	0	113.6	Y408 G414 V416 A424 Q427 R431 W432 V435	Y408-Y429 HydrophobicContact CD1-CE2 4.37Å; Y408-Y429 HydrophobicContact CD2-CD2 4.13Å; Y408-Y429 HydrophobicContact CD2-CE2 4.48Å; Y408-Y429 HydrophobicContact CE1-CD2 4.28Å; Y408-Y429 HydrophobicContact CE1-CE2 4.05Å; Y408-Y429 AromaticContact CE2-CD2 3.67Å; Y408-Y429 HydrophobicContact CE2-CD2 3.67Å; Y408-Y429 HydrophobicContact CE2-CE2 4.22Å; Y408-Y429 AromaticContact CZ-CD2 3.73Å; Y408-Y429 AromaticContact CZ-CE2 3.97Å; G414-Y429 CarbonylContact O-C 3.54Å; G414-Y429 WeakPolarHBondContact O-CA 3.37Å; G414-Y429 WeakPolarHBondContact O-CB 3.31Å; G414-Y429 PolarHBondContact O-N 2.81Å; V416-Y429 HydrophobicContact CG2-CD1 3.76Å; V416-Y429 HydrophobicContact CG2-CD2 3.63Å; V416-Y429 HydrophobicContact CG2-CE1 4.17Å; V416-Y429 HydrophobicContact CG2-CE2 4.05Å; V416-Y429 HydrophobicContact CG2-CG 3.48Å; V416-Y429 VanDerWaalsContact CG2-CG 3.48Å; A424-Y429 HydrophobicContact CB-CE1 4.17Å; A424-Y429 HydrophobicContact CB-CE2 4.2Å; A424-Y429 WeakPolarHBondContact CB-OH 3.46Å; Q427-Y429 HydrophobicContact CB-CD1 4.13Å; Q427-Y429 HydrophobicContact CB-CE1 3.92Å; Y429-R431 PolarHBondContact O-N 2.87Å; Y429-W432 AromaticContact CD1-CD1 3.64Å; Y429-W432 AromaticContact CD1-NE1 3.42Å; Y429-W432 AromaticContact CD2-CD1 3.76Å; Y429-W432 AromaticContact CD2-NE1 3.99Å; Y429-W432 AromaticContact CE1-NE1 3.59Å; Y429-W432 AromaticContact CG-CD1 3.37Å; Y429-W432 HydrophobicContact CG-CG 4.43Å; Y429-W432 AromaticContact CG-NE1 3.62Å; Y429-W432 AromaticContact CZ-NE1 3.96Å; Y429-W432 PolarHBondContact O-N 3.1Å; Y429-V435 WeakPolarHBondContact O-CB 3.46Å
430	S	91.3	Very high	90.5	Very high	27 Å²	27	69 Å²	69	19%	0.189	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-21.1	-178.2	64.5	0	0	0	0	115	Q413 G414 D428 W436	Q413-S430 WeakPolarHBondContact O-CB 3.4Å; G414-S430 PolarHBondContact O-N 3.16Å; D428-S430 WeakPolarHBondContact OD1-CB 3.44Å; D428-S430 PolarHBondContact OD1-N 3.01Å; D428-S430 PolarHBondContact OD1-OG 3.26Å; D428-S430 PolarHBondContact OD2-OG 3.33Å; S430-W436 WeakPolarHBondContact O-CB 3.07Å
431	R	91.7	Very high	90.4	Very high	224 Å²	224	71.1 Å²	71.1	85%	0.845	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-7.3	180	-62.1	-172.4	-179.5	-170.6	0.1	114.5	Y429	Y429-R431 PolarHBondContact O-N 2.87Å
432	W	91.3	Very high	90.7	Very high	93 Å²	93	74.5 Å²	74.5	35%	0.352	37%	0.37	S	S	.	.	S	Bend	trans	-72.7	135.9	173.4	-69.4	98.2	0	0	0	109.7	Y429 D434 V435 W436 T448	Y429-W432 AromaticContact CD1-CD1 3.64Å; Y429-W432 AromaticContact CD1-NE1 3.42Å; Y429-W432 AromaticContact CD2-CD1 3.76Å; Y429-W432 AromaticContact CD2-NE1 3.99Å; Y429-W432 AromaticContact CE1-NE1 3.59Å; Y429-W432 AromaticContact CG-CD1 3.37Å; Y429-W432 HydrophobicContact CG-CG 4.43Å; Y429-W432 AromaticContact CG-NE1 3.62Å; Y429-W432 AromaticContact CZ-NE1 3.96Å; Y429-W432 PolarHBondContact O-N 3.1Å; W432-D434 WeakPolarHBondContact CB-OD1 3.15Å; W432-D434 PolarHBondContact O-N 2.89Å; W432-D434 VanDerWaalsContact O-N 3.17Å; W432-V435 PolarHBondContact O-N 3.24Å; W432-W436 VanDerWaalsContact O-CB 3.3Å; W432-W436 WeakPolarHBondContact O-CB 3.41Å; W432-W436 PolarHBondContact O-N 3.49Å; W432-T448 HydrophobicContact CH2-CG2 3.95Å; W432-T448 HydrophobicContact CZ3-CG2 3.76Å
433	N	86.9	Confident	90.8	Very high	80 Å²	80	72.6 Å²	72.6	43%	0.428	35%	0.354	S	S	.	.	H	α-helix	trans	-59.4	-34	-168.7	-166.3	52.6	0	0	0	113.7	L437 A445 R446	N433-L437 VanDerWaalsContact O-CB 3.31Å; N433-L437 WeakPolarHBondContact O-CB 3.35Å; N433-L437 WeakPolarHBondContact O-CD1 3.38Å; N433-L437 VanDerWaalsContact O-CG 3.26Å; N433-L437 WeakPolarHBondContact O-CG 3.38Å; N433-L437 PolarHBondContact O-N 2.97Å; N433-A445 PolarHBondContact ND2-O 3.08Å; N433-R446 HydrophobicContact CB-CB 4.32Å
434	D	91.8	Very high	90.8	Very high	0 Å²	0	65 Å²	65	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.6	-44	175.1	63.6	-52.9	0	0	0	112	Y408 W432 T438 G444 R446 A463 S477	Y408-D434 VanDerWaalsContact OH-CG 3.31Å; Y408-D434 PolarHBondContact OH-OD1 3.31Å; Y408-D434 PolarHBondContact OH-OD2 3.12Å; W432-D434 WeakPolarHBondContact CB-OD1 3.15Å; W432-D434 PolarHBondContact O-N 2.89Å; W432-D434 VanDerWaalsContact O-N 3.17Å; D434-T438 WeakPolarHBondContact O-CB 3.16Å; D434-T438 PolarHBondContact O-N 3.13Å; D434-T438 PolarHBondContact O-OG1 2.88Å; D434-G444 WeakPolarHBondContact O-CA 3.44Å; D434-R446 HydrophobicContact CB-CG 4.07Å; D434-R446 WeakPolarHBondContact OD1-CD 3.25Å; D434-R446 WeakPolarHBondContact OD1-CG 3.32Å; D434-R446 IonicContact OD1-CZ 3.37Å; D434-R446 IonicContact OD1-NE 3.91Å; D434-R446 PolarHBondContact OD1-NE 3.46Å; D434-R446 IonicContact OD2-NE 3.93Å; D434-A463 HydrophobicContact CB-CB 3.96Å; D434-A463 WeakPolarHBondContact O-CB 3.41Å; D434-S477 VanDerWaalsContact OD2-CB 3.3Å; D434-S477 WeakPolarHBondContact OD2-CB 3.29Å; D434-S477 PolarHBondContact OD2-OG 3.37Å
435	V	94.1	Very high	90.8	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-73.6	-45.4	178	179.9	0	0	0	0	111.6	Y408 T410 Y429 W432 L437 T438 L439	Y408-V435 HydrophobicContact CE2-CG2 3.83Å; T410-V435 HydrophobicContact CG2-CG1 4.3Å; T410-V435 HydrophobicContact CG2-CG2 4.28Å; Y429-V435 WeakPolarHBondContact O-CB 3.46Å; W432-V435 PolarHBondContact O-N 3.24Å; V435-L437 PolarHBondContact O-N 3.45Å; V435-T438 PolarHBondContact O-N 3.38Å; V435-L439 HydrophobicContact CG1-CD1 3.74Å; V435-L439 HydrophobicContact CG1-CG 4.06Å; V435-L439 WeakPolarHBondContact O-CB 3.44Å; V435-L439 WeakPolarHBondContact O-CG 3.12Å; V435-L439 PolarHBondContact O-N 2.79Å
436	W	92.2	Very high	90.5	Very high	97 Å²	97	63.7 Å²	63.7	37%	0.367	31%	0.311	S	S	.	.	H	α-helix	trans	-60.4	-44.4	-176.3	-177.8	85.9	0	0	0	112.9	S430 W432 R440	S430-W436 WeakPolarHBondContact O-CB 3.07Å; W432-W436 VanDerWaalsContact O-CB 3.3Å; W432-W436 WeakPolarHBondContact O-CB 3.41Å; W432-W436 PolarHBondContact O-N 3.49Å; W436-R440 WeakPolarHBondContact O-CG 3.44Å
437	L	90	Very high	89.9	Confident	26 Å²	26	64.5 Å²	64.5	14%	0.136	31%	0.311	C	S	.	.	H	α-helix	trans	-67.7	-45.4	176.4	-72.1	171.8	0	0	0	110.6	N433 V435 L439 R440 G441 Q442 Y443	N433-L437 VanDerWaalsContact O-CB 3.31Å; N433-L437 WeakPolarHBondContact O-CB 3.35Å; N433-L437 WeakPolarHBondContact O-CD1 3.38Å; N433-L437 VanDerWaalsContact O-CG 3.26Å; N433-L437 WeakPolarHBondContact O-CG 3.38Å; N433-L437 PolarHBondContact O-N 2.97Å; V435-L437 PolarHBondContact O-N 3.45Å; L437-L439 PolarHBondContact O-N 3.26Å; L437-R440 CarbonylContact O-C 3.58Å; L437-R440 PolarHBondContact O-N 3.35Å; L437-G441 PolarHBondContact O-N 3.22Å; L437-Q442 CarbonylContact C-O 3.6Å; L437-Q442 VanDerWaalsContact C-O 3.3Å; L437-Q442 HydrophobicContact CB-CB 4.17Å; L437-Q442 HydrophobicContact CD2-CB 4.18Å; L437-Q442 VanDerWaalsContact CD2-OE1 3.28Å; L437-Q442 WeakPolarHBondContact O-CA 3.36Å; L437-Q442 WeakPolarHBondContact O-CB 3.43Å; L437-Q442 PolarHBondContact O-N 3.28Å; L437-Y443 VanDerWaalsContact CD1-O 3.31Å; L437-Y443 WeakPolarHBondContact CD1-O 3.4Å
438	T	93.3	Very high	89.3	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.018	30%	0.3	C	S	.	.	H	α-helix	trans	-66.5	-38.9	-177.5	-59	0	0	0	0	113.1	D434 V435 R440 G441 Q442 G444 A463 P465 L472 V475	D434-T438 WeakPolarHBondContact O-CB 3.16Å; D434-T438 PolarHBondContact O-N 3.13Å; D434-T438 PolarHBondContact O-OG1 2.88Å; V435-T438 PolarHBondContact O-N 3.38Å; T438-R440 PolarHBondContact O-N 2.95Å; T438-R440 VanDerWaalsContact O-N 3.1Å; T438-G441 PolarHBondContact O-N 3.08Å; T438-Q442 VanDerWaalsContact CA-O 3.26Å; T438-Q442 WeakPolarHBondContact CA-O 3.19Å; T438-Q442 PolarHBondContact N-O 2.97Å; T438-G444 PolarHBondContact OG1-N 2.78Å; T438-A463 HydrophobicContact CG2-CB 4.5Å; T438-A463 WeakPolarHBondContact OG1-CB 3.39Å; T438-P465 HydrophobicContact CG2-CB 3.85Å; T438-P465 HydrophobicContact CG2-CG 4.34Å; T438-L472 WeakPolarHBondContact O-CD1 3.37Å; T438-V475 HydrophobicContact CG2-CB 4.4Å; T438-V475 HydrophobicContact CG2-CG1 3.76Å; T438-V475 HydrophobicContact CG2-CG2 3.85Å
439	L	92.8	Very high	88.1	Confident	45 Å²	45	59 Å²	59	24%	0.236	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.1	172.7	-74.8	175.4	0	0	0	113.1	V435 L437 L472 V475	V435-L439 HydrophobicContact CG1-CD1 3.74Å; V435-L439 HydrophobicContact CG1-CG 4.06Å; V435-L439 WeakPolarHBondContact O-CB 3.44Å; V435-L439 WeakPolarHBondContact O-CG 3.12Å; V435-L439 PolarHBondContact O-N 2.79Å; L437-L439 PolarHBondContact O-N 3.26Å; L439-L472 HydrophobicContact CD2-CD2 3.61Å; L439-V475 HydrophobicContact CD2-CG2 3.6Å; L439-V475 HydrophobicContact CG-CG2 3.81Å
440	R	91.4	Very high	87.1	Confident	160 Å²	160	64.2 Å²	64.2	60%	0.604	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	11.7	179	-64.5	175	179.1	-146.7	-4.3	113.1	W436 L437 T438 Q442	W436-R440 WeakPolarHBondContact O-CG 3.44Å; L437-R440 CarbonylContact O-C 3.58Å; L437-R440 PolarHBondContact O-N 3.35Å; T438-R440 PolarHBondContact O-N 2.95Å; T438-R440 VanDerWaalsContact O-N 3.1Å; R440-Q442 VanDerWaalsContact C-N 3.27Å; R440-Q442 PolarHBondContact O-N 2.75Å
441	G	86.8	Confident	86.1	Confident	72 Å²	72	66.5 Å²	66.5	74%	0.742	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	16.6	-178.2	0	0	0	0	0	114.2	L437 T438	L437-G441 PolarHBondContact O-N 3.22Å; T438-G441 PolarHBondContact O-N 3.08Å
442	Q	89	Confident	85.1	Confident	116 Å²	116	61.4 Å²	61.4	54%	0.542	32%	0.317	S	S	.	.	S	Bend	trans	-104.3	158.3	176.6	-61.9	-175.1	-2.5	0	0	111.1	L437 T438 R440 G444	L437-Q442 CarbonylContact C-O 3.6Å; L437-Q442 VanDerWaalsContact C-O 3.3Å; L437-Q442 HydrophobicContact CB-CB 4.17Å; L437-Q442 HydrophobicContact CD2-CB 4.18Å; L437-Q442 VanDerWaalsContact CD2-OE1 3.28Å; L437-Q442 WeakPolarHBondContact O-CA 3.36Å; L437-Q442 WeakPolarHBondContact O-CB 3.43Å; L437-Q442 PolarHBondContact O-N 3.28Å; T438-Q442 VanDerWaalsContact CA-O 3.26Å; T438-Q442 WeakPolarHBondContact CA-O 3.19Å; T438-Q442 PolarHBondContact N-O 2.97Å; R440-Q442 VanDerWaalsContact C-N 3.27Å; R440-Q442 PolarHBondContact O-N 2.75Å; Q442-G444 PolarHBondContact O-N 3.08Å
443	Y	86.7	Confident	84.1	Confident	93 Å²	93	61.1 Å²	61.1	37%	0.365	33%	0.334	S	S	.	.			trans	-64.9	119.4	175.8	176.2	-97.3	0	0	0	111	E351 I355 L437 A445 V462	E351-Y443 HydrophobicContact CG-CE1 4.49Å; E351-Y443 WeakPolarHBondContact CG-OH 3.43Å; E351-Y443 WeakPolarHBondContact OE1-CE1 3.39Å; E351-Y443 PolarHBondContact OE1-OH 2.84Å; I355-Y443 HydrophobicContact CB-CE2 4.21Å; I355-Y443 HydrophobicContact CD1-CD2 4.28Å; I355-Y443 HydrophobicContact CD1-CE2 3.84Å; I355-Y443 HydrophobicContact CG1-CE2 3.98Å; L437-Y443 VanDerWaalsContact CD1-O 3.31Å; L437-Y443 WeakPolarHBondContact CD1-O 3.4Å; Y443-A445 HydrophobicContact CE1-CB 3.68Å; Y443-V462 HydrophobicContact CE2-CG1 3.82Å; Y443-V462 WeakPolarHBondContact OH-CG1 3.48Å; Y443-V462 WeakPolarHBondContact OH-CG2 3.35Å
444	G	85.8	Confident	83	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.8	-177.4	0	0	0	0	0	113.1	D434 T438 Q442 A463	D434-G444 WeakPolarHBondContact O-CA 3.44Å; T438-G444 PolarHBondContact OG1-N 2.78Å; Q442-G444 PolarHBondContact O-N 3.08Å; G444-A463 PolarHBondContact O-N 2.84Å
445	A	87.1	Confident	81.4	Confident	12 Å²	12	65 Å²	65	10%	0.099	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	151.5	170.5	0	0	0	0	0	112.1	N433 Y443 Y461 V462	N433-A445 PolarHBondContact ND2-O 3.08Å; Y443-A445 HydrophobicContact CE1-CB 3.68Å; A445-Y461 CarbonylContact C-O 3.5Å; A445-Y461 WeakPolarHBondContact CA-O 3.33Å; A445-V462 HydrophobicContact CB-CG2 4.21Å
446	R	85.4	Confident	79.8	Confident	23 Å²	23	70.3 Å²	70.3	9%	0.087	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	160.3	171.7	66.1	172.9	170.3	128.6	-13.5	111.7	Y408 N433 D434 T448 M460 Y461	Y408-R446 PolarHBondContact OH-NH2 2.76Å; N433-R446 HydrophobicContact CB-CB 4.32Å; D434-R446 HydrophobicContact CB-CG 4.07Å; D434-R446 WeakPolarHBondContact OD1-CD 3.25Å; D434-R446 WeakPolarHBondContact OD1-CG 3.32Å; D434-R446 IonicContact OD1-CZ 3.37Å; D434-R446 IonicContact OD1-NE 3.91Å; D434-R446 PolarHBondContact OD1-NE 3.46Å; D434-R446 IonicContact OD2-NE 3.93Å; R446-T448 PolarHBondContact NH1-OG1 3.48Å; R446-M460 CarbonylContact O-C 3.58Å; R446-M460 WeakPolarHBondContact O-CA 3.49Å; R446-Y461 HydrophobicContact CG-CD2 3.95Å; R446-Y461 HydrophobicContact CG-CG 4.18Å; R446-Y461 PolarHBondContact N-O 2.92Å; R446-Y461 PolarHBondContact O-N 2.71Å
447	S	78.8	Confident	78.7	Confident	58 Å²	58	66.5 Å²	66.5	41%	0.406	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.3	162.6	-63	0	0	0	0	108.3	V459	S447-V459 CarbonylContact C-O 3.56Å; S447-V459 VanDerWaalsContact CA-O 3.3Å; S447-V459 WeakPolarHBondContact CA-O 3.48Å
448	T	79.6	Confident	77.9	Confident	36 Å²	36	66 Å²	66	22%	0.221	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	132.3	-176.8	-54	0	0	0	0	109.2	W432 R446 Q450 V459	W432-T448 HydrophobicContact CH2-CG2 3.95Å; W432-T448 HydrophobicContact CZ3-CG2 3.76Å; R446-T448 PolarHBondContact NH1-OG1 3.48Å; T448-Q450 PolarHBondContact O-N 2.81Å; T448-V459 PolarHBondContact N-O 3.08Å; T448-V459 PolarHBondContact O-N 2.78Å
449	L	69.8	Low	77.3	Confident	48 Å²	48	66 Å²	66	25%	0.251	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	127.2	173.4	-66.8	173.7	0	0	0	109.6	M341 P455	M341-L449 HydrophobicContact CE-CD1 4.48Å; M341-L449 HydrophobicContact SD-CD1 3.82Å; M341-L449 HydrophobicContact SD-CD2 4.43Å; M341-L449 HydrophobicContact SD-CG 4.33Å; L449-P455 WeakPolarHBondContact CD2-O 3.48Å
450	Q	73.2	Confident	76.8	Confident	135 Å²	135	64.9 Å²	64.9	63%	0.631	37%	0.365	S	S	*	.	S	Bend	trans	-73.5	-32.7	174.8	-167.9	172.4	20.5	0	0	111.4	T448 S457 V459	T448-Q450 PolarHBondContact O-N 2.81Å; Q450-S457 WeakPolarHBondContact CB-O 3.49Å; Q450-S457 PolarHBondContact N-O 3Å; Q450-S457 PolarHBondContact N-OG 3.17Å; Q450-V459 HydrophobicContact CB-CG2 4.05Å
451	N	70.7	Confident	76.7	Confident	76 Å²	76	58 Å²	58	41%	0.406	34%	0.34	S	S	.	.	S	Bend	trans	-125.5	112.9	172.6	178.1	5.2	0	0	0	109.1	A453 D454 S457	N451-A453 PolarHBondContact O-N 3.36Å; N451-A453 VanDerWaalsContact O-N 3.07Å; N451-A453 WeakPolarHBondContact OD1-CB 3.34Å; N451-A453 PolarHBondContact OD1-N 3.1Å; N451-D454 HydrophobicContact CB-CB 4.02Å; N451-D454 CarbonylContact O-C 3.59Å; N451-D454 PolarHBondContact O-N 3.33Å; N451-D454 VanDerWaalsContact O-O 3.09Å; N451-S457 PolarHBondContact N-OG 3.44Å; N451-S457 PolarHBondContact O-OG 3.2Å
452	P	69.6	Low	76.9	Confident	117 Å²	117	54.6 Å²	54.6	76%	0.76	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-24.5	177.6	-24.5	33.6	0	0	0	114.2
453	A	70.2	Confident	77.1	Confident	87 Å²	87	49.2 Å²	49.2	72%	0.719	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-9.6	178.2	0	0	0	0	0	113.9	N451	N451-A453 PolarHBondContact O-N 3.36Å; N451-A453 VanDerWaalsContact O-N 3.07Å; N451-A453 WeakPolarHBondContact OD1-CB 3.34Å; N451-A453 PolarHBondContact OD1-N 3.1Å
454	D	64.4	Low	77.6	Confident	68 Å²	68	44.9 Å²	44.9	36%	0.364	26%	0.263	S	S	.	.			trans	-119.6	99.7	179.2	-176.6	7.5	0	0	0	110.1	N451 E456 S457	N451-D454 HydrophobicContact CB-CB 4.02Å; N451-D454 CarbonylContact O-C 3.59Å; N451-D454 PolarHBondContact O-N 3.33Å; N451-D454 VanDerWaalsContact O-O 3.09Å; D454-E456 PolarHBondContact O-N 2.82Å; D454-E456 VanDerWaalsContact O-N 3.12Å; D454-E456 WeakPolarHBondContact OD1-CB 3.34Å; D454-E456 PolarHBondContact OD1-N 2.94Å; D454-E456 VanDerWaalsContact OD1-N 3.16Å; D454-S457 VanDerWaalsContact O-CB 3.26Å; D454-S457 WeakPolarHBondContact O-CB 3.4Å; D454-S457 PolarHBondContact O-N 3.12Å; D454-S457 PolarHBondContact O-OG 2.95Å
455	P	58.7	Low	78	Confident	92 Å²	92	47.6 Å²	47.6	60%	0.597	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-24.8	179	-23.3	32.8	0	0	0	113.9	L449 S457	L449-P455 WeakPolarHBondContact CD2-O 3.48Å; P455-S457 VanDerWaalsContact C-N 3.26Å; P455-S457 PolarHBondContact O-N 3.2Å
456	E	60.9	Low	78.4	Confident	113 Å²	113	47 Å²	47	53%	0.528	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-6	179.8	-64	-71.4	138	0	0	112.4	D454 S458	D454-E456 PolarHBondContact O-N 2.82Å; D454-E456 VanDerWaalsContact O-N 3.12Å; D454-E456 WeakPolarHBondContact OD1-CB 3.34Å; D454-E456 PolarHBondContact OD1-N 2.94Å; D454-E456 VanDerWaalsContact OD1-N 3.16Å; E456-S458 PolarHBondContact O-N 3.04Å
457	S	68.9	Low	78.7	Confident	16 Å²	16	48.8 Å²	48.8	11%	0.112	29%	0.286	C	S	.	.			trans	-85	20.8	-177.1	74.8	0	0	0	0	114.6	Q450 N451 D454 P455 V459	Q450-S457 WeakPolarHBondContact CB-O 3.49Å; Q450-S457 PolarHBondContact N-O 3Å; Q450-S457 PolarHBondContact N-OG 3.17Å; N451-S457 PolarHBondContact N-OG 3.44Å; N451-S457 PolarHBondContact O-OG 3.2Å; D454-S457 VanDerWaalsContact O-CB 3.26Å; D454-S457 WeakPolarHBondContact O-CB 3.4Å; D454-S457 PolarHBondContact O-N 3.12Å; D454-S457 PolarHBondContact O-OG 2.95Å; P455-S457 VanDerWaalsContact C-N 3.26Å; P455-S457 PolarHBondContact O-N 3.2Å; S457-V459 PolarHBondContact O-N 3.26Å
458	S	72.5	Confident	79.3	Confident	16 Å²	16	49.6 Å²	49.6	11%	0.112	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	132.2	-178.9	-172.5	0	0	0	0	112	E456 N482	E456-S458 PolarHBondContact O-N 3.04Å; S458-N482 WeakPolarHBondContact O-CB 3.34Å; S458-N482 PolarHBondContact O-N 3.36Å
459	V	80.4	Confident	79.6	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.024	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.7	175	-177.1	0	0	0	0	108.6	S447 T448 Q450 S457 Y461 P481	S447-V459 CarbonylContact C-O 3.56Å; S447-V459 VanDerWaalsContact CA-O 3.3Å; S447-V459 WeakPolarHBondContact CA-O 3.48Å; T448-V459 PolarHBondContact N-O 3.08Å; T448-V459 PolarHBondContact O-N 2.78Å; Q450-V459 HydrophobicContact CB-CG2 4.05Å; S457-V459 PolarHBondContact O-N 3.26Å; V459-Y461 HydrophobicContact CB-CD2 4.44Å; V459-Y461 HydrophobicContact CB-CE2 3.73Å; V459-Y461 HydrophobicContact CG1-CD2 4.07Å; V459-Y461 HydrophobicContact CG1-CE1 4.22Å; V459-Y461 HydrophobicContact CG1-CE2 3.48Å; V459-Y461 VanDerWaalsContact CG1-CE2 3.48Å; V459-P481 HydrophobicContact CG2-CB 4.4Å; V459-P481 HydrophobicContact CG2-CG 4.42Å
460	M	83.3	Confident	80.4	Confident	20 Å²	20	54.6 Å²	54.6	10%	0.099	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	122.4	174.2	-176.5	171.6	-171.2	0	0	109.6	E351 L354 R446 V462 G479 K480	E351-M460 HydrophobicContact CB-CE 3.64Å; E351-M460 HydrophobicContact CG-CE 3.55Å; L354-M460 HydrophobicContact CD1-CB 4.19Å; L354-M460 HydrophobicContact CD1-CG 3.92Å; L354-M460 HydrophobicContact CD1-SD 4.2Å; R446-M460 CarbonylContact O-C 3.58Å; R446-M460 WeakPolarHBondContact O-CA 3.49Å; M460-V462 HydrophobicContact CE-CG2 4.24Å; M460-G479 CarbonylContact O-C 3.59Å; M460-G479 VanDerWaalsContact O-CA 3.23Å; M460-G479 WeakPolarHBondContact O-CA 2.93Å; M460-K480 PolarHBondContact N-O 2.85Å; M460-K480 PolarHBondContact O-N 3.19Å
461	Y	89.8	Confident	81.3	Confident	17 Å²	17	56.4 Å²	56.4	7%	0.067	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.9	175.1	-64.5	-92.7	0	0	0	110.1	H406 Y408 A445 R446 V459 V478 G479	H406-Y461 HydrophobicContact CB-CE1 4.49Å; H406-Y461 PolarHBondContact CE1-OH 2.89Å; H406-Y461 AromaticContact ND1-CE1 3.48Å; H406-Y461 WeakPolarHBondContact ND1-CE1 3.33Å; H406-Y461 AromaticContact ND1-CZ 3.57Å; H406-Y461 PolarHBondContact ND1-OH 3.02Å; Y408-Y461 HydrophobicContact CD1-CD1 4.45Å; Y408-Y461 HydrophobicContact CD1-CE1 4.19Å; Y408-Y461 AromaticContact CE1-CD1 3.64Å; Y408-Y461 HydrophobicContact CE1-CD1 3.64Å; Y408-Y461 AromaticContact CE1-CE1 3.62Å; Y408-Y461 HydrophobicContact CE1-CE1 3.62Å; A445-Y461 CarbonylContact C-O 3.5Å; A445-Y461 WeakPolarHBondContact CA-O 3.33Å; R446-Y461 HydrophobicContact CG-CD2 3.95Å; R446-Y461 HydrophobicContact CG-CG 4.18Å; R446-Y461 PolarHBondContact N-O 2.92Å; R446-Y461 PolarHBondContact O-N 2.71Å; V459-Y461 HydrophobicContact CB-CD2 4.44Å; V459-Y461 HydrophobicContact CB-CE2 3.73Å; V459-Y461 HydrophobicContact CG1-CD2 4.07Å; V459-Y461 HydrophobicContact CG1-CE1 4.22Å; V459-Y461 HydrophobicContact CG1-CE2 3.48Å; V459-Y461 VanDerWaalsContact CG1-CE2 3.48Å; Y461-V478 WeakPolarHBondContact CA-O 3.45Å; Y461-G479 VanDerWaalsContact CD1-CA 3.4Å
462	V	90.1	Very high	82.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	134.4	171.1	177.8	0	0	0	0	107.9	E351 L354 I355 Y443 A445 M460 S477 V478	E351-V462 HydrophobicContact CG-CG2 4.29Å; L354-V462 HydrophobicContact CB-CB 3.82Å; L354-V462 HydrophobicContact CB-CG2 3.63Å; L354-V462 HydrophobicContact CD1-CG2 3.97Å; L354-V462 HydrophobicContact CG-CG2 4.46Å; I355-V462 HydrophobicContact CB-CG1 3.81Å; I355-V462 HydrophobicContact CD1-CG1 3.79Å; I355-V462 HydrophobicContact CG1-CG1 4.35Å; Y443-V462 HydrophobicContact CE2-CG1 3.82Å; Y443-V462 WeakPolarHBondContact OH-CG1 3.48Å; Y443-V462 WeakPolarHBondContact OH-CG2 3.35Å; A445-V462 HydrophobicContact CB-CG2 4.21Å; M460-V462 HydrophobicContact CE-CG2 4.24Å; V462-S477 WeakPolarHBondContact O-CA 3.47Å; V462-V478 PolarHBondContact N-O 2.9Å; V462-V478 PolarHBondContact O-N 3.1Å
463	A	94.1	Very high	83.5	Confident	3 Å²	3	50.1 Å²	50.1	3%	0.025	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	147.8	-174.7	0	0	0	0	0	112.9	D434 T438 G444 V475 L476	D434-A463 HydrophobicContact CB-CB 3.96Å; D434-A463 WeakPolarHBondContact O-CB 3.41Å; T438-A463 HydrophobicContact CG2-CB 4.5Å; T438-A463 WeakPolarHBondContact OG1-CB 3.39Å; G444-A463 PolarHBondContact O-N 2.84Å; A463-V475 HydrophobicContact CB-CG1 3.69Å; A463-L476 CarbonylContact C-O 3.48Å; A463-L476 VanDerWaalsContact CA-O 3.25Å; A463-L476 WeakPolarHBondContact CA-O 3.47Å
464	A	95.3	Very high	84.6	Confident	1 Å²	1	46 Å²	46	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.8	173.6	0	0	0	0	0	110.2	A358 A362 L476	A358-A464 HydrophobicContact CB-CB 3.88Å; A362-A464 HydrophobicContact CB-CB 4.06Å; A464-L476 PolarHBondContact N-O 3.27Å; A464-L476 PolarHBondContact O-N 3.39Å
465	P	95.8	Very high	86.1	Confident	57 Å²	57	42.8 Å²	42.8	37%	0.37	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	145.1	179.5	31.7	-33.8	0	0	0	110.5	T438 M467 L472	T438-P465 HydrophobicContact CG2-CB 3.85Å; T438-P465 HydrophobicContact CG2-CG 4.34Å; P465-M467 HydrophobicContact CB-CG 4.37Å; P465-M467 HydrophobicContact CB-SD 4.04Å; P465-L472 HydrophobicContact CB-CD1 3.93Å; P465-L472 HydrophobicContact CB-CG 4.41Å
466	I	94.6	Very high	87.9	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117.3	170.6	-52.2	170.8	0	0	0	106.9	A362 A365 R366 L369 M409 I473 G474 L476	A362-I466 HydrophobicContact CB-CG1 3.92Å; A365-I466 HydrophobicContact CB-CD1 4.37Å; R366-I466 HydrophobicContact CB-CG2 3.93Å; R366-I466 HydrophobicContact CG-CG2 4.32Å; L369-I466 HydrophobicContact CD1-CB 4.13Å; L369-I466 HydrophobicContact CD1-CD1 3.24Å; L369-I466 HydrophobicContact CD1-CG1 4.28Å; L369-I466 HydrophobicContact CD1-CG2 3.83Å; M409-I466 HydrophobicContact CG-CD1 3.54Å; M409-I466 HydrophobicContact SD-CD1 3.4Å; M409-I466 WeakPolarHBondContact SD-CD1 3.38Å; I466-I473 HydrophobicContact CB-CG1 4.21Å; I466-I473 HydrophobicContact CG2-CD1 3.94Å; I466-I473 HydrophobicContact CG2-CG1 3.83Å; I466-I473 VanDerWaalsContact O-CG1 3.26Å; I466-I473 WeakPolarHBondContact O-CG1 3.45Å; I466-I473 PolarHBondContact O-N 2.89Å; I466-G474 PolarHBondContact N-O 3.5Å; I466-G474 PolarHBondContact O-N 2.89Å; I466-L476 HydrophobicContact CD1-CB 4Å; I466-L476 HydrophobicContact CG1-CB 4.15Å
467	M	91.7	Very high	89.5	Confident	60 Å²	60	33 Å²	33	30%	0.296	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	135.9	-171.5	-57.7	-64.8	-72.2	0	0	110.8	R366 P465 S470 R471 L472	R366-M467 WeakPolarHBondContact CD-O 3.44Å; P465-M467 HydrophobicContact CB-CG 4.37Å; P465-M467 HydrophobicContact CB-SD 4.04Å; M467-S470 VanDerWaalsContact CE-O 3.28Å; M467-S470 WeakPolarHBondContact CE-O 3.5Å; M467-R471 CarbonylContact C-O 3.5Å; M467-R471 WeakPolarHBondContact CA-O 3.27Å; M467-L472 HydrophobicContact SD-CB 3.81Å; M467-L472 HydrophobicContact SD-CG 4.2Å
468	D	91	Very high	90.7	Very high	74 Å²	74	32.2 Å²	32.2	40%	0.396	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	98.6	163.1	-177.9	27.5	0	0	0	108.3	L370 S470 R471 I473	L370-D468 HydrophobicContact CD2-CB 4.24Å; D468-S470 PolarHBondContact O-N 2.78Å; D468-S470 VanDerWaalsContact O-N 3.17Å; D468-R471 PolarHBondContact N-O 2.87Å; D468-R471 WeakPolarHBondContact O-CB 3.34Å; D468-R471 PolarHBondContact O-N 3.33Å; D468-I473 HydrophobicContact CB-CD1 4.2Å; D468-I473 HydrophobicContact CB-CG2 3.68Å
469	G	87.5	Confident	91.5	Very high	71 Å²	71	31.5 Å²	31.5	73%	0.732	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	-116.9	-164.9	0	0	0	0	0	111.1
470	S	86.3	Confident	91.7	Very high	119 Å²	119	34.1 Å²	34.1	83%	0.832	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	-4.2	176.1	57.5	0	0	0	0	113.9	M467 D468	M467-S470 VanDerWaalsContact CE-O 3.28Å; M467-S470 WeakPolarHBondContact CE-O 3.5Å; D468-S470 PolarHBondContact O-N 2.78Å; D468-S470 VanDerWaalsContact O-N 3.17Å
471	R	91.3	Very high	91.4	Very high	172 Å²	172	34.8 Å²	34.8	65%	0.649	20%	0.199	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	123.4	-176.2	-176	-179.3	179.3	179.1	-0.1	110.6	M467 D468 I473	M467-R471 CarbonylContact C-O 3.5Å; M467-R471 WeakPolarHBondContact CA-O 3.27Å; D468-R471 PolarHBondContact N-O 2.87Å; D468-R471 WeakPolarHBondContact O-CB 3.34Å; D468-R471 PolarHBondContact O-N 3.33Å; R471-I473 HydrophobicContact CG-CG2 4.25Å; R471-I473 PolarHBondContact O-N 3.31Å
472	L	92.4	Very high	90.2	Very high	39 Å²	39	36.7 Å²	36.7	20%	0.204	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	117.5	167.8	-170.4	155.4	0	0	0	109.1	T438 L439 P465 M467	T438-L472 WeakPolarHBondContact O-CD1 3.37Å; L439-L472 HydrophobicContact CD2-CD2 3.61Å; P465-L472 HydrophobicContact CB-CD1 3.93Å; P465-L472 HydrophobicContact CB-CG 4.41Å; M467-L472 HydrophobicContact SD-CB 3.81Å; M467-L472 HydrophobicContact SD-CG 4.2Å
473	I	94	Very high	88.6	Confident	23 Å²	23	39.4 Å²	39.4	12%	0.118	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-18.7	179.4	59.5	166.2	0	0	0	112.8	R366 L369 L370 D411 S412 I466 D468 R471	R366-I473 HydrophobicContact CG-CD1 4.29Å; L369-I473 HydrophobicContact CB-CD1 3.96Å; L369-I473 HydrophobicContact CD1-CD1 4.45Å; L370-I473 HydrophobicContact CD2-CD1 4.04Å; L370-I473 HydrophobicContact CG-CD1 4.16Å; D411-I473 CarbonylContact C-O 3.57Å; S412-I473 PolarHBondContact N-O 3.36Å; I466-I473 HydrophobicContact CB-CG1 4.21Å; I466-I473 HydrophobicContact CG2-CD1 3.94Å; I466-I473 HydrophobicContact CG2-CG1 3.83Å; I466-I473 VanDerWaalsContact O-CG1 3.26Å; I466-I473 WeakPolarHBondContact O-CG1 3.45Å; I466-I473 PolarHBondContact O-N 2.89Å; D468-I473 HydrophobicContact CB-CD1 4.2Å; D468-I473 HydrophobicContact CB-CG2 3.68Å; R471-I473 HydrophobicContact CG-CG2 4.25Å; R471-I473 PolarHBondContact O-N 3.31Å
474	G	94	Very high	86.6	Confident	0 Å²	0	43 Å²	43	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.1	-175.4	179.5	0	0	0	0	0	113.3	T410 I466	T410-G474 CarbonylContact O-C 3.57Å; T410-G474 WeakPolarHBondContact O-CA 3.47Å; I466-G474 PolarHBondContact N-O 3.5Å; I466-G474 PolarHBondContact O-N 2.89Å
475	V	96.4	Very high	84.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	134.1	176.4	177	0	0	0	0	109.2	M409 T410 T438 L439 A463	M409-V475 CarbonylContact C-O 3.55Å; M409-V475 VanDerWaalsContact CA-O 3.25Å; M409-V475 WeakPolarHBondContact CA-O 3.34Å; T410-V475 PolarHBondContact N-O 3.02Å; T410-V475 PolarHBondContact O-N 3.33Å; T410-V475 VanDerWaalsContact O-N 3.13Å; T438-V475 HydrophobicContact CG2-CB 4.4Å; T438-V475 HydrophobicContact CG2-CG1 3.76Å; T438-V475 HydrophobicContact CG2-CG2 3.85Å; L439-V475 HydrophobicContact CD2-CG2 3.6Å; L439-V475 HydrophobicContact CG-CG2 3.81Å; A463-V475 HydrophobicContact CB-CG1 3.69Å
476	L	95.7	Very high	82.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	128.1	170.5	-170.9	134.1	0	0	0	109.7	A358 L361 A362 A365 L379 V407 A463 A464 I466 V478	A358-L476 HydrophobicContact CB-CD2 4.45Å; A358-L476 WeakPolarHBondContact O-CD2 3.28Å; L361-L476 HydrophobicContact CB-CD1 3.96Å; L361-L476 HydrophobicContact CB-CD2 3.47Å; L361-L476 VanDerWaalsContact CB-CD2 3.47Å; L361-L476 HydrophobicContact CB-CG 4.38Å; L361-L476 HydrophobicContact CD1-CD2 4.36Å; A362-L476 HydrophobicContact CB-CB 4.02Å; A365-L476 HydrophobicContact CB-CD1 3.74Å; L379-L476 HydrophobicContact CD2-CD1 3.91Å; V407-L476 HydrophobicContact CG1-CD1 4.13Å; V407-L476 HydrophobicContact CG1-CD2 4Å; V407-L476 HydrophobicContact CG1-CG 4.03Å; A463-L476 CarbonylContact C-O 3.48Å; A463-L476 VanDerWaalsContact CA-O 3.25Å; A463-L476 WeakPolarHBondContact CA-O 3.47Å; A464-L476 PolarHBondContact N-O 3.27Å; A464-L476 PolarHBondContact O-N 3.39Å; I466-L476 HydrophobicContact CD1-CB 4Å; I466-L476 HydrophobicContact CG1-CB 4.15Å; L476-V478 HydrophobicContact CD2-CG2 3.76Å
477	S	95.2	Very high	80.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	136.3	178.6	-168.8	0	0	0	0	111.1	V407 Y408 D434 V462	V407-S477 VanDerWaalsContact CA-O 3.31Å; V407-S477 WeakPolarHBondContact CA-O 3.07Å; Y408-S477 PolarHBondContact N-O 2.88Å; Y408-S477 VanDerWaalsContact N-O 3.07Å; Y408-S477 PolarHBondContact O-N 3.22Å; D434-S477 VanDerWaalsContact OD2-CB 3.3Å; D434-S477 WeakPolarHBondContact OD2-CB 3.29Å; D434-S477 PolarHBondContact OD2-OG 3.37Å; V462-S477 WeakPolarHBondContact O-CA 3.47Å
478	V	93.3	Very high	78.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	115.2	177.9	-177	0	0	0	0	109.3	L354 T357 A358 L361 Y405 V407 Y461 V462 L476	L354-V478 HydrophobicContact CD2-CB 4.45Å; L354-V478 HydrophobicContact CD2-CG1 3.82Å; T357-V478 HydrophobicContact CG2-CG1 4.17Å; T357-V478 HydrophobicContact CG2-CG2 4.35Å; A358-V478 HydrophobicContact CB-CB 4.27Å; A358-V478 HydrophobicContact CB-CG2 3.72Å; L361-V478 HydrophobicContact CD1-CG2 3.92Å; Y405-V478 HydrophobicContact CD1-CG1 3.74Å; Y405-V478 HydrophobicContact CE1-CG1 4.31Å; Y405-V478 HydrophobicContact CG-CG1 4.31Å; V407-V478 HydrophobicContact CG2-CB 4.41Å; V407-V478 HydrophobicContact CG2-CG1 4.13Å; V407-V478 HydrophobicContact CG2-CG2 4.02Å; Y461-V478 WeakPolarHBondContact CA-O 3.45Å; V462-V478 PolarHBondContact N-O 2.9Å; V462-V478 PolarHBondContact O-N 3.1Å; L476-V478 HydrophobicContact CD2-CG2 3.76Å
479	G	89.4	Confident	76.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	136	174.4	0	0	0	0	0	112	Y405 H406 M460 Y461	Y405-G479 CarbonylContact C-O 3.5Å; Y405-G479 VanDerWaalsContact CA-O 3.3Å; Y405-G479 WeakPolarHBondContact CA-O 3.45Å; H406-G479 PolarHBondContact N-O 3.37Å; H406-G479 WeakPolarHBondContact O-CA 3.48Å; H406-G479 PolarHBondContact O-N 3.19Å; M460-G479 CarbonylContact O-C 3.59Å; M460-G479 VanDerWaalsContact O-CA 3.23Å; M460-G479 WeakPolarHBondContact O-CA 2.93Å; Y461-G479 VanDerWaalsContact CD1-CA 3.4Å
480	K	84.3	Confident	75.3	Confident	60 Å²	60	55.2 Å²	55.2	26%	0.261	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127	166.5	-178.4	178	-174.9	167.5	0	109.8	L354 Y405 M460 N482	L354-K480 HydrophobicContact CD1-CB 4.37Å; L354-K480 HydrophobicContact CD2-CB 3.81Å; Y405-K480 HydrophobicContact CD1-CB 4.03Å; Y405-K480 HydrophobicContact CD1-CG 4.45Å; Y405-K480 HydrophobicContact CE1-CB 3.96Å; Y405-K480 HydrophobicContact CE1-CD 3.85Å; Y405-K480 HydrophobicContact CE1-CG 4.13Å; M460-K480 PolarHBondContact N-O 2.85Å; M460-K480 PolarHBondContact O-N 3.19Å; K480-N482 PolarHBondContact O-N 3.31Å
481	P	77.4	Confident	73.7	Confident	33 Å²	33	59.3 Å²	59.3	21%	0.214	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	131.3	170.9	-21.4	31.6	0	0	0	109.7	E404 V459 A483	E404-P481 WeakPolarHBondContact O-CD 3.4Å; V459-P481 HydrophobicContact CG2-CB 4.4Å; V459-P481 HydrophobicContact CG2-CG 4.42Å; P481-A483 HydrophobicContact CB-CB 4.05Å; P481-A483 PolarHBondContact O-N 3.36Å
482	N	63.9	Low	72	Confident	57 Å²	57	53.7 Å²	53.7	31%	0.305	30%	0.295	S	S	.	.			trans	-71.6	13	169.3	-78.2	-14.9	0	0	0	112.2	S458 K480 A484	S458-N482 WeakPolarHBondContact O-CB 3.34Å; S458-N482 PolarHBondContact O-N 3.36Å; K480-N482 PolarHBondContact O-N 3.31Å; N482-A484 PolarHBondContact O-N 2.92Å
483	A	57.1	Low	70.6	Confident	58 Å²	58	57.1 Å²	57.1	48%	0.479	31%	0.31	S	S	.	.			trans	-69.4	59.7	176.6	0	0	0	0	0	111.9	P481	P481-A483 HydrophobicContact CB-CB 4.05Å; P481-A483 PolarHBondContact O-N 3.36Å
484	A	51.3	Low	69.4	Low	78 Å²	78	65.1 Å²	65.1	65%	0.645	34%	0.338	S	S	*	.	S	Bend	trans	-106.6	94.9	165	0	0	0	0	0	106.8	N482	N482-A484 PolarHBondContact O-N 2.92Å
485	M	51.9	Low	68.2	Low	95 Å²	95	74.6 Å²	74.6	47%	0.468	37%	0.374	S	S	.	.	S	Bend	trans	130.7	-19.9	156.7	-60.7	-120.4	84.7	0	0	116.4	P487 V488 I489	M485-P487 VanDerWaalsContact O-N 3.17Å; M485-V488 HydrophobicContact CE-CB 4.13Å; M485-V488 HydrophobicContact CE-CG1 4.18Å; M485-V488 HydrophobicContact CE-CG2 4.22Å; M485-V488 PolarHBondContact O-N 3.24Å; M485-I489 HydrophobicContact CB-CD1 4.16Å; M485-I489 HydrophobicContact CB-CG1 4.48Å; M485-I489 PolarHBondContact O-N 3.25Å; M485-I489 VanDerWaalsContact O-N 3.1Å
486	A	53.9	Low	67.2	Low	37 Å²	37	79.3 Å²	79.3	31%	0.306	40%	0.398	S	S	.	.	H	α-helix	trans	-49.6	-43.5	-177.6	0	0	0	0	0	115.6	V488 I489 K490	A486-V488 VanDerWaalsContact C-N 3.32Å; A486-V488 PolarHBondContact O-N 3.02Å; A486-I489 PolarHBondContact O-N 3.14Å; A486-K490 PolarHBondContact O-N 3.37Å
487	P	52.7	Low	66.3	Low	84 Å²	84	85 Å²	85	55%	0.545	43%	0.428	S	S	.	.	H	α-helix	trans	-74	-19.1	177.8	26.6	-32.5	0	0	0	114.1	M485	M485-P487 VanDerWaalsContact O-N 3.17Å
488	V	53.5	Low	65.6	Low	55 Å²	55	92.5 Å²	92.5	33%	0.333	46%	0.457	S	S	.	.	H	α-helix	trans	-80.3	-35.3	175.4	-177.3	0	0	0	0	110.5	I398 M485 A486	I398-V488 HydrophobicContact CD1-CG2 4.22Å; I398-V488 HydrophobicContact CG1-CG2 3.95Å; M485-V488 HydrophobicContact CE-CB 4.13Å; M485-V488 HydrophobicContact CE-CG1 4.18Å; M485-V488 HydrophobicContact CE-CG2 4.22Å; M485-V488 PolarHBondContact O-N 3.24Å; A486-V488 VanDerWaalsContact C-N 3.32Å; A486-V488 PolarHBondContact O-N 3.02Å
489	I	53.7	Low	65	Low	94 Å²	94	95.2 Å²	95.2	48%	0.482	48%	0.479	S	S	.	.	H	α-helix	trans	-70.9	-49.2	178.6	-62.7	171.4	0	0	0	111	M485 A486 R491 S492 E493	M485-I489 HydrophobicContact CB-CD1 4.16Å; M485-I489 HydrophobicContact CB-CG1 4.48Å; M485-I489 PolarHBondContact O-N 3.25Å; M485-I489 VanDerWaalsContact O-N 3.1Å; A486-I489 PolarHBondContact O-N 3.14Å; I489-R491 VanDerWaalsContact C-N 3.28Å; I489-R491 PolarHBondContact O-N 3.45Å; I489-S492 PolarHBondContact O-N 3.19Å; I489-E493 PolarHBondContact O-N 3.08Å
490	K	53.4	Low	64.6	Low	155 Å²	155	98.4 Å²	98.4	67%	0.674	50%	0.501	S	S	*	.	H	α-helix	trans	-63.7	-29.1	179.8	-76.8	-171.5	176.4	179.3	0	114.1	A486 S492	A486-K490 PolarHBondContact O-N 3.37Å; K490-S492 VanDerWaalsContact C-N 3.29Å
491	R	54	Low	64.8	Low	206 Å²	206	98.2 Å²	98.2	78%	0.777	51%	0.511	S	S	*	.	H	α-helix	trans	-71.6	-26.9	176.2	-128.7	176.4	-166.9	167.2	3.7	112.5	I489	I489-R491 VanDerWaalsContact C-N 3.28Å; I489-R491 PolarHBondContact O-N 3.45Å
492	S	55.6	Low	65.3	Low	54 Å²	54	101.5 Å²	101.5	38%	0.378	53%	0.525	S	S	.	.	H	α-helix	trans	-85.7	-31.9	176.5	-71.2	0	0	0	0	112.5	I489 K490 R494 R495 I496	I489-S492 PolarHBondContact O-N 3.19Å; K490-S492 VanDerWaalsContact C-N 3.29Å; S492-R494 PolarHBondContact O-N 2.89Å; S492-R495 PolarHBondContact O-N 2.83Å; S492-I496 VanDerWaalsContact O-CB 3.29Å; S492-I496 WeakPolarHBondContact O-CB 3.43Å; S492-I496 WeakPolarHBondContact O-CG1 3.17Å; S492-I496 PolarHBondContact O-N 3.31Å
493	E	63	Low	66.6	Low	111 Å²	111	104.8 Å²	104.8	52%	0.519	54%	0.542	S	S	.	.	H	α-helix	trans	-51.7	-51.4	-177.7	-82.3	177.5	174.6	0	0	113.8	I489 R495 I496 L497	I489-E493 PolarHBondContact O-N 3.08Å; E493-R495 PolarHBondContact O-N 3.04Å; E493-I496 PolarHBondContact O-N 3.28Å; E493-L497 VanDerWaalsContact O-CB 3.27Å; E493-L497 WeakPolarHBondContact O-CB 3.48Å; E493-L497 PolarHBondContact O-N 2.84Å
494	R	66.9	Low	68.3	Low	191 Å²	191	107.2 Å²	107.2	72%	0.721	55%	0.547	S	S	*	.	H	α-helix	trans	-69.4	-36.9	-176.3	-154.4	172	-169.9	-175.2	1.1	112.1	S492 L497 W498	S492-R494 PolarHBondContact O-N 2.89Å; R494-L497 PolarHBondContact O-N 3.1Å; R494-W498 PolarHBondContact O-N 3.13Å; R494-W498 VanDerWaalsContact O-N 3.1Å
495	R	70.5	Confident	70.1	Confident	198 Å²	198	105.1 Å²	105.1	75%	0.747	53%	0.532	S	S	*	.	H	α-helix	trans	-70.6	-40	178.3	-125.9	-171.9	-81.9	-171.1	-6.4	111.1	S492 E493 A499	S492-R495 PolarHBondContact O-N 2.83Å; E493-R495 PolarHBondContact O-N 3.04Å; R495-A499 VanDerWaalsContact O-CB 3.26Å; R495-A499 WeakPolarHBondContact O-CB 3.45Å; R495-A499 PolarHBondContact O-N 2.76Å
496	I	74.5	Confident	72.1	Confident	99 Å²	99	105.1 Å²	105.1	51%	0.508	53%	0.533	S	S	.	.	H	α-helix	trans	-64.6	-45.9	173.3	-68.4	170.1	0	0	0	109.9	S492 E493 W498 A499 S500	S492-I496 VanDerWaalsContact O-CB 3.29Å; S492-I496 WeakPolarHBondContact O-CB 3.43Å; S492-I496 WeakPolarHBondContact O-CG1 3.17Å; S492-I496 PolarHBondContact O-N 3.31Å; E493-I496 PolarHBondContact O-N 3.28Å; I496-W498 PolarHBondContact O-N 3.03Å; I496-A499 PolarHBondContact O-N 3.2Å; I496-S500 VanDerWaalsContact O-CB 3.29Å; I496-S500 WeakPolarHBondContact O-CB 3.45Å; I496-S500 PolarHBondContact O-N 3.4Å; I496-S500 PolarHBondContact O-OG 3.17Å
497	L	76.9	Confident	73.8	Confident	121 Å²	121	106 Å²	106	63%	0.634	54%	0.54	S	S	*	.	H	α-helix	trans	-60.3	-46.4	-179.7	-166	100.4	0	0	0	112	E493 R494 S500 A501	E493-L497 VanDerWaalsContact O-CB 3.27Å; E493-L497 WeakPolarHBondContact O-CB 3.48Å; E493-L497 PolarHBondContact O-N 2.84Å; R494-L497 PolarHBondContact O-N 3.1Å; L497-S500 PolarHBondContact O-N 3.12Å; L497-A501 VanDerWaalsContact O-CB 3.31Å; L497-A501 WeakPolarHBondContact O-CB 3.33Å; L497-A501 PolarHBondContact O-N 3.39Å
498	W	81.4	Confident	75.7	Confident	157 Å²	157	107.4 Å²	107.4	60%	0.595	54%	0.543	S	S	*	.	H	α-helix	trans	-66.8	-40.8	176.3	-80.9	104.2	0	0	0	112.4	R494 I496 A501 I502	R494-W498 PolarHBondContact O-N 3.13Å; R494-W498 VanDerWaalsContact O-N 3.1Å; I496-W498 PolarHBondContact O-N 3.03Å; W498-A501 PolarHBondContact O-N 2.91Å; W498-I502 WeakPolarHBondContact O-CB 3.49Å; W498-I502 VanDerWaalsContact O-CG1 3.26Å; W498-I502 WeakPolarHBondContact O-CG1 3.33Å; W498-I502 PolarHBondContact O-N 2.84Å
499	A	79.9	Confident	77.6	Confident	56 Å²	56	110 Å²	110	46%	0.463	56%	0.558	S	S	.	*	H	α-helix	trans	-62.2	-44.6	174.8	0	0	0	0	0	111.4	R495 I496 I502 L503	R495-A499 VanDerWaalsContact O-CB 3.26Å; R495-A499 WeakPolarHBondContact O-CB 3.45Å; R495-A499 PolarHBondContact O-N 2.76Å; I496-A499 PolarHBondContact O-N 3.2Å; A499-I502 PolarHBondContact O-N 2.8Å; A499-L503 VanDerWaalsContact O-CB 3.25Å; A499-L503 WeakPolarHBondContact O-CB 3.15Å; A499-L503 PolarHBondContact O-N 2.99Å
500	S	80.2	Confident	79.4	Confident	68 Å²	68	110.8 Å²	110.8	48%	0.476	56%	0.562	S	S	.	*	H	α-helix	trans	-62.9	-41.8	175.5	-65	0	0	0	0	112	I496 L497 L503 L504	I496-S500 VanDerWaalsContact O-CB 3.29Å; I496-S500 WeakPolarHBondContact O-CB 3.45Å; I496-S500 PolarHBondContact O-N 3.4Å; I496-S500 PolarHBondContact O-OG 3.17Å; L497-S500 PolarHBondContact O-N 3.12Å; S500-L503 PolarHBondContact O-N 2.69Å; S500-L504 VanDerWaalsContact O-CB 3.24Å; S500-L504 WeakPolarHBondContact O-CB 3.33Å; S500-L504 PolarHBondContact O-N 2.94Å
501	A	88.3	Confident	81.1	Confident	55 Å²	55	105 Å²	105	46%	0.455	55%	0.547	S	S	.	.	H	α-helix	trans	-66.3	-41.5	177.2	0	0	0	0	0	112.4	L497 W498 L504 G505	L497-A501 VanDerWaalsContact O-CB 3.31Å; L497-A501 WeakPolarHBondContact O-CB 3.33Å; L497-A501 PolarHBondContact O-N 3.39Å; W498-A501 PolarHBondContact O-N 2.91Å; A501-L504 PolarHBondContact O-N 3Å; A501-G505 PolarHBondContact O-N 3.47Å
502	I	89.5	Confident	83	Confident	102 Å²	102	98.2 Å²	98.2	52%	0.523	54%	0.535	S	S	.	.	H	α-helix	trans	-64.2	-45.5	174.6	-69.4	166.2	0	0	0	110.2	W498 A499 L504 G505 I506	W498-I502 WeakPolarHBondContact O-CB 3.49Å; W498-I502 VanDerWaalsContact O-CG1 3.26Å; W498-I502 WeakPolarHBondContact O-CG1 3.33Å; W498-I502 PolarHBondContact O-N 2.84Å; A499-I502 PolarHBondContact O-N 2.8Å; I502-L504 VanDerWaalsContact C-N 3.34Å; I502-L504 PolarHBondContact O-N 2.96Å; I502-G505 PolarHBondContact O-N 3.37Å; I502-I506 HydrophobicContact CG2-CD1 3.8Å; I502-I506 HydrophobicContact CG2-CG1 4.42Å; I502-I506 WeakPolarHBondContact O-CG1 3.45Å; I502-I506 PolarHBondContact O-N 2.9Å
503	L	90.1	Very high	84.7	Confident	126 Å²	126	97.4 Å²	97.4	66%	0.66	54%	0.535	S	S	*	.	H	α-helix	trans	-64	-40.5	179.8	-157.6	154	0	0	0	111	A499 S500 I506 A507	A499-L503 VanDerWaalsContact O-CB 3.25Å; A499-L503 WeakPolarHBondContact O-CB 3.15Å; A499-L503 PolarHBondContact O-N 2.99Å; S500-L503 PolarHBondContact O-N 2.69Å; L503-I506 PolarHBondContact O-N 2.85Å; L503-A507 VanDerWaalsContact O-CB 3.3Å; L503-A507 WeakPolarHBondContact O-CB 3.35Å; L503-A507 PolarHBondContact O-N 3.11Å
504	L	92.3	Very high	85.9	Confident	110 Å²	110	97.6 Å²	97.6	58%	0.576	54%	0.537	S	S	*	.	H	α-helix	trans	-62.4	-43.9	172.3	-174.5	68.3	0	0	0	111.8	S500 A501 I502 A507 L508	S500-L504 VanDerWaalsContact O-CB 3.24Å; S500-L504 WeakPolarHBondContact O-CB 3.33Å; S500-L504 PolarHBondContact O-N 2.94Å; A501-L504 PolarHBondContact O-N 3Å; I502-L504 VanDerWaalsContact C-N 3.34Å; I502-L504 PolarHBondContact O-N 2.96Å; L504-A507 PolarHBondContact O-N 2.92Å; L504-L508 HydrophobicContact CG-CD1 4.27Å; L504-L508 WeakPolarHBondContact O-CB 3.35Å; L504-L508 WeakPolarHBondContact O-CG 3.48Å; L504-L508 PolarHBondContact O-N 3.28Å
505	G	90.6	Very high	87	Confident	33 Å²	33	92.5 Å²	92.5	34%	0.34	53%	0.527	S	S	.	.	H	α-helix	trans	-62	-44.9	176.5	0	0	0	0	0	112.9	A501 I502 L508 V509	A501-G505 PolarHBondContact O-N 3.47Å; I502-G505 PolarHBondContact O-N 3.37Å; G505-L508 PolarHBondContact O-N 2.75Å; G505-V509 WeakPolarHBondContact O-CG2 3.33Å; G505-V509 PolarHBondContact O-N 3.01Å
506	I	92.4	Very high	88	Confident	95 Å²	95	90.6 Å²	90.6	49%	0.487	52%	0.52	S	S	.	.	H	α-helix	trans	-62.8	-44.9	175.2	-67.8	168.8	0	0	0	110.4	I502 L503 L508 V509 I510	I502-I506 HydrophobicContact CG2-CD1 3.8Å; I502-I506 HydrophobicContact CG2-CG1 4.42Å; I502-I506 WeakPolarHBondContact O-CG1 3.45Å; I502-I506 PolarHBondContact O-N 2.9Å; L503-I506 PolarHBondContact O-N 2.85Å; I506-L508 VanDerWaalsContact C-N 3.33Å; I506-L508 PolarHBondContact O-N 3.17Å; I506-V509 PolarHBondContact O-N 3.13Å; I506-I510 HydrophobicContact CG2-CD1 3.69Å; I506-I510 HydrophobicContact CG2-CG1 4.34Å; I506-I510 WeakPolarHBondContact O-CG1 3.43Å; I506-I510 PolarHBondContact O-N 3.25Å
507	A	90.3	Very high	88.5	Confident	55 Å²	55	91.3 Å²	91.3	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-60.4	-41.9	177.4	0	0	0	0	0	112	L503 L504 G511	L503-A507 VanDerWaalsContact O-CB 3.3Å; L503-A507 WeakPolarHBondContact O-CB 3.35Å; L503-A507 PolarHBondContact O-N 3.11Å; L504-A507 PolarHBondContact O-N 2.92Å; A507-G511 PolarHBondContact O-N 3.18Å
508	L	93.5	Very high	89	Confident	115 Å²	115	88.4 Å²	88.4	60%	0.602	50%	0.501	S	S	*	.	H	α-helix	trans	-64.5	-42.2	175.9	-76	169.5	0	0	0	112.5	L504 G505 I506 G511 A512	L504-L508 HydrophobicContact CG-CD1 4.27Å; L504-L508 WeakPolarHBondContact O-CB 3.35Å; L504-L508 WeakPolarHBondContact O-CG 3.48Å; L504-L508 PolarHBondContact O-N 3.28Å; G505-L508 PolarHBondContact O-N 2.75Å; I506-L508 VanDerWaalsContact C-N 3.33Å; I506-L508 PolarHBondContact O-N 3.17Å; L508-G511 PolarHBondContact O-N 3.1Å; L508-A512 WeakPolarHBondContact O-CB 3.47Å; L508-A512 PolarHBondContact O-N 2.62Å
509	V	92	Very high	89.4	Confident	108 Å²	108	85.6 Å²	85.6	66%	0.655	50%	0.498	S	S	*	.	H	α-helix	trans	-66.7	-44.9	178.1	171.5	0	0	0	0	111.5	G505 I506 G511 A512 G513	G505-V509 WeakPolarHBondContact O-CG2 3.33Å; G505-V509 PolarHBondContact O-N 3.01Å; I506-V509 PolarHBondContact O-N 3.13Å; V509-G511 VanDerWaalsContact C-N 3.34Å; V509-A512 PolarHBondContact O-N 3.08Å; V509-G513 PolarHBondContact O-N 3.41Å
510	I	92.3	Very high	89.8	Confident	111 Å²	111	89.5 Å²	89.5	57%	0.569	50%	0.501	S	S	*	.	H	α-helix	trans	-61.9	-45.1	175.3	-67.3	172	0	0	0	110.1	I506 G513 M514	I506-I510 HydrophobicContact CG2-CD1 3.69Å; I506-I510 HydrophobicContact CG2-CG1 4.34Å; I506-I510 WeakPolarHBondContact O-CG1 3.43Å; I506-I510 PolarHBondContact O-N 3.25Å; I510-G513 PolarHBondContact O-N 3.14Å; I510-M514 WeakPolarHBondContact O-CB 3.45Å; I510-M514 PolarHBondContact O-N 2.52Å
511	G	89.8	Confident	90.2	Very high	33 Å²	33	86.3 Å²	86.3	34%	0.34	48%	0.478	S	S	.	.	H	α-helix	trans	-57.9	-48.3	175.9	0	0	0	0	0	112.4	A507 L508 V509 M514 V515	A507-G511 PolarHBondContact O-N 3.18Å; L508-G511 PolarHBondContact O-N 3.1Å; V509-G511 VanDerWaalsContact C-N 3.34Å; G511-M514 PolarHBondContact O-N 3.07Å; G511-V515 VanDerWaalsContact O-CG2 3.3Å; G511-V515 WeakPolarHBondContact O-CG2 3.45Å; G511-V515 PolarHBondContact O-N 2.89Å
512	A	92.3	Very high	90.1	Very high	64 Å²	64	87.4 Å²	87.4	53%	0.529	48%	0.476	S	S	.	.	H	α-helix	trans	-63.2	-42	177.8	0	0	0	0	0	112.6	L508 V509 V515 W516	L508-A512 WeakPolarHBondContact O-CB 3.47Å; L508-A512 PolarHBondContact O-N 2.62Å; V509-A512 PolarHBondContact O-N 3.08Å; A512-V515 PolarHBondContact O-N 2.86Å; A512-W516 WeakPolarHBondContact O-CB 3.2Å; A512-W516 PolarHBondContact O-N 3.39Å
513	G	91.7	Very high	90.1	Very high	38 Å²	38	84.8 Å²	84.8	39%	0.392	47%	0.469	S	S	.	.	H	α-helix	trans	-63.1	-41.4	175.6	0	0	0	0	0	112.7	V509 I510 W516 W517	V509-G513 PolarHBondContact O-N 3.41Å; I510-G513 PolarHBondContact O-N 3.14Å; G513-W516 PolarHBondContact O-N 3.07Å; G513-W517 WeakPolarHBondContact O-CB 3.45Å; G513-W517 PolarHBondContact O-N 2.9Å
514	M	88.8	Confident	89.9	Confident	114 Å²	114	82.5 Å²	82.5	56%	0.562	45%	0.452	S	S	*	.	H	α-helix	trans	-65.9	-45.5	176.1	-172.8	168.5	-177.3	0	0	111.8	I510 G511 W516 W517 I518	I510-M514 WeakPolarHBondContact O-CB 3.45Å; I510-M514 PolarHBondContact O-N 2.52Å; G511-M514 PolarHBondContact O-N 3.07Å; M514-W516 PolarHBondContact O-N 2.88Å; M514-W517 PolarHBondContact O-N 3.38Å; M514-I518 HydrophobicContact CE-CD1 4.11Å; M514-I518 HydrophobicContact CG-CD1 3.91Å; M514-I518 VanDerWaalsContact O-CG1 3.32Å; M514-I518 WeakPolarHBondContact O-CG1 3.41Å; M514-I518 PolarHBondContact O-N 3.3Å
515	V	90.7	Very high	89.7	Confident	84 Å²	84	77.9 Å²	77.9	51%	0.509	43%	0.428	S	S	.	.	H	α-helix	trans	-60.2	-45.2	175.5	169.8	0	0	0	0	111.2	G511 A512 W517 I518 N519	G511-V515 VanDerWaalsContact O-CG2 3.3Å; G511-V515 WeakPolarHBondContact O-CG2 3.45Å; G511-V515 PolarHBondContact O-N 2.89Å; A512-V515 PolarHBondContact O-N 2.86Å; V515-W517 PolarHBondContact O-N 3.48Å; V515-I518 PolarHBondContact O-N 2.69Å; V515-N519 WeakPolarHBondContact O-CB 3.47Å; V515-N519 PolarHBondContact O-N 3.37Å
516	W	91	Very high	89.5	Confident	159 Å²	159	79.6 Å²	79.6	60%	0.602	43%	0.431	S	S	*	.	H	α-helix	trans	-62.1	-43.9	177.5	179.1	82.5	0	0	0	112.4	A512 G513 M514 R520	A512-W516 WeakPolarHBondContact O-CB 3.2Å; A512-W516 PolarHBondContact O-N 3.39Å; G513-W516 PolarHBondContact O-N 3.07Å; M514-W516 PolarHBondContact O-N 2.88Å; W516-R520 VanDerWaalsContact O-CB 3.27Å; W516-R520 WeakPolarHBondContact O-CB 3.47Å; W516-R520 PolarHBondContact O-N 2.74Å
517	W	85.1	Confident	89.2	Confident	113 Å²	113	82.9 Å²	82.9	43%	0.428	44%	0.438	S	S	.	.	H	α-helix	trans	-65.2	-42.8	178.8	175.2	71.4	0	0	0	112.9	G513 M514 V515 S521	G513-W517 WeakPolarHBondContact O-CB 3.45Å; G513-W517 PolarHBondContact O-N 2.9Å; M514-W517 PolarHBondContact O-N 3.38Å; V515-W517 PolarHBondContact O-N 3.48Å; W517-S521 WeakPolarHBondContact O-CB 3.28Å; W517-S521 PolarHBondContact O-N 2.89Å; W517-S521 VanDerWaalsContact O-N 3.12Å; W517-S521 PolarHBondContact O-OG 3.48Å
518	I	87.2	Confident	89	Confident	61 Å²	61	80.5 Å²	80.5	31%	0.313	42%	0.417	S	S	.	.	H	α-helix	trans	-64.5	-50.9	176.5	-68.6	171.1	0	0	0	110	M514 V515 R520 S521 I522	M514-I518 HydrophobicContact CE-CD1 4.11Å; M514-I518 HydrophobicContact CG-CD1 3.91Å; M514-I518 VanDerWaalsContact O-CG1 3.32Å; M514-I518 WeakPolarHBondContact O-CG1 3.41Å; M514-I518 PolarHBondContact O-N 3.3Å; V515-I518 PolarHBondContact O-N 2.69Å; I518-R520 VanDerWaalsContact C-N 3.35Å; I518-R520 PolarHBondContact O-N 2.9Å; I518-S521 PolarHBondContact O-N 2.77Å; I518-S521 VanDerWaalsContact O-N 3.08Å; I518-I522 HydrophobicContact CG2-CD1 3.62Å; I518-I522 HydrophobicContact CG2-CG1 4.28Å; I518-I522 WeakPolarHBondContact O-CG1 3.25Å; I518-I522 PolarHBondContact O-N 2.99Å
519	N	89.8	Confident	88.6	Confident	98 Å²	98	76.4 Å²	76.4	52%	0.524	40%	0.4	S	S	.	.	H	α-helix	trans	-60	-42.2	179.5	-79	-10.2	0	0	0	112.3	V515 S521 I522 A523	V515-N519 WeakPolarHBondContact O-CB 3.47Å; V515-N519 PolarHBondContact O-N 3.37Å; N519-S521 VanDerWaalsContact C-N 3.27Å; N519-S521 PolarHBondContact O-N 2.95Å; N519-I522 PolarHBondContact O-N 3.41Å; N519-A523 VanDerWaalsContact O-CB 3.24Å; N519-A523 WeakPolarHBondContact O-CB 3.44Å; N519-A523 PolarHBondContact O-N 3.28Å
520	R	88.7	Confident	88.3	Confident	137 Å²	137	75.6 Å²	75.6	52%	0.517	39%	0.392	S	S	.	.	H	α-helix	trans	-63	-34.7	176.4	-178.4	176	177.2	144.1	1.4	112.5	W516 I518 R524	W516-R520 VanDerWaalsContact O-CB 3.27Å; W516-R520 WeakPolarHBondContact O-CB 3.47Å; W516-R520 PolarHBondContact O-N 2.74Å; I518-R520 VanDerWaalsContact C-N 3.35Å; I518-R520 PolarHBondContact O-N 2.9Å; R520-R524 PolarHBondContact O-N 3.15Å
521	S	87	Confident	87.8	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.007	37%	0.368	C	S	.	.	H	α-helix	trans	-78.2	-40.8	-179.2	-54.8	0	0	0	0	111.5	W517 I518 N519 R524 L525 L548	W517-S521 WeakPolarHBondContact O-CB 3.28Å; W517-S521 PolarHBondContact O-N 2.89Å; W517-S521 VanDerWaalsContact O-N 3.12Å; W517-S521 PolarHBondContact O-OG 3.48Å; I518-S521 PolarHBondContact O-N 2.77Å; I518-S521 VanDerWaalsContact O-N 3.08Å; N519-S521 VanDerWaalsContact C-N 3.27Å; N519-S521 PolarHBondContact O-N 2.95Å; S521-R524 PolarHBondContact O-N 2.9Å; S521-L525 PolarHBondContact O-N 2.97Å; S521-L548 VanDerWaalsContact CB-CD1 3.48Å
522	I	87.7	Confident	87.1	Confident	79 Å²	79	70.8 Å²	70.8	41%	0.405	36%	0.362	S	S	.	.	H	α-helix	trans	-61.6	-46.6	171.6	-65.8	173.3	0	0	0	110.3	I518 N519 R524 L525 T526	I518-I522 HydrophobicContact CG2-CD1 3.62Å; I518-I522 HydrophobicContact CG2-CG1 4.28Å; I518-I522 WeakPolarHBondContact O-CG1 3.25Å; I518-I522 PolarHBondContact O-N 2.99Å; N519-I522 PolarHBondContact O-N 3.41Å; I522-R524 PolarHBondContact O-N 3.46Å; I522-L525 CarbonylContact O-C 3.57Å; I522-L525 WeakPolarHBondContact O-CA 3.4Å; I522-L525 WeakPolarHBondContact O-CB 3.22Å; I522-L525 PolarHBondContact O-N 3.01Å; I522-T526 PolarHBondContact O-N 3.47Å; I522-T526 PolarHBondContact O-OG1 3.15Å; I522-T526 VanDerWaalsContact O-OG1 3.1Å
523	A	87.9	Confident	86.4	Confident	46 Å²	46	73.6 Å²	73.6	38%	0.38	37%	0.372	S	S	.	.	H	α-helix	trans	-63.3	-24.9	179	0	0	0	0	0	114.1	N519 R527	N519-A523 VanDerWaalsContact O-CB 3.24Å; N519-A523 WeakPolarHBondContact O-CB 3.44Å; N519-A523 PolarHBondContact O-N 3.28Å; A523-R527 WeakPolarHBondContact O-CG 3.28Å; A523-R527 PolarHBondContact O-N 3.11Å; A523-R527 PolarHBondContact O-NE 2.8Å
524	R	86.9	Confident	85.6	Confident	79 Å²	79	76.4 Å²	76.4	30%	0.298	38%	0.378	S	S	.	.	H	α-helix	trans	-71.9	-40.9	169.5	-88.5	-172.3	-81.5	169.3	-3.4	111.5	R520 S521 I522 Y528 P541 E542	R520-R524 PolarHBondContact O-N 3.15Å; S521-R524 PolarHBondContact O-N 2.9Å; I522-R524 PolarHBondContact O-N 3.46Å; R524-Y528 PolarHBondContact O-N 2.85Å; R524-Y528 VanDerWaalsContact O-N 3.12Å; R524-P541 HydrophobicContact CB-CB 4.45Å; R524-E542 PolarHBondContact NH1-O 2.66Å
525	L	87.5	Confident	84.5	Confident	13 Å²	13	76.2 Å²	76.2	7%	0.068	38%	0.38	C	S	.	.	H	α-helix	trans	-70.3	-37.7	178.2	-167.5	71.5	0	0	0	112.4	S521 I522 Y528 A529 L543 L551 A552 L555	S521-L525 PolarHBondContact O-N 2.97Å; I522-L525 CarbonylContact O-C 3.57Å; I522-L525 WeakPolarHBondContact O-CA 3.4Å; I522-L525 WeakPolarHBondContact O-CB 3.22Å; I522-L525 PolarHBondContact O-N 3.01Å; L525-Y528 WeakPolarHBondContact O-CB 3.13Å; L525-Y528 PolarHBondContact O-N 2.81Å; L525-A529 PolarHBondContact O-N 3.3Å; L525-L543 HydrophobicContact CD1-CD1 4.06Å; L525-L551 HydrophobicContact CD2-CB 4.35Å; L525-L551 HydrophobicContact CD2-CD2 3.33Å; L525-L551 HydrophobicContact CD2-CG 3.68Å; L525-A552 HydrophobicContact CD1-CB 3.85Å; L525-L555 HydrophobicContact CD1-CD1 3.66Å; L525-L555 HydrophobicContact CD2-CD1 3.95Å; L525-L555 HydrophobicContact CG-CD1 3.68Å
526	T	87.5	Confident	83.3	Confident	68 Å²	68	78 Å²	78	42%	0.417	38%	0.381	S	S	.	.	H	α-helix	trans	-60.3	-47.9	173.5	-51.7	0	0	0	0	110.8	I522 Y528 A529 D530	I522-T526 PolarHBondContact O-N 3.47Å; I522-T526 PolarHBondContact O-OG1 3.15Å; I522-T526 VanDerWaalsContact O-OG1 3.1Å; T526-Y528 PolarHBondContact O-N 3.21Å; T526-A529 WeakPolarHBondContact O-CB 3.37Å; T526-A529 PolarHBondContact O-N 3.34Å; T526-A529 VanDerWaalsContact O-N 3.07Å; T526-D530 VanDerWaalsContact O-CG 3.24Å; T526-D530 PolarHBondContact O-N 2.89Å
527	R	85.9	Confident	81.9	Confident	164 Å²	164	76.4 Å²	76.4	62%	0.619	39%	0.391	S	S	*	.	H	α-helix	trans	-58.9	-35.1	174.5	-77.7	-176	-73.5	160.5	-8.6	113.2	A523 S531	A523-R527 WeakPolarHBondContact O-CG 3.28Å; A523-R527 PolarHBondContact O-N 3.11Å; A523-R527 PolarHBondContact O-NE 2.8Å; R527-S531 PolarHBondContact O-N 2.86Å; R527-S531 VanDerWaalsContact O-N 3.1Å
528	Y	86.3	Confident	81.2	Confident	5 Å²	5	74.3 Å²	74.3	2%	0.02	39%	0.39	C	S	.	.	H	α-helix	trans	-65.8	-48.5	173.4	-174.8	-101.3	0	0	0	111.4	R524 L525 T526 D530 S531 V532 V538 L540 L555 E556	R524-Y528 PolarHBondContact O-N 2.85Å; R524-Y528 VanDerWaalsContact O-N 3.12Å; L525-Y528 WeakPolarHBondContact O-CB 3.13Å; L525-Y528 PolarHBondContact O-N 2.81Å; T526-Y528 PolarHBondContact O-N 3.21Å; Y528-D530 VanDerWaalsContact C-N 3.33Å; Y528-D530 PolarHBondContact O-N 3.41Å; Y528-S531 WeakPolarHBondContact O-CB 3.03Å; Y528-S531 PolarHBondContact O-N 3.49Å; Y528-S531 VanDerWaalsContact O-N 3.08Å; Y528-S531 PolarHBondContact O-OG 2.92Å; Y528-V532 HydrophobicContact CD1-CG2 4.46Å; Y528-V532 HydrophobicContact CE1-CG2 4.15Å; Y528-V532 PolarHBondContact O-N 3.28Å; Y528-V532 VanDerWaalsContact O-N 3.13Å; Y528-V538 WeakPolarHBondContact CE2-O 3.29Å; Y528-L540 HydrophobicContact CD1-CD1 4.1Å; Y528-L540 HydrophobicContact CD2-CD1 4.5Å; Y528-L540 HydrophobicContact CE1-CD1 3.55Å; Y528-L540 HydrophobicContact CE2-CB 4.44Å; Y528-L540 HydrophobicContact CE2-CD1 3.99Å; Y528-L540 VanDerWaalsContact CZ-CD1 3.49Å; Y528-L555 HydrophobicContact CD1-CB 4.39Å; Y528-L555 HydrophobicContact CE1-CB 4.31Å; Y528-E556 PolarHBondContact OH-OE2 3.32Å
529	A	85.1	Confident	80.8	Confident	30 Å²	30	76.7 Å²	76.7	25%	0.248	41%	0.409	C	S	.	.	H	α-helix	trans	-60	-41	177	0	0	0	0	0	112.4	L525 T526 S531 V532 T533 L555	L525-A529 PolarHBondContact O-N 3.3Å; T526-A529 WeakPolarHBondContact O-CB 3.37Å; T526-A529 PolarHBondContact O-N 3.34Å; T526-A529 VanDerWaalsContact O-N 3.07Å; A529-S531 VanDerWaalsContact C-N 3.3Å; A529-S531 PolarHBondContact O-N 3.05Å; A529-V532 WeakPolarHBondContact O-CB 3.25Å; A529-V532 PolarHBondContact O-N 2.89Å; A529-T533 PolarHBondContact O-N 2.8Å; A529-T533 PolarHBondContact O-OG1 3.3Å; A529-L555 HydrophobicContact CB-CD2 4.22Å
530	D	85.1	Confident	80.3	Confident	90 Å²	90	75 Å²	75	48%	0.481	40%	0.4	S	S	.	.	H	α-helix	trans	-61.1	-39.7	174.1	-62.6	-26.2	0	0	0	111	T526 Y528 V532 T533 D534	T526-D530 VanDerWaalsContact O-CG 3.24Å; T526-D530 PolarHBondContact O-N 2.89Å; Y528-D530 VanDerWaalsContact C-N 3.33Å; Y528-D530 PolarHBondContact O-N 3.41Å; D530-V532 VanDerWaalsContact C-N 3.3Å; D530-V532 PolarHBondContact O-N 3.16Å; D530-T533 WeakPolarHBondContact O-CB 3.35Å; D530-T533 PolarHBondContact O-N 3.03Å; D530-T533 VanDerWaalsContact O-N 3.09Å; D530-D534 PolarHBondContact O-N 3.4Å
531	S	81.7	Confident	79.8	Confident	11 Å²	11	69.8 Å²	69.8	8%	0.077	38%	0.384	C	S	.	.	H	α-helix	trans	-65.4	-30	177	76.6	0	0	0	0	114	R527 Y528 A529 T533 D534 N535 K536	R527-S531 PolarHBondContact O-N 2.86Å; R527-S531 VanDerWaalsContact O-N 3.1Å; Y528-S531 WeakPolarHBondContact O-CB 3.03Å; Y528-S531 PolarHBondContact O-N 3.49Å; Y528-S531 VanDerWaalsContact O-N 3.08Å; Y528-S531 PolarHBondContact O-OG 2.92Å; A529-S531 VanDerWaalsContact C-N 3.3Å; A529-S531 PolarHBondContact O-N 3.05Å; S531-T533 VanDerWaalsContact C-N 3.3Å; S531-D534 PolarHBondContact O-N 3.17Å; S531-N535 PolarHBondContact O-N 2.81Å; S531-N535 VanDerWaalsContact O-N 3.17Å; S531-K536 PolarHBondContact O-N 3.44Å; S531-K536 VanDerWaalsContact O-N 3.07Å
532	V	75.6	Confident	79.5	Confident	33 Å²	33	78.2 Å²	78.2	20%	0.2	42%	0.423	C	S	.	.	H	α-helix	trans	-66.9	-34.8	173.2	174.9	0	0	0	0	110.7	Y528 A529 D530 R559	Y528-V532 HydrophobicContact CD1-CG2 4.46Å; Y528-V532 HydrophobicContact CE1-CG2 4.15Å; Y528-V532 PolarHBondContact O-N 3.28Å; Y528-V532 VanDerWaalsContact O-N 3.13Å; A529-V532 WeakPolarHBondContact O-CB 3.25Å; A529-V532 PolarHBondContact O-N 2.89Å; D530-V532 VanDerWaalsContact C-N 3.3Å; D530-V532 PolarHBondContact O-N 3.16Å; V532-R559 HydrophobicContact CG1-CB 4.01Å; V532-R559 HydrophobicContact CG1-CG 4Å; V532-R559 HydrophobicContact CG2-CB 3.97Å; V532-R559 HydrophobicContact CG2-CG 3.96Å
533	T	76.7	Confident	79.1	Confident	122 Å²	122	74.7 Å²	74.7	75%	0.748	41%	0.405	S	S	*	.	H	α-helix	trans	-74.7	-37.3	176.8	-53.6	0	0	0	0	111.6	A529 D530 S531 N535	A529-T533 PolarHBondContact O-N 2.8Å; A529-T533 PolarHBondContact O-OG1 3.3Å; D530-T533 WeakPolarHBondContact O-CB 3.35Å; D530-T533 PolarHBondContact O-N 3.03Å; D530-T533 VanDerWaalsContact O-N 3.09Å; S531-T533 VanDerWaalsContact C-N 3.3Å; T533-N535 PolarHBondContact O-N 3.35Å
534	D	74.4	Confident	78.3	Confident	97 Å²	97	75.3 Å²	75.3	52%	0.519	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-2.3	178.2	-87.9	8.2	0	0	0	114.5	D530 S531 K536	D530-D534 PolarHBondContact O-N 3.4Å; S531-D534 PolarHBondContact O-N 3.17Å; D534-K536 HydrophobicContact CB-CD 4.02Å; D534-K536 HydrophobicContact CB-CG 4.13Å; D534-K536 PolarHBondContact O-N 3.22Å; D534-K536 IonicContact OD2-NZ 3.47Å; D534-K536 PolarHBondContact OD2-NZ 2.67Å
535	N	65.9	Low	77.8	Confident	111 Å²	111	72.9 Å²	72.9	59%	0.594	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	36.8	-174.7	-147.2	37.1	0	0	0	113.2	S531 T533	S531-N535 PolarHBondContact O-N 2.81Å; S531-N535 VanDerWaalsContact O-N 3.17Å; T533-N535 PolarHBondContact O-N 3.35Å
536	K	67	Low	77.5	Confident	121 Å²	121	75.4 Å²	75.4	53%	0.526	43%	0.43	S	S	.	.			trans	-100.4	125.2	177.9	-72.9	171.7	-172.7	149.8	0	109.6	S531 D534 V538	S531-K536 PolarHBondContact O-N 3.44Å; S531-K536 VanDerWaalsContact O-N 3.07Å; D534-K536 HydrophobicContact CB-CD 4.02Å; D534-K536 HydrophobicContact CB-CG 4.13Å; D534-K536 PolarHBondContact O-N 3.22Å; D534-K536 IonicContact OD2-NZ 3.47Å; D534-K536 PolarHBondContact OD2-NZ 2.67Å; K536-V538 PolarHBondContact O-N 3.5Å
537	P	59.8	Low	77.3	Confident	125 Å²	125	77.6 Å²	77.6	81%	0.812	44%	0.436	S	S	*	.			trans	-72	96.1	178.8	27.9	-31.8	0	0	0	109.9
538	V	71.9	Confident	77.2	Confident	70 Å²	70	71.1 Å²	71.1	42%	0.424	41%	0.413	S	S	.	.			trans	-106.9	133.2	170.4	-177.7	0	0	0	0	107.5	Y528 K536	Y528-V538 WeakPolarHBondContact CE2-O 3.29Å; K536-V538 PolarHBondContact O-N 3.5Å
539	P	77.7	Confident	77.1	Confident	110 Å²	110	76.4 Å²	76.4	71%	0.714	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-66.3	147.9	175.8	26.8	-33.9	0	0	0	111
540	L	79.1	Confident	77.1	Confident	64 Å²	64	80.4 Å²	80.4	34%	0.335	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-56.7	126.6	177.2	-167.1	70.9	0	0	0	110.4	Y528 E542 A552 E556	Y528-L540 HydrophobicContact CD1-CD1 4.1Å; Y528-L540 HydrophobicContact CD2-CD1 4.5Å; Y528-L540 HydrophobicContact CE1-CD1 3.55Å; Y528-L540 HydrophobicContact CE2-CB 4.44Å; Y528-L540 HydrophobicContact CE2-CD1 3.99Å; Y528-L540 VanDerWaalsContact CZ-CD1 3.49Å; L540-E542 PolarHBondContact O-N 3.08Å; L540-A552 HydrophobicContact CD1-CB 3.83Å; L540-A552 WeakPolarHBondContact CD1-O 3.25Å; L540-A552 HydrophobicContact CD2-CB 4.17Å; L540-A552 HydrophobicContact CG-CB 4.11Å; L540-E556 HydrophobicContact CD1-CB 4.09Å
541	P	79.8	Confident	77.2	Confident	27 Å²	27	80.3 Å²	80.3	18%	0.175	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-68.6	136.7	-178.2	26.3	-33.3	0	0	0	111.2	R524 L543	R524-P541 HydrophobicContact CB-CB 4.45Å; P541-L543 PolarHBondContact O-N 3.4Å; P541-L543 VanDerWaalsContact O-N 3.16Å
542	E	79.2	Confident	77.4	Confident	178 Å²	178	79.8 Å²	79.8	83%	0.832	44%	0.441	S	S	*	.			trans	-69.6	112	169.3	-67.8	-169.9	172.8	0	0	110.3	R524 L540	R524-E542 PolarHBondContact NH1-O 2.66Å; L540-E542 PolarHBondContact O-N 3.08Å
543	L	79.5	Confident	77.9	Confident	4 Å²	4	83.6 Å²	83.6	2%	0.021	46%	0.456	C	S	.	.			trans	-105.4	136.3	178.8	-61.8	166.3	0	0	0	109.7	L525 P541 L548 R549 A552	L525-L543 HydrophobicContact CD1-CD1 4.06Å; P541-L543 PolarHBondContact O-N 3.4Å; P541-L543 VanDerWaalsContact O-N 3.16Å; L543-L548 HydrophobicContact CB-CB 3.93Å; L543-L548 HydrophobicContact CD1-CB 3.89Å; L543-L548 WeakPolarHBondContact CD1-O 3.31Å; L543-L548 HydrophobicContact CG-CB 4.38Å; L543-R549 PolarHBondContact O-NE 3.33Å; L543-R549 PolarHBondContact O-NH2 3.19Å; L543-A552 HydrophobicContact CD1-CB 3.69Å
544	G	72	Confident	78.3	Confident	59 Å²	59	80.6 Å²	80.6	61%	0.608	44%	0.443	S	S	*	.	S	Bend	trans	-74.3	-31.1	-173.7	0	0	0	0	0	114.1	R549	G544-R549 PolarHBondContact O-NH2 3.17Å
545	S	76.4	Confident	78.9	Confident	29 Å²	29	77.8 Å²	77.8	20%	0.203	43%	0.428	C	S	.	.	S	Bend	trans	-90.3	145.5	-178.9	75.8	0	0	0	0	112.3	E547 L548 R549	S545-E547 VanDerWaalsContact C-N 3.29Å; S545-E547 PolarHBondContact O-N 3.18Å; S545-L548 PolarHBondContact O-N 3.19Å; S545-L548 WeakPolarHBondContact OG-CB 3.25Å; S545-L548 VanDerWaalsContact OG-CD1 3.28Å; S545-L548 WeakPolarHBondContact OG-CD1 3.42Å; S545-L548 WeakPolarHBondContact OG-CG 3.48Å; S545-L548 PolarHBondContact OG-N 2.94Å; S545-R549 WeakPolarHBondContact O-CB 3.47Å; S545-R549 PolarHBondContact O-N 2.78Å
546	S	80.5	Confident	79.7	Confident	66 Å²	66	74.8 Å²	74.8	46%	0.462	41%	0.411	S	S	.	.	H	α-helix	trans	-58.9	-41	178	56.1	0	0	0	0	112	R549 K550	S546-R549 PolarHBondContact O-N 3.01Å; S546-K550 WeakPolarHBondContact O-CG 3.33Å; S546-K550 PolarHBondContact O-N 3.4Å
547	E	82.8	Confident	80.5	Confident	114 Å²	114	72 Å²	72	53%	0.533	41%	0.406	S	S	.	.	H	α-helix	trans	-71.8	-40.1	-177	-57.3	-46.6	124.2	0	0	112.2	S545 R549 K550 L551	S545-E547 VanDerWaalsContact C-N 3.29Å; S545-E547 PolarHBondContact O-N 3.18Å; E547-R549 VanDerWaalsContact C-N 3.31Å; E547-R549 PolarHBondContact O-N 3.09Å; E547-K550 PolarHBondContact O-N 3.42Å; E547-K550 IonicContact OE1-NZ 3.65Å; E547-K550 PolarHBondContact OE1-NZ 2.88Å; E547-K550 IonicContact OE2-NZ 2.77Å; E547-K550 PolarHBondContact OE2-NZ 2.7Å; E547-L551 PolarHBondContact O-N 3.44Å
548	L	84.3	Confident	81.4	Confident	28 Å²	28	71.3 Å²	71.3	15%	0.147	39%	0.393	C	S	.	.	H	α-helix	trans	-67.7	-34.7	174	-71.6	172.3	0	0	0	111.4	S521 L543 S545 L551 A552	S521-L548 VanDerWaalsContact CB-CD1 3.48Å; L543-L548 HydrophobicContact CB-CB 3.93Å; L543-L548 HydrophobicContact CD1-CB 3.89Å; L543-L548 WeakPolarHBondContact CD1-O 3.31Å; L543-L548 HydrophobicContact CG-CB 4.38Å; S545-L548 PolarHBondContact O-N 3.19Å; S545-L548 WeakPolarHBondContact OG-CB 3.25Å; S545-L548 VanDerWaalsContact OG-CD1 3.28Å; S545-L548 WeakPolarHBondContact OG-CD1 3.42Å; S545-L548 WeakPolarHBondContact OG-CG 3.48Å; S545-L548 PolarHBondContact OG-N 2.94Å; L548-L551 PolarHBondContact O-N 3.2Å; L548-A552 WeakPolarHBondContact O-CB 3.33Å; L548-A552 PolarHBondContact O-N 2.81Å
549	R	84.4	Confident	81.8	Confident	115 Å²	115	70.5 Å²	70.5	43%	0.434	38%	0.383	S	S	.	.	H	α-helix	trans	-65	-42	174.3	-166.8	179.3	-56.4	124.1	10	112.1	L543 G544 S545 S546 E547 L551 A552 Q553	L543-R549 PolarHBondContact O-NE 3.33Å; L543-R549 PolarHBondContact O-NH2 3.19Å; G544-R549 PolarHBondContact O-NH2 3.17Å; S545-R549 WeakPolarHBondContact O-CB 3.47Å; S545-R549 PolarHBondContact O-N 2.78Å; S546-R549 PolarHBondContact O-N 3.01Å; E547-R549 VanDerWaalsContact C-N 3.31Å; E547-R549 PolarHBondContact O-N 3.09Å; R549-L551 VanDerWaalsContact C-N 3.33Å; R549-L551 PolarHBondContact O-N 3.37Å; R549-A552 PolarHBondContact O-N 3.23Å; R549-Q553 VanDerWaalsContact O-CG 3.32Å; R549-Q553 WeakPolarHBondContact O-CG 3.39Å; R549-Q553 PolarHBondContact O-N 3.07Å
550	K	85.5	Confident	81.5	Confident	114 Å²	114	69 Å²	69	50%	0.496	37%	0.372	S	S	.	.	H	α-helix	trans	-60.7	-42.5	172.8	-72.4	172.2	-172	162.8	0	111.6	S546 E547 Q553 A554	S546-K550 WeakPolarHBondContact O-CG 3.33Å; S546-K550 PolarHBondContact O-N 3.4Å; E547-K550 PolarHBondContact O-N 3.42Å; E547-K550 IonicContact OE1-NZ 3.65Å; E547-K550 PolarHBondContact OE1-NZ 2.88Å; E547-K550 IonicContact OE2-NZ 2.77Å; E547-K550 PolarHBondContact OE2-NZ 2.7Å; K550-Q553 PolarHBondContact O-N 3.45Å; K550-A554 WeakPolarHBondContact O-CB 3.49Å; K550-A554 PolarHBondContact O-N 2.64Å
551	L	86.8	Confident	81.3	Confident	88 Å²	88	73.4 Å²	73.4	46%	0.461	39%	0.388	S	S	.	.	H	α-helix	trans	-65.5	-40.6	177.4	-174	62.3	0	0	0	111.9	L525 E547 L548 R549 A554 L555	L525-L551 HydrophobicContact CD2-CB 4.35Å; L525-L551 HydrophobicContact CD2-CD2 3.33Å; L525-L551 HydrophobicContact CD2-CG 3.68Å; E547-L551 PolarHBondContact O-N 3.44Å; L548-L551 PolarHBondContact O-N 3.2Å; R549-L551 VanDerWaalsContact C-N 3.33Å; R549-L551 PolarHBondContact O-N 3.37Å; L551-A554 PolarHBondContact O-N 3.22Å; L551-L555 PolarHBondContact O-N 2.97Å
552	A	85.3	Confident	80.9	Confident	1 Å²	1	76 Å²	76	1%	0.008	40%	0.4	C	S	.	.	H	α-helix	trans	-60.5	-45.6	172.2	0	0	0	0	0	111.7	L525 L540 L543 L548 R549 A554 L555 E556	L525-A552 HydrophobicContact CD1-CB 3.85Å; L540-A552 HydrophobicContact CD1-CB 3.83Å; L540-A552 WeakPolarHBondContact CD1-O 3.25Å; L540-A552 HydrophobicContact CD2-CB 4.17Å; L540-A552 HydrophobicContact CG-CB 4.11Å; L543-A552 HydrophobicContact CD1-CB 3.69Å; L548-A552 WeakPolarHBondContact O-CB 3.33Å; L548-A552 PolarHBondContact O-N 2.81Å; R549-A552 PolarHBondContact O-N 3.23Å; A552-A554 VanDerWaalsContact C-N 3.32Å; A552-A554 PolarHBondContact O-N 3.1Å; A552-L555 PolarHBondContact O-N 3.47Å; A552-E556 PolarHBondContact O-N 3.29Å
553	Q	86.4	Confident	80.3	Confident	113 Å²	113	71.2 Å²	71.2	53%	0.528	38%	0.378	S	S	.	.	H	α-helix	trans	-61.7	-37.2	174.8	-73.4	172.1	-20	0	0	112.7	R549 K550 E556 S557	R549-Q553 VanDerWaalsContact O-CG 3.32Å; R549-Q553 WeakPolarHBondContact O-CG 3.39Å; R549-Q553 PolarHBondContact O-N 3.07Å; K550-Q553 PolarHBondContact O-N 3.45Å; Q553-E556 PolarHBondContact O-N 3.01Å; Q553-S557 PolarHBondContact O-N 2.91Å
554	A	86.4	Confident	79.7	Confident	58 Å²	58	72.5 Å²	72.5	48%	0.479	39%	0.392	S	S	.	.	H	α-helix	trans	-67.1	-43.2	175.9	0	0	0	0	0	112.1	K550 L551 A552 E556 S557 M558	K550-A554 WeakPolarHBondContact O-CB 3.49Å; K550-A554 PolarHBondContact O-N 2.64Å; L551-A554 PolarHBondContact O-N 3.22Å; A552-A554 VanDerWaalsContact C-N 3.32Å; A552-A554 PolarHBondContact O-N 3.1Å; A554-E556 VanDerWaalsContact C-N 3.3Å; A554-E556 PolarHBondContact O-N 3.08Å; A554-S557 PolarHBondContact O-N 2.77Å; A554-M558 PolarHBondContact O-N 3.35Å
555	L	85.8	Confident	79.5	Confident	39 Å²	39	75.5 Å²	75.5	20%	0.204	39%	0.388	C	S	.	.	H	α-helix	trans	-61.2	-39.8	172.5	-88.5	161.2	0	0	0	111.5	L525 Y528 A529 L551 A552 M558 R559	L525-L555 HydrophobicContact CD1-CD1 3.66Å; L525-L555 HydrophobicContact CD2-CD1 3.95Å; L525-L555 HydrophobicContact CG-CD1 3.68Å; Y528-L555 HydrophobicContact CD1-CB 4.39Å; Y528-L555 HydrophobicContact CE1-CB 4.31Å; A529-L555 HydrophobicContact CB-CD2 4.22Å; L551-L555 PolarHBondContact O-N 2.97Å; A552-L555 PolarHBondContact O-N 3.47Å; L555-M558 WeakPolarHBondContact O-CB 3.2Å; L555-M558 PolarHBondContact O-N 3.18Å; L555-R559 PolarHBondContact O-N 3.33Å
556	E	84.1	Confident	78.8	Confident	48 Å²	48	78 Å²	78	22%	0.224	40%	0.399	C	S	.	.	H	α-helix	trans	-65.5	-43.2	175.7	178	56.7	-179.3	0	0	112.5	Y528 L540 A552 Q553 A554 M558 R559 V560	Y528-E556 PolarHBondContact OH-OE2 3.32Å; L540-E556 HydrophobicContact CD1-CB 4.09Å; A552-E556 PolarHBondContact O-N 3.29Å; Q553-E556 PolarHBondContact O-N 3.01Å; A554-E556 VanDerWaalsContact C-N 3.3Å; A554-E556 PolarHBondContact O-N 3.08Å; E556-M558 PolarHBondContact O-N 2.66Å; E556-R559 PolarHBondContact O-N 3.45Å; E556-R559 IonicContact OE1-CZ 3.4Å; E556-R559 IonicContact OE1-NE 2.82Å; E556-R559 PolarHBondContact OE1-NE 2.6Å; E556-R559 IonicContact OE1-NH2 2.64Å; E556-R559 PolarHBondContact OE1-NH2 2.82Å; E556-R559 IonicContact OE2-CZ 3.39Å; E556-R559 IonicContact OE2-NE 3.19Å; E556-R559 PolarHBondContact OE2-NE 2.72Å; E556-R559 IonicContact OE2-NH2 3.83Å; E556-V560 WeakPolarHBondContact O-CG2 3.27Å; E556-V560 PolarHBondContact O-N 2.95Å
557	S	82.2	Confident	78	Confident	61 Å²	61	78.1 Å²	78.1	43%	0.427	39%	0.39	S	S	.	.	H	α-helix	trans	-58.9	-36.5	173.6	-172.6	0	0	0	0	111.9	Q553 A554 K561	Q553-S557 PolarHBondContact O-N 2.91Å; A554-S557 PolarHBondContact O-N 2.77Å; S557-K561 WeakPolarHBondContact O-CB 3.32Å; S557-K561 WeakPolarHBondContact O-CG 3.45Å; S557-K561 PolarHBondContact O-N 3.2Å; S557-K561 VanDerWaalsContact O-N 3.08Å
558	M	79.7	Confident	77.4	Confident	111 Å²	111	77.6 Å²	77.6	55%	0.547	39%	0.39	S	S	.	.	H	α-helix	trans	-69.4	-43.4	175.3	-168.2	174.2	-170.6	0	0	112.2	A554 L555 E556 V560 K561 L562	A554-M558 PolarHBondContact O-N 3.35Å; L555-M558 WeakPolarHBondContact O-CB 3.2Å; L555-M558 PolarHBondContact O-N 3.18Å; E556-M558 PolarHBondContact O-N 2.66Å; M558-V560 PolarHBondContact O-N 2.83Å; M558-K561 PolarHBondContact O-N 3.13Å; M558-L562 HydrophobicContact CE-CD1 4.48Å; M558-L562 HydrophobicContact CG-CD1 4.09Å; M558-L562 HydrophobicContact CG-CG 4.44Å; M558-L562 WeakPolarHBondContact O-CB 3.47Å; M558-L562 WeakPolarHBondContact O-CG 3.49Å; M558-L562 PolarHBondContact O-N 3.28Å
559	R	78.9	Confident	76.6	Confident	54 Å²	54	81.4 Å²	81.4	20%	0.204	41%	0.407	C	S	.	.	H	α-helix	trans	-54.9	-51.5	173.8	-175.8	-172.7	74.5	87.7	3.9	110.7	V532 L555 E556 K561 L562 E563	V532-R559 HydrophobicContact CG1-CB 4.01Å; V532-R559 HydrophobicContact CG1-CG 4Å; V532-R559 HydrophobicContact CG2-CB 3.97Å; V532-R559 HydrophobicContact CG2-CG 3.96Å; L555-R559 PolarHBondContact O-N 3.33Å; E556-R559 PolarHBondContact O-N 3.45Å; E556-R559 IonicContact OE1-CZ 3.4Å; E556-R559 IonicContact OE1-NE 2.82Å; E556-R559 PolarHBondContact OE1-NE 2.6Å; E556-R559 IonicContact OE1-NH2 2.64Å; E556-R559 PolarHBondContact OE1-NH2 2.82Å; E556-R559 IonicContact OE2-CZ 3.39Å; E556-R559 IonicContact OE2-NE 3.19Å; E556-R559 PolarHBondContact OE2-NE 2.72Å; E556-R559 IonicContact OE2-NH2 3.83Å; R559-K561 VanDerWaalsContact C-N 3.32Å; R559-K561 PolarHBondContact O-N 3.29Å; R559-L562 PolarHBondContact O-N 3.01Å; R559-L562 VanDerWaalsContact O-N 3.14Å; R559-E563 IonicContact CZ-OE1 3Å; R559-E563 IonicContact CZ-OE2 2.64Å; R559-E563 IonicContact NH1-OE1 2.64Å; R559-E563 PolarHBondContact NH1-OE1 3.47Å; R559-E563 IonicContact NH1-OE2 2.71Å; R559-E563 PolarHBondContact NH1-OE2 2.77Å; R559-E563 PolarHBondContact O-N 3.06Å
560	V	72.7	Confident	75.8	Confident	79 Å²	79	82.8 Å²	82.8	48%	0.479	42%	0.418	S	S	.	.	H	α-helix	trans	-59.8	-41	179.6	173.5	0	0	0	0	111.6	E556 M558 G564	E556-V560 WeakPolarHBondContact O-CG2 3.27Å; E556-V560 PolarHBondContact O-N 2.95Å; M558-V560 PolarHBondContact O-N 2.83Å; V560-G564 PolarHBondContact O-N 3.49Å
561	K	73.8	Confident	75	Confident	155 Å²	155	78.9 Å²	78.9	67%	0.674	40%	0.4	S	S	*	.	H	α-helix	trans	-67.3	-37.6	176	-76.1	178.4	-179.6	-178.3	0	113.1	S557 M558 R559 G564 K565	S557-K561 WeakPolarHBondContact O-CB 3.32Å; S557-K561 WeakPolarHBondContact O-CG 3.45Å; S557-K561 PolarHBondContact O-N 3.2Å; S557-K561 VanDerWaalsContact O-N 3.08Å; M558-K561 PolarHBondContact O-N 3.13Å; R559-K561 VanDerWaalsContact C-N 3.32Å; R559-K561 PolarHBondContact O-N 3.29Å; K561-G564 PolarHBondContact O-N 2.84Å; K561-K565 PolarHBondContact O-N 2.84Å
562	L	71.5	Confident	74.4	Confident	81 Å²	81	78.3 Å²	78.3	42%	0.424	40%	0.4	S	S	.	.	H	α-helix	trans	-71.1	-42.9	177.8	-73.9	171.8	0	0	0	111.8	M558 R559 G564 K565 N566	M558-L562 HydrophobicContact CE-CD1 4.48Å; M558-L562 HydrophobicContact CG-CD1 4.09Å; M558-L562 HydrophobicContact CG-CG 4.44Å; M558-L562 WeakPolarHBondContact O-CB 3.47Å; M558-L562 WeakPolarHBondContact O-CG 3.49Å; M558-L562 PolarHBondContact O-N 3.28Å; R559-L562 PolarHBondContact O-N 3.01Å; R559-L562 VanDerWaalsContact O-N 3.14Å; L562-G564 VanDerWaalsContact C-N 3.27Å; L562-G564 PolarHBondContact O-N 2.96Å; L562-K565 WeakPolarHBondContact O-CB 3.47Å; L562-K565 PolarHBondContact O-N 3.41Å; L562-N566 PolarHBondContact O-N 2.93Å; L562-N566 VanDerWaalsContact O-N 3.11Å
563	E	67.2	Low	73.9	Confident	79 Å²	79	86.6 Å²	86.6	37%	0.369	43%	0.433	S	S	.	.	H	α-helix	trans	-58.6	-41.3	172.1	-77.7	179.3	178.4	0	0	111	R559 K565 N566 Y567	R559-E563 IonicContact CZ-OE1 3Å; R559-E563 IonicContact CZ-OE2 2.64Å; R559-E563 IonicContact NH1-OE1 2.64Å; R559-E563 PolarHBondContact NH1-OE1 3.47Å; R559-E563 IonicContact NH1-OE2 2.71Å; R559-E563 PolarHBondContact NH1-OE2 2.77Å; R559-E563 PolarHBondContact O-N 3.06Å; E563-K565 VanDerWaalsContact C-N 3.28Å; E563-K565 PolarHBondContact O-N 3.1Å; E563-N566 PolarHBondContact O-N 2.85Å; E563-Y567 VanDerWaalsContact O-CB 3.27Å; E563-Y567 WeakPolarHBondContact O-CB 3.34Å; E563-Y567 PolarHBondContact O-N 3.21Å
564	G	67	Low	73.1	Confident	31 Å²	31	82.2 Å²	82.2	32%	0.32	42%	0.416	S	S	.	.	H	α-helix	trans	-58.4	-35.8	172.6	0	0	0	0	0	113.7	V560 K561 L562 I568	V560-G564 PolarHBondContact O-N 3.49Å; K561-G564 PolarHBondContact O-N 2.84Å; L562-G564 VanDerWaalsContact C-N 3.27Å; L562-G564 PolarHBondContact O-N 2.96Å; G564-I568 WeakPolarHBondContact O-CD1 3.25Å; G564-I568 VanDerWaalsContact O-CG1 3.26Å; G564-I568 WeakPolarHBondContact O-CG1 3.49Å; G564-I568 PolarHBondContact O-N 3.13Å; G564-I568 VanDerWaalsContact O-N 3.16Å
565	K	66.9	Low	72.6	Confident	122 Å²	122	81.7 Å²	81.7	53%	0.53	41%	0.405	S	S	.	.	H	α-helix	trans	-70.4	-49.4	177.2	-173.9	-173.1	170.4	-164.9	0	112	K561 L562 E563 Y567 I568 E569	K561-K565 PolarHBondContact O-N 2.84Å; L562-K565 WeakPolarHBondContact O-CB 3.47Å; L562-K565 PolarHBondContact O-N 3.41Å; E563-K565 VanDerWaalsContact C-N 3.28Å; E563-K565 PolarHBondContact O-N 3.1Å; K565-Y567 PolarHBondContact O-N 2.75Å; K565-I568 PolarHBondContact O-N 3.41Å; K565-I568 VanDerWaalsContact O-N 3.14Å; K565-E569 WeakPolarHBondContact CE-OE1 3.48Å; K565-E569 IonicContact NZ-OE1 2.63Å; K565-E569 PolarHBondContact O-N 3.14Å
566	N	62.8	Low	72.2	Confident	82 Å²	82	83.9 Å²	83.9	44%	0.439	42%	0.42	S	S	.	.	H	α-helix	trans	-60.2	-36.9	178.2	-77	-9.7	0	0	0	111.2	L562 E563 E569 Q570	L562-N566 PolarHBondContact O-N 2.93Å; L562-N566 VanDerWaalsContact O-N 3.11Å; E563-N566 PolarHBondContact O-N 2.85Å; N566-E569 PolarHBondContact O-N 2.85Å; N566-Q570 PolarHBondContact O-N 2.85Å; N566-Q570 VanDerWaalsContact O-N 3.11Å
567	Y	64.2	Low	71.8	Confident	67 Å²	67	87.3 Å²	87.3	26%	0.263	44%	0.436	S	S	.	.	H	α-helix	trans	-58.9	-48.8	173.9	176.9	-104.9	0	0	0	112.4	E563 K565 E569 Q570 Y571 E630 R734	E563-Y567 VanDerWaalsContact O-CB 3.27Å; E563-Y567 WeakPolarHBondContact O-CB 3.34Å; E563-Y567 PolarHBondContact O-N 3.21Å; K565-Y567 PolarHBondContact O-N 2.75Å; Y567-E569 PolarHBondContact O-N 3.12Å; Y567-Q570 PolarHBondContact O-N 3.42Å; Y567-Y571 WeakPolarHBondContact O-CB 3Å; Y567-Y571 PolarHBondContact O-N 2.89Å; Y567-E630 VanDerWaalsContact CE1-OE2 3.26Å; Y567-E630 WeakPolarHBondContact CE1-OE2 3.43Å; Y567-E630 PolarHBondContact OH-OE1 2.65Å; Y567-E630 PolarHBondContact OH-OE2 3.19Å; Y567-R734 PolarHBondContact OH-NE 3.39Å
568	I	69.2	Low	71.5	Confident	103 Å²	103	86.8 Å²	86.8	53%	0.528	43%	0.427	S	S	.	.	H	α-helix	trans	-62.7	-41.9	178.1	-67.9	163.7	0	0	0	111.1	G564 K565 Q570 Y571 V572	G564-I568 WeakPolarHBondContact O-CD1 3.25Å; G564-I568 VanDerWaalsContact O-CG1 3.26Å; G564-I568 WeakPolarHBondContact O-CG1 3.49Å; G564-I568 PolarHBondContact O-N 3.13Å; G564-I568 VanDerWaalsContact O-N 3.16Å; K565-I568 PolarHBondContact O-N 3.41Å; K565-I568 VanDerWaalsContact O-N 3.14Å; I568-Q570 PolarHBondContact O-N 3.39Å; I568-Y571 WeakPolarHBondContact O-CB 3.36Å; I568-Y571 PolarHBondContact O-N 3.09Å; I568-V572 HydrophobicContact CG2-CG2 4.23Å; I568-V572 VanDerWaalsContact O-CG2 3.3Å; I568-V572 WeakPolarHBondContact O-CG2 3.35Å; I568-V572 PolarHBondContact O-N 3.28Å
569	E	68.1	Low	71.6	Confident	108 Å²	108	83.5 Å²	83.5	51%	0.505	41%	0.411	S	S	.	.	H	α-helix	trans	-61	-45.9	178.7	-74.8	-177.2	-174.9	0	0	112.1	K565 N566 Y567 Y571 V572 Y573	K565-E569 WeakPolarHBondContact CE-OE1 3.48Å; K565-E569 IonicContact NZ-OE1 2.63Å; K565-E569 PolarHBondContact O-N 3.14Å; N566-E569 PolarHBondContact O-N 2.85Å; Y567-E569 PolarHBondContact O-N 3.12Å; E569-Y571 VanDerWaalsContact C-N 3.33Å; E569-Y571 PolarHBondContact O-N 3.35Å; E569-V572 PolarHBondContact O-N 3.07Å; E569-Y573 WeakPolarHBondContact O-CB 3.17Å; E569-Y573 PolarHBondContact O-N 3.23Å
570	Q	66.4	Low	71.6	Confident	144 Å²	144	88.3 Å²	88.3	67%	0.673	43%	0.433	S	S	*	.	H	α-helix	trans	-63.2	-39.7	175.6	-72.4	-178.8	-0.7	0	0	112	N566 Y567 I568 Y573 A574	N566-Q570 PolarHBondContact O-N 2.85Å; N566-Q570 VanDerWaalsContact O-N 3.11Å; Y567-Q570 PolarHBondContact O-N 3.42Å; I568-Q570 PolarHBondContact O-N 3.39Å; Q570-Y573 PolarHBondContact O-N 3.12Å; Q570-A574 WeakPolarHBondContact O-CB 3.22Å; Q570-A574 PolarHBondContact O-N 3.31Å
571	Y	69	Low	71.7	Confident	32 Å²	32	87.8 Å²	87.8	13%	0.125	43%	0.433	C	S	.	.	H	α-helix	trans	-62.1	-46.5	177.8	-157.6	-101.5	0	0	0	112.2	Y567 I568 E569 A574 L575 L623 F735	Y567-Y571 WeakPolarHBondContact O-CB 3Å; Y567-Y571 PolarHBondContact O-N 2.89Å; I568-Y571 WeakPolarHBondContact O-CB 3.36Å; I568-Y571 PolarHBondContact O-N 3.09Å; E569-Y571 VanDerWaalsContact C-N 3.33Å; E569-Y571 PolarHBondContact O-N 3.35Å; Y571-A574 PolarHBondContact O-N 3.27Å; Y571-L575 VanDerWaalsContact O-CB 3.28Å; Y571-L575 WeakPolarHBondContact O-CB 3.42Å; Y571-L575 PolarHBondContact O-N 3.33Å; Y571-L623 HydrophobicContact CE1-CB 4.13Å; Y571-L623 HydrophobicContact CE1-CD2 3.91Å; Y571-L623 HydrophobicContact CE1-CG 4.47Å; Y571-L623 HydrophobicContact CE2-CD2 3.8Å; Y571-L623 VanDerWaalsContact OH-C 3.3Å; Y571-L623 WeakPolarHBondContact OH-CA 3.49Å; Y571-L623 VanDerWaalsContact OH-CB 3.3Å; Y571-L623 WeakPolarHBondContact OH-CB 3.37Å; Y571-L623 WeakPolarHBondContact OH-CD2 3.4Å; Y571-L623 PolarHBondContact OH-O 2.95Å; Y571-F735 HydrophobicContact CD2-CE2 4.33Å
572	V	74.8	Confident	72	Confident	76 Å²	76	80.4 Å²	80.4	46%	0.461	40%	0.401	S	S	.	.	H	α-helix	trans	-64.7	-41.4	177.4	171.6	0	0	0	0	110.9	I568 E569 T576	I568-V572 HydrophobicContact CG2-CG2 4.23Å; I568-V572 VanDerWaalsContact O-CG2 3.3Å; I568-V572 WeakPolarHBondContact O-CG2 3.35Å; I568-V572 PolarHBondContact O-N 3.28Å; E569-V572 PolarHBondContact O-N 3.07Å; V572-T576 WeakPolarHBondContact O-CB 3.47Å; V572-T576 PolarHBondContact O-N 3.35Å; V572-T576 PolarHBondContact O-OG1 3.02Å
573	Y	74.6	Confident	72.6	Confident	176 Å²	176	81 Å²	81	69%	0.69	41%	0.405	S	S	*	.	H	α-helix	trans	-62.3	-48.7	178.4	-173.7	-93.9	0	0	0	111.6	E569 Q570 T576 H577	E569-Y573 WeakPolarHBondContact O-CB 3.17Å; E569-Y573 PolarHBondContact O-N 3.23Å; Q570-Y573 PolarHBondContact O-N 3.12Å; Y573-T576 PolarHBondContact O-N 3.35Å; Y573-H577 PolarHBondContact O-N 2.92Å
574	A	69.4	Low	73.2	Confident	21 Å²	21	79.7 Å²	79.7	17%	0.174	41%	0.407	C	S	.	.	H	α-helix	trans	-65.5	-42.1	179.6	0	0	0	0	0	111.9	Q570 Y571 T576 H577 E578 F735	Q570-A574 WeakPolarHBondContact O-CB 3.22Å; Q570-A574 PolarHBondContact O-N 3.31Å; Y571-A574 PolarHBondContact O-N 3.27Å; A574-T576 VanDerWaalsContact C-N 3.31Å; A574-T576 PolarHBondContact O-N 2.83Å; A574-H577 WeakPolarHBondContact O-CB 3.35Å; A574-H577 PolarHBondContact O-N 2.86Å; A574-E578 PolarHBondContact O-N 2.9Å; A574-F735 HydrophobicContact CB-CD1 4.4Å; A574-F735 HydrophobicContact CB-CD2 3.5Å; A574-F735 VanDerWaalsContact CB-CD2 3.5Å; A574-F735 HydrophobicContact CB-CE1 4.34Å; A574-F735 HydrophobicContact CB-CE2 3.46Å; A574-F735 VanDerWaalsContact CB-CE2 3.46Å; A574-F735 HydrophobicContact CB-CG 3.98Å; A574-F735 HydrophobicContact CB-CZ 3.87Å
575	L	76.3	Confident	73.6	Confident	47 Å²	47	79.7 Å²	79.7	25%	0.246	40%	0.404	C	S	.	.	H	α-helix	trans	-56.5	-45.9	173.3	171.4	68.1	0	0	0	111.2	Y571 H577 E578 L579 L623	Y571-L575 VanDerWaalsContact O-CB 3.28Å; Y571-L575 WeakPolarHBondContact O-CB 3.42Å; Y571-L575 PolarHBondContact O-N 3.33Å; L575-H577 VanDerWaalsContact C-N 3.29Å; L575-H577 PolarHBondContact O-N 3.14Å; L575-E578 PolarHBondContact O-N 3.36Å; L575-L579 HydrophobicContact CD1-CD1 3.7Å; L575-L579 HydrophobicContact CD1-CD2 4.38Å; L575-L579 HydrophobicContact CD1-CG 3.8Å; L575-L579 HydrophobicContact CG-CD1 3.92Å; L575-L579 HydrophobicContact CG-CG 4.3Å; L575-L579 WeakPolarHBondContact O-CB 3.44Å; L575-L579 VanDerWaalsContact O-CG 3.3Å; L575-L579 WeakPolarHBondContact O-CG 3.36Å; L575-L579 PolarHBondContact O-N 3.42Å; L575-L623 HydrophobicContact CB-CD1 4.36Å; L575-L623 HydrophobicContact CD1-CD1 3.29Å; L575-L623 HydrophobicContact CG-CD1 4.3Å
576	T	77.4	Confident	74.4	Confident	85 Å²	85	75.7 Å²	75.7	52%	0.521	39%	0.388	S	S	.	.	H	α-helix	trans	-61.8	-41.4	179.7	-56.1	0	0	0	0	110.9	V572 Y573 A574 K580	V572-T576 WeakPolarHBondContact O-CB 3.47Å; V572-T576 PolarHBondContact O-N 3.35Å; V572-T576 PolarHBondContact O-OG1 3.02Å; Y573-T576 PolarHBondContact O-N 3.35Å; A574-T576 VanDerWaalsContact C-N 3.31Å; A574-T576 PolarHBondContact O-N 2.83Å; T576-K580 WeakPolarHBondContact O-CB 3.36Å; T576-K580 PolarHBondContact O-N 2.85Å; T576-K580 VanDerWaalsContact O-N 3.12Å
577	H	75.9	Confident	75.2	Confident	119 Å²	119	79.1 Å²	79.1	55%	0.551	40%	0.395	S	S	*	.	H	α-helix	trans	-64.3	-46.9	177.2	-170.2	-87.7	0	0	0	112	Y573 A574 L575 L579 K580	Y573-H577 PolarHBondContact O-N 2.92Å; A574-H577 WeakPolarHBondContact O-CB 3.35Å; A574-H577 PolarHBondContact O-N 2.86Å; L575-H577 VanDerWaalsContact C-N 3.29Å; L575-H577 PolarHBondContact O-N 3.14Å; H577-L579 PolarHBondContact O-N 3.25Å; H577-K580 PolarHBondContact O-N 2.88Å
578	E	76.3	Confident	75.7	Confident	51 Å²	51	77 Å²	77	24%	0.238	39%	0.394	C	S	.	.	H	α-helix	trans	-69.8	-30.1	-179.5	-71	-55.6	117.4	0	0	113.2	A574 L575 P582 L619 F735	A574-E578 PolarHBondContact O-N 2.9Å; L575-E578 PolarHBondContact O-N 3.36Å; E578-P582 WeakPolarHBondContact O-CD 3.44Å; E578-P582 WeakPolarHBondContact O-CG 3.47Å; E578-L619 HydrophobicContact CB-CD1 4.43Å; E578-F735 HydrophobicContact CG-CD1 4.22Å
579	L	82.1	Confident	76.3	Confident	41 Å²	41	72.2 Å²	72.2	22%	0.215	37%	0.369	C	S	.	.	H	α-helix	trans	-76.3	-28.2	174	-70.8	-179.4	0	0	0	113	L575 H577 S581 P582 L583 M616	L575-L579 HydrophobicContact CD1-CD1 3.7Å; L575-L579 HydrophobicContact CD1-CD2 4.38Å; L575-L579 HydrophobicContact CD1-CG 3.8Å; L575-L579 HydrophobicContact CG-CD1 3.92Å; L575-L579 HydrophobicContact CG-CG 4.3Å; L575-L579 WeakPolarHBondContact O-CB 3.44Å; L575-L579 VanDerWaalsContact O-CG 3.3Å; L575-L579 WeakPolarHBondContact O-CG 3.36Å; L575-L579 PolarHBondContact O-N 3.42Å; H577-L579 PolarHBondContact O-N 3.25Å; L579-S581 VanDerWaalsContact C-N 3.35Å; L579-S581 PolarHBondContact O-N 2.92Å; L579-P582 VanDerWaalsContact O-CD 3.28Å; L579-P582 WeakPolarHBondContact O-CD 3.43Å; L579-P582 WeakPolarHBondContact O-CG 3.42Å; L579-L583 WeakPolarHBondContact O-CB 3.46Å; L579-L583 WeakPolarHBondContact O-CD1 3.38Å; L579-L583 VanDerWaalsContact O-CG 3.28Å; L579-L583 WeakPolarHBondContact O-CG 3.3Å; L579-L583 PolarHBondContact O-N 3.02Å; L579-M616 HydrophobicContact CD2-CE 4.01Å; L579-M616 HydrophobicContact CD2-CG 4.23Å
580	K	77.8	Confident	77	Confident	155 Å²	155	69.4 Å²	69.4	67%	0.674	36%	0.364	S	S	*	.	H	α-helix	trans	-63.4	-39.1	-178.4	-174	179.3	179.3	-178.8	0	112.5	T576 H577 A584	T576-K580 WeakPolarHBondContact O-CB 3.36Å; T576-K580 PolarHBondContact O-N 2.85Å; T576-K580 VanDerWaalsContact O-N 3.12Å; H577-K580 PolarHBondContact O-N 2.88Å; K580-A584 WeakPolarHBondContact O-CB 3.46Å; K580-A584 PolarHBondContact O-N 3.2Å
581	S	75.2	Confident	77.8	Confident	69 Å²	69	66.5 Å²	66.5	48%	0.483	35%	0.351	S	S	.	.	H	α-helix	trans	-63.5	-54.7	-178.8	-175.8	0	0	0	0	113.7	L579 L583 A584 A585	L579-S581 VanDerWaalsContact C-N 3.35Å; L579-S581 PolarHBondContact O-N 2.92Å; S581-L583 VanDerWaalsContact C-N 3.33Å; S581-L583 PolarHBondContact O-N 3.5Å; S581-A584 PolarHBondContact O-N 3.01Å; S581-A585 PolarHBondContact O-N 2.93Å
582	P	79.7	Confident	78.1	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-64.9	-36.3	177.7	25.5	-33.8	0	0	0	111.8	E578 L579 A584 A585 I586 Q612 M616	E578-P582 WeakPolarHBondContact O-CD 3.44Å; E578-P582 WeakPolarHBondContact O-CG 3.47Å; L579-P582 VanDerWaalsContact O-CD 3.28Å; L579-P582 WeakPolarHBondContact O-CD 3.43Å; L579-P582 WeakPolarHBondContact O-CG 3.42Å; P582-A584 PolarHBondContact O-N 3.4Å; P582-A585 PolarHBondContact O-N 3.39Å; P582-I586 WeakPolarHBondContact O-CB 3.45Å; P582-I586 VanDerWaalsContact O-CG1 3.26Å; P582-I586 WeakPolarHBondContact O-CG1 3.44Å; P582-I586 PolarHBondContact O-N 3.03Å; P582-Q612 HydrophobicContact CB-CB 3.99Å; P582-Q612 HydrophobicContact CB-CG 4.42Å; P582-M616 HydrophobicContact CB-CG 3.63Å; P582-M616 HydrophobicContact CB-SD 3.82Å; P582-M616 HydrophobicContact CG-CG 3.4Å; P582-M616 VanDerWaalsContact CG-CG 3.4Å; P582-M616 HydrophobicContact CG-SD 3.84Å
583	L	84.9	Confident	78.5	Confident	94 Å²	94	66.4 Å²	66.4	49%	0.492	35%	0.349	S	S	.	.	H	α-helix	trans	-61.5	-41.9	173.9	-75.8	172.9	0	0	0	112.4	L579 S581 R587 M616	L579-L583 WeakPolarHBondContact O-CB 3.46Å; L579-L583 WeakPolarHBondContact O-CD1 3.38Å; L579-L583 VanDerWaalsContact O-CG 3.28Å; L579-L583 WeakPolarHBondContact O-CG 3.3Å; L579-L583 PolarHBondContact O-N 3.02Å; S581-L583 VanDerWaalsContact C-N 3.33Å; S581-L583 PolarHBondContact O-N 3.5Å; L583-R587 WeakPolarHBondContact O-CB 3.04Å; L583-R587 PolarHBondContact O-N 2.8Å; L583-M616 HydrophobicContact CD2-CE 3.92Å; L583-M616 HydrophobicContact CD2-SD 4.28Å; L583-M616 HydrophobicContact CG-CE 4.02Å; L583-M616 HydrophobicContact CG-SD 4.31Å
584	A	78.6	Confident	79	Confident	50 Å²	50	67.8 Å²	67.8	41%	0.413	35%	0.353	S	S	.	.	H	α-helix	trans	-65.3	-40	175.5	0	0	0	0	0	112	K580 S581 P582 R587 G588	K580-A584 WeakPolarHBondContact O-CB 3.46Å; K580-A584 PolarHBondContact O-N 3.2Å; S581-A584 PolarHBondContact O-N 3.01Å; P582-A584 PolarHBondContact O-N 3.4Å; A584-R587 PolarHBondContact O-N 2.64Å; A584-G588 PolarHBondContact O-N 3.28Å
585	A	76.7	Confident	79.8	Confident	31 Å²	31	74.4 Å²	74.4	26%	0.256	38%	0.38	S	S	.	.	H	α-helix	trans	-67.2	-42.2	176.8	0	0	0	0	0	112.6	S581 P582 G588 A589 Q612	S581-A585 PolarHBondContact O-N 2.93Å; P582-A585 PolarHBondContact O-N 3.39Å; A585-G588 PolarHBondContact O-N 3.45Å; A585-A589 WeakPolarHBondContact O-CB 3.39Å; A585-A589 PolarHBondContact O-N 3.34Å; A585-Q612 HydrophobicContact CB-CG 3.84Å
586	I	82.7	Confident	80.2	Confident	39 Å²	39	75.2 Å²	75.2	20%	0.2	40%	0.4	C	S	.	.	H	α-helix	trans	-62.3	-45.2	173.9	-69.4	166.1	0	0	0	110.2	P582 A589 A590 I609 Q612 M616	P582-I586 WeakPolarHBondContact O-CB 3.45Å; P582-I586 VanDerWaalsContact O-CG1 3.26Å; P582-I586 WeakPolarHBondContact O-CG1 3.44Å; P582-I586 PolarHBondContact O-N 3.03Å; I586-A589 PolarHBondContact O-N 3.34Å; I586-A590 WeakPolarHBondContact O-CB 2.9Å; I586-A590 PolarHBondContact O-N 3.02Å; I586-I609 HydrophobicContact CG2-CG1 4.39Å; I586-I609 HydrophobicContact CG2-CG2 4.33Å; I586-Q612 HydrophobicContact CD1-CB 3.83Å; I586-Q612 HydrophobicContact CG1-CB 3.61Å; I586-Q612 HydrophobicContact CG1-CG 4.24Å; I586-M616 HydrophobicContact CD1-SD 4.01Å
587	R	79.1	Confident	80.5	Confident	153 Å²	153	72.5 Å²	72.5	58%	0.577	38%	0.384	S	S	*	.	H	α-helix	trans	-61.3	-47.4	177.5	-176	174.8	66.3	96.3	-5.1	111.8	L583 A584 A589 A590 E591	L583-R587 WeakPolarHBondContact O-CB 3.04Å; L583-R587 PolarHBondContact O-N 2.8Å; A584-R587 PolarHBondContact O-N 2.64Å; R587-A589 VanDerWaalsContact C-N 3.34Å; R587-A589 PolarHBondContact O-N 2.91Å; R587-A590 PolarHBondContact O-N 2.82Å; R587-E591 WeakPolarHBondContact CG-OE1 3.3Å; R587-E591 IonicContact CZ-OE1 2.82Å; R587-E591 IonicContact NH1-OE1 3.21Å; R587-E591 PolarHBondContact NH1-OE1 2.88Å; R587-E591 WeakPolarHBondContact O-CG 3.45Å; R587-E591 PolarHBondContact O-N 3.11Å
588	G	75.7	Confident	80.9	Confident	24 Å²	24	70.8 Å²	70.8	25%	0.247	38%	0.383	C	S	.	.	H	α-helix	trans	-62.6	-40	177.5	0	0	0	0	0	112.7	A584 A585 E591 I592	A584-G588 PolarHBondContact O-N 3.28Å; A585-G588 PolarHBondContact O-N 3.45Å; G588-E591 PolarHBondContact O-N 3.34Å; G588-I592 WeakPolarHBondContact O-CG1 3.39Å; G588-I592 PolarHBondContact O-N 2.93Å
589	A	81.3	Confident	81.4	Confident	2 Å²	2	73.7 Å²	73.7	2%	0.017	41%	0.407	C	S	.	.	H	α-helix	trans	-63.7	-42.9	173.8	0	0	0	0	0	112	A585 I586 R587 I592 L593 F605 I609	A585-A589 WeakPolarHBondContact O-CB 3.39Å; A585-A589 PolarHBondContact O-N 3.34Å; I586-A589 PolarHBondContact O-N 3.34Å; R587-A589 VanDerWaalsContact C-N 3.34Å; R587-A589 PolarHBondContact O-N 2.91Å; A589-I592 PolarHBondContact O-N 2.84Å; A589-L593 VanDerWaalsContact O-CG 3.29Å; A589-L593 WeakPolarHBondContact O-CG 3.48Å; A589-L593 PolarHBondContact O-N 3.43Å; A589-F605 HydrophobicContact CB-CB 4.16Å; A589-F605 HydrophobicContact CB-CD1 3.72Å; A589-F605 HydrophobicContact CB-CG 4.37Å; A589-I609 HydrophobicContact CB-CD1 3.88Å; A589-I609 HydrophobicContact CB-CG1 3.58Å
590	A	82.9	Confident	81.4	Confident	48 Å²	48	79.8 Å²	79.8	40%	0.397	43%	0.434	S	S	.	.	H	α-helix	trans	-66.3	-37.3	177.3	0	0	0	0	0	112.9	I586 R587 I592 L593 R594	I586-A590 WeakPolarHBondContact O-CB 2.9Å; I586-A590 PolarHBondContact O-N 3.02Å; R587-A590 PolarHBondContact O-N 2.82Å; A590-I592 VanDerWaalsContact C-N 3.34Å; A590-L593 PolarHBondContact O-N 3.17Å; A590-R594 PolarHBondContact O-N 3.35Å; A590-R594 VanDerWaalsContact O-N 3.12Å
591	E	83	Confident	81.4	Confident	83 Å²	83	74.1 Å²	74.1	39%	0.388	41%	0.413	S	S	.	.	H	α-helix	trans	-60	-43.7	174.1	-77.2	169.8	-172.7	0	0	111.2	R587 G588 R594	R587-E591 WeakPolarHBondContact CG-OE1 3.3Å; R587-E591 IonicContact CZ-OE1 2.82Å; R587-E591 IonicContact NH1-OE1 3.21Å; R587-E591 PolarHBondContact NH1-OE1 2.88Å; R587-E591 WeakPolarHBondContact O-CG 3.45Å; R587-E591 PolarHBondContact O-N 3.11Å; G588-E591 PolarHBondContact O-N 3.34Å; E591-R594 WeakPolarHBondContact O-CB 3.48Å; E591-R594 PolarHBondContact O-N 2.77Å
592	I	76.5	Confident	81.7	Confident	59 Å²	59	73.4 Å²	73.4	30%	0.303	41%	0.405	S	S	.	.	H	α-helix	trans	-70.5	-41.5	178.3	-64.9	166.8	0	0	0	111.6	G588 A589 A590 R594 E595 P597 V601 F605	G588-I592 WeakPolarHBondContact O-CG1 3.39Å; G588-I592 PolarHBondContact O-N 2.93Å; A589-I592 PolarHBondContact O-N 2.84Å; A590-I592 VanDerWaalsContact C-N 3.34Å; I592-R594 PolarHBondContact O-N 2.96Å; I592-E595 PolarHBondContact O-N 3.4Å; I592-E595 VanDerWaalsContact O-N 3.1Å; I592-P597 HydrophobicContact CG2-CG 4.3Å; I592-P597 WeakPolarHBondContact O-CD 3.49Å; I592-V601 HydrophobicContact CG2-CG1 4.39Å; I592-F605 HydrophobicContact CB-CD2 4.36Å; I592-F605 HydrophobicContact CB-CE2 4.25Å; I592-F605 HydrophobicContact CB-CZ 4.39Å; I592-F605 HydrophobicContact CD1-CD1 4.3Å; I592-F605 HydrophobicContact CD1-CE1 3.48Å; I592-F605 VanDerWaalsContact CD1-CE1 3.48Å; I592-F605 HydrophobicContact CD1-CE2 3.93Å; I592-F605 HydrophobicContact CD1-CZ 3.27Å; I592-F605 HydrophobicContact CG1-CZ 4.39Å; I592-F605 HydrophobicContact CG2-CD2 3.74Å; I592-F605 HydrophobicContact CG2-CE2 3.52Å; I592-F605 HydrophobicContact CG2-CG 4.45Å; I592-F605 HydrophobicContact CG2-CZ 4.07Å
593	L	81.4	Confident	81.9	Confident	47 Å²	47	76.3 Å²	76.3	25%	0.246	43%	0.429	C	S	.	.	H	α-helix	trans	-59.7	-31.9	176.6	-73.9	172.8	0	0	0	112.3	A589 A590 E595 G596 V602 F605 I609	A589-L593 VanDerWaalsContact O-CG 3.29Å; A589-L593 WeakPolarHBondContact O-CG 3.48Å; A589-L593 PolarHBondContact O-N 3.43Å; A590-L593 PolarHBondContact O-N 3.17Å; L593-E595 VanDerWaalsContact C-N 3.26Å; L593-E595 PolarHBondContact O-N 3.4Å; L593-G596 PolarHBondContact O-N 3.47Å; L593-V602 HydrophobicContact CD2-CB 4.08Å; L593-V602 HydrophobicContact CD2-CG1 3.89Å; L593-V602 HydrophobicContact CD2-CG2 4.12Å; L593-F605 HydrophobicContact CD1-CB 4.35Å; L593-F605 HydrophobicContact CD2-CB 4.03Å; L593-F605 HydrophobicContact CG-CB 4Å; L593-I609 HydrophobicContact CD1-CD1 3.59Å
594	R	87	Confident	81.5	Confident	206 Å²	206	79.5 Å²	79.5	78%	0.777	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-23	177.9	-168.2	179.1	65.7	-176.4	-1.4	113.4	A590 E591 I592 G596	A590-R594 PolarHBondContact O-N 3.35Å; A590-R594 VanDerWaalsContact O-N 3.12Å; E591-R594 WeakPolarHBondContact O-CB 3.48Å; E591-R594 PolarHBondContact O-N 2.77Å; I592-R594 PolarHBondContact O-N 2.96Å; R594-G596 PolarHBondContact O-N 3.44Å
595	E	85	Confident	81.7	Confident	159 Å²	159	78.6 Å²	78.6	74%	0.743	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-3.7	179.9	-63.4	-177.8	174.8	0	0	113.5	I592 L593	I592-E595 PolarHBondContact O-N 3.4Å; I592-E595 VanDerWaalsContact O-N 3.1Å; L593-E595 VanDerWaalsContact C-N 3.26Å; L593-E595 PolarHBondContact O-N 3.4Å
596	G	85.3	Confident	82.1	Confident	65 Å²	65	79.9 Å²	79.9	67%	0.67	43%	0.426	S	S	*	.			trans	67.9	51.3	-178.1	0	0	0	0	0	114	L593 R594	L593-G596 PolarHBondContact O-N 3.47Å; R594-G596 PolarHBondContact O-N 3.44Å
597	P	82.8	Confident	82.1	Confident	27 Å²	27	82.9 Å²	82.9	18%	0.175	44%	0.442	C	S	.	.			trans	-72.2	168.6	-176.9	34.6	-37.4	0	0	0	111.7	I592 V601 V602	I592-P597 HydrophobicContact CG2-CG 4.3Å; I592-P597 WeakPolarHBondContact O-CD 3.49Å; P597-V601 HydrophobicContact CB-CB 3.89Å; P597-V601 HydrophobicContact CB-CG1 3.65Å; P597-V601 HydrophobicContact CG-CB 4.28Å; P597-V601 HydrophobicContact CG-CG1 3.92Å; P597-V602 HydrophobicContact CG-CG2 3.89Å; P597-V602 WeakPolarHBondContact O-CG2 3.49Å
598	P	84.2	Confident	82	Confident	83 Å²	83	78 Å²	78	54%	0.539	43%	0.428	S	S	.	.			trans	-55.9	154.1	178.2	-25.6	34.5	0	0	0	113.3	E600 V601 V602	P598-E600 VanDerWaalsContact C-N 3.27Å; P598-E600 PolarHBondContact O-N 2.84Å; P598-E600 VanDerWaalsContact O-N 3.12Å; P598-V601 HydrophobicContact CB-CG2 4.46Å; P598-V601 WeakPolarHBondContact O-CA 3.46Å; P598-V601 WeakPolarHBondContact O-CB 3.38Å; P598-V601 PolarHBondContact O-N 3.35Å; P598-V602 PolarHBondContact O-N 2.97Å
599	P	87.5	Confident	82.3	Confident	112 Å²	112	78.8 Å²	78.8	73%	0.727	43%	0.426	S	S	*	.	H	α-helix	trans	-53.7	-36.3	-175	-28.4	35.1	0	0	0	115.3	V601 V602 A603	P599-V601 VanDerWaalsContact C-N 3.31Å; P599-V601 PolarHBondContact O-N 3.22Å; P599-V602 PolarHBondContact O-N 2.96Å; P599-A603 PolarHBondContact O-N 3.32Å
600	E	82.7	Confident	82.7	Confident	169 Å²	169	83.9 Å²	83.9	79%	0.79	45%	0.452	S	S	*	.	H	α-helix	trans	-63.7	-38.1	176.6	-63.7	179.9	-177.2	0	0	112.2	P598 R604	P598-E600 VanDerWaalsContact C-N 3.27Å; P598-E600 PolarHBondContact O-N 2.84Å; P598-E600 VanDerWaalsContact O-N 3.12Å; E600-R604 PolarHBondContact O-N 2.89Å; E600-R604 VanDerWaalsContact O-N 3.13Å
601	V	78.3	Confident	82.6	Confident	37 Å²	37	85 Å²	85	22%	0.224	45%	0.454	C	S	.	.	H	α-helix	trans	-71.5	-41.1	177.9	-179	0	0	0	0	109.9	I592 P597 P598 P599 A603 R604 F605	I592-V601 HydrophobicContact CG2-CG1 4.39Å; P597-V601 HydrophobicContact CB-CB 3.89Å; P597-V601 HydrophobicContact CB-CG1 3.65Å; P597-V601 HydrophobicContact CG-CB 4.28Å; P597-V601 HydrophobicContact CG-CG1 3.92Å; P598-V601 HydrophobicContact CB-CG2 4.46Å; P598-V601 WeakPolarHBondContact O-CA 3.46Å; P598-V601 WeakPolarHBondContact O-CB 3.38Å; P598-V601 PolarHBondContact O-N 3.35Å; P599-V601 VanDerWaalsContact C-N 3.31Å; P599-V601 PolarHBondContact O-N 3.22Å; V601-A603 PolarHBondContact O-N 3.22Å; V601-R604 PolarHBondContact O-N 3.39Å; V601-F605 HydrophobicContact CG1-CD2 3.47Å; V601-F605 VanDerWaalsContact CG1-CD2 3.47Å; V601-F605 HydrophobicContact CG1-CE2 3.43Å; V601-F605 VanDerWaalsContact CG1-CE2 3.43Å; V601-F605 VanDerWaalsContact O-CD2 3.22Å; V601-F605 WeakPolarHBondContact O-CD2 3.28Å; V601-F605 PolarHBondContact O-N 3.12Å
602	V	81	Confident	82.7	Confident	54 Å²	54	82.2 Å²	82.2	33%	0.327	44%	0.441	S	S	.	.	H	α-helix	trans	-57.3	-48.2	173.7	173.7	0	0	0	0	111.2	L593 P597 P598 P599 R604 F605 T606	L593-V602 HydrophobicContact CD2-CB 4.08Å; L593-V602 HydrophobicContact CD2-CG1 3.89Å; L593-V602 HydrophobicContact CD2-CG2 4.12Å; P597-V602 HydrophobicContact CG-CG2 3.89Å; P597-V602 WeakPolarHBondContact O-CG2 3.49Å; P598-V602 PolarHBondContact O-N 2.97Å; P599-V602 PolarHBondContact O-N 2.96Å; V602-R604 PolarHBondContact O-N 3.28Å; V602-F605 PolarHBondContact O-N 3.23Å; V602-T606 VanDerWaalsContact O-CB 3.32Å; V602-T606 WeakPolarHBondContact O-CB 3.38Å; V602-T606 PolarHBondContact O-N 3.42Å; V602-T606 PolarHBondContact O-OG1 2.98Å
603	A	84.2	Confident	83.2	Confident	61 Å²	61	82.8 Å²	82.8	50%	0.504	45%	0.445	S	S	.	.	H	α-helix	trans	-59.1	-47.3	178.4	0	0	0	0	0	111.5	P599 V601 F605 T606 D607	P599-A603 PolarHBondContact O-N 3.32Å; V601-A603 PolarHBondContact O-N 3.22Å; A603-F605 PolarHBondContact O-N 3.41Å; A603-T606 PolarHBondContact O-N 2.83Å; A603-D607 WeakPolarHBondContact O-CB 3.35Å; A603-D607 PolarHBondContact O-N 3.2Å
604	R	76.3	Confident	83.4	Confident	161 Å²	161	83.1 Å²	83.1	61%	0.608	45%	0.454	S	S	*	.	H	α-helix	trans	-62.2	-43.6	179.7	-171.4	178.1	69.8	-174.6	0.9	113.3	E600 V601 V602 N608	E600-R604 PolarHBondContact O-N 2.89Å; E600-R604 VanDerWaalsContact O-N 3.13Å; V601-R604 PolarHBondContact O-N 3.39Å; V602-R604 PolarHBondContact O-N 3.28Å; R604-N608 PolarHBondContact O-N 2.8Å
605	F	81.5	Confident	83.1	Confident	31 Å²	31	78 Å²	78	14%	0.136	44%	0.435	C	S	.	.	H	α-helix	trans	-75.5	-32	-179.8	-77.7	-69.7	0	0	0	112.7	A589 I592 L593 V601 V602 A603 N608 I609	A589-F605 HydrophobicContact CB-CB 4.16Å; A589-F605 HydrophobicContact CB-CD1 3.72Å; A589-F605 HydrophobicContact CB-CG 4.37Å; I592-F605 HydrophobicContact CB-CD2 4.36Å; I592-F605 HydrophobicContact CB-CE2 4.25Å; I592-F605 HydrophobicContact CB-CZ 4.39Å; I592-F605 HydrophobicContact CD1-CD1 4.3Å; I592-F605 HydrophobicContact CD1-CE1 3.48Å; I592-F605 VanDerWaalsContact CD1-CE1 3.48Å; I592-F605 HydrophobicContact CD1-CE2 3.93Å; I592-F605 HydrophobicContact CD1-CZ 3.27Å; I592-F605 HydrophobicContact CG1-CZ 4.39Å; I592-F605 HydrophobicContact CG2-CD2 3.74Å; I592-F605 HydrophobicContact CG2-CE2 3.52Å; I592-F605 HydrophobicContact CG2-CG 4.45Å; I592-F605 HydrophobicContact CG2-CZ 4.07Å; L593-F605 HydrophobicContact CD1-CB 4.35Å; L593-F605 HydrophobicContact CD2-CB 4.03Å; L593-F605 HydrophobicContact CG-CB 4Å; V601-F605 HydrophobicContact CG1-CD2 3.47Å; V601-F605 VanDerWaalsContact CG1-CD2 3.47Å; V601-F605 HydrophobicContact CG1-CE2 3.43Å; V601-F605 VanDerWaalsContact CG1-CE2 3.43Å; V601-F605 VanDerWaalsContact O-CD2 3.22Å; V601-F605 WeakPolarHBondContact O-CD2 3.28Å; V601-F605 PolarHBondContact O-N 3.12Å; V602-F605 PolarHBondContact O-N 3.23Å; A603-F605 PolarHBondContact O-N 3.41Å; F605-N608 PolarHBondContact O-N 2.75Å; F605-I609 WeakPolarHBondContact O-CG1 3.36Å; F605-I609 PolarHBondContact O-N 2.82Å
606	T	86.2	Confident	83.1	Confident	58 Å²	58	72.1 Å²	72.1	36%	0.356	41%	0.408	S	S	.	.	H	α-helix	trans	-64.5	-44.9	171.7	-55.1	0	0	0	0	110.8	V602 A603 N608 I609 L610	V602-T606 VanDerWaalsContact O-CB 3.32Å; V602-T606 WeakPolarHBondContact O-CB 3.38Å; V602-T606 PolarHBondContact O-N 3.42Å; V602-T606 PolarHBondContact O-OG1 2.98Å; A603-T606 PolarHBondContact O-N 2.83Å; T606-N608 VanDerWaalsContact C-N 3.33Å; T606-N608 PolarHBondContact O-N 3.12Å; T606-I609 WeakPolarHBondContact O-CB 3.48Å; T606-I609 PolarHBondContact O-N 3.11Å; T606-L610 HydrophobicContact CG2-CD1 4.4Å; T606-L610 WeakPolarHBondContact O-CG 3.45Å; T606-L610 PolarHBondContact O-N 3.04Å
607	D	82.5	Confident	83.2	Confident	101 Å²	101	74.3 Å²	74.3	54%	0.54	40%	0.401	S	S	.	.	H	α-helix	trans	-61	-40.9	175.1	-175.7	65.6	0	0	0	112.1	A603 I609 L610 T611	A603-D607 WeakPolarHBondContact O-CB 3.35Å; A603-D607 PolarHBondContact O-N 3.2Å; D607-I609 PolarHBondContact O-N 3.38Å; D607-L610 PolarHBondContact O-N 3.41Å; D607-T611 VanDerWaalsContact O-CB 3.32Å; D607-T611 WeakPolarHBondContact O-CB 3.48Å; D607-T611 PolarHBondContact O-N 3.46Å; D607-T611 PolarHBondContact O-OG1 3.32Å
608	N	75.8	Confident	83.1	Confident	50 Å²	50	75.3 Å²	75.3	27%	0.267	41%	0.412	S	S	.	.	H	α-helix	trans	-60.7	-44.6	173.3	-172	26.3	0	0	0	111.7	R604 F605 T606 L610 T611 Q612	R604-N608 PolarHBondContact O-N 2.8Å; F605-N608 PolarHBondContact O-N 2.75Å; T606-N608 VanDerWaalsContact C-N 3.33Å; T606-N608 PolarHBondContact O-N 3.12Å; N608-L610 PolarHBondContact O-N 3.45Å; N608-T611 PolarHBondContact O-N 2.93Å; N608-Q612 VanDerWaalsContact O-CG 3.3Å; N608-Q612 WeakPolarHBondContact O-CG 3.44Å; N608-Q612 PolarHBondContact O-N 3.33Å; N608-Q612 PolarHBondContact OD1-NE2 3Å; N608-Q612 VanDerWaalsContact OD1-NE2 3.11Å
609	I	83.8	Confident	82.9	Confident	42 Å²	42	72 Å²	72	22%	0.215	39%	0.389	C	S	.	.	H	α-helix	trans	-59.2	-48	176.7	-70.2	168.5	0	0	0	110.9	I586 A589 L593 F605 T606 D607 T611 Q612 N613	I586-I609 HydrophobicContact CG2-CG1 4.39Å; I586-I609 HydrophobicContact CG2-CG2 4.33Å; A589-I609 HydrophobicContact CB-CD1 3.88Å; A589-I609 HydrophobicContact CB-CG1 3.58Å; L593-I609 HydrophobicContact CD1-CD1 3.59Å; F605-I609 WeakPolarHBondContact O-CG1 3.36Å; F605-I609 PolarHBondContact O-N 2.82Å; T606-I609 WeakPolarHBondContact O-CB 3.48Å; T606-I609 PolarHBondContact O-N 3.11Å; D607-I609 PolarHBondContact O-N 3.38Å; I609-T611 VanDerWaalsContact C-N 3.35Å; I609-T611 PolarHBondContact O-N 3.01Å; I609-Q612 PolarHBondContact O-N 3.19Å; I609-N613 WeakPolarHBondContact O-CB 3.27Å; I609-N613 PolarHBondContact O-N 2.78Å
610	L	88.6	Confident	82.6	Confident	108 Å²	108	69.6 Å²	69.6	57%	0.565	37%	0.372	S	S	*	.	H	α-helix	trans	-62.7	-42.6	179.5	-68.8	174.8	0	0	0	111.5	T606 D607 N608 N613 A614	T606-L610 HydrophobicContact CG2-CD1 4.4Å; T606-L610 WeakPolarHBondContact O-CG 3.45Å; T606-L610 PolarHBondContact O-N 3.04Å; D607-L610 PolarHBondContact O-N 3.41Å; N608-L610 PolarHBondContact O-N 3.45Å; L610-N613 PolarHBondContact O-N 2.87Å; L610-A614 WeakPolarHBondContact O-CB 3.42Å; L610-A614 PolarHBondContact O-N 2.97Å
611	T	80.8	Confident	82.7	Confident	71 Å²	71	66.5 Å²	66.5	44%	0.436	36%	0.358	S	S	.	.	H	α-helix	trans	-63.4	-44.6	176.9	-61.7	0	0	0	0	111.9	D607 N608 I609 A614 R615	D607-T611 VanDerWaalsContact O-CB 3.32Å; D607-T611 WeakPolarHBondContact O-CB 3.48Å; D607-T611 PolarHBondContact O-N 3.46Å; D607-T611 PolarHBondContact O-OG1 3.32Å; N608-T611 PolarHBondContact O-N 2.93Å; I609-T611 VanDerWaalsContact C-N 3.35Å; I609-T611 PolarHBondContact O-N 3.01Å; T611-A614 PolarHBondContact O-N 2.96Å; T611-R615 WeakPolarHBondContact O-CB 3.46Å; T611-R615 PolarHBondContact O-N 2.91Å
612	Q	85	Confident	82.7	Confident	25 Å²	25	66.3 Å²	66.3	12%	0.117	36%	0.357	C	S	.	.	H	α-helix	trans	-65.7	-37.7	176.2	-65.8	-40.8	-52.7	0	0	112.2	P582 A585 I586 N608 I609 R615 M616	P582-Q612 HydrophobicContact CB-CB 3.99Å; P582-Q612 HydrophobicContact CB-CG 4.42Å; A585-Q612 HydrophobicContact CB-CG 3.84Å; I586-Q612 HydrophobicContact CD1-CB 3.83Å; I586-Q612 HydrophobicContact CG1-CB 3.61Å; I586-Q612 HydrophobicContact CG1-CG 4.24Å; N608-Q612 VanDerWaalsContact O-CG 3.3Å; N608-Q612 WeakPolarHBondContact O-CG 3.44Å; N608-Q612 PolarHBondContact O-N 3.33Å; N608-Q612 PolarHBondContact OD1-NE2 3Å; N608-Q612 VanDerWaalsContact OD1-NE2 3.11Å; I609-Q612 PolarHBondContact O-N 3.19Å; Q612-R615 PolarHBondContact O-N 3.16Å; Q612-M616 WeakPolarHBondContact O-CG 3.38Å; Q612-M616 PolarHBondContact O-N 3.49Å
613	N	87.9	Confident	82.6	Confident	72 Å²	72	64.2 Å²	64.2	39%	0.385	34%	0.344	S	S	.	.	H	α-helix	trans	-65.3	-46.5	176.5	-175.4	54.5	0	0	0	111.7	I609 L610 R615 M616 Q617	I609-N613 WeakPolarHBondContact O-CB 3.27Å; I609-N613 PolarHBondContact O-N 2.78Å; L610-N613 PolarHBondContact O-N 2.87Å; N613-R615 VanDerWaalsContact C-N 3.28Å; N613-R615 PolarHBondContact O-N 2.86Å; N613-M616 PolarHBondContact O-N 2.92Å; N613-Q617 WeakPolarHBondContact O-CG 3.45Å; N613-Q617 PolarHBondContact O-N 3.46Å
614	A	85.2	Confident	82.4	Confident	53 Å²	53	65.9 Å²	65.9	44%	0.438	34%	0.344	S	S	.	.	H	α-helix	trans	-59.7	-40.3	174.7	0	0	0	0	0	111.5	L610 T611 Q617 A618	L610-A614 WeakPolarHBondContact O-CB 3.42Å; L610-A614 PolarHBondContact O-N 2.97Å; T611-A614 PolarHBondContact O-N 2.96Å; A614-Q617 PolarHBondContact O-N 3.38Å; A614-A618 WeakPolarHBondContact O-CB 3.27Å; A614-A618 PolarHBondContact O-N 2.95Å
615	R	80.9	Confident	82.5	Confident	100 Å²	100	62.6 Å²	62.6	38%	0.377	33%	0.331	S	S	.	.	H	α-helix	trans	-62.1	-44	174.4	-176.5	179.2	176	-176.5	-1.5	112.4	T611 Q612 N613 A618 L619	T611-R615 WeakPolarHBondContact O-CB 3.46Å; T611-R615 PolarHBondContact O-N 2.91Å; Q612-R615 PolarHBondContact O-N 3.16Å; N613-R615 VanDerWaalsContact C-N 3.28Å; N613-R615 PolarHBondContact O-N 2.86Å; R615-A618 PolarHBondContact O-N 3.45Å; R615-L619 HydrophobicContact CG-CD1 4.25Å; R615-L619 WeakPolarHBondContact O-CG 3.45Å; R615-L619 PolarHBondContact O-N 3.16Å
616	M	84.7	Confident	82.4	Confident	35 Å²	35	61.1 Å²	61.1	17%	0.172	33%	0.325	C	S	.	.	H	α-helix	trans	-62.3	-44.2	176.6	-77	175.3	67.5	0	0	111.7	L579 P582 L583 I586 Q612 N613 L619 V620	L579-M616 HydrophobicContact CD2-CE 4.01Å; L579-M616 HydrophobicContact CD2-CG 4.23Å; P582-M616 HydrophobicContact CB-CG 3.63Å; P582-M616 HydrophobicContact CB-SD 3.82Å; P582-M616 HydrophobicContact CG-CG 3.4Å; P582-M616 VanDerWaalsContact CG-CG 3.4Å; P582-M616 HydrophobicContact CG-SD 3.84Å; L583-M616 HydrophobicContact CD2-CE 3.92Å; L583-M616 HydrophobicContact CD2-SD 4.28Å; L583-M616 HydrophobicContact CG-CE 4.02Å; L583-M616 HydrophobicContact CG-SD 4.31Å; I586-M616 HydrophobicContact CD1-SD 4.01Å; Q612-M616 WeakPolarHBondContact O-CG 3.38Å; Q612-M616 PolarHBondContact O-N 3.49Å; N613-M616 PolarHBondContact O-N 2.92Å; M616-L619 PolarHBondContact O-N 2.65Å; M616-V620 WeakPolarHBondContact O-CG2 3.27Å; M616-V620 PolarHBondContact O-N 2.76Å
617	Q	86.8	Confident	81.9	Confident	110 Å²	110	59.9 Å²	59.9	51%	0.514	32%	0.321	S	S	.	.	H	α-helix	trans	-59.9	-48.3	176.3	-73.2	178.9	-28.3	0	0	111.3	N613 A614 L619 V620 E621	N613-Q617 WeakPolarHBondContact O-CG 3.45Å; N613-Q617 PolarHBondContact O-N 3.46Å; A614-Q617 PolarHBondContact O-N 3.38Å; Q617-L619 VanDerWaalsContact C-N 3.32Å; Q617-L619 PolarHBondContact O-N 2.54Å; Q617-V620 PolarHBondContact O-N 3.43Å; Q617-E621 WeakPolarHBondContact O-CG 3.13Å; Q617-E621 PolarHBondContact O-N 3.37Å
618	A	81.3	Confident	81.8	Confident	49 Å²	49	64 Å²	64	41%	0.405	33%	0.328	S	S	.	.	H	α-helix	trans	-60.4	-39.6	177.8	0	0	0	0	0	112.8	A614 R615 T622	A614-A618 WeakPolarHBondContact O-CB 3.27Å; A614-A618 PolarHBondContact O-N 2.95Å; R615-A618 PolarHBondContact O-N 3.45Å; A618-T622 VanDerWaalsContact O-CB 3.31Å; A618-T622 WeakPolarHBondContact O-CB 3.47Å; A618-T622 PolarHBondContact O-N 2.89Å; A618-T622 PolarHBondContact O-OG1 3.3Å
619	L	80	Confident	82	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.063	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-51.2	174.8	-78.1	168.5	0	0	0	111.3	E578 R615 M616 Q617 E621 T622 L623	E578-L619 HydrophobicContact CB-CD1 4.43Å; R615-L619 HydrophobicContact CG-CD1 4.25Å; R615-L619 WeakPolarHBondContact O-CG 3.45Å; R615-L619 PolarHBondContact O-N 3.16Å; M616-L619 PolarHBondContact O-N 2.65Å; Q617-L619 VanDerWaalsContact C-N 3.32Å; Q617-L619 PolarHBondContact O-N 2.54Å; L619-E621 PolarHBondContact O-N 3Å; L619-T622 PolarHBondContact O-N 2.96Å; L619-L623 VanDerWaalsContact O-CG 3.24Å; L619-L623 WeakPolarHBondContact O-CG 3.27Å; L619-L623 PolarHBondContact O-N 2.99Å
620	V	81.6	Confident	81.5	Confident	62 Å²	62	61.5 Å²	61.5	38%	0.376	31%	0.314	S	S	.	.	H	α-helix	trans	-60.5	-46.3	-179.6	171	0	0	0	0	111.2	M616 Q617 T622 L623 L624	M616-V620 WeakPolarHBondContact O-CG2 3.27Å; M616-V620 PolarHBondContact O-N 2.76Å; Q617-V620 PolarHBondContact O-N 3.43Å; V620-T622 VanDerWaalsContact C-N 3.34Å; V620-T622 PolarHBondContact O-N 3.31Å; V620-L623 PolarHBondContact O-N 3.41Å; V620-L624 HydrophobicContact CG1-CD1 3.98Å; V620-L624 HydrophobicContact CG1-CG 4.41Å; V620-L624 WeakPolarHBondContact O-CG 3.26Å; V620-L624 PolarHBondContact O-N 3.02Å
621	E	84.9	Confident	80.7	Confident	104 Å²	104	62.9 Å²	62.9	49%	0.486	32%	0.322	S	S	.	.	H	α-helix	trans	-62.3	-41.8	177.5	-73.4	-174.8	-178.7	0	0	112.5	Q617 L619 L623 L624 R625	Q617-E621 WeakPolarHBondContact O-CG 3.13Å; Q617-E621 PolarHBondContact O-N 3.37Å; L619-E621 PolarHBondContact O-N 3Å; E621-L623 VanDerWaalsContact C-N 3.29Å; E621-L623 PolarHBondContact O-N 3.09Å; E621-L624 PolarHBondContact O-N 2.99Å; E621-R625 WeakPolarHBondContact O-CB 3.43Å; E621-R625 VanDerWaalsContact O-CG 3.32Å; E621-R625 WeakPolarHBondContact O-CG 3.26Å; E621-R625 PolarHBondContact O-N 2.81Å; E621-R625 IonicContact OE2-NH1 2.82Å; E621-R625 PolarHBondContact OE2-NH1 3.07Å; E621-R625 VanDerWaalsContact OE2-NH1 3.1Å
622	T	78.3	Confident	80.3	Confident	33 Å²	33	64 Å²	64	20%	0.202	32%	0.318	C	S	.	.	H	α-helix	trans	-62.7	-41	178	-56.8	0	0	0	0	110.7	A618 L619 V620 R625 Q626 L749	A618-T622 VanDerWaalsContact O-CB 3.31Å; A618-T622 WeakPolarHBondContact O-CB 3.47Å; A618-T622 PolarHBondContact O-N 2.89Å; A618-T622 PolarHBondContact O-OG1 3.3Å; L619-T622 PolarHBondContact O-N 2.96Å; V620-T622 VanDerWaalsContact C-N 3.34Å; V620-T622 PolarHBondContact O-N 3.31Å; T622-R625 PolarHBondContact O-N 3.12Å; T622-R625 PolarHBondContact OG1-NH2 3.48Å; T622-Q626 WeakPolarHBondContact O-CB 3.25Å; T622-Q626 PolarHBondContact O-N 3.33Å; T622-L749 HydrophobicContact CG2-CB 3.73Å; T622-L749 HydrophobicContact CG2-CD1 3.55Å; T622-L749 HydrophobicContact CG2-CG 4.29Å
623	L	77.5	Confident	79.4	Confident	10 Å²	10	71.9 Å²	71.9	5%	0.052	36%	0.355	C	S	.	.	H	α-helix	trans	-68	-39.3	177.2	-68.3	171.4	0	0	0	112.7	Y571 L575 L619 V620 E621 Q626 A627 F735 L749	Y571-L623 HydrophobicContact CE1-CB 4.13Å; Y571-L623 HydrophobicContact CE1-CD2 3.91Å; Y571-L623 HydrophobicContact CE1-CG 4.47Å; Y571-L623 HydrophobicContact CE2-CD2 3.8Å; Y571-L623 VanDerWaalsContact OH-C 3.3Å; Y571-L623 WeakPolarHBondContact OH-CA 3.49Å; Y571-L623 VanDerWaalsContact OH-CB 3.3Å; Y571-L623 WeakPolarHBondContact OH-CB 3.37Å; Y571-L623 WeakPolarHBondContact OH-CD2 3.4Å; Y571-L623 PolarHBondContact OH-O 2.95Å; L575-L623 HydrophobicContact CB-CD1 4.36Å; L575-L623 HydrophobicContact CD1-CD1 3.29Å; L575-L623 HydrophobicContact CG-CD1 4.3Å; L619-L623 VanDerWaalsContact O-CG 3.24Å; L619-L623 WeakPolarHBondContact O-CG 3.27Å; L619-L623 PolarHBondContact O-N 2.99Å; V620-L623 PolarHBondContact O-N 3.41Å; E621-L623 VanDerWaalsContact C-N 3.29Å; E621-L623 PolarHBondContact O-N 3.09Å; L623-Q626 PolarHBondContact O-N 2.95Å; L623-A627 WeakPolarHBondContact O-CB 3.39Å; L623-A627 PolarHBondContact O-N 2.86Å; L623-F735 HydrophobicContact CD2-CE1 3.75Å; L623-F735 HydrophobicContact CD2-CE2 4.49Å; L623-F735 HydrophobicContact CD2-CZ 3.41Å; L623-F735 VanDerWaalsContact CD2-CZ 3.41Å; L623-L749 HydrophobicContact CD2-CD1 3.55Å; L623-L749 HydrophobicContact CD2-CD2 4.16Å; L623-L749 HydrophobicContact CG-CD1 3.99Å
624	L	80.8	Confident	78.4	Confident	96 Å²	96	76.7 Å²	76.7	50%	0.503	38%	0.376	S	S	.	.	H	α-helix	trans	-66.8	-39.8	175	-72	173.8	0	0	0	111.6	V620 E621 Q626 R628	V620-L624 HydrophobicContact CG1-CD1 3.98Å; V620-L624 HydrophobicContact CG1-CG 4.41Å; V620-L624 WeakPolarHBondContact O-CG 3.26Å; V620-L624 PolarHBondContact O-N 3.02Å; E621-L624 PolarHBondContact O-N 2.99Å; L624-Q626 VanDerWaalsContact C-N 3.33Å; L624-R628 WeakPolarHBondContact O-CB 3.37Å; L624-R628 VanDerWaalsContact O-CG 3.27Å; L624-R628 WeakPolarHBondContact O-CG 3.49Å; L624-R628 PolarHBondContact O-N 2.95Å
625	R	79.3	Confident	78.1	Confident	92 Å²	92	75.7 Å²	75.7	35%	0.347	36%	0.364	S	S	.	.	H	α-helix	trans	-60.5	-45.1	173.6	-76.7	-174.6	-66.9	-103.1	0.5	111	E621 T622 R628 L629	E621-R625 WeakPolarHBondContact O-CB 3.43Å; E621-R625 VanDerWaalsContact O-CG 3.32Å; E621-R625 WeakPolarHBondContact O-CG 3.26Å; E621-R625 PolarHBondContact O-N 2.81Å; E621-R625 IonicContact OE2-NH1 2.82Å; E621-R625 PolarHBondContact OE2-NH1 3.07Å; E621-R625 VanDerWaalsContact OE2-NH1 3.1Å; T622-R625 PolarHBondContact O-N 3.12Å; T622-R625 PolarHBondContact OG1-NH2 3.48Å; R625-R628 PolarHBondContact O-N 3.34Å; R625-L629 PolarHBondContact O-N 3.41Å
626	Q	78.5	Confident	78.2	Confident	1 Å²	1	76.3 Å²	76.3	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-65.6	-45.6	179.6	-176.3	165.7	-9.4	0	0	112.5	T622 L623 L624 R628 L629 E630 R734	T622-Q626 WeakPolarHBondContact O-CB 3.25Å; T622-Q626 PolarHBondContact O-N 3.33Å; L623-Q626 PolarHBondContact O-N 2.95Å; L624-Q626 VanDerWaalsContact C-N 3.33Å; Q626-R628 VanDerWaalsContact C-N 3.26Å; Q626-R628 PolarHBondContact O-N 2.89Å; Q626-L629 WeakPolarHBondContact O-CB 3.28Å; Q626-L629 PolarHBondContact O-N 3.02Å; Q626-L629 VanDerWaalsContact O-N 3.09Å; Q626-E630 VanDerWaalsContact CG-OE1 3.25Å; Q626-E630 WeakPolarHBondContact CG-OE1 3.36Å; Q626-E630 PolarHBondContact NE2-OE1 3.07Å; Q626-E630 WeakPolarHBondContact O-CG 3.44Å; Q626-E630 PolarHBondContact O-N 3.04Å; Q626-R734 VanDerWaalsContact NE2-CD 3.31Å
627	A	75.3	Confident	78.3	Confident	32 Å²	32	78.7 Å²	78.7	26%	0.264	39%	0.391	S	S	.	.	H	α-helix	trans	-62.9	-32.1	176.3	0	0	0	0	0	113	L623 N631	L623-A627 WeakPolarHBondContact O-CB 3.39Å; L623-A627 PolarHBondContact O-N 2.86Å; A627-N631 WeakPolarHBondContact O-CB 3.42Å; A627-N631 PolarHBondContact O-N 3Å; A627-N631 PolarHBondContact O-ND2 3.2Å; A627-N631 VanDerWaalsContact O-ND2 3.07Å
628	R	81.2	Confident	78.5	Confident	187 Å²	187	76.4 Å²	76.4	71%	0.706	39%	0.385	S	S	*	.	H	α-helix	trans	-69.7	-38.6	172.8	-75.8	174.9	-175.1	175.9	3	112.1	L624 R625 Q626	L624-R628 WeakPolarHBondContact O-CB 3.37Å; L624-R628 VanDerWaalsContact O-CG 3.27Å; L624-R628 WeakPolarHBondContact O-CG 3.49Å; L624-R628 PolarHBondContact O-N 2.95Å; R625-R628 PolarHBondContact O-N 3.34Å; Q626-R628 VanDerWaalsContact C-N 3.26Å; Q626-R628 PolarHBondContact O-N 2.89Å
629	L	80.6	Confident	78.9	Confident	5 Å²	5	77.8 Å²	77.8	3%	0.026	39%	0.388	C	S	.	.	H	α-helix	trans	-66.7	-45	178.6	-170.6	68.1	0	0	0	111.3	R625 Q626 N631 R632 L679 F753 E756 V757 L760	R625-L629 PolarHBondContact O-N 3.41Å; Q626-L629 WeakPolarHBondContact O-CB 3.28Å; Q626-L629 PolarHBondContact O-N 3.02Å; Q626-L629 VanDerWaalsContact O-N 3.09Å; L629-N631 VanDerWaalsContact C-N 3.33Å; L629-N631 PolarHBondContact O-N 3.5Å; L629-R632 WeakPolarHBondContact O-CB 3.45Å; L629-R632 PolarHBondContact O-N 2.82Å; L629-R632 VanDerWaalsContact O-N 3.11Å; L629-L679 HydrophobicContact CD1-CD1 3.7Å; L629-L679 HydrophobicContact CD1-CD2 3.66Å; L629-L679 HydrophobicContact CD1-CG 4.34Å; L629-F753 HydrophobicContact CD2-CD2 3.67Å; L629-F753 HydrophobicContact CD2-CE2 3.59Å; L629-F753 HydrophobicContact CD2-CG 4.28Å; L629-F753 HydrophobicContact CD2-CZ 4.12Å; L629-E756 HydrophobicContact CD2-CB 3.76Å; L629-E756 HydrophobicContact CD2-CG 3.53Å; L629-E756 HydrophobicContact CG-CG 3.78Å; L629-V757 HydrophobicContact CD1-CG2 4.41Å; L629-V757 HydrophobicContact CD2-CG2 3.71Å; L629-L760 HydrophobicContact CD1-CD1 3.29Å; L629-L760 HydrophobicContact CD2-CD1 4.38Å; L629-L760 HydrophobicContact CG-CD1 3.61Å
630	E	73	Confident	79.6	Confident	35 Å²	35	77.5 Å²	77.5	16%	0.164	39%	0.387	C	S	.	.	H	α-helix	trans	-68	-31.2	-177.5	-70.8	165	178.5	0	0	113.3	Y567 Q626 R632 R734 E756	Y567-E630 VanDerWaalsContact CE1-OE2 3.26Å; Y567-E630 WeakPolarHBondContact CE1-OE2 3.43Å; Y567-E630 PolarHBondContact OH-OE1 2.65Å; Y567-E630 PolarHBondContact OH-OE2 3.19Å; Q626-E630 VanDerWaalsContact CG-OE1 3.25Å; Q626-E630 WeakPolarHBondContact CG-OE1 3.36Å; Q626-E630 PolarHBondContact NE2-OE1 3.07Å; Q626-E630 WeakPolarHBondContact O-CG 3.44Å; Q626-E630 PolarHBondContact O-N 3.04Å; E630-R632 PolarHBondContact O-N 3.26Å; E630-R734 IonicContact OE1-CZ 2.96Å; E630-R734 VanDerWaalsContact OE1-CZ 3.23Å; E630-R734 IonicContact OE1-NE 3.35Å; E630-R734 PolarHBondContact OE1-NE 3.08Å; E630-R734 IonicContact OE1-NH2 3.85Å; E630-R734 PolarHBondContact OE1-NH2 3.38Å; E630-E756 HydrophobicContact CG-CG 4.2Å
631	N	70.8	Confident	80.2	Confident	136 Å²	136	77.7 Å²	77.7	73%	0.727	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	3.6	175.6	-75.7	-42.4	0	0	0	113.4	A627 L629 Q633	A627-N631 WeakPolarHBondContact O-CB 3.42Å; A627-N631 PolarHBondContact O-N 3Å; A627-N631 PolarHBondContact O-ND2 3.2Å; A627-N631 VanDerWaalsContact O-ND2 3.07Å; L629-N631 VanDerWaalsContact C-N 3.33Å; L629-N631 PolarHBondContact O-N 3.5Å; N631-Q633 PolarHBondContact O-N 2.88Å
632	R	73.7	Confident	80.7	Confident	94 Å²	94	72.7 Å²	72.7	36%	0.355	36%	0.363	S	S	.	.			trans	-82.8	113.2	-178.3	-152.5	168.8	-169.5	173.8	-0.8	109.5	L629 E630 V635 E676	L629-R632 WeakPolarHBondContact O-CB 3.45Å; L629-R632 PolarHBondContact O-N 2.82Å; L629-R632 VanDerWaalsContact O-N 3.11Å; E630-R632 PolarHBondContact O-N 3.26Å; R632-V635 HydrophobicContact CG-CG2 4.38Å; R632-E676 IonicContact CZ-OE1 3.95Å; R632-E676 VanDerWaalsContact CZ-OE1 3.29Å; R632-E676 IonicContact CZ-OE2 3.29Å; R632-E676 IonicContact NE-OE2 2.68Å; R632-E676 VanDerWaalsContact NH1-CD 3.31Å; R632-E676 IonicContact NH1-OE1 3.73Å; R632-E676 PolarHBondContact NH1-OE1 3.05Å; R632-E676 IonicContact NH1-OE2 2.88Å; R632-E676 PolarHBondContact NH1-OE2 3.24Å; R632-E676 VanDerWaalsContact NH2-CD 3.28Å; R632-E676 IonicContact NH2-OE1 3.05Å; R632-E676 PolarHBondContact NH2-OE1 3.33Å; R632-E676 IonicContact NH2-OE2 2.85Å; R632-E676 PolarHBondContact NH2-OE2 3.4Å
633	Q	64.9	Low	81.5	Confident	191 Å²	191	72 Å²	72	89%	0.893	36%	0.361	S	S	*	.			trans	-89.5	-28.7	-179.6	-67.6	-176.5	-1.9	0	0	113.1	N631	N631-Q633 PolarHBondContact O-N 2.88Å
634	E	68.1	Low	82.3	Confident	174 Å²	174	72.3 Å²	72.3	81%	0.813	36%	0.364	S	S	*	.			trans	-130.1	135.4	-179.1	-69.8	-179.2	173.1	0	0	110.3
635	V	77.7	Confident	83	Confident	31 Å²	31	67.8 Å²	67.8	19%	0.188	34%	0.34	C	S	.	.			trans	-123.2	128.1	175.4	-176.1	0	0	0	0	109	R632 L637 E676 L760 F761	R632-V635 HydrophobicContact CG-CG2 4.38Å; V635-L637 HydrophobicContact CG1-CD2 4.07Å; V635-L637 PolarHBondContact O-N 2.85Å; V635-E676 HydrophobicContact CG1-CB 3.8Å; V635-E676 VanDerWaalsContact CG1-OE2 3.3Å; V635-E676 WeakPolarHBondContact CG1-OE2 3.38Å; V635-L760 HydrophobicContact CG2-CB 4.23Å; V635-L760 HydrophobicContact CG2-CD1 4.4Å; V635-L760 HydrophobicContact CG2-CD2 4.05Å; V635-L760 HydrophobicContact CG2-CG 4.47Å; V635-F761 HydrophobicContact CG1-CD1 4.34Å; V635-F761 HydrophobicContact CG1-CE1 3.69Å
636	V	83.2	Confident	83.9	Confident	114 Å²	114	63.4 Å²	63.4	69%	0.691	32%	0.324	S	S	*	.			trans	-84.4	103.3	176.4	-177.7	0	0	0	0	107.8	T638	V636-T638 HydrophobicContact CG1-CG2 4.42Å
637	L	87.1	Confident	84.7	Confident	84 Å²	84	69.8 Å²	69.8	44%	0.44	35%	0.348	S	S	.	.			trans	-78.5	125.5	176.8	-53.6	178.1	0	0	0	109.3	V635 A674 F761	V635-L637 HydrophobicContact CG1-CD2 4.07Å; V635-L637 PolarHBondContact O-N 2.85Å; L637-A674 HydrophobicContact CB-CB 4.2Å; L637-A674 HydrophobicContact CD1-CB 4.43Å; L637-F761 HydrophobicContact CD2-CD1 3.43Å; L637-F761 VanDerWaalsContact CD2-CD1 3.43Å; L637-F761 HydrophobicContact CD2-CE1 3.64Å; L637-F761 HydrophobicContact CD2-CG 4.41Å
638	T	90.2	Very high	85.7	Confident	63 Å²	63	72.6 Å²	72.6	39%	0.387	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	167.2	171.1	64.2	0	0	0	0	110.1	V636 V640 A674 A675 P677	V636-T638 HydrophobicContact CG1-CG2 4.42Å; T638-V640 PolarHBondContact O-N 2.84Å; T638-A674 WeakPolarHBondContact O-CA 3.39Å; T638-A675 PolarHBondContact N-O 3.4Å; T638-A675 PolarHBondContact O-N 3.32Å; T638-A675 PolarHBondContact OG1-O 2.9Å; T638-P677 WeakPolarHBondContact OG1-CD 3.13Å; T638-P677 WeakPolarHBondContact OG1-CG 3.45Å
639	V	91.3	Very high	86.4	Confident	77 Å²	77	63.7 Å²	63.7	47%	0.467	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	120.7	176.3	-169	0	0	0	0	109	N672 H784	V639-N672 HydrophobicContact CG1-CB 3.78Å; V639-H784 WeakPolarHBondContact CG2-CD2 3.33Å; V639-H784 WeakPolarHBondContact CG2-NE2 3.44Å
640	V	93.2	Very high	87.1	Confident	6 Å²	6	64.2 Å²	64.2	4%	0.036	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.7	175.5	-176.3	0	0	0	0	109.3	T638 V642 L645 N672 V673 A675 P677 L680	T638-V640 PolarHBondContact O-N 2.84Å; V640-V642 PolarHBondContact O-N 2.96Å; V640-L645 HydrophobicContact CG1-CB 4.39Å; V640-N672 WeakPolarHBondContact O-CA 3.5Å; V640-V673 HydrophobicContact CB-CG2 4.08Å; V640-V673 PolarHBondContact N-O 3.4Å; V640-V673 PolarHBondContact O-N 3.47Å; V640-V673 VanDerWaalsContact O-N 3.09Å; V640-A675 HydrophobicContact CG2-CB 4.14Å; V640-P677 HydrophobicContact CG2-CB 4.15Å; V640-P677 HydrophobicContact CG2-CG 3.89Å; V640-L680 HydrophobicContact CB-CD2 4.46Å; V640-L680 HydrophobicContact CG1-CD2 4.25Å
641	D	94.3	Very high	88.2	Confident	66 Å²	66	68.9 Å²	68.9	35%	0.353	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	112.7	168.4	172	5.2	0	0	0	109.6	A643 A644 L645 N672	D641-A643 VanDerWaalsContact C-N 3.3Å; D641-A643 PolarHBondContact O-N 2.83Å; D641-A643 WeakPolarHBondContact OD1-CA 3.13Å; D641-A643 VanDerWaalsContact OD1-CB 3.28Å; D641-A643 WeakPolarHBondContact OD1-CB 3.5Å; D641-A643 PolarHBondContact OD1-N 3.06Å; D641-A644 HydrophobicContact CB-CB 4.02Å; D641-A644 PolarHBondContact O-N 3.3Å; D641-A644 PolarHBondContact OD1-N 3.4Å; D641-A644 WeakPolarHBondContact OD2-CB 3.42Å; D641-L645 WeakPolarHBondContact O-CB 3.29Å; D641-L645 PolarHBondContact O-N 3.14Å; D641-N672 WeakPolarHBondContact CA-OD1 3.42Å
642	V	94.7	Very high	89.3	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-66.4	-32.4	-178	177.9	0	0	0	0	111.4	V640 L645 F646 T669 V671 V673 A705 L714	V640-V642 PolarHBondContact O-N 2.96Å; V642-L645 WeakPolarHBondContact O-CB 3Å; V642-L645 PolarHBondContact O-N 3.25Å; V642-F646 HydrophobicContact CG1-CD1 4Å; V642-F646 HydrophobicContact CG1-CD2 4.35Å; V642-F646 HydrophobicContact CG1-CE1 3.63Å; V642-F646 HydrophobicContact CG1-CE2 4.01Å; V642-F646 HydrophobicContact CG1-CG 4.36Å; V642-F646 HydrophobicContact CG1-CZ 3.64Å; V642-F646 WeakPolarHBondContact O-CB 3.47Å; V642-F646 WeakPolarHBondContact O-CG 3.42Å; V642-F646 PolarHBondContact O-N 3.27Å; V642-T669 HydrophobicContact CB-CG2 4.29Å; V642-T669 HydrophobicContact CG1-CG2 3.91Å; V642-V671 VanDerWaalsContact CB-O 3.22Å; V642-V671 WeakPolarHBondContact CB-O 3.42Å; V642-V671 WeakPolarHBondContact CG2-O 3.24Å; V642-V671 PolarHBondContact N-O 2.93Å; V642-V671 VanDerWaalsContact N-O 3.12Å; V642-V673 HydrophobicContact CG2-CG1 3.97Å; V642-V673 HydrophobicContact CG2-CG2 4.03Å; V642-A705 HydrophobicContact CG1-CB 4.04Å; V642-L714 HydrophobicContact CB-CD2 4.44Å; V642-L714 HydrophobicContact CG1-CD2 3.5Å; V642-L714 VanDerWaalsContact CG1-CD2 3.5Å; V642-L714 HydrophobicContact CG2-CD2 3.99Å
643	A	95.3	Very high	90.3	Very high	19 Å²	19	63.1 Å²	63.1	16%	0.157	33%	0.327	C	S	.	.	H	α-helix	trans	-66.8	-44	177.4	0	0	0	0	0	111	D641 L645 F646 R647 T669	D641-A643 VanDerWaalsContact C-N 3.3Å; D641-A643 PolarHBondContact O-N 2.83Å; D641-A643 WeakPolarHBondContact OD1-CA 3.13Å; D641-A643 VanDerWaalsContact OD1-CB 3.28Å; D641-A643 WeakPolarHBondContact OD1-CB 3.5Å; D641-A643 PolarHBondContact OD1-N 3.06Å; A643-L645 VanDerWaalsContact C-N 3.34Å; A643-F646 PolarHBondContact O-N 3.11Å; A643-R647 WeakPolarHBondContact O-CG 3.44Å; A643-R647 PolarHBondContact O-N 3.5Å; A643-R647 VanDerWaalsContact O-N 3.17Å; A643-R647 PolarHBondContact O-NH1 3.4Å; A643-T669 HydrophobicContact CB-CG2 4.3Å; A643-T669 WeakPolarHBondContact CB-O 3.3Å
644	A	95.4	Very high	91.8	Very high	16 Å²	16	58 Å²	58	13%	0.132	31%	0.309	C	S	.	.	H	α-helix	trans	-64.6	-39.2	174.4	0	0	0	0	0	112.2	D641 R648	D641-A644 HydrophobicContact CB-CB 4.02Å; D641-A644 PolarHBondContact O-N 3.3Å; D641-A644 PolarHBondContact OD1-N 3.4Å; D641-A644 WeakPolarHBondContact OD2-CB 3.42Å; A644-R648 PolarHBondContact O-N 3.14Å; A644-R648 PolarHBondContact O-NH1 2.79Å
645	L	96.2	Very high	92.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.6	-54.9	173.9	-179	67.5	0	0	0	110.9	V640 D641 V642 A643 R647 R648 V649 L680 E681 L684 L714	V640-L645 HydrophobicContact CG1-CB 4.39Å; D641-L645 WeakPolarHBondContact O-CB 3.29Å; D641-L645 PolarHBondContact O-N 3.14Å; V642-L645 WeakPolarHBondContact O-CB 3Å; V642-L645 PolarHBondContact O-N 3.25Å; A643-L645 VanDerWaalsContact C-N 3.34Å; L645-R647 VanDerWaalsContact C-N 3.27Å; L645-R647 PolarHBondContact O-N 3.47Å; L645-R648 PolarHBondContact O-N 2.81Å; L645-R648 VanDerWaalsContact O-N 3.08Å; L645-V649 HydrophobicContact CD1-CG2 4.11Å; L645-V649 HydrophobicContact CG-CG2 4.09Å; L645-V649 WeakPolarHBondContact O-CG2 3.18Å; L645-V649 PolarHBondContact O-N 3.11Å; L645-L680 HydrophobicContact CD2-CD2 3.74Å; L645-L680 HydrophobicContact CD2-CG 3.74Å; L645-E681 HydrophobicContact CD1-CB 3.63Å; L645-E681 HydrophobicContact CD1-CG 3.94Å; L645-L684 HydrophobicContact CD2-CD2 3.92Å; L645-L684 HydrophobicContact CG-CD2 4.09Å; L645-L714 HydrophobicContact CD2-CD1 4.4Å
646	F	97.2	Very high	93.6	Very high	1 Å²	1	57.1 Å²	57.1	0%	0.004	31%	0.31	C	S	.	.	H	α-helix	trans	-56.1	-40.5	-178.7	-76.1	3.1	0	0	0	112.6	V642 A643 S650 V666 T669 L684 L703 S704 A705 L714	V642-F646 HydrophobicContact CG1-CD1 4Å; V642-F646 HydrophobicContact CG1-CD2 4.35Å; V642-F646 HydrophobicContact CG1-CE1 3.63Å; V642-F646 HydrophobicContact CG1-CE2 4.01Å; V642-F646 HydrophobicContact CG1-CG 4.36Å; V642-F646 HydrophobicContact CG1-CZ 3.64Å; V642-F646 WeakPolarHBondContact O-CB 3.47Å; V642-F646 WeakPolarHBondContact O-CG 3.42Å; V642-F646 PolarHBondContact O-N 3.27Å; A643-F646 PolarHBondContact O-N 3.11Å; F646-S650 VanDerWaalsContact O-CB 3.29Å; F646-S650 WeakPolarHBondContact O-CB 3.27Å; F646-S650 PolarHBondContact O-N 3.25Å; F646-S650 PolarHBondContact O-OG 3.01Å; F646-V666 HydrophobicContact CB-CG1 3.88Å; F646-V666 HydrophobicContact CD2-CG1 3.76Å; F646-V666 HydrophobicContact CG-CG1 4.26Å; F646-T669 HydrophobicContact CD2-CG2 4.11Å; F646-T669 HydrophobicContact CE2-CG2 4.1Å; F646-L684 HydrophobicContact CD1-CD2 3.53Å; F646-L684 HydrophobicContact CE1-CD2 3.53Å; F646-L703 HydrophobicContact CD2-CB 4.36Å; F646-L703 HydrophobicContact CE2-CB 4.34Å; F646-S704 WeakPolarHBondContact CZ-O 3.29Å; F646-A705 HydrophobicContact CE2-CB 4.26Å; F646-A705 HydrophobicContact CZ-CB 4.14Å; F646-L714 HydrophobicContact CE1-CD2 4.22Å; F646-L714 HydrophobicContact CZ-CD2 4.13Å
647	R	95.6	Very high	94.1	Very high	134 Å²	134	52.3 Å²	52.3	51%	0.506	28%	0.28	S	S	.	.	H	α-helix	trans	-59.2	-52.7	174.1	-72.2	-170.1	-60.8	-87.6	3.6	111.7	A643 L645 V649 S650 E651	A643-R647 WeakPolarHBondContact O-CG 3.44Å; A643-R647 PolarHBondContact O-N 3.5Å; A643-R647 VanDerWaalsContact O-N 3.17Å; A643-R647 PolarHBondContact O-NH1 3.4Å; L645-R647 VanDerWaalsContact C-N 3.27Å; L645-R647 PolarHBondContact O-N 3.47Å; R647-V649 PolarHBondContact O-N 3.03Å; R647-S650 PolarHBondContact O-N 2.91Å; R647-E651 WeakPolarHBondContact O-CB 3.49Å; R647-E651 WeakPolarHBondContact O-CG 3.43Å; R647-E651 PolarHBondContact O-N 3.01Å
648	R	95.7	Very high	94.4	Very high	91 Å²	91	51.7 Å²	51.7	34%	0.343	29%	0.287	S	S	.	.	H	α-helix	trans	-58.8	-45.8	-179.5	-70.4	-166.5	-56.9	-83.1	0.3	112.5	A644 L645 S650 E651 A652 E681	A644-R648 PolarHBondContact O-N 3.14Å; A644-R648 PolarHBondContact O-NH1 2.79Å; L645-R648 PolarHBondContact O-N 2.81Å; L645-R648 VanDerWaalsContact O-N 3.08Å; R648-S650 VanDerWaalsContact C-N 3.3Å; R648-S650 PolarHBondContact O-N 3.25Å; R648-E651 PolarHBondContact O-N 3.24Å; R648-A652 WeakPolarHBondContact O-CB 3.17Å; R648-A652 PolarHBondContact O-N 2.88Å; R648-A652 VanDerWaalsContact O-N 3.13Å; R648-E681 IonicContact CZ-OE2 2.84Å; R648-E681 IonicContact NE-OE1 3.91Å; R648-E681 IonicContact NE-OE2 3.3Å; R648-E681 PolarHBondContact NE-OE2 3.45Å; R648-E681 IonicContact NH2-OE2 2.96Å; R648-E681 PolarHBondContact NH2-OE2 3.15Å
649	V	96	Very high	94.4	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-37	-177.9	-149.5	0	0	0	0	111.1	L645 R647 R653 E681 L684 L688	L645-V649 HydrophobicContact CD1-CG2 4.11Å; L645-V649 HydrophobicContact CG-CG2 4.09Å; L645-V649 WeakPolarHBondContact O-CG2 3.18Å; L645-V649 PolarHBondContact O-N 3.11Å; R647-V649 PolarHBondContact O-N 3.03Å; V649-R653 WeakPolarHBondContact O-CD 3.49Å; V649-R653 PolarHBondContact O-NH1 3.47Å; V649-E681 HydrophobicContact CG2-CG 4.35Å; V649-L684 HydrophobicContact CG2-CB 4.47Å; V649-L684 HydrophobicContact CG2-CD2 3.79Å; V649-L684 HydrophobicContact CG2-CG 4.24Å; V649-L688 HydrophobicContact CG1-CD2 4.26Å
650	S	95.7	Very high	94.3	Very high	17 Å²	17	54.9 Å²	54.9	12%	0.119	29%	0.292	C	S	.	.	H	α-helix	trans	-68.4	-49.2	177.7	-55.6	0	0	0	0	111.9	F646 R647 R648 A652 R653 T654 L664	F646-S650 VanDerWaalsContact O-CB 3.29Å; F646-S650 WeakPolarHBondContact O-CB 3.27Å; F646-S650 PolarHBondContact O-N 3.25Å; F646-S650 PolarHBondContact O-OG 3.01Å; R647-S650 PolarHBondContact O-N 2.91Å; R648-S650 VanDerWaalsContact C-N 3.3Å; R648-S650 PolarHBondContact O-N 3.25Å; S650-A652 VanDerWaalsContact C-N 3.28Å; S650-A652 PolarHBondContact O-N 2.62Å; S650-R653 PolarHBondContact O-N 2.96Å; S650-T654 PolarHBondContact O-N 3.17Å; S650-L664 WeakPolarHBondContact OG-CD2 3.28Å
651	E	95.6	Very high	94.4	Very high	132 Å²	132	59.7 Å²	59.7	62%	0.617	32%	0.317	S	S	*	.	H	α-helix	trans	-57.5	-42.2	179.6	-75.7	170.2	-174.5	0	0	111.4	R647 R648 R653 T654	R647-E651 WeakPolarHBondContact O-CB 3.49Å; R647-E651 WeakPolarHBondContact O-CG 3.43Å; R647-E651 PolarHBondContact O-N 3.01Å; R648-E651 PolarHBondContact O-N 3.24Å; E651-R653 PolarHBondContact O-N 3.1Å; E651-R653 VanDerWaalsContact O-N 3.11Å; E651-T654 PolarHBondContact O-N 3.14Å; E651-T654 PolarHBondContact O-OG1 3.06Å
652	A	94.7	Very high	94.4	Very high	70 Å²	70	57 Å²	57	58%	0.579	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-17	178.6	0	0	0	0	0	114.4	R648 S650	R648-A652 WeakPolarHBondContact O-CB 3.17Å; R648-A652 PolarHBondContact O-N 2.88Å; R648-A652 VanDerWaalsContact O-N 3.13Å; S650-A652 VanDerWaalsContact C-N 3.28Å; S650-A652 PolarHBondContact O-N 2.62Å
653	R	95.2	Very high	94.5	Very high	40 Å²	40	61.2 Å²	61.2	15%	0.151	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	11.6	-174.5	-72.7	153.3	177.8	76.7	10.3	113.8	V649 S650 E651 V655 Q656 L657 G685 D689 I692	V649-R653 WeakPolarHBondContact O-CD 3.49Å; V649-R653 PolarHBondContact O-NH1 3.47Å; S650-R653 PolarHBondContact O-N 2.96Å; E651-R653 PolarHBondContact O-N 3.1Å; E651-R653 VanDerWaalsContact O-N 3.11Å; R653-V655 VanDerWaalsContact C-N 3.27Å; R653-V655 PolarHBondContact O-N 3.41Å; R653-Q656 PolarHBondContact O-N 3.47Å; R653-L657 HydrophobicContact CB-CD1 4.4Å; R653-L657 WeakPolarHBondContact O-CG 3.2Å; R653-L657 PolarHBondContact O-N 3.24Å; R653-G685 VanDerWaalsContact NH2-CA 3.32Å; R653-D689 WeakPolarHBondContact CD-OD1 3.43Å; R653-D689 IonicContact CZ-OD1 2.92Å; R653-D689 IonicContact CZ-OD2 3.6Å; R653-D689 IonicContact NE-OD1 3.71Å; R653-D689 PolarHBondContact NE-OD1 3.24Å; R653-D689 IonicContact NE-OD2 3.77Å; R653-D689 IonicContact NH2-OD1 3.58Å; R653-D689 IonicContact NH2-OD2 3.1Å; R653-D689 PolarHBondContact NH2-OD2 2.94Å; R653-I692 HydrophobicContact CB-CD1 4.02Å; R653-I692 HydrophobicContact CG-CD1 4.32Å
654	T	94.6	Very high	94.5	Very high	84 Å²	84	62.1 Å²	62.1	52%	0.515	33%	0.33	S	S	.	.	H	α-helix	trans	-54.3	-41.7	-177.9	-53	0	0	0	0	112.5	S650 E651 A658	S650-T654 PolarHBondContact O-N 3.17Å; E651-T654 PolarHBondContact O-N 3.14Å; E651-T654 PolarHBondContact O-OG1 3.06Å; T654-A658 WeakPolarHBondContact O-CB 3.49Å; T654-A658 PolarHBondContact O-N 2.86Å
655	V	92.9	Very high	94.6	Very high	102 Å²	102	65.5 Å²	65.5	62%	0.618	34%	0.344	S	S	*	.	H	α-helix	trans	-65.6	-47.8	-179.2	179.8	0	0	0	0	111.3	R653 L657 A658 E659	R653-V655 VanDerWaalsContact C-N 3.27Å; R653-V655 PolarHBondContact O-N 3.41Å; V655-L657 VanDerWaalsContact C-N 3.32Å; V655-L657 PolarHBondContact O-N 3.14Å; V655-A658 PolarHBondContact O-N 2.75Å; V655-E659 HydrophobicContact CG1-CG 4.43Å; V655-E659 WeakPolarHBondContact O-CG 3.37Å; V655-E659 PolarHBondContact O-N 2.97Å
656	Q	90.9	Very high	94.6	Very high	83 Å²	83	68.2 Å²	68.2	39%	0.388	36%	0.36	S	S	.	.	H	α-helix	trans	-65.8	-36.2	-178.7	-65.3	165.9	-54.6	0	0	112.1	R653 K660 I692	R653-Q656 PolarHBondContact O-N 3.47Å; Q656-K660 PolarHBondContact O-N 2.81Å; Q656-I692 HydrophobicContact CB-CG2 4.26Å
657	L	94.3	Very high	94.5	Very high	14 Å²	14	71.7 Å²	71.7	7%	0.073	38%	0.377	C	S	.	.	H	α-helix	trans	-65.2	-44.4	173.7	-70.9	162.4	0	0	0	111.1	R653 V655 K660 N661 I662 L664 I692 I701	R653-L657 HydrophobicContact CB-CD1 4.4Å; R653-L657 WeakPolarHBondContact O-CG 3.2Å; R653-L657 PolarHBondContact O-N 3.24Å; V655-L657 VanDerWaalsContact C-N 3.32Å; V655-L657 PolarHBondContact O-N 3.14Å; L657-K660 PolarHBondContact O-N 2.86Å; L657-N661 PolarHBondContact O-N 3.4Å; L657-I662 HydrophobicContact CD2-CB 4Å; L657-I662 HydrophobicContact CD2-CG2 3.82Å; L657-I662 PolarHBondContact O-N 3.32Å; L657-L664 HydrophobicContact CD1-CB 3.96Å; L657-L664 HydrophobicContact CD1-CD2 3.71Å; L657-L664 HydrophobicContact CD1-CG 4.44Å; L657-L664 HydrophobicContact CD2-CB 4.19Å; L657-I692 HydrophobicContact CD2-CD1 3.95Å; L657-I692 HydrophobicContact CD2-CG1 3.79Å; L657-I692 HydrophobicContact CG-CD1 4.02Å; L657-I692 HydrophobicContact CG-CG1 4.38Å; L657-I701 HydrophobicContact CD2-CD1 4.37Å
658	A	94.1	Very high	94.3	Very high	71 Å²	71	71.4 Å²	71.4	59%	0.587	39%	0.393	S	S	*	.	H	α-helix	trans	-65.9	-40.3	178.8	0	0	0	0	0	112.4	T654 V655 K660 N661	T654-A658 WeakPolarHBondContact O-CB 3.49Å; T654-A658 PolarHBondContact O-N 2.86Å; V655-A658 PolarHBondContact O-N 2.75Å; A658-K660 VanDerWaalsContact C-N 3.26Å; A658-K660 PolarHBondContact O-N 3.17Å; A658-N661 PolarHBondContact O-N 2.9Å
659	E	90.4	Very high	94.1	Very high	152 Å²	152	68.1 Å²	68.1	71%	0.71	38%	0.382	S	S	*	.	H	α-helix	trans	-57.9	-36.2	177.9	-79	177.7	173.1	0	0	112.9	V655	V655-E659 HydrophobicContact CG1-CG 4.43Å; V655-E659 WeakPolarHBondContact O-CG 3.37Å; V655-E659 PolarHBondContact O-N 2.97Å
660	K	89.2	Confident	93.8	Very high	54 Å²	54	77.2 Å²	77.2	24%	0.235	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	5.9	176.8	-64.4	-175.3	72.9	-174.6	0	113.5	Q656 L657 A658 I662 I692 D693 T695 E697 S698	Q656-K660 PolarHBondContact O-N 2.81Å; L657-K660 PolarHBondContact O-N 2.86Å; A658-K660 VanDerWaalsContact C-N 3.26Å; A658-K660 PolarHBondContact O-N 3.17Å; K660-I662 HydrophobicContact CB-CD1 3.64Å; K660-I662 HydrophobicContact CB-CG1 3.77Å; K660-I662 HydrophobicContact CD-CD1 4.09Å; K660-I662 HydrophobicContact CG-CD1 4.46Å; K660-I662 PolarHBondContact O-N 3.35Å; K660-I692 HydrophobicContact CD-CG2 4.45Å; K660-I692 PolarHBondContact NZ-O 2.91Å; K660-D693 PolarHBondContact NZ-O 3.24Å; K660-T695 WeakPolarHBondContact CE-O 3.41Å; K660-T695 PolarHBondContact NZ-O 3.32Å; K660-E697 CarbonylContact O-C 3.6Å; K660-E697 VanDerWaalsContact O-CA 3.26Å; K660-E697 WeakPolarHBondContact O-CA 3.41Å; K660-S698 PolarHBondContact O-N 3.06Å
661	N	94	Very high	93.5	Very high	107 Å²	107	77.5 Å²	77.5	57%	0.572	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	32.7	-174.5	-164.6	37.3	0	0	0	113.7	L657 A658 S698	L657-N661 PolarHBondContact O-N 3.4Å; A658-N661 PolarHBondContact O-N 2.9Å; N661-S698 PolarHBondContact ND2-OG 3.22Å; N661-S698 VanDerWaalsContact ND2-OG 3.1Å; N661-S698 VanDerWaalsContact O-CA 3.29Å; N661-S698 WeakPolarHBondContact O-CA 3.26Å
662	I	95.1	Very high	93.3	Very high	11 Å²	11	74.8 Å²	74.8	6%	0.056	42%	0.416	C	S	.	.			trans	-81	130	-176.7	-67.3	167.1	0	0	0	109.7	L657 K660 L664 I692 T695 G699 I701	L657-I662 HydrophobicContact CD2-CB 4Å; L657-I662 HydrophobicContact CD2-CG2 3.82Å; L657-I662 PolarHBondContact O-N 3.32Å; K660-I662 HydrophobicContact CB-CD1 3.64Å; K660-I662 HydrophobicContact CB-CG1 3.77Å; K660-I662 HydrophobicContact CD-CD1 4.09Å; K660-I662 HydrophobicContact CG-CD1 4.46Å; K660-I662 PolarHBondContact O-N 3.35Å; I662-L664 PolarHBondContact O-N 3.02Å; I662-I692 HydrophobicContact CD1-CG2 4.29Å; I662-T695 HydrophobicContact CD1-CG2 3.96Å; I662-T695 HydrophobicContact CG1-CG2 3.99Å; I662-T695 HydrophobicContact CG2-CG2 4.2Å; I662-G699 WeakPolarHBondContact CA-O 3.41Å; I662-I701 HydrophobicContact CG2-CB 4.43Å; I662-I701 HydrophobicContact CG2-CD1 3.77Å; I662-I701 HydrophobicContact CG2-CG1 3.82Å
663	T	96.1	Very high	93.2	Very high	87 Å²	87	71.4 Å²	71.4	53%	0.534	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	114.2	173.6	-57	0	0	0	0	110.3	G699 R700 I701	T663-G699 PolarHBondContact N-O 2.78Å; T663-R700 WeakPolarHBondContact O-CA 3.36Å; T663-I701 PolarHBondContact O-N 3.37Å
664	L	96.7	Very high	92.9	Very high	38 Å²	38	70.4 Å²	70.4	20%	0.199	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	115.6	172.1	-178.6	63	0	0	0	110.5	S650 L657 I662 V666 L688 I701 L703	S650-L664 WeakPolarHBondContact OG-CD2 3.28Å; L657-L664 HydrophobicContact CD1-CB 3.96Å; L657-L664 HydrophobicContact CD1-CD2 3.71Å; L657-L664 HydrophobicContact CD1-CG 4.44Å; L657-L664 HydrophobicContact CD2-CB 4.19Å; I662-L664 PolarHBondContact O-N 3.02Å; L664-V666 HydrophobicContact CD2-CG2 4.38Å; L664-V666 HydrophobicContact CG-CG2 4.22Å; L664-L688 HydrophobicContact CD1-CD1 4.11Å; L664-I701 CarbonylContact C-O 3.46Å; L664-I701 WeakPolarHBondContact CA-O 3.48Å; L664-I701 HydrophobicContact CD1-CB 3.93Å; L664-I701 HydrophobicContact CD1-CG2 3.76Å; L664-L703 HydrophobicContact CD1-CD1 4.14Å; L664-L703 HydrophobicContact CD1-CG 4.01Å; L664-L703 HydrophobicContact CD2-CD1 4.37Å
665	H	96.3	Very high	92.8	Very high	88 Å²	88	66.4 Å²	66.4	41%	0.407	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	113.3	174.6	-165.6	-48.7	0	0	0	110.5	M667 I701 T702 L703	H665-M667 WeakPolarHBondContact CE1-CE 3.43Å; H665-M667 WeakPolarHBondContact ND1-CE 3.44Å; H665-I701 PolarHBondContact N-O 3.11Å; H665-T702 HydrophobicContact CB-CG2 4.49Å; H665-T702 CarbonylContact O-C 3.56Å; H665-T702 VanDerWaalsContact O-CA 3.28Å; H665-T702 WeakPolarHBondContact O-CA 3.28Å; H665-L703 PolarHBondContact O-N 3.05Å
666	V	96.2	Very high	92.7	Very high	56 Å²	56	63.1 Å²	63.1	34%	0.339	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	115.7	175.1	-172.9	0	0	0	0	109.2	F646 L664 L703	F646-V666 HydrophobicContact CB-CG1 3.88Å; F646-V666 HydrophobicContact CD2-CG1 3.76Å; F646-V666 HydrophobicContact CG-CG1 4.26Å; L664-V666 HydrophobicContact CD2-CG2 4.38Å; L664-V666 HydrophobicContact CG-CG2 4.22Å; V666-L703 HydrophobicContact CG1-CB 4.45Å; V666-L703 HydrophobicContact CG2-CB 4.45Å; V666-L703 HydrophobicContact CG2-CD1 4.28Å
667	M	95.6	Very high	92.8	Very high	74 Å²	74	61.6 Å²	61.6	37%	0.365	34%	0.339	S	S	.	.			trans	-70.5	133.1	173.9	-66.7	-81.1	99.8	0	0	109.8	H665 T702 L703	H665-M667 WeakPolarHBondContact CE1-CE 3.43Å; H665-M667 WeakPolarHBondContact ND1-CE 3.44Å; M667-T702 HydrophobicContact CG-CG2 4.09Å; M667-L703 PolarHBondContact N-O 2.91Å
668	P	91.7	Very high	92.7	Very high	129 Å²	129	64 Å²	64	84%	0.838	36%	0.361	S	S	*	.			trans	-56.5	138.2	172.3	-23.9	33.7	0	0	0	111.8
669	T	91.1	Very high	92.6	Very high	21 Å²	21	61.2 Å²	61.2	13%	0.129	34%	0.336	C	S	.	.			trans	-148.2	146.8	178.1	179.3	0	0	0	0	109.7	V642 A643 F646 V671 A705	V642-T669 HydrophobicContact CB-CG2 4.29Å; V642-T669 HydrophobicContact CG1-CG2 3.91Å; A643-T669 HydrophobicContact CB-CG2 4.3Å; A643-T669 WeakPolarHBondContact CB-O 3.3Å; F646-T669 HydrophobicContact CD2-CG2 4.11Å; F646-T669 HydrophobicContact CE2-CG2 4.1Å; T669-V671 VanDerWaalsContact OG1-CG2 3.31Å; T669-V671 WeakPolarHBondContact OG1-CG2 3.45Å; T669-V671 PolarHBondContact OG1-N 3.38Å; T669-A705 HydrophobicContact CG2-CB 4.31Å
670	E	88.8	Confident	92.8	Very high	191 Å²	191	54 Å²	54	89%	0.893	30%	0.302	S	S	*	.			trans	-121.6	27.1	175.4	-63.6	-172.5	167	0	0	111.1
671	V	90.9	Very high	93.1	Very high	24 Å²	24	54.3 Å²	54.3	15%	0.145	31%	0.305	C	S	.	.			trans	-92.9	140.9	-171	-176	0	0	0	0	111.2	V642 T669 V707 V712	V642-V671 VanDerWaalsContact CB-O 3.22Å; V642-V671 WeakPolarHBondContact CB-O 3.42Å; V642-V671 WeakPolarHBondContact CG2-O 3.24Å; V642-V671 PolarHBondContact N-O 2.93Å; V642-V671 VanDerWaalsContact N-O 3.12Å; T669-V671 VanDerWaalsContact OG1-CG2 3.31Å; T669-V671 WeakPolarHBondContact OG1-CG2 3.45Å; T669-V671 PolarHBondContact OG1-N 3.38Å; V671-V707 HydrophobicContact CB-CG2 4.22Å; V671-V707 HydrophobicContact CG1-CG2 3.78Å; V671-V707 HydrophobicContact CG2-CG2 3.32Å; V671-V712 HydrophobicContact CG1-CB 4.17Å; V671-V712 HydrophobicContact CG1-CG1 3.61Å; V671-V712 HydrophobicContact CG1-CG2 3.43Å; V671-V712 VanDerWaalsContact CG1-CG2 3.43Å
672	N	91.2	Very high	93	Very high	74 Å²	74	52.4 Å²	52.4	40%	0.396	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	144.3	171	-67	-34	0	0	0	111	V639 V640 D641	V639-N672 HydrophobicContact CG1-CB 3.78Å; V640-N672 WeakPolarHBondContact O-CA 3.5Å; D641-N672 WeakPolarHBondContact CA-OD1 3.42Å
673	V	91.9	Very high	93	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	152.8	174.7	-63.9	0	0	0	0	111	V640 V642 A675 L680 V712 L781	V640-V673 HydrophobicContact CB-CG2 4.08Å; V640-V673 PolarHBondContact N-O 3.4Å; V640-V673 PolarHBondContact O-N 3.47Å; V640-V673 VanDerWaalsContact O-N 3.09Å; V642-V673 HydrophobicContact CG2-CG1 3.97Å; V642-V673 HydrophobicContact CG2-CG2 4.03Å; V673-A675 HydrophobicContact CG2-CB 4.35Å; V673-L680 HydrophobicContact CG2-CD2 3.59Å; V673-V712 HydrophobicContact CG1-CB 3.59Å; V673-V712 HydrophobicContact CG1-CG1 3.69Å; V673-V712 HydrophobicContact CG1-CG2 3.83Å; V673-L781 HydrophobicContact CG2-CD1 4.4Å
674	A	89.2	Confident	93	Very high	19 Å²	19	47.7 Å²	47.7	16%	0.157	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	106.2	173	0	0	0	0	0	109	L637 T638 H784	L637-A674 HydrophobicContact CB-CB 4.2Å; L637-A674 HydrophobicContact CD1-CB 4.43Å; T638-A674 WeakPolarHBondContact O-CA 3.39Å; A674-H784 HydrophobicContact CB-CB 4.06Å
675	A	91.4	Very high	93	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	164.3	-175.3	0	0	0	0	0	111.5	T638 V640 V673 P677 L680 F761	T638-A675 PolarHBondContact N-O 3.4Å; T638-A675 PolarHBondContact O-N 3.32Å; T638-A675 PolarHBondContact OG1-O 2.9Å; V640-A675 HydrophobicContact CG2-CB 4.14Å; V673-A675 HydrophobicContact CG2-CB 4.35Å; A675-P677 WeakPolarHBondContact O-CD 3.3Å; A675-L680 HydrophobicContact CB-CB 4.07Å; A675-L680 HydrophobicContact CB-CD2 3.64Å; A675-L680 HydrophobicContact CB-CG 4.38Å; A675-F761 HydrophobicContact CB-CD2 4.2Å; A675-F761 HydrophobicContact CB-CE1 4.37Å; A675-F761 HydrophobicContact CB-CE2 3.76Å; A675-F761 HydrophobicContact CB-CZ 3.87Å
676	E	92.1	Very high	92.8	Very high	32 Å²	32	43.2 Å²	43.2	15%	0.15	24%	0.243	C	C	.	.			trans	-79.9	118.2	163.1	-176.9	174.9	159.4	0	0	108.7	R632 V635 A678 L679 L680 F761	R632-E676 IonicContact CZ-OE1 3.95Å; R632-E676 VanDerWaalsContact CZ-OE1 3.29Å; R632-E676 IonicContact CZ-OE2 3.29Å; R632-E676 IonicContact NE-OE2 2.68Å; R632-E676 VanDerWaalsContact NH1-CD 3.31Å; R632-E676 IonicContact NH1-OE1 3.73Å; R632-E676 PolarHBondContact NH1-OE1 3.05Å; R632-E676 IonicContact NH1-OE2 2.88Å; R632-E676 PolarHBondContact NH1-OE2 3.24Å; R632-E676 VanDerWaalsContact NH2-CD 3.28Å; R632-E676 IonicContact NH2-OE1 3.05Å; R632-E676 PolarHBondContact NH2-OE1 3.33Å; R632-E676 IonicContact NH2-OE2 2.85Å; R632-E676 PolarHBondContact NH2-OE2 3.4Å; V635-E676 HydrophobicContact CG1-CB 3.8Å; V635-E676 VanDerWaalsContact CG1-OE2 3.3Å; V635-E676 WeakPolarHBondContact CG1-OE2 3.38Å; E676-A678 VanDerWaalsContact C-N 3.33Å; E676-A678 PolarHBondContact O-N 3.5Å; E676-L679 HydrophobicContact CB-CB 4.3Å; E676-L679 HydrophobicContact CB-CD1 4.24Å; E676-L679 HydrophobicContact CB-CG 4.35Å; E676-L679 HydrophobicContact CG-CD1 4.44Å; E676-L679 HydrophobicContact CG-CG 4.26Å; E676-L679 PolarHBondContact O-N 3.38Å; E676-L679 WeakPolarHBondContact OE2-CD1 3.13Å; E676-L680 PolarHBondContact O-N 3.43Å; E676-F761 HydrophobicContact CB-CE1 4.05Å; E676-F761 HydrophobicContact CB-CZ 3.95Å
677	P	92.6	Very high	92.8	Very high	51 Å²	51	40.8 Å²	40.8	33%	0.331	23%	0.228	S	C	.	.	H	α-helix	trans	-55.6	-44.3	-169.2	-23.5	28.1	0	0	0	113.6	T638 V640 A675 L680 E681	T638-P677 WeakPolarHBondContact OG1-CD 3.13Å; T638-P677 WeakPolarHBondContact OG1-CG 3.45Å; V640-P677 HydrophobicContact CG2-CB 4.15Å; V640-P677 HydrophobicContact CG2-CG 3.89Å; A675-P677 WeakPolarHBondContact O-CD 3.3Å; P677-L680 PolarHBondContact O-N 3.13Å; P677-E681 VanDerWaalsContact O-CB 3.27Å; P677-E681 WeakPolarHBondContact O-CB 3.39Å; P677-E681 PolarHBondContact O-N 3.42Å
678	A	91.8	Very high	92.8	Very high	65 Å²	65	37.3 Å²	37.3	54%	0.537	21%	0.211	S	C	.	.	H	α-helix	trans	-67.5	-41.9	-176.9	0	0	0	0	0	112.7	E676 Q682	E676-A678 VanDerWaalsContact C-N 3.33Å; E676-A678 PolarHBondContact O-N 3.5Å; A678-Q682 WeakPolarHBondContact O-CB 3.28Å; A678-Q682 PolarHBondContact O-N 3.37Å
679	L	91.8	Very high	92.9	Very high	13 Å²	13	33 Å²	33	7%	0.068	18%	0.181	C	C	.	.	H	α-helix	trans	-68.3	-41.2	178.3	-70.8	-176.4	0	0	0	111.5	L629 E676 Q682 A683 F753 V757 F761	L629-L679 HydrophobicContact CD1-CD1 3.7Å; L629-L679 HydrophobicContact CD1-CD2 3.66Å; L629-L679 HydrophobicContact CD1-CG 4.34Å; E676-L679 HydrophobicContact CB-CB 4.3Å; E676-L679 HydrophobicContact CB-CD1 4.24Å; E676-L679 HydrophobicContact CB-CG 4.35Å; E676-L679 HydrophobicContact CG-CD1 4.44Å; E676-L679 HydrophobicContact CG-CG 4.26Å; E676-L679 PolarHBondContact O-N 3.38Å; E676-L679 WeakPolarHBondContact OE2-CD1 3.13Å; L679-Q682 PolarHBondContact O-N 2.83Å; L679-A683 WeakPolarHBondContact O-CB 3.46Å; L679-A683 PolarHBondContact O-N 3.49Å; L679-F753 HydrophobicContact CD2-CZ 4.05Å; L679-V757 HydrophobicContact CB-CG1 4.39Å; L679-V757 HydrophobicContact CB-CG2 4.33Å; L679-F761 HydrophobicContact CB-CZ 3.99Å; L679-F761 HydrophobicContact CD1-CZ 4.44Å
680	L	94.9	Very high	92.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.1	-42.1	178.3	-176.4	58	0	0	0	111.6	V640 L645 V673 A675 E676 P677 Q682 A683 L684 L714 F761 L779 L781	V640-L680 HydrophobicContact CB-CD2 4.46Å; V640-L680 HydrophobicContact CG1-CD2 4.25Å; L645-L680 HydrophobicContact CD2-CD2 3.74Å; L645-L680 HydrophobicContact CD2-CG 3.74Å; V673-L680 HydrophobicContact CG2-CD2 3.59Å; A675-L680 HydrophobicContact CB-CB 4.07Å; A675-L680 HydrophobicContact CB-CD2 3.64Å; A675-L680 HydrophobicContact CB-CG 4.38Å; E676-L680 PolarHBondContact O-N 3.43Å; P677-L680 PolarHBondContact O-N 3.13Å; L680-Q682 VanDerWaalsContact C-N 3.35Å; L680-A683 PolarHBondContact O-N 2.96Å; L680-L684 WeakPolarHBondContact O-CB 3.37Å; L680-L684 PolarHBondContact O-N 3.21Å; L680-L714 HydrophobicContact CD1-CD1 3.99Å; L680-L714 HydrophobicContact CD2-CD1 4.36Å; L680-F761 HydrophobicContact CB-CE2 4.1Å; L680-F761 HydrophobicContact CD1-CE2 4.42Å; L680-L779 HydrophobicContact CD1-CD2 3.79Å; L680-L781 HydrophobicContact CD1-CD1 3.65Å; L680-L781 HydrophobicContact CD2-CD1 4.21Å
681	E	95.4	Very high	93.2	Very high	61 Å²	61	24.7 Å²	24.7	29%	0.285	14%	0.143	S	C	.	.	H	α-helix	trans	-61.3	-42.8	175.1	-171.9	166.3	149.4	0	0	112.1	L645 R648 V649 P677 G685	L645-E681 HydrophobicContact CD1-CB 3.63Å; L645-E681 HydrophobicContact CD1-CG 3.94Å; R648-E681 IonicContact CZ-OE2 2.84Å; R648-E681 IonicContact NE-OE1 3.91Å; R648-E681 IonicContact NE-OE2 3.3Å; R648-E681 PolarHBondContact NE-OE2 3.45Å; R648-E681 IonicContact NH2-OE2 2.96Å; R648-E681 PolarHBondContact NH2-OE2 3.15Å; V649-E681 HydrophobicContact CG2-CG 4.35Å; P677-E681 VanDerWaalsContact O-CB 3.27Å; P677-E681 WeakPolarHBondContact O-CB 3.39Å; P677-E681 PolarHBondContact O-N 3.42Å; E681-G685 PolarHBondContact O-N 3.46Å
682	Q	92.8	Very high	93.3	Very high	66 Å²	66	23.8 Å²	23.8	31%	0.308	14%	0.137	S	C	.	.	H	α-helix	trans	-66.8	-42.1	175.8	-171.5	179.1	-20.7	0	0	112.4	A678 L679 L680 G685 N686 F753	A678-Q682 WeakPolarHBondContact O-CB 3.28Å; A678-Q682 PolarHBondContact O-N 3.37Å; L679-Q682 PolarHBondContact O-N 2.83Å; L680-Q682 VanDerWaalsContact C-N 3.35Å; Q682-G685 PolarHBondContact O-N 3.46Å; Q682-N686 PolarHBondContact O-N 2.72Å; Q682-F753 HydrophobicContact CB-CE1 3.91Å; Q682-F753 HydrophobicContact CB-CZ 4.11Å; Q682-F753 HydrophobicContact CG-CD1 4.44Å; Q682-F753 HydrophobicContact CG-CE1 3.66Å; Q682-F753 HydrophobicContact CG-CZ 3.8Å; Q682-F753 VanDerWaalsContact NE2-CZ 3.3Å
683	A	94.5	Very high	93.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.9	-46.5	178.1	0	0	0	0	0	111.5	L679 L680 G685 N686 L687 F753 V754 V757 L779	L679-A683 WeakPolarHBondContact O-CB 3.46Å; L679-A683 PolarHBondContact O-N 3.49Å; L680-A683 PolarHBondContact O-N 2.96Å; A683-G685 VanDerWaalsContact C-N 3.31Å; A683-G685 PolarHBondContact O-N 2.97Å; A683-N686 PolarHBondContact O-N 2.96Å; A683-L687 PolarHBondContact O-N 3.37Å; A683-L687 VanDerWaalsContact O-N 3.12Å; A683-F753 HydrophobicContact CB-CE1 4.36Å; A683-V754 HydrophobicContact CB-CG1 4.5Å; A683-V754 HydrophobicContact CB-CG2 4.24Å; A683-V754 WeakPolarHBondContact O-CG2 3.5Å; A683-V757 HydrophobicContact CB-CB 4.08Å; A683-V757 HydrophobicContact CB-CG1 3.91Å; A683-V757 HydrophobicContact CB-CG2 4.25Å; A683-L779 HydrophobicContact CB-CD2 4.49Å
684	L	96.7	Very high	93.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.4	-36.5	176.5	-172.5	60.5	0	0	0	111.7	L645 F646 V649 L680 L687 L688 L703 V716	L645-L684 HydrophobicContact CD2-CD2 3.92Å; L645-L684 HydrophobicContact CG-CD2 4.09Å; F646-L684 HydrophobicContact CD1-CD2 3.53Å; F646-L684 HydrophobicContact CE1-CD2 3.53Å; V649-L684 HydrophobicContact CG2-CB 4.47Å; V649-L684 HydrophobicContact CG2-CD2 3.79Å; V649-L684 HydrophobicContact CG2-CG 4.24Å; L680-L684 WeakPolarHBondContact O-CB 3.37Å; L680-L684 PolarHBondContact O-N 3.21Å; L684-L687 PolarHBondContact O-N 3.04Å; L684-L688 WeakPolarHBondContact O-CB 3.27Å; L684-L688 PolarHBondContact O-N 2.97Å; L684-L703 HydrophobicContact CD1-CD2 4.43Å; L684-V716 HydrophobicContact CD1-CG2 3.76Å
685	G	95.4	Very high	93.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-56.9	-48.9	171.7	0	0	0	0	0	112.3	R653 E681 Q682 A683 L687 L688 D689	R653-G685 VanDerWaalsContact NH2-CA 3.32Å; E681-G685 PolarHBondContact O-N 3.46Å; Q682-G685 PolarHBondContact O-N 3.46Å; A683-G685 VanDerWaalsContact C-N 3.31Å; A683-G685 PolarHBondContact O-N 2.97Å; G685-L687 VanDerWaalsContact C-N 3.33Å; G685-L687 PolarHBondContact O-N 3.43Å; G685-L688 PolarHBondContact O-N 3.01Å; G685-L688 VanDerWaalsContact O-N 3.17Å; G685-D689 WeakPolarHBondContact O-CB 3.46Å; G685-D689 PolarHBondContact O-N 2.63Å; G685-D689 VanDerWaalsContact O-OD2 3.08Å
686	N	93.2	Very high	93.1	Very high	32 Å²	32	28 Å²	28	17%	0.171	16%	0.157	C	C	.	.	H	α-helix	trans	-61.9	-38.6	177.5	-73.9	-8.2	0	0	0	112.8	Q682 A683 N690 G750 F753 V754	Q682-N686 PolarHBondContact O-N 2.72Å; A683-N686 PolarHBondContact O-N 2.96Å; N686-N690 PolarHBondContact O-N 3.44Å; N686-N690 VanDerWaalsContact O-N 3.14Å; N686-N690 PolarHBondContact O-ND2 2.92Å; N686-G750 PolarHBondContact ND2-O 2.83Å; N686-F753 WeakPolarHBondContact ND2-CD1 3.46Å; N686-V754 HydrophobicContact CB-CG2 3.87Å
687	L	95.9	Very high	93.1	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-64.5	-42.7	175	-69.5	-178.6	0	0	0	111.3	A683 L684 G685 N690 A691 V716 L751 V754 A777 L779	A683-L687 PolarHBondContact O-N 3.37Å; A683-L687 VanDerWaalsContact O-N 3.12Å; L684-L687 PolarHBondContact O-N 3.04Å; G685-L687 VanDerWaalsContact C-N 3.33Å; G685-L687 PolarHBondContact O-N 3.43Å; L687-N690 PolarHBondContact O-N 2.96Å; L687-A691 PolarHBondContact O-N 3.44Å; L687-V716 HydrophobicContact CB-CB 4.47Å; L687-V716 HydrophobicContact CB-CG2 3.77Å; L687-V716 HydrophobicContact CD1-CG2 4.29Å; L687-L751 HydrophobicContact CD2-CD2 3.81Å; L687-V754 HydrophobicContact CD1-CG1 4.18Å; L687-V754 HydrophobicContact CD2-CB 4.47Å; L687-V754 HydrophobicContact CD2-CG1 4.06Å; L687-V754 HydrophobicContact CD2-CG2 4.07Å; L687-V754 HydrophobicContact CG-CG1 4.11Å; L687-V754 HydrophobicContact CG-CG2 4.03Å; L687-A777 HydrophobicContact CD1-CB 4.23Å; L687-A777 HydrophobicContact CD2-CB 3.86Å; L687-A777 HydrophobicContact CG-CB 4.49Å; L687-L779 HydrophobicContact CD1-CB 4.38Å
688	L	95.6	Very high	93	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-69.4	-39.2	179.2	-172.8	56.9	0	0	0	112.2	V649 L664 L684 G685 N690 A691 I692 I701 L703 V716	V649-L688 HydrophobicContact CG1-CD2 4.26Å; L664-L688 HydrophobicContact CD1-CD1 4.11Å; L684-L688 WeakPolarHBondContact O-CB 3.27Å; L684-L688 PolarHBondContact O-N 2.97Å; G685-L688 PolarHBondContact O-N 3.01Å; G685-L688 VanDerWaalsContact O-N 3.17Å; L688-N690 VanDerWaalsContact C-N 3.33Å; L688-N690 PolarHBondContact O-N 3.18Å; L688-A691 WeakPolarHBondContact O-CB 3.37Å; L688-A691 PolarHBondContact O-N 2.95Å; L688-I692 HydrophobicContact CG-CD1 4.16Å; L688-I692 VanDerWaalsContact O-CG1 3.28Å; L688-I692 WeakPolarHBondContact O-CG1 3.38Å; L688-I692 PolarHBondContact O-N 2.77Å; L688-I701 HydrophobicContact CD1-CD1 4.44Å; L688-I701 HydrophobicContact CD1-CG2 3.8Å; L688-L703 HydrophobicContact CD1-CD2 4.36Å; L688-L703 HydrophobicContact CD2-CD1 4.22Å; L688-V716 HydrophobicContact CD1-CG1 4.26Å
689	D	93	Very high	93	Very high	39 Å²	39	32.5 Å²	32.5	21%	0.209	18%	0.175	C	C	.	.	H	α-helix	trans	-61.4	-42.5	175.6	-67.5	-30	0	0	0	110.9	R653 G685 I692 D693	R653-D689 WeakPolarHBondContact CD-OD1 3.43Å; R653-D689 IonicContact CZ-OD1 2.92Å; R653-D689 IonicContact CZ-OD2 3.6Å; R653-D689 IonicContact NE-OD1 3.71Å; R653-D689 PolarHBondContact NE-OD1 3.24Å; R653-D689 IonicContact NE-OD2 3.77Å; R653-D689 IonicContact NH2-OD1 3.58Å; R653-D689 IonicContact NH2-OD2 3.1Å; R653-D689 PolarHBondContact NH2-OD2 2.94Å; G685-D689 WeakPolarHBondContact O-CB 3.46Å; G685-D689 PolarHBondContact O-N 2.63Å; G685-D689 VanDerWaalsContact O-OD2 3.08Å; D689-I692 PolarHBondContact O-N 2.67Å; D689-D693 WeakPolarHBondContact O-CB 3.33Å; D689-D693 VanDerWaalsContact O-CG 3.3Å; D689-D693 PolarHBondContact O-N 3.39Å
690	N	92.2	Very high	93.2	Very high	35 Å²	35	39.1 Å²	39.1	19%	0.187	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-44.9	172.7	-72.3	-37.2	0	0	0	111.6	N686 L687 L688 I692 D693 F694 L751	N686-N690 PolarHBondContact O-N 3.44Å; N686-N690 VanDerWaalsContact O-N 3.14Å; N686-N690 PolarHBondContact O-ND2 2.92Å; L687-N690 PolarHBondContact O-N 2.96Å; L688-N690 VanDerWaalsContact C-N 3.33Å; L688-N690 PolarHBondContact O-N 3.18Å; N690-I692 VanDerWaalsContact C-N 3.32Å; N690-I692 PolarHBondContact O-N 2.89Å; N690-D693 PolarHBondContact O-N 3.36Å; N690-F694 VanDerWaalsContact O-CD2 3.26Å; N690-F694 WeakPolarHBondContact O-CD2 3.46Å; N690-F694 PolarHBondContact O-N 2.73Å; N690-F694 VanDerWaalsContact O-N 3.1Å; N690-L751 WeakPolarHBondContact ND2-CD2 3.44Å; N690-L751 WeakPolarHBondContact ND2-CG 3.35Å
691	A	94.1	Very high	93.3	Very high	3 Å²	3	39.1 Å²	39.1	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-59	-43	176.8	0	0	0	0	0	111.6	L687 L688 T695 I701 V716 D718	L687-A691 PolarHBondContact O-N 3.44Å; L688-A691 WeakPolarHBondContact O-CB 3.37Å; L688-A691 PolarHBondContact O-N 2.95Å; A691-T695 VanDerWaalsContact O-CB 3.24Å; A691-T695 WeakPolarHBondContact O-CB 3.41Å; A691-T695 PolarHBondContact O-N 3.27Å; A691-T695 PolarHBondContact O-OG1 2.9Å; A691-I701 HydrophobicContact CB-CD1 3.81Å; A691-I701 HydrophobicContact CB-CG1 4.22Å; A691-I701 HydrophobicContact CB-CG2 4.15Å; A691-V716 HydrophobicContact CB-CG1 3.7Å; A691-D718 HydrophobicContact CB-CB 3.98Å
692	I	93	Very high	93.4	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-62.6	-44.9	176.2	-68.5	166.5	0	0	0	110.9	R653 Q656 L657 K660 I662 L688 D689 N690 F694 I701	R653-I692 HydrophobicContact CB-CD1 4.02Å; R653-I692 HydrophobicContact CG-CD1 4.32Å; Q656-I692 HydrophobicContact CB-CG2 4.26Å; L657-I692 HydrophobicContact CD2-CD1 3.95Å; L657-I692 HydrophobicContact CD2-CG1 3.79Å; L657-I692 HydrophobicContact CG-CD1 4.02Å; L657-I692 HydrophobicContact CG-CG1 4.38Å; K660-I692 HydrophobicContact CD-CG2 4.45Å; K660-I692 PolarHBondContact NZ-O 2.91Å; I662-I692 HydrophobicContact CD1-CG2 4.29Å; L688-I692 HydrophobicContact CG-CD1 4.16Å; L688-I692 VanDerWaalsContact O-CG1 3.28Å; L688-I692 WeakPolarHBondContact O-CG1 3.38Å; L688-I692 PolarHBondContact O-N 2.77Å; D689-I692 PolarHBondContact O-N 2.67Å; N690-I692 VanDerWaalsContact C-N 3.32Å; N690-I692 PolarHBondContact O-N 2.89Å; I692-F694 PolarHBondContact O-N 2.88Å; I692-I701 HydrophobicContact CB-CD1 4.38Å; I692-I701 HydrophobicContact CG1-CD1 3.7Å
693	D	89.6	Confident	93.6	Very high	46 Å²	46	34.5 Å²	34.5	25%	0.246	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-43.2	-179	-78.8	-29.1	0	0	0	112.4	K660 D689 N690 R740	K660-D693 PolarHBondContact NZ-O 3.24Å; D689-D693 WeakPolarHBondContact O-CB 3.33Å; D689-D693 VanDerWaalsContact O-CG 3.3Å; D689-D693 PolarHBondContact O-N 3.39Å; N690-D693 PolarHBondContact O-N 3.36Å; D693-R740 IonicContact OD1-CZ 3.81Å; D693-R740 IonicContact OD1-NE 2.79Å; D693-R740 IonicContact OD1-NH1 3.73Å; D693-R740 IonicContact OD1-NH2 3.88Å; D693-R740 IonicContact OD2-CZ 3.24Å; D693-R740 IonicContact OD2-NE 3.52Å; D693-R740 PolarHBondContact OD2-NE 3.01Å; D693-R740 IonicContact OD2-NH1 2.73Å; D693-R740 IonicContact OD2-NH2 3.55Å; D693-R740 PolarHBondContact OD2-NH2 3.45Å
694	F	90.2	Very high	93.7	Very high	64 Å²	64	35.6 Å²	35.6	28%	0.281	19%	0.187	S	C	.	.	H	α-helix	trans	-94.8	-13.4	-173.4	-70.7	-75.2	0	0	0	115.1	N690 I692 G720 L738	N690-F694 VanDerWaalsContact O-CD2 3.26Å; N690-F694 WeakPolarHBondContact O-CD2 3.46Å; N690-F694 PolarHBondContact O-N 2.73Å; N690-F694 VanDerWaalsContact O-N 3.1Å; I692-F694 PolarHBondContact O-N 2.88Å; F694-G720 WeakPolarHBondContact O-CA 3.39Å; F694-L738 HydrophobicContact CZ-CB 4.4Å
695	T	92.2	Very high	93.7	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	20%	0.195	C	C	.	.	S	Bend	trans	-72.5	132	171.8	-60.5	0	0	0	0	109.8	K660 I662 A691 I701 D718	K660-T695 WeakPolarHBondContact CE-O 3.41Å; K660-T695 PolarHBondContact NZ-O 3.32Å; I662-T695 HydrophobicContact CD1-CG2 3.96Å; I662-T695 HydrophobicContact CG1-CG2 3.99Å; I662-T695 HydrophobicContact CG2-CG2 4.2Å; A691-T695 VanDerWaalsContact O-CB 3.24Å; A691-T695 WeakPolarHBondContact O-CB 3.41Å; A691-T695 PolarHBondContact O-N 3.27Å; A691-T695 PolarHBondContact O-OG1 2.9Å; T695-I701 HydrophobicContact CG2-CG1 4.41Å; T695-D718 WeakPolarHBondContact OG1-CB 3.42Å
696	P	89	Confident	93.6	Very high	70 Å²	70	41.5 Å²	41.5	46%	0.455	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-65.9	166.1	174.9	28.5	-36.1	0	0	0	111.9	S698 G699 T719	P696-S698 PolarHBondContact O-N 3.41Å; P696-G699 PolarHBondContact O-N 3.23Å; P696-T719 WeakPolarHBondContact CD-O 3.37Å
697	E	90.4	Very high	93.4	Very high	153 Å²	153	43.2 Å²	43.2	72%	0.715	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	139.1	173.2	-70.5	179.3	-170.5	0	0	111	K660 G699	K660-E697 CarbonylContact O-C 3.6Å; K660-E697 VanDerWaalsContact O-CA 3.26Å; K660-E697 WeakPolarHBondContact O-CA 3.41Å; E697-G699 PolarHBondContact O-N 3.1Å
698	S	91.4	Very high	92.9	Very high	80 Å²	80	47 Å²	47	56%	0.559	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	12.8	-174.4	-49	0	0	0	0	115.6	K660 N661 P696	K660-S698 PolarHBondContact O-N 3.06Å; N661-S698 PolarHBondContact ND2-OG 3.22Å; N661-S698 VanDerWaalsContact ND2-OG 3.1Å; N661-S698 VanDerWaalsContact O-CA 3.29Å; N661-S698 WeakPolarHBondContact O-CA 3.26Å; P696-S698 PolarHBondContact O-N 3.41Å
699	G	92.6	Very high	92	Very high	11 Å²	11	55.6 Å²	55.6	11%	0.113	29%	0.29	C	S	.	.			trans	-72.5	-177.6	173	0	0	0	0	0	113.4	I662 T663 P696 E697	I662-G699 WeakPolarHBondContact CA-O 3.41Å; T663-G699 PolarHBondContact N-O 2.78Å; P696-G699 PolarHBondContact O-N 3.23Å; E697-G699 PolarHBondContact O-N 3.1Å
700	R	95.7	Very high	91.5	Very high	152 Å²	152	59.2 Å²	59.2	57%	0.574	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.6	139.7	-178.7	-172.3	-176.2	-62.3	166.1	2.1	111.2	T663 T719	T663-R700 WeakPolarHBondContact O-CA 3.36Å; R700-T719 HydrophobicContact CB-CG2 4.22Å; R700-T719 PolarHBondContact N-OG1 3.37Å; R700-T719 PolarHBondContact O-N 3.46Å; R700-T719 PolarHBondContact O-OG1 3.33Å
701	I	97.1	Very high	91.3	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.2	167.7	-60.8	170.2	0	0	0	108.4	L657 I662 T663 L664 H665 L688 A691 I692 T695 V716 L717 D718	L657-I701 HydrophobicContact CD2-CD1 4.37Å; I662-I701 HydrophobicContact CG2-CB 4.43Å; I662-I701 HydrophobicContact CG2-CD1 3.77Å; I662-I701 HydrophobicContact CG2-CG1 3.82Å; T663-I701 PolarHBondContact O-N 3.37Å; L664-I701 CarbonylContact C-O 3.46Å; L664-I701 WeakPolarHBondContact CA-O 3.48Å; L664-I701 HydrophobicContact CD1-CB 3.93Å; L664-I701 HydrophobicContact CD1-CG2 3.76Å; H665-I701 PolarHBondContact N-O 3.11Å; L688-I701 HydrophobicContact CD1-CD1 4.44Å; L688-I701 HydrophobicContact CD1-CG2 3.8Å; A691-I701 HydrophobicContact CB-CD1 3.81Å; A691-I701 HydrophobicContact CB-CG1 4.22Å; A691-I701 HydrophobicContact CB-CG2 4.15Å; I692-I701 HydrophobicContact CB-CD1 4.38Å; I692-I701 HydrophobicContact CG1-CD1 3.7Å; T695-I701 HydrophobicContact CG2-CG1 4.41Å; I701-V716 HydrophobicContact CG2-CG1 3.94Å; I701-L717 CarbonylContact C-O 3.54Å; I701-L717 VanDerWaalsContact CA-O 3.27Å; I701-L717 WeakPolarHBondContact CA-O 3.32Å; I701-D718 HydrophobicContact CG1-CB 4.35Å
702	T	97.1	Very high	91.3	Very high	30 Å²	30	58.8 Å²	58.8	18%	0.184	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	126.7	176.2	-51.3	0	0	0	0	110.4	H665 M667 L717	H665-T702 HydrophobicContact CB-CG2 4.49Å; H665-T702 CarbonylContact O-C 3.56Å; H665-T702 VanDerWaalsContact O-CA 3.28Å; H665-T702 WeakPolarHBondContact O-CA 3.28Å; M667-T702 HydrophobicContact CG-CG2 4.09Å; T702-L717 PolarHBondContact N-O 3.49Å; T702-L717 PolarHBondContact O-N 3.29Å
703	L	97.2	Very high	91.4	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126	168.5	-69.8	176.6	0	0	0	109.4	F646 L664 H665 V666 M667 L684 L688 K715 V716	F646-L703 HydrophobicContact CD2-CB 4.36Å; F646-L703 HydrophobicContact CE2-CB 4.34Å; L664-L703 HydrophobicContact CD1-CD1 4.14Å; L664-L703 HydrophobicContact CD1-CG 4.01Å; L664-L703 HydrophobicContact CD2-CD1 4.37Å; H665-L703 PolarHBondContact O-N 3.05Å; V666-L703 HydrophobicContact CG1-CB 4.45Å; V666-L703 HydrophobicContact CG2-CB 4.45Å; V666-L703 HydrophobicContact CG2-CD1 4.28Å; M667-L703 PolarHBondContact N-O 2.91Å; L684-L703 HydrophobicContact CD1-CD2 4.43Å; L688-L703 HydrophobicContact CD1-CD2 4.36Å; L688-L703 HydrophobicContact CD2-CD1 4.22Å; L703-K715 WeakPolarHBondContact CA-O 3.43Å; L703-V716 HydrophobicContact CD2-CB 4.15Å; L703-V716 HydrophobicContact CD2-CG1 4.01Å; L703-V716 HydrophobicContact CD2-CG2 3.59Å
704	S	97.1	Very high	91.7	Very high	22 Å²	22	57.1 Å²	57.1	15%	0.154	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	161.6	176.9	71.3	0	0	0	0	112.3	F646 K715	F646-S704 WeakPolarHBondContact CZ-O 3.29Å; S704-K715 PolarHBondContact N-O 3.1Å; S704-K715 PolarHBondContact O-N 3.26Å
705	A	95.4	Very high	92.1	Very high	21 Å²	21	55.2 Å²	55.2	17%	0.174	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.5	172.2	0	0	0	0	0	108.4	V642 F646 T669 A713 L714	V642-A705 HydrophobicContact CG1-CB 4.04Å; F646-A705 HydrophobicContact CE2-CB 4.26Å; F646-A705 HydrophobicContact CZ-CB 4.14Å; T669-A705 HydrophobicContact CG2-CB 4.31Å; A705-A713 WeakPolarHBondContact CA-O 3.24Å; A705-L714 HydrophobicContact CB-CD2 3.88Å
706	E	93.5	Very high	92.3	Very high	103 Å²	103	55.3 Å²	55.3	48%	0.481	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	139.8	175.7	-75.2	175.1	-143.4	0	0	109.8	V712 A713 K715	E706-V712 CarbonylContact O-C 3.55Å; E706-V712 WeakPolarHBondContact O-CA 3.34Å; E706-A713 PolarHBondContact N-O 2.82Å; E706-A713 PolarHBondContact O-N 3.15Å; E706-K715 WeakPolarHBondContact OE1-CE 3.45Å; E706-K715 IonicContact OE1-NZ 2.7Å; E706-K715 PolarHBondContact OE1-NZ 3.05Å; E706-K715 WeakPolarHBondContact OE2-CE 3.31Å; E706-K715 IonicContact OE2-NZ 3.66Å; E706-K715 PolarHBondContact OE2-NZ 3.05Å
707	V	89.9	Confident	92.7	Very high	68 Å²	68	54.8 Å²	54.8	41%	0.412	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.8	179.8	-174.9	0	0	0	0	108.9	V671 V712	V671-V707 HydrophobicContact CB-CG2 4.22Å; V671-V707 HydrophobicContact CG1-CG2 3.78Å; V671-V707 HydrophobicContact CG2-CG2 3.32Å; V707-V712 HydrophobicContact CG2-CG2 4.4Å
708	D	83.8	Confident	92.9	Very high	86 Å²	86	48 Å²	48	46%	0.46	25%	0.25	S	C	.	.			trans	-103.5	175.2	164.7	-172.4	16.5	0	0	0	108.9	E710 H711 R780	D708-E710 PolarHBondContact O-N 3.33Å; D708-E710 VanDerWaalsContact O-N 3.1Å; D708-H711 PolarHBondContact N-O 3.18Å; D708-H711 PolarHBondContact O-N 3.41Å; D708-R780 IonicContact OD2-CZ 3.71Å; D708-R780 IonicContact OD2-NH1 2.72Å; D708-R780 IonicContact OD2-NH2 3.73Å; D708-R780 PolarHBondContact OD2-NH2 3.08Å
709	Q	77.1	Confident	93.1	Very high	179 Å²	179	47.3 Å²	47.3	84%	0.836	24%	0.242	S	C	*	.	S	Bend	trans	-52.2	-38.9	-173.8	-68.1	-172.9	-7.1	0	0	113.4
710	E	83.3	Confident	92.9	Very high	115 Å²	115	47.2 Å²	47.2	54%	0.537	24%	0.241	S	C	.	.	S	Bend	trans	-118.7	-8.5	-176.4	-68.1	-172.2	162.5	0	0	114.6	D708 R783	D708-E710 PolarHBondContact O-N 3.33Å; D708-E710 VanDerWaalsContact O-N 3.1Å; E710-R783 PolarHBondContact O-N 2.92Å
711	H	88.6	Confident	92.5	Very high	29 Å²	29	44.9 Å²	44.9	13%	0.134	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	153.7	-166.2	-59.6	79.9	0	0	0	112.4	D708 R780 L781 H782	D708-H711 PolarHBondContact N-O 3.18Å; D708-H711 PolarHBondContact O-N 3.41Å; H711-R780 HydrophobicContact CB-CG 3.81Å; H711-R780 PolarHBondContact CD2-NE 3.36Å; H711-R780 VanDerWaalsContact CG-NE 3.26Å; H711-R780 PolarHBondContact ND1-NH2 3.36Å; H711-L781 CarbonylContact C-O 3.58Å; H711-L781 VanDerWaalsContact CA-O 3.22Å; H711-L781 WeakPolarHBondContact CA-O 3.35Å; H711-L781 WeakPolarHBondContact CB-O 3.46Å; H711-H782 AromaticContact CD2-CE1 3.92Å; H711-H782 AromaticContact CD2-ND1 3.73Å; H711-H782 AromaticContact CE1-CE1 3.92Å; H711-H782 AromaticContact NE2-CE1 3.21Å; H711-H782 PolarHBondContact NE2-CE1 2.94Å; H711-H782 AromaticContact NE2-ND1 3.41Å; H711-H782 PolarHBondContact NE2-ND1 3.39Å; H711-H782 AromaticContact NE2-NE2 4Å
712	V	92.9	Very high	92.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	122.2	171.3	-179.1	0	0	0	0	107.9	V671 V673 E706 V707 L714 L781 R783	V671-V712 HydrophobicContact CG1-CB 4.17Å; V671-V712 HydrophobicContact CG1-CG1 3.61Å; V671-V712 HydrophobicContact CG1-CG2 3.43Å; V671-V712 VanDerWaalsContact CG1-CG2 3.43Å; V673-V712 HydrophobicContact CG1-CB 3.59Å; V673-V712 HydrophobicContact CG1-CG1 3.69Å; V673-V712 HydrophobicContact CG1-CG2 3.83Å; E706-V712 CarbonylContact O-C 3.55Å; E706-V712 WeakPolarHBondContact O-CA 3.34Å; V707-V712 HydrophobicContact CG2-CG2 4.4Å; V712-L714 HydrophobicContact CG1-CD2 4.02Å; V712-L781 PolarHBondContact N-O 3.44Å; V712-L781 PolarHBondContact O-N 2.89Å; V712-R783 HydrophobicContact CG2-CB 4.11Å; V712-R783 HydrophobicContact CG2-CG 4.07Å
713	A	95	Very high	91.9	Very high	16 Å²	16	44.8 Å²	44.8	13%	0.132	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	110	175.8	0	0	0	0	0	110	A705 E706 L779	A705-A713 WeakPolarHBondContact CA-O 3.24Å; E706-A713 PolarHBondContact N-O 2.82Å; E706-A713 PolarHBondContact O-N 3.15Å; A713-L779 WeakPolarHBondContact CA-O 3.48Å
714	L	96.7	Very high	91.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	124	170.4	-53.2	-176	0	0	0	108.9	V642 L645 F646 L680 A705 V712 S778 L779 L781	V642-L714 HydrophobicContact CB-CD2 4.44Å; V642-L714 HydrophobicContact CG1-CD2 3.5Å; V642-L714 VanDerWaalsContact CG1-CD2 3.5Å; V642-L714 HydrophobicContact CG2-CD2 3.99Å; L645-L714 HydrophobicContact CD2-CD1 4.4Å; F646-L714 HydrophobicContact CE1-CD2 4.22Å; F646-L714 HydrophobicContact CZ-CD2 4.13Å; L680-L714 HydrophobicContact CD1-CD1 3.99Å; L680-L714 HydrophobicContact CD2-CD1 4.36Å; A705-L714 HydrophobicContact CB-CD2 3.88Å; V712-L714 HydrophobicContact CG1-CD2 4.02Å; L714-S778 WeakPolarHBondContact O-CA 3.29Å; L714-L779 HydrophobicContact CB-CB 4.47Å; L714-L779 PolarHBondContact N-O 2.73Å; L714-L779 PolarHBondContact O-N 3.12Å; L714-L781 HydrophobicContact CD1-CD1 4.31Å
715	K	97.2	Very high	91.1	Very high	24 Å²	24	52.4 Å²	52.4	10%	0.104	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	134.7	-168.9	-69.5	-177.3	-176.6	-171	0	111.6	L703 S704 E706 L776 A777	L703-K715 WeakPolarHBondContact CA-O 3.43Å; S704-K715 PolarHBondContact N-O 3.1Å; S704-K715 PolarHBondContact O-N 3.26Å; E706-K715 WeakPolarHBondContact OE1-CE 3.45Å; E706-K715 IonicContact OE1-NZ 2.7Å; E706-K715 PolarHBondContact OE1-NZ 3.05Å; E706-K715 WeakPolarHBondContact OE2-CE 3.31Å; E706-K715 IonicContact OE2-NZ 3.66Å; E706-K715 PolarHBondContact OE2-NZ 3.05Å; K715-L776 HydrophobicContact CB-CD1 4.03Å; K715-L776 HydrophobicContact CD-CD1 4.31Å; K715-L776 HydrophobicContact CD-CD2 4.39Å; K715-L776 HydrophobicContact CG-CD1 4.36Å; K715-A777 CarbonylContact C-O 3.42Å; K715-A777 VanDerWaalsContact CA-O 3.3Å; K715-A777 WeakPolarHBondContact CA-O 3.22Å
716	V	97.4	Very high	90.8	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.012	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	112.8	169.1	-168.9	0	0	0	0	107.3	L684 L687 L688 A691 I701 L703 A777	L684-V716 HydrophobicContact CD1-CG2 3.76Å; L687-V716 HydrophobicContact CB-CB 4.47Å; L687-V716 HydrophobicContact CB-CG2 3.77Å; L687-V716 HydrophobicContact CD1-CG2 4.29Å; L688-V716 HydrophobicContact CD1-CG1 4.26Å; A691-V716 HydrophobicContact CB-CG1 3.7Å; I701-V716 HydrophobicContact CG2-CG1 3.94Å; L703-V716 HydrophobicContact CD2-CB 4.15Å; L703-V716 HydrophobicContact CD2-CG1 4.01Å; L703-V716 HydrophobicContact CD2-CG2 3.59Å; V716-A777 HydrophobicContact CB-CB 4.41Å; V716-A777 PolarHBondContact N-O 3.48Å; V716-A777 PolarHBondContact O-N 3.44Å
717	L	97.4	Very high	90.6	Very high	59 Å²	59	53.9 Å²	53.9	31%	0.309	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.2	177	175.2	61.3	0	0	0	109.3	I701 T702 V770 V775 L776	I701-L717 CarbonylContact C-O 3.54Å; I701-L717 VanDerWaalsContact CA-O 3.27Å; I701-L717 WeakPolarHBondContact CA-O 3.32Å; T702-L717 PolarHBondContact N-O 3.49Å; T702-L717 PolarHBondContact O-N 3.29Å; L717-V770 HydrophobicContact CD1-CB 4.48Å; L717-V770 HydrophobicContact CD1-CG2 3.59Å; L717-V775 WeakPolarHBondContact CA-O 3.5Å; L717-L776 HydrophobicContact CB-CD1 3.8Å; L717-L776 HydrophobicContact CD1-CB 4.14Å; L717-L776 HydrophobicContact CD1-CD1 4.26Å
718	D	95.3	Very high	90.5	Very high	12 Å²	12	53.4 Å²	53.4	6%	0.064	28%	0.283	C	S	.	.			trans	-104.6	171.6	171.8	70.3	69	0	0	0	112.6	A691 T695 I701 G720 G774 V775	A691-D718 HydrophobicContact CB-CB 3.98Å; T695-D718 WeakPolarHBondContact OG1-CB 3.42Å; I701-D718 HydrophobicContact CG1-CB 4.35Å; D718-G720 WeakPolarHBondContact OD1-CA 3.5Å; D718-G720 PolarHBondContact OD1-N 2.98Å; D718-G774 WeakPolarHBondContact O-CA 3.35Å; D718-G774 WeakPolarHBondContact OD1-CA 3.35Å; D718-V775 PolarHBondContact N-O 3.04Å; D718-V775 PolarHBondContact OD1-N 3.45Å; D718-V775 WeakPolarHBondContact OD2-CB 3.44Å; D718-V775 PolarHBondContact OD2-N 3.13Å
719	T	94.2	Very high	90.6	Very high	64 Å²	64	54.2 Å²	54.2	39%	0.393	30%	0.296	S	S	.	.			trans	-115.6	30.2	174.8	45.9	0	0	0	0	111.1	P696 R700	P696-T719 WeakPolarHBondContact CD-O 3.37Å; R700-T719 HydrophobicContact CB-CG2 4.22Å; R700-T719 PolarHBondContact N-OG1 3.37Å; R700-T719 PolarHBondContact O-N 3.46Å; R700-T719 PolarHBondContact O-OG1 3.33Å
720	G	89.2	Confident	91.1	Very high	10 Å²	10	50.8 Å²	50.8	10%	0.103	28%	0.275	C	S	.	.	S	Bend	trans	-78.3	-163.8	-177.6	0	0	0	0	0	114.7	F694 D718 G722 G774	F694-G720 WeakPolarHBondContact O-CA 3.39Å; D718-G720 WeakPolarHBondContact OD1-CA 3.5Å; D718-G720 PolarHBondContact OD1-N 2.98Å; G720-G722 PolarHBondContact O-N 3.43Å; G720-G774 VanDerWaalsContact O-CA 3.27Å; G720-G774 WeakPolarHBondContact O-CA 3.38Å; G720-G774 PolarHBondContact O-N 3.4Å
721	S	87.3	Confident	91.4	Very high	103 Å²	103	46 Å²	46	72%	0.72	25%	0.253	S	S	*	.			trans	-73.2	-9.6	-176.4	57.9	0	0	0	0	115
722	G	90.2	Very high	91.4	Very high	12 Å²	12	47.2 Å²	47.2	12%	0.124	26%	0.258	C	S	.	.			trans	74.4	177.5	-165.1	0	0	0	0	0	112.6	G720 N769	G720-G722 PolarHBondContact O-N 3.43Å; G722-N769 WeakPolarHBondContact CA-OD1 3.33Å
723	I	90.5	Very high	91	Very high	15 Å²	15	51.3 Å²	51.3	8%	0.077	28%	0.277	C	S	.	.			trans	-103.8	126.3	176.7	-60	166.6	0	0	0	108.5	A727 L728 I731 L738 L767 N769 V775	I723-A727 HydrophobicContact CG2-CB 3.82Å; I723-L728 HydrophobicContact CB-CD2 3.78Å; I723-L728 HydrophobicContact CB-CG 4.32Å; I723-L728 HydrophobicContact CD1-CD2 4.12Å; I723-L728 HydrophobicContact CG2-CD2 3.78Å; I723-L728 HydrophobicContact CG2-CG 3.97Å; I723-I731 HydrophobicContact CG2-CG2 3.75Å; I723-L738 HydrophobicContact CG2-CD1 4.36Å; I723-L767 HydrophobicContact CD1-CB 3.99Å; I723-L767 HydrophobicContact CD1-CD2 3.65Å; I723-L767 HydrophobicContact CD1-CG 4.45Å; I723-N769 PolarHBondContact N-OD1 3.4Å; I723-N769 PolarHBondContact O-ND2 3.47Å; I723-V775 HydrophobicContact CD1-CG1 3.86Å; I723-V775 HydrophobicContact CD1-CG2 4.12Å; I723-V775 HydrophobicContact CG1-CG1 4.45Å; I723-V775 HydrophobicContact CG1-CG2 3.79Å
724	P	89.4	Confident	90.2	Very high	49 Å²	49	54.7 Å²	54.7	32%	0.318	29%	0.287	S	S	.	.			trans	-57.2	143.7	174.1	-24.6	34.3	0	0	0	112.7	Y726 A727 L728 L738	P724-Y726 HydrophobicContact CB-CD1 3.63Å; P724-Y726 HydrophobicContact CB-CE1 3.24Å; P724-Y726 HydrophobicContact CB-CE2 4.49Å; P724-Y726 HydrophobicContact CB-CG 4.41Å; P724-Y726 HydrophobicContact CG-CE1 3.95Å; P724-Y726 PolarHBondContact O-N 2.96Å; P724-Y726 VanDerWaalsContact O-N 3.12Å; P724-A727 HydrophobicContact CB-CB 4.49Å; P724-A727 WeakPolarHBondContact O-CA 3.35Å; P724-A727 WeakPolarHBondContact O-CB 3.3Å; P724-A727 PolarHBondContact O-N 2.91Å; P724-L728 PolarHBondContact O-N 3.26Å; P724-L738 HydrophobicContact CG-CD1 4.45Å
725	D	87.7	Confident	89.3	Confident	134 Å²	134	56.8 Å²	56.8	72%	0.717	30%	0.296	S	S	*	.	H	α-helix	trans	-55.8	-37.2	-174.5	-66.5	-21.1	0	0	0	113.5	A727 L728	D725-A727 PolarHBondContact O-N 2.97Å; D725-L728 PolarHBondContact O-N 2.9Å
726	Y	89.9	Confident	88.7	Confident	155 Å²	155	57.6 Å²	57.6	61%	0.608	30%	0.298	S	S	*	.	H	α-helix	trans	-66.2	-20.2	177.6	70.8	-101.2	0	0	0	113.5	P724 L738	P724-Y726 HydrophobicContact CB-CD1 3.63Å; P724-Y726 HydrophobicContact CB-CE1 3.24Å; P724-Y726 HydrophobicContact CB-CE2 4.49Å; P724-Y726 HydrophobicContact CB-CG 4.41Å; P724-Y726 HydrophobicContact CG-CE1 3.95Å; P724-Y726 PolarHBondContact O-N 2.96Å; P724-Y726 VanDerWaalsContact O-N 3.12Å; Y726-L738 HydrophobicContact CE2-CD2 4.32Å
727	A	89.8	Confident	88.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-94.9	-26.5	-177.4	0	0	0	0	0	111.9	I723 P724 D725 S729 R730 I731 Y736 L738	I723-A727 HydrophobicContact CG2-CB 3.82Å; P724-A727 HydrophobicContact CB-CB 4.49Å; P724-A727 WeakPolarHBondContact O-CA 3.35Å; P724-A727 WeakPolarHBondContact O-CB 3.3Å; P724-A727 PolarHBondContact O-N 2.91Å; D725-A727 PolarHBondContact O-N 2.97Å; A727-S729 PolarHBondContact O-N 3Å; A727-S729 VanDerWaalsContact O-N 3.12Å; A727-R730 CarbonylContact O-C 3.6Å; A727-R730 WeakPolarHBondContact O-CA 3.35Å; A727-R730 PolarHBondContact O-N 3.19Å; A727-I731 HydrophobicContact CB-CG2 4.13Å; A727-I731 VanDerWaalsContact O-CG2 3.27Å; A727-I731 WeakPolarHBondContact O-CG2 3.3Å; A727-I731 PolarHBondContact O-N 3.01Å; A727-Y736 HydrophobicContact CB-CE1 4.01Å; A727-Y736 WeakPolarHBondContact CB-OH 3.36Å; A727-L738 HydrophobicContact CB-CD1 4.11Å; A727-L738 HydrophobicContact CB-CD2 3.99Å; A727-L738 HydrophobicContact CB-CG 4.44Å
728	L	86.8	Confident	87.5	Confident	58 Å²	58	57.3 Å²	57.3	30%	0.304	30%	0.299	S	S	.	.	H	α-helix	trans	-51.7	-39.2	-174.5	-78.4	171.3	0	0	0	113.8	I723 P724 D725 R730 I731	I723-L728 HydrophobicContact CB-CD2 3.78Å; I723-L728 HydrophobicContact CB-CG 4.32Å; I723-L728 HydrophobicContact CD1-CD2 4.12Å; I723-L728 HydrophobicContact CG2-CD2 3.78Å; I723-L728 HydrophobicContact CG2-CG 3.97Å; P724-L728 PolarHBondContact O-N 3.26Å; D725-L728 PolarHBondContact O-N 2.9Å; L728-R730 VanDerWaalsContact C-N 3.28Å; L728-R730 PolarHBondContact O-N 3.42Å; L728-I731 WeakPolarHBondContact O-CG1 3.39Å
729	S	85.9	Confident	86.6	Confident	103 Å²	103	60.4 Å²	60.4	72%	0.72	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-12	179	66.8	0	0	0	0	114.1	A727	A727-S729 PolarHBondContact O-N 3Å; A727-S729 VanDerWaalsContact O-N 3.12Å
730	R	87.8	Confident	85.8	Confident	107 Å²	107	60.3 Å²	60.3	40%	0.404	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-13.7	-169.6	-56.1	-168.8	61.6	-157.6	-9.4	113.9	A727 L728 F732 E733 Y736	A727-R730 CarbonylContact O-C 3.6Å; A727-R730 WeakPolarHBondContact O-CA 3.35Å; A727-R730 PolarHBondContact O-N 3.19Å; L728-R730 VanDerWaalsContact C-N 3.28Å; L728-R730 PolarHBondContact O-N 3.42Å; R730-F732 PolarHBondContact O-N 3.23Å; R730-E733 HydrophobicContact CB-CG 4.33Å; R730-E733 WeakPolarHBondContact CG-OE1 3.26Å; R730-E733 IonicContact CZ-OE2 3.78Å; R730-E733 IonicContact NE-OE1 2.85Å; R730-E733 PolarHBondContact NE-OE1 3.31Å; R730-E733 IonicContact NE-OE2 3.89Å; R730-E733 PolarHBondContact NE-OE2 3.12Å; R730-E733 IonicContact NH2-OE2 3.43Å; R730-E733 PolarHBondContact NH2-OE2 3.25Å; R730-E733 WeakPolarHBondContact O-CB 3.41Å; R730-E733 WeakPolarHBondContact O-CG 3.38Å; R730-E733 PolarHBondContact O-N 3.43Å; R730-Y736 HydrophobicContact CB-CD1 4.21Å; R730-Y736 HydrophobicContact CB-CD2 4.15Å; R730-Y736 HydrophobicContact CB-CE1 4.09Å; R730-Y736 HydrophobicContact CB-CE2 4.03Å; R730-Y736 HydrophobicContact CB-CG 4.22Å; R730-Y736 WeakPolarHBondContact O-CD1 3.37Å
731	I	89.4	Confident	84.9	Confident	13 Å²	13	65.4 Å²	65.4	7%	0.067	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-19.2	-176.7	52.8	94.3	0	0	0	114.8	I723 A727 L728 Y736 L751 L767	I723-I731 HydrophobicContact CG2-CG2 3.75Å; A727-I731 HydrophobicContact CB-CG2 4.13Å; A727-I731 VanDerWaalsContact O-CG2 3.27Å; A727-I731 WeakPolarHBondContact O-CG2 3.3Å; A727-I731 PolarHBondContact O-N 3.01Å; L728-I731 WeakPolarHBondContact O-CG1 3.39Å; I731-Y736 HydrophobicContact CG2-CE1 4.29Å; I731-L751 HydrophobicContact CB-CD1 4.14Å; I731-L751 HydrophobicContact CD1-CD1 3.96Å; I731-L751 WeakPolarHBondContact O-CD1 3.4Å; I731-L767 HydrophobicContact CD1-CB 4.28Å; I731-L767 HydrophobicContact CD1-CD1 3.95Å; I731-L767 HydrophobicContact CD1-CD2 4.06Å; I731-L767 HydrophobicContact CD1-CG 4.33Å
732	F	90.1	Very high	83.9	Confident	56 Å²	56	65.5 Å²	65.5	25%	0.246	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-6.9	172.7	-63.8	-69.9	0	0	0	113.6	R730 L751 V765 L767	R730-F732 PolarHBondContact O-N 3.23Å; F732-L751 HydrophobicContact CD1-CB 3.98Å; F732-L751 HydrophobicContact CE1-CB 4.39Å; F732-V765 HydrophobicContact CD1-CG1 4.26Å; F732-V765 HydrophobicContact CE1-CB 4.36Å; F732-V765 HydrophobicContact CE1-CG1 3.45Å; F732-V765 VanDerWaalsContact CE1-CG1 3.45Å; F732-V765 HydrophobicContact CE1-CG2 4.01Å; F732-V765 HydrophobicContact CZ-CB 4.4Å; F732-V765 HydrophobicContact CZ-CG1 3.68Å; F732-V765 HydrophobicContact CZ-CG2 4.07Å; F732-L767 HydrophobicContact CE1-CD1 3.56Å; F732-L767 HydrophobicContact CE2-CD1 4.11Å; F732-L767 HydrophobicContact CZ-CD1 3.19Å
733	E	84.1	Confident	82.7	Confident	85 Å²	85	67.5 Å²	67.5	40%	0.397	37%	0.366	S	S	.	.	S	Bend	trans	-65.4	139	173.5	-65.7	173.8	-168.4	0	0	110	R730 Y736	R730-E733 HydrophobicContact CB-CG 4.33Å; R730-E733 WeakPolarHBondContact CG-OE1 3.26Å; R730-E733 IonicContact CZ-OE2 3.78Å; R730-E733 IonicContact NE-OE1 2.85Å; R730-E733 PolarHBondContact NE-OE1 3.31Å; R730-E733 IonicContact NE-OE2 3.89Å; R730-E733 PolarHBondContact NE-OE2 3.12Å; R730-E733 IonicContact NH2-OE2 3.43Å; R730-E733 PolarHBondContact NH2-OE2 3.25Å; R730-E733 WeakPolarHBondContact O-CB 3.41Å; R730-E733 WeakPolarHBondContact O-CG 3.38Å; R730-E733 PolarHBondContact O-N 3.43Å; E733-Y736 WeakPolarHBondContact O-CB 3.44Å; E733-Y736 PolarHBondContact O-N 3.48Å
734	R	78.4	Confident	81.5	Confident	88 Å²	88	72.7 Å²	72.7	33%	0.332	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	138.9	177.4	-63.4	170.3	-179.8	64.6	5.9	109.7	Y567 Q626 E630 Y736 L749 A752	Y567-R734 PolarHBondContact OH-NE 3.39Å; Q626-R734 VanDerWaalsContact NE2-CD 3.31Å; E630-R734 IonicContact OE1-CZ 2.96Å; E630-R734 VanDerWaalsContact OE1-CZ 3.23Å; E630-R734 IonicContact OE1-NE 3.35Å; E630-R734 PolarHBondContact OE1-NE 3.08Å; E630-R734 IonicContact OE1-NH2 3.85Å; E630-R734 PolarHBondContact OE1-NH2 3.38Å; R734-Y736 PolarHBondContact O-N 2.96Å; R734-Y736 VanDerWaalsContact O-N 3.11Å; R734-L749 HydrophobicContact CB-CD2 4.21Å; R734-A752 HydrophobicContact CG-CB 3.91Å
735	F	77.6	Confident	80.4	Confident	44 Å²	44	76.6 Å²	76.6	19%	0.193	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	65	3.3	-179.2	-48.3	-82.7	0	0	0	115.3	Y571 A574 E578 L623 S747 G748 L749	Y571-F735 HydrophobicContact CD2-CE2 4.33Å; A574-F735 HydrophobicContact CB-CD1 4.4Å; A574-F735 HydrophobicContact CB-CD2 3.5Å; A574-F735 VanDerWaalsContact CB-CD2 3.5Å; A574-F735 HydrophobicContact CB-CE1 4.34Å; A574-F735 HydrophobicContact CB-CE2 3.46Å; A574-F735 VanDerWaalsContact CB-CE2 3.46Å; A574-F735 HydrophobicContact CB-CG 3.98Å; A574-F735 HydrophobicContact CB-CZ 3.87Å; E578-F735 HydrophobicContact CG-CD1 4.22Å; L623-F735 HydrophobicContact CD2-CE1 3.75Å; L623-F735 HydrophobicContact CD2-CE2 4.49Å; L623-F735 HydrophobicContact CD2-CZ 3.41Å; L623-F735 VanDerWaalsContact CD2-CZ 3.41Å; F735-S747 WeakPolarHBondContact CA-O 3.46Å; F735-G748 PolarHBondContact N-O 2.93Å; F735-G748 VanDerWaalsContact N-O 3.14Å; F735-L749 HydrophobicContact CD1-CD2 3.95Å; F735-L749 HydrophobicContact CD1-CG 4.46Å; F735-L749 HydrophobicContact CD2-CD2 4.32Å; F735-L749 HydrophobicContact CE1-CD1 4.26Å; F735-L749 HydrophobicContact CE1-CD2 3.85Å; F735-L749 HydrophobicContact CE1-CG 4.41Å; F735-L749 HydrophobicContact CE2-CD2 4.2Å; F735-L749 HydrophobicContact CG-CD2 4.21Å; F735-L749 HydrophobicContact CZ-CD2 3.99Å
736	Y	83.8	Confident	79.8	Confident	41 Å²	41	72.2 Å²	72.2	16%	0.161	38%	0.382	C	S	.	.			trans	-81.9	120.5	170.9	-170.8	-89.8	0	0	0	109.2	A727 R730 I731 E733 R734 L738 G748	A727-Y736 HydrophobicContact CB-CE1 4.01Å; A727-Y736 WeakPolarHBondContact CB-OH 3.36Å; R730-Y736 HydrophobicContact CB-CD1 4.21Å; R730-Y736 HydrophobicContact CB-CD2 4.15Å; R730-Y736 HydrophobicContact CB-CE1 4.09Å; R730-Y736 HydrophobicContact CB-CE2 4.03Å; R730-Y736 HydrophobicContact CB-CG 4.22Å; R730-Y736 WeakPolarHBondContact O-CD1 3.37Å; I731-Y736 HydrophobicContact CG2-CE1 4.29Å; E733-Y736 WeakPolarHBondContact O-CB 3.44Å; E733-Y736 PolarHBondContact O-N 3.48Å; R734-Y736 PolarHBondContact O-N 2.96Å; R734-Y736 VanDerWaalsContact O-N 3.11Å; Y736-L738 HydrophobicContact CE1-CD2 4.35Å; Y736-G748 VanDerWaalsContact O-CA 3.28Å; Y736-G748 WeakPolarHBondContact O-CA 3.4Å
737	S	85.4	Confident	79.1	Confident	27 Å²	27	66.4 Å²	66.4	19%	0.189	36%	0.364	C	S	.	.			trans	-143.4	143.1	175.2	65.9	0	0	0	0	111.5	S746	S737-S746 WeakPolarHBondContact CB-O 3.39Å; S737-S746 PolarHBondContact OG-O 2.97Å
738	L	84.2	Confident	78.7	Confident	28 Å²	28	66.9 Å²	66.9	15%	0.147	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-83.9	144	171.4	-64.9	173.3	0	0	0	109.3	F694 I723 P724 Y726 A727 Y736 R740	F694-L738 HydrophobicContact CZ-CB 4.4Å; I723-L738 HydrophobicContact CG2-CD1 4.36Å; P724-L738 HydrophobicContact CG-CD1 4.45Å; Y726-L738 HydrophobicContact CE2-CD2 4.32Å; A727-L738 HydrophobicContact CB-CD1 4.11Å; A727-L738 HydrophobicContact CB-CD2 3.99Å; A727-L738 HydrophobicContact CB-CG 4.44Å; Y736-L738 HydrophobicContact CE1-CD2 4.35Å; L738-R740 PolarHBondContact O-N 3.18Å
739	P	77.5	Confident	78.5	Confident	76 Å²	76	64.1 Å²	64.1	49%	0.494	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-62.5	133.6	173.1	26.2	-31.6	0	0	0	110
740	R	76.7	Confident	78.6	Confident	62 Å²	62	60 Å²	60	23%	0.234	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-74	171	172.1	-64.2	173.1	179.7	175.6	-1.9	110.3	D693 L738 N742 G743 Q744	D693-R740 IonicContact OD1-CZ 3.81Å; D693-R740 IonicContact OD1-NE 2.79Å; D693-R740 IonicContact OD1-NH1 3.73Å; D693-R740 IonicContact OD1-NH2 3.88Å; D693-R740 IonicContact OD2-CZ 3.24Å; D693-R740 IonicContact OD2-NE 3.52Å; D693-R740 PolarHBondContact OD2-NE 3.01Å; D693-R740 IonicContact OD2-NH1 2.73Å; D693-R740 IonicContact OD2-NH2 3.55Å; D693-R740 PolarHBondContact OD2-NH2 3.45Å; L738-R740 PolarHBondContact O-N 3.18Å; R740-N742 VanDerWaalsContact CB-OD1 3.3Å; R740-N742 WeakPolarHBondContact CB-OD1 3.41Å; R740-N742 PolarHBondContact O-N 3.23Å; R740-N742 VanDerWaalsContact O-N 3.15Å; R740-G743 WeakPolarHBondContact O-CA 3.47Å; R740-G743 PolarHBondContact O-N 3.44Å; R740-Q744 WeakPolarHBondContact CB-O 3.42Å; R740-Q744 WeakPolarHBondContact CG-O 2.93Å; R740-Q744 PolarHBondContact N-O 3Å; R740-Q744 VanDerWaalsContact N-O 3.08Å
741	A	69.8	Low	78.9	Confident	118 Å²	118	56.2 Å²	56.2	98%	0.975	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.9	177.7	0	0	0	0	0	113.5	G743	A741-G743 PolarHBondContact O-N 2.95Å
742	N	67.2	Low	78.8	Confident	104 Å²	104	55.8 Å²	55.8	56%	0.556	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	5.1	174.4	68.2	-2.1	0	0	0	113.9	R740 Q744	R740-N742 VanDerWaalsContact CB-OD1 3.3Å; R740-N742 WeakPolarHBondContact CB-OD1 3.41Å; R740-N742 PolarHBondContact O-N 3.23Å; R740-N742 VanDerWaalsContact O-N 3.15Å; N742-Q744 PolarHBondContact O-N 3.46Å; N742-Q744 WeakPolarHBondContact OD1-CB 3.28Å; N742-Q744 PolarHBondContact OD1-N 3.11Å
743	G	64.1	Low	78.8	Confident	54 Å²	54	53.6 Å²	53.6	56%	0.557	31%	0.305	S	S	*	.	S	Bend	trans	76.5	-8.8	-177.3	0	0	0	0	0	115.2	R740 A741	R740-G743 WeakPolarHBondContact O-CA 3.47Å; R740-G743 PolarHBondContact O-N 3.44Å; A741-G743 PolarHBondContact O-N 2.95Å
744	Q	66.4	Low	79.3	Confident	125 Å²	125	49.6 Å²	49.6	58%	0.584	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-75.8	136.2	178.9	-67.2	-174.8	-5.4	0	0	110.8	R740 N742	R740-Q744 WeakPolarHBondContact CB-O 3.42Å; R740-Q744 WeakPolarHBondContact CG-O 2.93Å; R740-Q744 PolarHBondContact N-O 3Å; R740-Q744 VanDerWaalsContact N-O 3.08Å; N742-Q744 PolarHBondContact O-N 3.46Å; N742-Q744 WeakPolarHBondContact OD1-CB 3.28Å; N742-Q744 PolarHBondContact OD1-N 3.11Å
745	K	66.3	Low	79.9	Confident	131 Å²	131	47.6 Å²	47.6	57%	0.57	29%	0.286	S	S	*	.	B	Isolated β-bridge	trans	-92	135.8	172.9	-73.8	-172.4	179.8	-174.3	0	110
746	S	74.8	Confident	80.4	Confident	41 Å²	41	46.3 Å²	46.3	29%	0.287	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-71.9	168.4	167.5	-173.3	0	0	0	0	110.6	S737 G748	S737-S746 WeakPolarHBondContact CB-O 3.39Å; S737-S746 PolarHBondContact OG-O 2.97Å; S746-G748 PolarHBondContact O-N 3.37Å; S746-G748 VanDerWaalsContact O-N 3.15Å
747	S	74.6	Confident	80.8	Confident	34 Å²	34	44.4 Å²	44.4	24%	0.238	27%	0.273	C	S	.	.			trans	-60.4	-20.6	176.8	62.9	0	0	0	0	113.6	F735 L749	F735-S747 WeakPolarHBondContact CA-O 3.46Å; S747-L749 PolarHBondContact O-N 2.88Å; S747-L749 PolarHBondContact OG-N 3.37Å
748	G	82.1	Confident	81	Confident	10 Å²	10	43.2 Å²	43.2	10%	0.103	27%	0.265	C	S	.	.	S	Bend	trans	70.4	16.6	-176.2	0	0	0	0	0	113.7	F735 Y736 S746	F735-G748 PolarHBondContact N-O 2.93Å; F735-G748 VanDerWaalsContact N-O 3.14Å; Y736-G748 VanDerWaalsContact O-CA 3.28Å; Y736-G748 WeakPolarHBondContact O-CA 3.4Å; S746-G748 PolarHBondContact O-N 3.37Å; S746-G748 VanDerWaalsContact O-N 3.15Å
749	L	83	Confident	81.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.282	C	S	.	.			trans	-102	-17.6	-178.3	-58	172.1	0	0	0	112.9	T622 L623 R734 F735 S747 A752 F753	T622-L749 HydrophobicContact CG2-CB 3.73Å; T622-L749 HydrophobicContact CG2-CD1 3.55Å; T622-L749 HydrophobicContact CG2-CG 4.29Å; L623-L749 HydrophobicContact CD2-CD1 3.55Å; L623-L749 HydrophobicContact CD2-CD2 4.16Å; L623-L749 HydrophobicContact CG-CD1 3.99Å; R734-L749 HydrophobicContact CB-CD2 4.21Å; F735-L749 HydrophobicContact CD1-CD2 3.95Å; F735-L749 HydrophobicContact CD1-CG 4.46Å; F735-L749 HydrophobicContact CD2-CD2 4.32Å; F735-L749 HydrophobicContact CE1-CD1 4.26Å; F735-L749 HydrophobicContact CE1-CD2 3.85Å; F735-L749 HydrophobicContact CE1-CG 4.41Å; F735-L749 HydrophobicContact CE2-CD2 4.2Å; F735-L749 HydrophobicContact CG-CD2 4.21Å; F735-L749 HydrophobicContact CZ-CD2 3.99Å; S747-L749 PolarHBondContact O-N 2.88Å; S747-L749 PolarHBondContact OG-N 3.37Å; L749-A752 PolarHBondContact O-N 2.86Å; L749-F753 WeakPolarHBondContact O-CB 3.4Å; L749-F753 PolarHBondContact O-N 3.48Å
750	G	88.2	Confident	81.7	Confident	17 Å²	17	46 Å²	46	18%	0.175	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-49.9	-174.8	0	0	0	0	0	113.4	N686 F753 V754	N686-G750 PolarHBondContact ND2-O 2.83Å; G750-F753 WeakPolarHBondContact O-CB 3.48Å; G750-F753 PolarHBondContact O-N 2.92Å; G750-V754 WeakPolarHBondContact O-CG2 3.28Å; G750-V754 PolarHBondContact O-N 2.89Å; G750-V754 VanDerWaalsContact O-N 3.14Å
751	L	92.5	Very high	82.2	Confident	27 Å²	27	43.4 Å²	43.4	14%	0.141	26%	0.256	C	S	.	.	H	α-helix	trans	-71.8	-35.2	179.1	-68.9	176.9	0	0	0	112.6	L687 N690 I731 F732 F753 V754 S755 L767	L687-L751 HydrophobicContact CD2-CD2 3.81Å; N690-L751 WeakPolarHBondContact ND2-CD2 3.44Å; N690-L751 WeakPolarHBondContact ND2-CG 3.35Å; I731-L751 HydrophobicContact CB-CD1 4.14Å; I731-L751 HydrophobicContact CD1-CD1 3.96Å; I731-L751 WeakPolarHBondContact O-CD1 3.4Å; F732-L751 HydrophobicContact CD1-CB 3.98Å; F732-L751 HydrophobicContact CE1-CB 4.39Å; L751-F753 VanDerWaalsContact C-N 3.29Å; L751-F753 PolarHBondContact O-N 3.32Å; L751-V754 PolarHBondContact O-N 3.48Å; L751-V754 VanDerWaalsContact O-N 3.16Å; L751-S755 PolarHBondContact O-N 3.45Å; L751-L767 HydrophobicContact CD1-CD2 4.19Å; L751-L767 HydrophobicContact CD2-CD1 4.28Å; L751-L767 HydrophobicContact CD2-CD2 4.27Å
752	A	88.2	Confident	82.9	Confident	4 Å²	4	43.9 Å²	43.9	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-59.5	-41.7	172.3	0	0	0	0	0	111.3	R734 L749 S755 E756	R734-A752 HydrophobicContact CG-CB 3.91Å; L749-A752 PolarHBondContact O-N 2.86Å; A752-S755 PolarHBondContact O-N 2.92Å; A752-E756 WeakPolarHBondContact O-CB 3.3Å; A752-E756 PolarHBondContact O-N 2.95Å
753	F	90.4	Very high	84	Confident	10 Å²	10	40 Å²	40	4%	0.044	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-44.3	172.9	179.8	-84.8	0	0	0	112.1	L629 L679 Q682 A683 N686 L749 G750 L751 S755 E756 V757	L629-F753 HydrophobicContact CD2-CD2 3.67Å; L629-F753 HydrophobicContact CD2-CE2 3.59Å; L629-F753 HydrophobicContact CD2-CG 4.28Å; L629-F753 HydrophobicContact CD2-CZ 4.12Å; L679-F753 HydrophobicContact CD2-CZ 4.05Å; Q682-F753 HydrophobicContact CB-CE1 3.91Å; Q682-F753 HydrophobicContact CB-CZ 4.11Å; Q682-F753 HydrophobicContact CG-CD1 4.44Å; Q682-F753 HydrophobicContact CG-CE1 3.66Å; Q682-F753 HydrophobicContact CG-CZ 3.8Å; Q682-F753 VanDerWaalsContact NE2-CZ 3.3Å; A683-F753 HydrophobicContact CB-CE1 4.36Å; N686-F753 WeakPolarHBondContact ND2-CD1 3.46Å; L749-F753 WeakPolarHBondContact O-CB 3.4Å; L749-F753 PolarHBondContact O-N 3.48Å; G750-F753 WeakPolarHBondContact O-CB 3.48Å; G750-F753 PolarHBondContact O-N 2.92Å; L751-F753 VanDerWaalsContact C-N 3.29Å; L751-F753 PolarHBondContact O-N 3.32Å; F753-S755 VanDerWaalsContact C-N 3.34Å; F753-S755 PolarHBondContact O-N 2.93Å; F753-E756 PolarHBondContact O-N 3Å; F753-V757 HydrophobicContact CD1-CG2 3.92Å; F753-V757 HydrophobicContact CE1-CG2 3.46Å; F753-V757 VanDerWaalsContact CE1-CG2 3.46Å; F753-V757 HydrophobicContact CZ-CG2 3.8Å; F753-V757 WeakPolarHBondContact O-CG2 3.47Å; F753-V757 PolarHBondContact O-N 3.48Å
754	V	93.6	Very high	85.3	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.3	-42.8	178.1	178.8	0	0	0	0	111.2	A683 N686 L687 G750 L751 E756 V757 A758 V765 L779	A683-V754 HydrophobicContact CB-CG1 4.5Å; A683-V754 HydrophobicContact CB-CG2 4.24Å; A683-V754 WeakPolarHBondContact O-CG2 3.5Å; N686-V754 HydrophobicContact CB-CG2 3.87Å; L687-V754 HydrophobicContact CD1-CG1 4.18Å; L687-V754 HydrophobicContact CD2-CB 4.47Å; L687-V754 HydrophobicContact CD2-CG1 4.06Å; L687-V754 HydrophobicContact CD2-CG2 4.07Å; L687-V754 HydrophobicContact CG-CG1 4.11Å; L687-V754 HydrophobicContact CG-CG2 4.03Å; G750-V754 WeakPolarHBondContact O-CG2 3.28Å; G750-V754 PolarHBondContact O-N 2.89Å; G750-V754 VanDerWaalsContact O-N 3.14Å; L751-V754 PolarHBondContact O-N 3.48Å; L751-V754 VanDerWaalsContact O-N 3.16Å; V754-E756 VanDerWaalsContact C-N 3.27Å; V754-E756 PolarHBondContact O-N 3.46Å; V754-V757 PolarHBondContact O-N 2.93Å; V754-A758 WeakPolarHBondContact O-CB 3.32Å; V754-A758 PolarHBondContact O-N 3.45Å; V754-V765 HydrophobicContact CG1-CB 4.13Å; V754-V765 HydrophobicContact CG1-CG1 4.4Å; V754-V765 HydrophobicContact CG1-CG2 3.76Å; V754-L779 HydrophobicContact CG1-CD1 4.45Å
755	S	91.9	Very high	86.7	Confident	47 Å²	47	37.6 Å²	37.6	33%	0.329	20%	0.202	S	C	.	.	H	α-helix	trans	-60.5	-39.1	175.9	-174.2	0	0	0	0	112	L751 A752 F753 A758 R759	L751-S755 PolarHBondContact O-N 3.45Å; A752-S755 PolarHBondContact O-N 2.92Å; F753-S755 VanDerWaalsContact C-N 3.34Å; F753-S755 PolarHBondContact O-N 2.93Å; S755-A758 PolarHBondContact O-N 3.25Å; S755-R759 WeakPolarHBondContact O-CB 3.34Å; S755-R759 PolarHBondContact O-N 3.46Å
756	E	88.5	Confident	88	Confident	17 Å²	17	34 Å²	34	8%	0.079	19%	0.191	C	C	.	.	H	α-helix	trans	-71.8	-39.6	179.1	-173.6	63.2	-172.9	0	0	112.2	L629 E630 A752 F753 V754 R759 L760	L629-E756 HydrophobicContact CD2-CB 3.76Å; L629-E756 HydrophobicContact CD2-CG 3.53Å; L629-E756 HydrophobicContact CG-CG 3.78Å; E630-E756 HydrophobicContact CG-CG 4.2Å; A752-E756 WeakPolarHBondContact O-CB 3.3Å; A752-E756 PolarHBondContact O-N 2.95Å; F753-E756 PolarHBondContact O-N 3Å; V754-E756 VanDerWaalsContact C-N 3.27Å; V754-E756 PolarHBondContact O-N 3.46Å; E756-R759 PolarHBondContact O-N 2.97Å; E756-R759 IonicContact OE1-CZ 3.86Å; E756-R759 IonicContact OE1-NE 2.66Å; E756-R759 PolarHBondContact OE1-NE 2.93Å; E756-R759 IonicContact OE1-NH2 3.91Å; E756-R759 PolarHBondContact OE1-NH2 2.79Å; E756-R759 IonicContact OE2-CZ 3.46Å; E756-R759 IonicContact OE2-NE 2.82Å; E756-R759 PolarHBondContact OE2-NE 3.17Å; E756-R759 IonicContact OE2-NH2 3.2Å; E756-L760 WeakPolarHBondContact O-CG 3.39Å; E756-L760 PolarHBondContact O-N 3.36Å
757	V	90.8	Very high	89	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-43.6	172.3	172.2	0	0	0	0	111.1	L629 L679 A683 F753 V754 R759 L760 F761	L629-V757 HydrophobicContact CD1-CG2 4.41Å; L629-V757 HydrophobicContact CD2-CG2 3.71Å; L679-V757 HydrophobicContact CB-CG1 4.39Å; L679-V757 HydrophobicContact CB-CG2 4.33Å; A683-V757 HydrophobicContact CB-CB 4.08Å; A683-V757 HydrophobicContact CB-CG1 3.91Å; A683-V757 HydrophobicContact CB-CG2 4.25Å; F753-V757 HydrophobicContact CD1-CG2 3.92Å; F753-V757 HydrophobicContact CE1-CG2 3.46Å; F753-V757 VanDerWaalsContact CE1-CG2 3.46Å; F753-V757 HydrophobicContact CZ-CG2 3.8Å; F753-V757 WeakPolarHBondContact O-CG2 3.47Å; F753-V757 PolarHBondContact O-N 3.48Å; V754-V757 PolarHBondContact O-N 2.93Å; V757-R759 VanDerWaalsContact C-N 3.33Å; V757-R759 PolarHBondContact O-N 3.34Å; V757-L760 PolarHBondContact O-N 3.4Å; V757-F761 HydrophobicContact CG1-CD2 3.66Å; V757-F761 HydrophobicContact CG1-CE2 3.33Å; V757-F761 HydrophobicContact CG1-CZ 4.06Å; V757-F761 WeakPolarHBondContact O-CG 3.26Å; V757-F761 PolarHBondContact O-N 3.47Å; V757-F761 VanDerWaalsContact O-N 3.07Å
758	A	91.2	Very high	89.9	Confident	2 Å²	2	39 Å²	39	2%	0.017	20%	0.201	C	C	.	.	H	α-helix	trans	-56.8	-49.2	175.3	0	0	0	0	0	110.5	V754 S755 L760 F761 N762 G763 V765 L779	V754-A758 WeakPolarHBondContact O-CB 3.32Å; V754-A758 PolarHBondContact O-N 3.45Å; S755-A758 PolarHBondContact O-N 3.25Å; A758-L760 PolarHBondContact O-N 3.03Å; A758-F761 CarbonylContact O-C 3.47Å; A758-F761 PolarHBondContact O-N 2.88Å; A758-F761 VanDerWaalsContact O-N 3.14Å; A758-N762 PolarHBondContact O-N 3.33Å; A758-G763 CarbonylContact O-C 3.57Å; A758-G763 WeakPolarHBondContact O-CA 3.34Å; A758-G763 PolarHBondContact O-N 2.88Å; A758-V765 HydrophobicContact CB-CB 4.28Å; A758-V765 HydrophobicContact CB-CG1 4.33Å; A758-L779 HydrophobicContact CB-CD1 3.52Å
759	R	88.2	Confident	90.4	Very high	135 Å²	135	41.6 Å²	41.6	51%	0.509	21%	0.212	S	C	.	.	H	α-helix	trans	-57.8	-45.2	177.3	-170.2	-174.4	74.1	80.4	-0.7	112.5	S755 E756 V757 F761 N762	S755-R759 WeakPolarHBondContact O-CB 3.34Å; S755-R759 PolarHBondContact O-N 3.46Å; E756-R759 PolarHBondContact O-N 2.97Å; E756-R759 IonicContact OE1-CZ 3.86Å; E756-R759 IonicContact OE1-NE 2.66Å; E756-R759 PolarHBondContact OE1-NE 2.93Å; E756-R759 IonicContact OE1-NH2 3.91Å; E756-R759 PolarHBondContact OE1-NH2 2.79Å; E756-R759 IonicContact OE2-CZ 3.46Å; E756-R759 IonicContact OE2-NE 2.82Å; E756-R759 PolarHBondContact OE2-NE 3.17Å; E756-R759 IonicContact OE2-NH2 3.2Å; V757-R759 VanDerWaalsContact C-N 3.33Å; V757-R759 PolarHBondContact O-N 3.34Å; R759-F761 PolarHBondContact O-N 3.2Å; R759-N762 PolarHBondContact O-N 3.44Å; R759-N762 VanDerWaalsContact O-N 3.12Å
760	L	87.4	Confident	90.9	Very high	29 Å²	29	43.8 Å²	43.8	15%	0.152	23%	0.226	C	C	.	.	H	α-helix	trans	-64.2	-28.4	178.7	-77.8	171.1	0	0	0	113.3	L629 V635 E756 V757 A758 N762	L629-L760 HydrophobicContact CD1-CD1 3.29Å; L629-L760 HydrophobicContact CD2-CD1 4.38Å; L629-L760 HydrophobicContact CG-CD1 3.61Å; V635-L760 HydrophobicContact CG2-CB 4.23Å; V635-L760 HydrophobicContact CG2-CD1 4.4Å; V635-L760 HydrophobicContact CG2-CD2 4.05Å; V635-L760 HydrophobicContact CG2-CG 4.47Å; E756-L760 WeakPolarHBondContact O-CG 3.39Å; E756-L760 PolarHBondContact O-N 3.36Å; V757-L760 PolarHBondContact O-N 3.4Å; A758-L760 PolarHBondContact O-N 3.03Å; L760-N762 VanDerWaalsContact C-N 3.34Å
761	F	87.9	Confident	90.5	Very high	7 Å²	7	52.8 Å²	52.8	3%	0.031	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	13.4	175.9	-62	-26.1	0	0	0	113.6	V635 L637 A675 E676 L679 L680 V757 A758 R759 G763 L781	V635-F761 HydrophobicContact CG1-CD1 4.34Å; V635-F761 HydrophobicContact CG1-CE1 3.69Å; L637-F761 HydrophobicContact CD2-CD1 3.43Å; L637-F761 VanDerWaalsContact CD2-CD1 3.43Å; L637-F761 HydrophobicContact CD2-CE1 3.64Å; L637-F761 HydrophobicContact CD2-CG 4.41Å; A675-F761 HydrophobicContact CB-CD2 4.2Å; A675-F761 HydrophobicContact CB-CE1 4.37Å; A675-F761 HydrophobicContact CB-CE2 3.76Å; A675-F761 HydrophobicContact CB-CZ 3.87Å; E676-F761 HydrophobicContact CB-CE1 4.05Å; E676-F761 HydrophobicContact CB-CZ 3.95Å; L679-F761 HydrophobicContact CB-CZ 3.99Å; L679-F761 HydrophobicContact CD1-CZ 4.44Å; L680-F761 HydrophobicContact CB-CE2 4.1Å; L680-F761 HydrophobicContact CD1-CE2 4.42Å; V757-F761 HydrophobicContact CG1-CD2 3.66Å; V757-F761 HydrophobicContact CG1-CE2 3.33Å; V757-F761 HydrophobicContact CG1-CZ 4.06Å; V757-F761 WeakPolarHBondContact O-CG 3.26Å; V757-F761 PolarHBondContact O-N 3.47Å; V757-F761 VanDerWaalsContact O-N 3.07Å; A758-F761 CarbonylContact O-C 3.47Å; A758-F761 PolarHBondContact O-N 2.88Å; A758-F761 VanDerWaalsContact O-N 3.14Å; R759-F761 PolarHBondContact O-N 3.2Å; F761-G763 PolarHBondContact O-N 3.24Å; F761-L781 HydrophobicContact CB-CD2 3.79Å; F761-L781 HydrophobicContact CD2-CD2 3.87Å; F761-L781 HydrophobicContact CG-CD2 4.34Å
762	N	84.7	Confident	89.9	Confident	128 Å²	128	60.8 Å²	60.8	68%	0.684	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	34.7	-172.7	-65.2	-32.6	0	0	0	112.8	A758 R759 L760 H782	A758-N762 PolarHBondContact O-N 3.33Å; R759-N762 PolarHBondContact O-N 3.44Å; R759-N762 VanDerWaalsContact O-N 3.12Å; L760-N762 VanDerWaalsContact C-N 3.34Å; N762-H782 PolarHBondContact O-CD2 3.1Å; N762-H782 PolarHBondContact O-NE2 2.97Å
763	G	88.4	Confident	89.7	Confident	23 Å²	23	62.2 Å²	62.2	24%	0.237	32%	0.315	C	S	.	.			trans	-108.9	-172.8	178.4	0	0	0	0	0	112.8	A758 F761 R780	A758-G763 CarbonylContact O-C 3.57Å; A758-G763 WeakPolarHBondContact O-CA 3.34Å; A758-G763 PolarHBondContact O-N 2.88Å; F761-G763 PolarHBondContact O-N 3.24Å; G763-R780 CarbonylContact C-O 3.54Å; G763-R780 WeakPolarHBondContact CA-O 3.45Å
764	E	93.2	Very high	89.7	Confident	115 Å²	115	61.7 Å²	61.7	54%	0.537	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.8	177.9	-172.1	-177.8	178.9	0	0	109.7	T766 R780	E764-T766 HydrophobicContact CG-CG2 4.15Å; E764-R780 PolarHBondContact N-O 2.99Å; E764-R780 PolarHBondContact O-N 3.43Å
765	V	94.6	Very high	89.8	Confident	13 Å²	13	62.2 Å²	62.2	8%	0.079	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.7	167.7	60.7	0	0	0	0	109.4	F732 V754 A758 L767 S778 L779	F732-V765 HydrophobicContact CD1-CG1 4.26Å; F732-V765 HydrophobicContact CE1-CB 4.36Å; F732-V765 HydrophobicContact CE1-CG1 3.45Å; F732-V765 VanDerWaalsContact CE1-CG1 3.45Å; F732-V765 HydrophobicContact CE1-CG2 4.01Å; F732-V765 HydrophobicContact CZ-CB 4.4Å; F732-V765 HydrophobicContact CZ-CG1 3.68Å; F732-V765 HydrophobicContact CZ-CG2 4.07Å; V754-V765 HydrophobicContact CG1-CB 4.13Å; V754-V765 HydrophobicContact CG1-CG1 4.4Å; V754-V765 HydrophobicContact CG1-CG2 3.76Å; A758-V765 HydrophobicContact CB-CB 4.28Å; A758-V765 HydrophobicContact CB-CG1 4.33Å; V765-L767 HydrophobicContact CG2-CD1 4.17Å; V765-S778 WeakPolarHBondContact CA-O 3.32Å; V765-L779 HydrophobicContact CB-CD1 4.23Å
766	T	94.4	Very high	90	Very high	55 Å²	55	60.6 Å²	60.6	34%	0.337	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	142.6	176.6	55.5	0	0	0	0	109.6	E764 A777 S778	E764-T766 HydrophobicContact CG-CG2 4.15Å; T766-A777 CarbonylContact O-C 3.59Å; T766-A777 WeakPolarHBondContact O-CA 3.38Å; T766-S778 PolarHBondContact N-O 3.25Å; T766-S778 PolarHBondContact O-N 3.32Å; T766-S778 PolarHBondContact OG1-O 3.48Å
767	L	94.4	Very high	90.4	Very high	34 Å²	34	60.2 Å²	60.2	18%	0.178	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.1	168	-79.6	83.7	0	0	0	107.9	I723 I731 F732 L751 V765 V775 L776 A777	I723-L767 HydrophobicContact CD1-CB 3.99Å; I723-L767 HydrophobicContact CD1-CD2 3.65Å; I723-L767 HydrophobicContact CD1-CG 4.45Å; I731-L767 HydrophobicContact CD1-CB 4.28Å; I731-L767 HydrophobicContact CD1-CD1 3.95Å; I731-L767 HydrophobicContact CD1-CD2 4.06Å; I731-L767 HydrophobicContact CD1-CG 4.33Å; F732-L767 HydrophobicContact CE1-CD1 3.56Å; F732-L767 HydrophobicContact CE2-CD1 4.11Å; F732-L767 HydrophobicContact CZ-CD1 3.19Å; L751-L767 HydrophobicContact CD1-CD2 4.19Å; L751-L767 HydrophobicContact CD2-CD1 4.28Å; L751-L767 HydrophobicContact CD2-CD2 4.27Å; V765-L767 HydrophobicContact CG2-CD1 4.17Å; L767-V775 HydrophobicContact CB-CG1 4.07Å; L767-V775 HydrophobicContact CD2-CG1 4.02Å; L767-V775 HydrophobicContact CG-CG1 4.22Å; L767-L776 WeakPolarHBondContact CA-O 3.4Å; L767-A777 HydrophobicContact CD1-CB 4.49Å; L767-A777 HydrophobicContact CG-CB 4.11Å
768	R	93.8	Very high	90.7	Very high	147 Å²	147	60.9 Å²	60.9	56%	0.555	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	140.5	175.8	65.4	179.7	-168.9	-175.5	-0.1	110.3	V775 L776	R768-V775 WeakPolarHBondContact O-CA 3.5Å; R768-L776 HydrophobicContact CG-CB 3.87Å; R768-L776 HydrophobicContact CG-CD2 4.42Å; R768-L776 VanDerWaalsContact CZ-CD2 3.47Å; R768-L776 PolarHBondContact N-O 3.33Å; R768-L776 PolarHBondContact O-N 2.96Å
769	N	94	Very high	90.9	Very high	63 Å²	63	60.8 Å²	60.8	34%	0.337	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	142.2	168.5	-68.6	-19.6	0	0	0	109.9	G722 I723	G722-N769 WeakPolarHBondContact CA-OD1 3.33Å; I723-N769 PolarHBondContact N-OD1 3.4Å; I723-N769 PolarHBondContact O-ND2 3.47Å
770	V	91.9	Very high	91.2	Very high	47 Å²	47	58.7 Å²	58.7	29%	0.285	30%	0.299	S	S	.	.			trans	-96.9	141.3	172.9	-178	0	0	0	0	109	L717 E772 G773 G774 L776	L717-V770 HydrophobicContact CD1-CB 4.48Å; L717-V770 HydrophobicContact CD1-CG2 3.59Å; V770-E772 PolarHBondContact O-N 2.73Å; V770-G773 PolarHBondContact O-N 2.93Å; V770-G774 PolarHBondContact N-O 2.9Å; V770-L776 HydrophobicContact CG2-CB 4.03Å
771	Q	81	Confident	91.4	Very high	206 Å²	206	57.3 Å²	57.3	96%	0.963	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-32.3	-174.4	-71.1	-173.9	-14.3	0	0	113.3	G773	Q771-G773 PolarHBondContact O-N 3.36Å
772	E	78.6	Confident	90.9	Very high	194 Å²	194	60.4 Å²	60.4	91%	0.907	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-0	179.3	-62.1	179.2	176.9	0	0	113.4	V770	V770-E772 PolarHBondContact O-N 2.73Å
773	G	84	Confident	90.4	Very high	34 Å²	34	60.1 Å²	60.1	35%	0.351	30%	0.295	S	S	.	.	S	Bend	trans	106.3	157.4	-172.1	0	0	0	0	0	112.5	V770 Q771	V770-G773 PolarHBondContact O-N 2.93Å; Q771-G773 PolarHBondContact O-N 3.36Å
774	G	91.9	Very high	89.3	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.301	C	S	.	.	S	Bend	trans	83.3	-178	-179	0	0	0	0	0	115.4	D718 G720 V770	D718-G774 WeakPolarHBondContact O-CA 3.35Å; D718-G774 WeakPolarHBondContact OD1-CA 3.35Å; G720-G774 VanDerWaalsContact O-CA 3.27Å; G720-G774 WeakPolarHBondContact O-CA 3.38Å; G720-G774 PolarHBondContact O-N 3.4Å; V770-G774 PolarHBondContact N-O 2.9Å
775	V	95	Very high	87.7	Confident	11 Å²	11	65 Å²	65	7%	0.067	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.9	-177.5	-171	0	0	0	0	110	L717 D718 I723 L767 R768	L717-V775 WeakPolarHBondContact CA-O 3.5Å; D718-V775 PolarHBondContact N-O 3.04Å; D718-V775 PolarHBondContact OD1-N 3.45Å; D718-V775 WeakPolarHBondContact OD2-CB 3.44Å; D718-V775 PolarHBondContact OD2-N 3.13Å; I723-V775 HydrophobicContact CD1-CG1 3.86Å; I723-V775 HydrophobicContact CD1-CG2 4.12Å; I723-V775 HydrophobicContact CG1-CG1 4.45Å; I723-V775 HydrophobicContact CG1-CG2 3.79Å; L767-V775 HydrophobicContact CB-CG1 4.07Å; L767-V775 HydrophobicContact CD2-CG1 4.02Å; L767-V775 HydrophobicContact CG-CG1 4.22Å; R768-V775 WeakPolarHBondContact O-CA 3.5Å
776	L	96.7	Very high	85.3	Confident	13 Å²	13	74.2 Å²	74.2	7%	0.068	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	111.3	163.1	-177.9	72.1	0	0	0	109.1	K715 L717 L767 R768 V770	K715-L776 HydrophobicContact CB-CD1 4.03Å; K715-L776 HydrophobicContact CD-CD1 4.31Å; K715-L776 HydrophobicContact CD-CD2 4.39Å; K715-L776 HydrophobicContact CG-CD1 4.36Å; L717-L776 HydrophobicContact CB-CD1 3.8Å; L717-L776 HydrophobicContact CD1-CB 4.14Å; L717-L776 HydrophobicContact CD1-CD1 4.26Å; L767-L776 WeakPolarHBondContact CA-O 3.4Å; R768-L776 HydrophobicContact CG-CB 3.87Å; R768-L776 HydrophobicContact CG-CD2 4.42Å; R768-L776 VanDerWaalsContact CZ-CD2 3.47Å; R768-L776 PolarHBondContact N-O 3.33Å; R768-L776 PolarHBondContact O-N 2.96Å; V770-L776 HydrophobicContact CG2-CB 4.03Å
777	A	96.6	Very high	84.9	Confident	8 Å²	8	75.2 Å²	75.2	7%	0.066	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	130	163.2	0	0	0	0	0	109.5	L687 K715 V716 T766 L767	L687-A777 HydrophobicContact CD1-CB 4.23Å; L687-A777 HydrophobicContact CD2-CB 3.86Å; L687-A777 HydrophobicContact CG-CB 4.49Å; K715-A777 CarbonylContact C-O 3.42Å; K715-A777 VanDerWaalsContact CA-O 3.3Å; K715-A777 WeakPolarHBondContact CA-O 3.22Å; V716-A777 HydrophobicContact CB-CB 4.41Å; V716-A777 PolarHBondContact N-O 3.48Å; V716-A777 PolarHBondContact O-N 3.44Å; T766-A777 CarbonylContact O-C 3.59Å; T766-A777 WeakPolarHBondContact O-CA 3.38Å; L767-A777 HydrophobicContact CD1-CB 4.49Å; L767-A777 HydrophobicContact CG-CB 4.11Å
778	S	96.3	Very high	84.4	Confident	14 Å²	14	77.3 Å²	77.3	10%	0.098	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	114.8	179.1	179.6	0	0	0	0	110.1	L714 V765 T766	L714-S778 WeakPolarHBondContact O-CA 3.29Å; V765-S778 WeakPolarHBondContact CA-O 3.32Å; T766-S778 PolarHBondContact N-O 3.25Å; T766-S778 PolarHBondContact O-N 3.32Å; T766-S778 PolarHBondContact OG1-O 3.48Å
779	L	96.2	Very high	83.9	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	103.2	173.2	178.1	63.3	0	0	0	109	L680 A683 L687 A713 L714 V754 A758 V765 L781	L680-L779 HydrophobicContact CD1-CD2 3.79Å; A683-L779 HydrophobicContact CB-CD2 4.49Å; L687-L779 HydrophobicContact CD1-CB 4.38Å; A713-L779 WeakPolarHBondContact CA-O 3.48Å; L714-L779 HydrophobicContact CB-CB 4.47Å; L714-L779 PolarHBondContact N-O 2.73Å; L714-L779 PolarHBondContact O-N 3.12Å; V754-L779 HydrophobicContact CG1-CD1 4.45Å; A758-L779 HydrophobicContact CB-CD1 3.52Å; V765-L779 HydrophobicContact CB-CD1 4.23Å; L779-L781 HydrophobicContact CD1-CD2 4.15Å; L779-L781 HydrophobicContact CD2-CD1 4.45Å; L779-L781 HydrophobicContact CG-CD2 4.11Å; L779-L781 HydrophobicContact CG-CG 4.18Å
780	R	94.4	Very high	83.3	Confident	91 Å²	91	74.1 Å²	74.1	34%	0.343	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	121.5	179.7	-174.3	-179.6	175.4	126	6.9	109.4	D708 H711 G763 E764	D708-R780 IonicContact OD2-CZ 3.71Å; D708-R780 IonicContact OD2-NH1 2.72Å; D708-R780 IonicContact OD2-NH2 3.73Å; D708-R780 PolarHBondContact OD2-NH2 3.08Å; H711-R780 HydrophobicContact CB-CG 3.81Å; H711-R780 PolarHBondContact CD2-NE 3.36Å; H711-R780 VanDerWaalsContact CG-NE 3.26Å; H711-R780 PolarHBondContact ND1-NH2 3.36Å; G763-R780 CarbonylContact C-O 3.54Å; G763-R780 WeakPolarHBondContact CA-O 3.45Å; E764-R780 PolarHBondContact N-O 2.99Å; E764-R780 PolarHBondContact O-N 3.43Å
781	L	91.1	Very high	82.7	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	157.4	179.5	-57.7	175.5	0	0	0	109.9	V673 L680 H711 V712 L714 F761 L779	V673-L781 HydrophobicContact CG2-CD1 4.4Å; L680-L781 HydrophobicContact CD1-CD1 3.65Å; L680-L781 HydrophobicContact CD2-CD1 4.21Å; H711-L781 CarbonylContact C-O 3.58Å; H711-L781 VanDerWaalsContact CA-O 3.22Å; H711-L781 WeakPolarHBondContact CA-O 3.35Å; H711-L781 WeakPolarHBondContact CB-O 3.46Å; V712-L781 PolarHBondContact N-O 3.44Å; V712-L781 PolarHBondContact O-N 2.89Å; L714-L781 HydrophobicContact CD1-CD1 4.31Å; F761-L781 HydrophobicContact CB-CD2 3.79Å; F761-L781 HydrophobicContact CD2-CD2 3.87Å; F761-L781 HydrophobicContact CG-CD2 4.34Å; L779-L781 HydrophobicContact CD1-CD2 4.15Å; L779-L781 HydrophobicContact CD2-CD1 4.45Å; L779-L781 HydrophobicContact CG-CD2 4.11Å; L779-L781 HydrophobicContact CG-CG 4.18Å
782	H	78.1	Confident	82.8	Confident	72 Å²	72	67.1 Å²	67.1	33%	0.333	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	139	170.7	-77.6	-70.2	0	0	0	111.2	H711 N762	H711-H782 AromaticContact CD2-CE1 3.92Å; H711-H782 AromaticContact CD2-ND1 3.73Å; H711-H782 AromaticContact CE1-CE1 3.92Å; H711-H782 AromaticContact NE2-CE1 3.21Å; H711-H782 PolarHBondContact NE2-CE1 2.94Å; H711-H782 AromaticContact NE2-ND1 3.41Å; H711-H782 PolarHBondContact NE2-ND1 3.39Å; H711-H782 AromaticContact NE2-NE2 4Å; N762-H782 PolarHBondContact O-CD2 3.1Å; N762-H782 PolarHBondContact O-NE2 2.97Å
783	R	72.9	Confident	83.1	Confident	123 Å²	123	58 Å²	58	46%	0.464	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	-66.4	140.7	171.3	-167.7	174.5	178.8	-177.1	-0.9	108.8	E710 V712 F785	E710-R783 PolarHBondContact O-N 2.92Å; V712-R783 HydrophobicContact CG2-CB 4.11Å; V712-R783 HydrophobicContact CG2-CG 4.07Å; R783-F785 PolarHBondContact O-N 3.12Å
784	H	65.8	Low	83.1	Confident	78 Å²	78	59.8 Å²	59.8	36%	0.361	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-67.6	118.2	170.8	-169.1	43.5	0	0	0	108.7	V639 A674 T786	V639-H784 WeakPolarHBondContact CG2-CD2 3.33Å; V639-H784 WeakPolarHBondContact CG2-NE2 3.44Å; A674-H784 HydrophobicContact CB-CB 4.06Å; H784-T786 PolarHBondContact O-N 3.39Å
785	F	60.5	Low	82.3	Confident	163 Å²	163	64.8 Å²	64.8	72%	0.715	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-65.8	124.5	169.3	-71.1	-83.5	0	0	0	107.9	R783	R783-F785 PolarHBondContact O-N 3.12Å
786	T	44.5	Very low	81.2	Confident	205 Å²	205	69.7 Å²	69.7	100%	1.258	34%	0.337	S	S	*	.			trans	-80.1	0	169.6	7.9	0	0	0	0	110.1	H784	H784-T786 PolarHBondContact O-N 3.39Å

Retrieved 786 of 786 residues in 432.4 ms (Link to these results)

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