A0A077ZK77_TRITR Loading...

Chromosome segregation protein sudA

AlphaFold DB , UniProt , Accession A0A077ZK77, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 660 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	37.5	Very low	60.8	Low	241 Å²	241	104 Å²	104	100%	1.187	71%	0.712	S	S	*	*				0	89.4	0	-68.7	-84.6	-99.6	0	0	107.1	G3	M1-G3 PolarHBondContact O-N 3.42Å
2	A	35.4	Very low	63.2	Low	109 Å²	109	97.2 Å²	97.2	90%	0.901	66%	0.664	S	S	*	*			trans	-72.9	107.5	176	0	0	0	0	0	107.4	A4	A2-A4 PolarHBondContact O-N 3.48Å
3	G	37.4	Very low	64.8	Low	73 Å²	73	94.9 Å²	94.9	75%	0.753	65%	0.646	S	S	*	*			trans	-60.1	127.1	-179	0	0	0	0	0	110.2	M1 G5	M1-G3 PolarHBondContact O-N 3.42Å; G3-G5 VanDerWaalsContact C-N 3.28Å; G3-G5 PolarHBondContact O-N 3.04Å
4	A	42.2	Very low	66.1	Low	111 Å²	111	89.1 Å²	89.1	92%	0.917	61%	0.605	S	S	*	*			trans	-65.2	89.9	170.1	0	0	0	0	0	108.6	A2	A2-A4 PolarHBondContact O-N 3.48Å
5	G	52	Low	67	Low	63 Å²	63	89.4 Å²	89.4	65%	0.649	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-75.5	127.3	176.6	0	0	0	0	0	110.5	G3 L7	G3-G5 VanDerWaalsContact C-N 3.28Å; G3-G5 PolarHBondContact O-N 3.04Å; G5-L7 PolarHBondContact O-N 3.5Å
6	T	55	Low	67.8	Low	148 Å²	148	89.4 Å²	89.4	91%	0.908	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-58.7	126	166.6	24.8	0	0	0	0	109.8
7	L	71	Confident	68.6	Low	149 Å²	149	87.8 Å²	87.8	78%	0.78	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-75.9	129.3	175.5	-68.5	171.1	0	0	0	109.7	G5	G5-L7 PolarHBondContact O-N 3.5Å
8	A	77.7	Confident	69.3	Low	87 Å²	87	83.7 Å²	83.7	72%	0.719	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-65.5	146.9	173.5	0	0	0	0	0	110.9
9	P	84.7	Confident	70.3	Confident	51 Å²	51	85.7 Å²	85.7	33%	0.331	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-61.4	147	175	24.4	-31.7	0	0	0	111.4	V11 T95 Q97	P9-V11 PolarHBondContact O-N 3.46Å; P9-T95 CarbonylContact C-O 3.49Å; P9-T95 VanDerWaalsContact CA-O 3.3Å; P9-T95 WeakPolarHBondContact CA-O 3.48Å; P9-T95 HydrophobicContact CB-CG2 4Å; P9-Q97 HydrophobicContact CB-CG 4.08Å; P9-Q97 HydrophobicContact CG-CG 4.5Å
10	T	88.8	Confident	71.3	Confident	57 Å²	57	82.1 Å²	82.1	35%	0.35	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	113.7	172	-55.6	0	0	0	0	108.6	V12 T95 I96 Q97	T10-V12 HydrophobicContact CG2-CG2 4.15Å; T10-T95 PolarHBondContact N-O 2.89Å; T10-I96 CarbonylContact O-C 3.31Å; T10-I96 WeakPolarHBondContact O-CA 3.38Å; T10-Q97 PolarHBondContact O-N 3.45Å
11	V	87.6	Confident	72.3	Confident	55 Å²	55	81.9 Å²	81.9	33%	0.333	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	124.8	178.3	-177.8	0	0	0	0	109.1	P9 Q97 V99 P142 T144	P9-V11 PolarHBondContact O-N 3.46Å; V11-Q97 WeakPolarHBondContact CA-O 3.49Å; V11-V99 HydrophobicContact CG1-CB 4.47Å; V11-V99 HydrophobicContact CG1-CG2 3.65Å; V11-P142 HydrophobicContact CG1-CB 4.03Å; V11-P142 HydrophobicContact CG1-CG 4.48Å; V11-P142 HydrophobicContact CG2-CB 3.94Å; V11-P142 HydrophobicContact CG2-CG 4.28Å; V11-T144 HydrophobicContact CG1-CG2 3.89Å
12	V	88.7	Confident	74.9	Confident	22 Å²	22	70.8 Å²	70.8	13%	0.133	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	108.5	-179.8	-176.5	0	0	0	0	108.7	T10 M14 A20 I22 I96 Q97 L98 V99	T10-V12 HydrophobicContact CG2-CG2 4.15Å; V12-M14 HydrophobicContact CG1-CG 4.09Å; V12-A20 HydrophobicContact CG1-CB 3.83Å; V12-I22 HydrophobicContact CB-CD1 4.37Å; V12-I22 HydrophobicContact CG1-CD1 4.15Å; V12-I22 HydrophobicContact CG2-CD1 4.02Å; V12-I22 HydrophobicContact CG2-CG1 4.42Å; V12-I96 HydrophobicContact CG2-CG2 4.04Å; V12-Q97 PolarHBondContact N-O 3.33Å; V12-L98 HydrophobicContact CB-CD2 4.13Å; V12-L98 WeakPolarHBondContact O-CA 3.34Å; V12-V99 PolarHBondContact O-N 3.05Å
13	P	83.9	Confident	77.7	Confident	68 Å²	68	67.1 Å²	67.1	44%	0.442	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	131	174.1	27.9	-31.6	0	0	0	109.9	V99 T144	P13-V99 CarbonylContact C-O 3.52Å; P13-V99 VanDerWaalsContact CA-O 3.29Å; P13-V99 WeakPolarHBondContact CA-O 3.47Å; P13-T144 HydrophobicContact CB-CG2 4.47Å
14	M	83.3	Confident	80.4	Confident	14 Å²	14	63.8 Å²	63.8	7%	0.069	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	160.4	179.2	-65.1	-165.5	68.8	0	0	110.3	V12 G18 A20 L82 S83 I84 L98 V99 S100	V12-M14 HydrophobicContact CG1-CG 4.09Å; M14-G18 VanDerWaalsContact CE-O 3.25Å; M14-G18 WeakPolarHBondContact CE-O 3.45Å; M14-A20 HydrophobicContact CE-CB 3.84Å; M14-A20 HydrophobicContact CG-CB 4.19Å; M14-A20 HydrophobicContact SD-CB 3.88Å; M14-L82 HydrophobicContact CB-CD2 4.09Å; M14-L82 HydrophobicContact CE-CB 4Å; M14-L82 HydrophobicContact CE-CD2 4.27Å; M14-L82 HydrophobicContact SD-CB 4.25Å; M14-L82 HydrophobicContact SD-CD2 4.41Å; M14-S83 WeakPolarHBondContact CE-O 3.37Å; M14-I84 HydrophobicContact CE-CD1 4Å; M14-I84 HydrophobicContact SD-CD1 3.69Å; M14-L98 HydrophobicContact SD-CB 4.43Å; M14-L98 HydrophobicContact SD-CD1 4.36Å; M14-L98 HydrophobicContact SD-CD2 3.79Å; M14-L98 HydrophobicContact SD-CG 4.42Å; M14-V99 PolarHBondContact N-O 3.3Å; M14-S100 VanDerWaalsContact O-CA 3.26Å; M14-S100 WeakPolarHBondContact O-CA 3.17Å; M14-S100 PolarHBondContact O-OG 3.01Å
15	V	79.6	Confident	82.8	Confident	93 Å²	93	58.7 Å²	58.7	56%	0.564	39%	0.386	S	S	*	.			trans	-113.9	157.7	168.9	-65.9	0	0	0	0	108.5	G17 G18	V15-G17 PolarHBondContact O-N 2.9Å; V15-G18 WeakPolarHBondContact O-CA 3.48Å; V15-G18 PolarHBondContact O-N 2.66Å
16	N	80	Confident	84.8	Confident	90 Å²	90	56.7 Å²	56.7	48%	0.481	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	129.3	174.4	-166.9	9.2	0	0	0	110.4	G18 L80 N81	N16-G18 PolarHBondContact O-N 2.87Å; N16-L80 HydrophobicContact CB-CD2 3.8Å; N16-N81 PolarHBondContact OD1-N 3.17Å
17	G	80.9	Confident	86.6	Confident	61 Å²	61	53.6 Å²	53.6	63%	0.629	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-3.1	-172.4	0	0	0	0	0	114.9	V15 N81	V15-G17 PolarHBondContact O-N 2.9Å; G17-N81 VanDerWaalsContact CA-O 3.29Å; G17-N81 WeakPolarHBondContact CA-O 3.34Å; G17-N81 PolarHBondContact N-O 3.16Å
18	G	81.6	Confident	87.7	Confident	14 Å²	14	48.7 Å²	48.7	14%	0.144	32%	0.319	C	S	.	.			trans	-71.9	157.1	179.4	0	0	0	0	0	113.2	M14 V15 N16 S83	M14-G18 VanDerWaalsContact CE-O 3.25Å; M14-G18 WeakPolarHBondContact CE-O 3.45Å; V15-G18 WeakPolarHBondContact O-CA 3.48Å; V15-G18 PolarHBondContact O-N 2.66Å; N16-G18 PolarHBondContact O-N 2.87Å; G18-S83 PolarHBondContact O-N 3.49Å
19	Q	89	Confident	88.4	Confident	122 Å²	122	48.3 Å²	48.3	57%	0.57	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	135.6	173.9	-174.3	172.2	71.9	0	0	111.7	S83 Q85	Q19-S83 CarbonylContact C-O 3.47Å; Q19-S83 VanDerWaalsContact CA-O 3.23Å; Q19-S83 WeakPolarHBondContact CA-O 3.32Å; Q19-S83 PolarHBondContact NE2-OG 3.08Å; Q19-S83 VanDerWaalsContact NE2-OG 3.1Å; Q19-Q85 HydrophobicContact CG-CB 4.47Å
20	A	88.9	Confident	88.9	Confident	13 Å²	13	46 Å²	46	11%	0.107	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.9	174.9	0	0	0	0	0	111.6	V12 M14 I22 S83 Q85	V12-A20 HydrophobicContact CG1-CB 3.83Å; M14-A20 HydrophobicContact CE-CB 3.84Å; M14-A20 HydrophobicContact CG-CB 4.19Å; M14-A20 HydrophobicContact SD-CB 3.88Å; A20-I22 HydrophobicContact CB-CD1 4.18Å; A20-I22 HydrophobicContact CB-CG1 4.13Å; A20-S83 PolarHBondContact N-O 2.84Å; A20-Q85 PolarHBondContact O-N 3.46Å
21	S	92.8	Very high	89.2	Confident	79 Å²	79	45.4 Å²	45.4	55%	0.552	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	116.1	173.7	-156.8	0	0	0	0	110.1	Q85	S21-Q85 CarbonylContact C-O 3.57Å; S21-Q85 WeakPolarHBondContact CA-O 3.35Å; S21-Q85 PolarHBondContact OG-OE1 2.86Å
22	I	92.9	Very high	89.5	Confident	8 Å²	8	42.8 Å²	42.8	4%	0.041	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	126.3	-169	-55.5	-178.9	0	0	0	110.2	V12 A20 I24 F32 I84 Q85 V87 I96 L98	V12-I22 HydrophobicContact CB-CD1 4.37Å; V12-I22 HydrophobicContact CG1-CD1 4.15Å; V12-I22 HydrophobicContact CG2-CD1 4.02Å; V12-I22 HydrophobicContact CG2-CG1 4.42Å; A20-I22 HydrophobicContact CB-CD1 4.18Å; A20-I22 HydrophobicContact CB-CG1 4.13Å; I22-I24 HydrophobicContact CG2-CG2 4.26Å; I22-I24 PolarHBondContact O-N 2.95Å; I22-F32 HydrophobicContact CD1-CE1 4.21Å; I22-I84 HydrophobicContact CB-CG2 4.27Å; I22-I84 HydrophobicContact CD1-CD1 3.96Å; I22-I84 HydrophobicContact CD1-CG2 3.99Å; I22-I84 HydrophobicContact CG1-CG2 4.3Å; I22-Q85 PolarHBondContact N-O 2.99Å; I22-V87 PolarHBondContact O-N 2.71Å; I22-I96 HydrophobicContact CD1-CG2 4.06Å; I22-I96 HydrophobicContact CG2-CG1 4.12Å; I22-I96 HydrophobicContact CG2-CG2 4.45Å; I22-L98 HydrophobicContact CD1-CD2 3.88Å
23	A	93	Very high	89.7	Confident	31 Å²	31	43 Å²	43	26%	0.256	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	122.8	172.5	0	0	0	0	0	110.7	V87	A23-V87 WeakPolarHBondContact CA-O 3.49Å
24	I	94	Very high	90	Very high	4 Å²	4	40 Å²	40	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	152.3	179.3	64.8	166.9	0	0	0	111.2	I22 F32 T64 F70 A86 V87 P88 R89	I22-I24 HydrophobicContact CG2-CG2 4.26Å; I22-I24 PolarHBondContact O-N 2.95Å; I24-F32 HydrophobicContact CG2-CE2 4.24Å; I24-F32 HydrophobicContact CG2-CZ 3.81Å; I24-T64 HydrophobicContact CD1-CG2 3.64Å; I24-T64 HydrophobicContact CG1-CG2 4.38Å; I24-F70 HydrophobicContact CD1-CE1 4.36Å; I24-F70 HydrophobicContact CD1-CZ 4Å; I24-A86 HydrophobicContact CD1-CB 3.58Å; I24-A86 HydrophobicContact CG1-CB 4.04Å; I24-V87 PolarHBondContact N-O 3.06Å; I24-V87 VanDerWaalsContact N-O 3.12Å; I24-P88 CarbonylContact O-C 3.51Å; I24-P88 WeakPolarHBondContact O-CA 3.31Å; I24-R89 PolarHBondContact O-N 3.02Å
25	S	94.2	Very high	90	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.028	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	135.6	173.6	177.6	0	0	0	0	111.3	T27 S28 N30 R89 G91	S25-T27 PolarHBondContact OG-N 3.15Å; S25-T27 VanDerWaalsContact OG-N 3.09Å; S25-T27 PolarHBondContact OG-OG1 3.18Å; S25-S28 WeakPolarHBondContact CB-O 2.99Å; S25-S28 PolarHBondContact OG-N 3.24Å; S25-S28 PolarHBondContact OG-O 2.98Å; S25-N30 PolarHBondContact N-ND2 3.05Å; S25-N30 PolarHBondContact N-OD1 3.17Å; S25-N30 PolarHBondContact O-ND2 2.7Å; S25-R89 VanDerWaalsContact CA-O 3.31Å; S25-R89 WeakPolarHBondContact CA-O 3.15Å; S25-G91 WeakPolarHBondContact CB-O 3.35Å; S25-G91 PolarHBondContact OG-O 3.43Å
26	N	93.2	Very high	89.8	Confident	21 Å²	21	37.4 Å²	37.4	11%	0.112	25%	0.247	C	C	.	.	S	Bend	trans	-100.8	4.8	167.6	70.4	-15.9	0	0	0	113.7	T64 P88 R89 E90	N26-T64 CarbonylContact C-O 3.5Å; N26-T64 WeakPolarHBondContact CA-O 3.16Å; N26-T64 HydrophobicContact CB-CG2 4.38Å; N26-T64 VanDerWaalsContact O-O 3.09Å; N26-P88 HydrophobicContact CB-CB 3.97Å; N26-R89 PolarHBondContact N-O 2.71Å; N26-R89 PolarHBondContact OD1-O 2.84Å; N26-R89 VanDerWaalsContact OD1-O 3.05Å; N26-E90 WeakPolarHBondContact OD1-CA 3.43Å; N26-E90 WeakPolarHBondContact OD1-CG 3.28Å; N26-E90 PolarHBondContact OD1-N 3.48Å
27	T	93.4	Very high	89.9	Confident	83 Å²	83	33.8 Å²	33.8	51%	0.509	23%	0.227	S	C	.	.	S	Bend	trans	-118.6	-5.8	179.4	48.7	0	0	0	0	112.5	S25 E90 G91	S25-T27 PolarHBondContact OG-N 3.15Å; S25-T27 VanDerWaalsContact OG-N 3.09Å; S25-T27 PolarHBondContact OG-OG1 3.18Å; T27-E90 HydrophobicContact CG2-CB 4.4Å; T27-E90 HydrophobicContact CG2-CG 4.14Å; T27-G91 PolarHBondContact OG1-N 2.96Å; T27-G91 PolarHBondContact OG1-O 3.47Å
28	S	92.7	Very high	90.2	Very high	45 Å²	45	36.6 Å²	36.6	32%	0.315	22%	0.219	S	C	.	.	S	Bend	trans	-151.7	149.3	-179.4	-65.3	0	0	0	0	110.4	S25 N30 G93	S25-S28 WeakPolarHBondContact CB-O 2.99Å; S25-S28 PolarHBondContact OG-N 3.24Å; S25-S28 PolarHBondContact OG-O 2.98Å; S28-N30 PolarHBondContact O-ND2 3.4Å; S28-G93 VanDerWaalsContact CB-N 3.31Å
29	P	93.5	Very high	90.7	Very high	80 Å²	80	36.1 Å²	36.1	52%	0.519	21%	0.213	S	C	.	.			trans	-61.4	147.3	176.9	-20.3	31.8	0	0	0	112.5	V61 G93	P29-V61 HydrophobicContact CB-CG1 3.54Å; P29-G93 VanDerWaalsContact O-CA 3.24Å; P29-G93 WeakPolarHBondContact O-CA 3.47Å
30	N	95	Very high	90.9	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	138.1	176.6	-53.6	-89.3	0	0	0	108.7	S25 S28 F32 V61 V62 R94 I96	S25-N30 PolarHBondContact N-ND2 3.05Å; S25-N30 PolarHBondContact N-OD1 3.17Å; S25-N30 PolarHBondContact O-ND2 2.7Å; S28-N30 PolarHBondContact O-ND2 3.4Å; N30-F32 HydrophobicContact CB-CE2 4.14Å; N30-V61 CarbonylContact O-C 3.43Å; N30-V61 WeakPolarHBondContact O-CA 3.32Å; N30-V62 HydrophobicContact CB-CG2 4.15Å; N30-V62 PolarHBondContact N-O 2.84Å; N30-V62 PolarHBondContact O-N 3.35Å; N30-R94 CarbonylContact C-O 3.48Å; N30-R94 WeakPolarHBondContact CA-O 2.94Å; N30-R94 PolarHBondContact OD1-N 2.79Å; N30-I96 HydrophobicContact CB-CD1 4.15Å
31	L	95	Very high	91	Very high	46 Å²	46	34.7 Å²	34.7	24%	0.241	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	124	178.4	173.3	63.4	0	0	0	109.3	T33 T55 V61 R94 T95 I96	L31-T33 HydrophobicContact CD1-CG2 4.13Å; L31-T33 HydrophobicContact CD2-CG2 4.25Å; L31-T33 HydrophobicContact CG-CG2 4.02Å; L31-T55 HydrophobicContact CD1-CG2 3.9Å; L31-V61 HydrophobicContact CD1-CG2 3.88Å; L31-R94 PolarHBondContact N-O 2.74Å; L31-T95 HydrophobicContact CB-CG2 4.39Å; L31-T95 HydrophobicContact CD2-CG2 3.97Å; L31-T95 HydrophobicContact CG-CG2 4.21Å; L31-T95 CarbonylContact O-C 3.44Å; L31-T95 WeakPolarHBondContact O-CA 3.23Å; L31-I96 PolarHBondContact O-N 3.26Å
32	F	95.1	Very high	91.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	133.8	169.8	-73.3	-98.7	0	0	0	109.7	I22 I24 N30 I39 G59 V60 V62 F72 L74 I84 I96 L98	I22-F32 HydrophobicContact CD1-CE1 4.21Å; I24-F32 HydrophobicContact CG2-CE2 4.24Å; I24-F32 HydrophobicContact CG2-CZ 3.81Å; N30-F32 HydrophobicContact CB-CE2 4.14Å; F32-I39 HydrophobicContact CB-CD1 4.17Å; F32-I39 WeakPolarHBondContact O-CD1 3.5Å; F32-G59 CarbonylContact O-C 3.39Å; F32-G59 WeakPolarHBondContact O-CA 3.31Å; F32-V60 HydrophobicContact CB-CG1 3.89Å; F32-V60 PolarHBondContact N-O 2.83Å; F32-V60 PolarHBondContact O-N 2.83Å; F32-V62 HydrophobicContact CD2-CG1 4.49Å; F32-V62 HydrophobicContact CD2-CG2 3.59Å; F32-V62 HydrophobicContact CE2-CG2 3.37Å; F32-F72 HydrophobicContact CD2-CZ 4.42Å; F32-F72 HydrophobicContact CE1-CZ 4.09Å; F32-F72 AromaticContact CE2-CZ 3.88Å; F32-F72 HydrophobicContact CE2-CZ 3.88Å; F32-F72 HydrophobicContact CZ-CE1 4.5Å; F32-F72 AromaticContact CZ-CZ 3.69Å; F32-F72 HydrophobicContact CZ-CZ 3.69Å; F32-L74 HydrophobicContact CB-CD1 4.18Å; F32-L74 HydrophobicContact CD1-CD1 4.09Å; F32-L74 HydrophobicContact CG-CD1 4.3Å; F32-I84 HydrophobicContact CE1-CG1 4.48Å; F32-I84 HydrophobicContact CE1-CG2 4.14Å; F32-I84 HydrophobicContact CZ-CG2 4.35Å; F32-I96 WeakPolarHBondContact CA-O 3.39Å; F32-I96 HydrophobicContact CD1-CB 3.87Å; F32-I96 HydrophobicContact CD1-CG2 3.94Å; F32-I96 HydrophobicContact CD2-CD1 4.39Å; F32-I96 HydrophobicContact CE1-CB 3.9Å; F32-I96 HydrophobicContact CE1-CD1 4.19Å; F32-I96 HydrophobicContact CE1-CG1 4.17Å; F32-I96 HydrophobicContact CE1-CG2 3.85Å; F32-I96 HydrophobicContact CE2-CD1 3.94Å; F32-I96 HydrophobicContact CG-CB 4.41Å; F32-I96 HydrophobicContact CZ-CB 4.43Å; F32-I96 HydrophobicContact CZ-CD1 3.84Å; F32-I96 HydrophobicContact CZ-CG1 4.27Å; F32-L98 HydrophobicContact CD1-CD1 4.11Å; F32-L98 HydrophobicContact CD1-CD2 4.33Å; F32-L98 HydrophobicContact CD1-CG 4.32Å
33	T	92.9	Very high	91	Very high	26 Å²	26	35.4 Å²	35.4	16%	0.16	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	148	174	57	0	0	0	0	110.4	L31 I96 Q97 L98	L31-T33 HydrophobicContact CD1-CG2 4.13Å; L31-T33 HydrophobicContact CD2-CG2 4.25Å; L31-T33 HydrophobicContact CG-CG2 4.02Å; T33-I96 PolarHBondContact N-O 3.42Å; T33-Q97 CarbonylContact O-C 3.57Å; T33-Q97 WeakPolarHBondContact O-CA 3.41Å; T33-Q97 WeakPolarHBondContact OG1-CG 3.21Å; T33-L98 PolarHBondContact O-N 2.94Å
34	V	89.2	Confident	90.9	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.03	21%	0.21	C	C	.	.			trans	-112.8	106.1	170.5	-176.2	0	0	0	0	106.5	G36 D37 I39 T76 L80 L82 L98	V34-G36 PolarHBondContact O-N 2.88Å; V34-D37 HydrophobicContact CB-CB 4.03Å; V34-D37 HydrophobicContact CG1-CB 3.68Å; V34-D37 PolarHBondContact O-N 3.24Å; V34-I39 HydrophobicContact CG2-CD1 4.11Å; V34-I39 HydrophobicContact CG2-CG1 3.85Å; V34-T76 HydrophobicContact CB-CG2 4.42Å; V34-T76 HydrophobicContact CG2-CG2 3.88Å; V34-L80 HydrophobicContact CG1-CD1 4.17Å; V34-L82 HydrophobicContact CG2-CD1 3.99Å; V34-L98 HydrophobicContact CG2-CB 4.22Å; V34-L98 HydrophobicContact CG2-CD1 4.46Å
35	P	83	Confident	90.6	Very high	22 Å²	22	42.1 Å²	42.1	14%	0.143	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	125.8	-177.4	-27.4	37.2	0	0	0	111.7	Q97 L98 V99 L102 V141 P142	P35-Q97 HydrophobicContact CG-CB 4.27Å; P35-Q97 HydrophobicContact CG-CG 4.33Å; P35-L98 WeakPolarHBondContact CD-O 3.33Å; P35-V99 HydrophobicContact CG-CG2 4.28Å; P35-L102 WeakPolarHBondContact O-CD1 3.34Å; P35-V141 HydrophobicContact CB-CG1 4.33Å; P35-P142 HydrophobicContact CG-CG 4.28Å
36	G	76.8	Confident	89.9	Confident	31 Å²	31	50.1 Å²	50.1	32%	0.32	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	2.2	-179	0	0	0	0	0	115.5	V34 R78	V34-G36 PolarHBondContact O-N 2.88Å; G36-R78 PolarHBondContact O-NH1 3.02Å; G36-R78 PolarHBondContact O-NH2 3.26Å
37	D	81.7	Confident	89.4	Confident	13 Å²	13	52.4 Å²	52.4	7%	0.07	31%	0.313	C	S	.	.	S	Bend	trans	-142.7	162	-174.3	-165.4	4	0	0	0	111	V34 T76 R78 L102	V34-D37 HydrophobicContact CB-CB 4.03Å; V34-D37 HydrophobicContact CG1-CB 3.68Å; V34-D37 PolarHBondContact O-N 3.24Å; D37-T76 VanDerWaalsContact CG-CB 3.44Å; D37-T76 WeakPolarHBondContact OD2-CB 2.91Å; D37-T76 WeakPolarHBondContact OD2-CG2 3.4Å; D37-T76 PolarHBondContact OD2-OG1 3.09Å; D37-R78 WeakPolarHBondContact OD1-CB 3.48Å; D37-R78 PolarHBondContact OD1-N 2.94Å; D37-R78 WeakPolarHBondContact OD2-CB 3.14Å; D37-L102 HydrophobicContact CB-CD2 3.99Å
38	R	87.6	Confident	89.1	Confident	121 Å²	121	48.8 Å²	48.8	46%	0.457	29%	0.292	S	S	.	.			trans	-113.3	129.5	179.2	-62.6	-170.7	175.8	-96.1	-0.7	110.2	I40 A56 G58 T76 E77	R38-I40 PolarHBondContact O-N 2.94Å; R38-A56 PolarHBondContact NH1-O 3.32Å; R38-G58 WeakPolarHBondContact CA-O 3.48Å; R38-T76 CarbonylContact O-C 3.59Å; R38-T76 WeakPolarHBondContact O-CA 3.41Å; R38-T76 WeakPolarHBondContact O-CB 3.22Å; R38-E77 HydrophobicContact CB-CB 4.18Å; R38-E77 WeakPolarHBondContact CD-OE2 3.43Å; R38-E77 PolarHBondContact O-N 2.84Å
39	I	91.6	Very high	89	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.015	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	118.7	171.4	-58.4	171.6	0	0	0	108.1	F32 V34 V42 G58 V60 L74 T76	F32-I39 HydrophobicContact CB-CD1 4.17Å; F32-I39 WeakPolarHBondContact O-CD1 3.5Å; V34-I39 HydrophobicContact CG2-CD1 4.11Å; V34-I39 HydrophobicContact CG2-CG1 3.85Å; I39-V42 HydrophobicContact CG2-CG2 4.3Å; I39-G58 PolarHBondContact N-O 2.81Å; I39-V60 HydrophobicContact CD1-CB 4.47Å; I39-V60 HydrophobicContact CD1-CG1 3.82Å; I39-V60 HydrophobicContact CG2-CB 4.25Å; I39-V60 HydrophobicContact CG2-CG1 4.05Å; I39-L74 HydrophobicContact CD1-CD1 4.26Å; I39-L74 HydrophobicContact CG2-CB 4.44Å; I39-L74 HydrophobicContact CG2-CD2 4.12Å; I39-T76 HydrophobicContact CG1-CG2 4.44Å
40	I	92.5	Very high	88.7	Confident	83 Å²	83	47.6 Å²	47.6	43%	0.426	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-20.8	-175.9	60.4	167.4	0	0	0	113.2	R38 Q54 E75 E77	R38-I40 PolarHBondContact O-N 2.94Å; I40-Q54 VanDerWaalsContact C-NE2 3.34Å; I40-Q54 PolarHBondContact O-NE2 3.38Å; I40-E75 HydrophobicContact CG1-CB 4.43Å; I40-E75 WeakPolarHBondContact CG1-O 3.4Å; I40-E75 PolarHBondContact N-O 2.99Å; I40-E77 HydrophobicContact CG2-CB 3.75Å; I40-E77 HydrophobicContact CG2-CG 4.49Å
41	A	91.7	Very high	88.5	Confident	23 Å²	23	51.8 Å²	51.8	19%	0.19	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	151.5	176.9	0	0	0	0	0	112.3	E75	A41-E75 HydrophobicContact CB-CB 4.03Å; A41-E75 HydrophobicContact CB-CG 4.22Å; A41-E75 PolarHBondContact N-O 2.83Å; A41-E75 PolarHBondContact O-N 3.04Å
42	V	93.7	Very high	88.2	Confident	20 Å²	20	53.3 Å²	53.3	12%	0.121	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	112	172.6	-177.8	0	0	0	0	108.4	I39 L49 V60 F72 I73 L74	I39-V42 HydrophobicContact CG2-CG2 4.3Å; V42-L49 HydrophobicContact CG1-CD1 3.75Å; V42-V60 HydrophobicContact CG2-CB 4.1Å; V42-V60 HydrophobicContact CG2-CG1 3.86Å; V42-V60 HydrophobicContact CG2-CG2 3.64Å; V42-F72 HydrophobicContact CG1-CD2 4.03Å; V42-I73 CarbonylContact C-O 3.5Å; V42-I73 WeakPolarHBondContact CA-O 3.4Å; V42-L74 HydrophobicContact CB-CD2 4.15Å; V42-L74 HydrophobicContact CG1-CD2 3.97Å; V42-L74 HydrophobicContact CG2-CD2 3.47Å; V42-L74 VanDerWaalsContact CG2-CD2 3.47Å
43	N	92.3	Very high	88	Confident	82 Å²	82	59.1 Å²	59.1	44%	0.439	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	118.7	-177.5	-69.8	-28.2	0	0	0	110	F72 I73 E75	N43-F72 CarbonylContact O-C 3.57Å; N43-F72 VanDerWaalsContact O-CA 3.25Å; N43-F72 WeakPolarHBondContact O-CA 3.36Å; N43-F72 WeakPolarHBondContact O-CB 3.46Å; N43-I73 HydrophobicContact CB-CB 4.33Å; N43-I73 PolarHBondContact N-O 3.29Å; N43-I73 PolarHBondContact O-N 2.86Å; N43-E75 PolarHBondContact ND2-OE1 2.94Å
44	S	90.5	Very high	87.9	Confident	41 Å²	41	63.2 Å²	63.2	29%	0.287	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	155.9	-176.8	177	0	0	0	0	109.9	A48	S44-A48 WeakPolarHBondContact OG-CB 3.25Å
45	L	87	Confident	87.9	Confident	135 Å²	135	64.7 Å²	64.7	71%	0.707	37%	0.365	S	S	*	.			trans	-58.4	143.4	165.6	-85.1	132.9	0	0	0	110.8	G47 A48	L45-G47 PolarHBondContact O-N 2.66Å; L45-A48 HydrophobicContact CB-CB 4.45Å; L45-A48 WeakPolarHBondContact O-CB 3.46Å; L45-A48 PolarHBondContact O-N 3.22Å; L45-A48 VanDerWaalsContact O-N 3.09Å
46	D	78.7	Confident	88	Confident	172 Å²	172	68.5 Å²	68.5	92%	0.92	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	129.2	178.6	-76.5	-25.6	0	0	0	111.5	A48	D46-A48 VanDerWaalsContact C-N 3.27Å; D46-A48 PolarHBondContact O-N 2.01Å
47	G	82.7	Confident	88.2	Confident	68 Å²	68	71.4 Å²	71.4	70%	0.701	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	-2.8	179.1	0	0	0	0	0	115.8	L45	L45-G47 PolarHBondContact O-N 2.66Å
48	A	88	Confident	88.4	Confident	7 Å²	7	71.1 Å²	71.1	6%	0.058	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-34.6	176.5	0	0	0	0	0	112.7	S44 L45 D46 T64 F70	S44-A48 WeakPolarHBondContact OG-CB 3.25Å; L45-A48 HydrophobicContact CB-CB 4.45Å; L45-A48 WeakPolarHBondContact O-CB 3.46Å; L45-A48 PolarHBondContact O-N 3.22Å; L45-A48 VanDerWaalsContact O-N 3.09Å; D46-A48 VanDerWaalsContact C-N 3.27Å; D46-A48 PolarHBondContact O-N 2.01Å; A48-T64 WeakPolarHBondContact O-CB 3.11Å; A48-T64 PolarHBondContact O-OG1 3.3Å; A48-F70 HydrophobicContact CB-CB 4.23Å; A48-F70 HydrophobicContact CB-CD2 3.66Å; A48-F70 HydrophobicContact CB-CE2 4.11Å; A48-F70 HydrophobicContact CB-CG 3.92Å; A48-F70 WeakPolarHBondContact O-CZ 3.35Å
49	L	90.2	Very high	88.6	Confident	23 Å²	23	65.3 Å²	65.3	12%	0.12	39%	0.391	C	S	.	.			trans	-105.7	135.7	167.5	-63.8	177.9	0	0	0	109.2	V42 V62 A63 F70 F72	V42-L49 HydrophobicContact CG1-CD1 3.75Å; L49-V62 HydrophobicContact CD1-CG1 4.29Å; L49-V62 HydrophobicContact CD2-CB 4.15Å; L49-A63 CarbonylContact C-O 3.53Å; L49-A63 WeakPolarHBondContact CA-O 3.46Å; L49-F70 HydrophobicContact CD2-CE2 3.59Å; L49-F70 HydrophobicContact CD2-CZ 3.66Å; L49-F70 HydrophobicContact CG-CE2 4.08Å; L49-F72 HydrophobicContact CD1-CB 4.43Å; L49-F72 HydrophobicContact CD1-CG 4.42Å
50	T	88.6	Confident	88.8	Confident	77 Å²	77	65.3 Å²	65.3	47%	0.472	39%	0.391	S	S	.	.	S	Bend	trans	-89.3	-24.8	175.4	49.2	0	0	0	0	112.7	A63 V65	T50-A63 PolarHBondContact N-O 2.87Å; T50-A63 VanDerWaalsContact OG1-C 3.27Å; T50-A63 PolarHBondContact OG1-O 3.06Å; T50-A63 VanDerWaalsContact OG1-O 3.13Å; T50-V65 HydrophobicContact CG2-CB 4.25Å; T50-V65 HydrophobicContact CG2-CG1 4Å; T50-V65 HydrophobicContact CG2-CG2 3.58Å
51	N	89	Confident	88.9	Confident	89 Å²	89	63.4 Å²	63.4	48%	0.476	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	145.5	173.1	-165.7	0.3	0	0	0	109.6	V62 A63	N51-V62 WeakPolarHBondContact O-CA 3.41Å; N51-A63 HydrophobicContact CB-CB 4.16Å; N51-A63 PolarHBondContact N-O 3.02Å; N51-A63 PolarHBondContact O-N 2.77Å
52	N	90.1	Very high	89	Confident	78 Å²	78	62.4 Å²	62.4	42%	0.417	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	120.1	167.4	55.5	-0.8	0	0	0	109.6	V60 V61 V62	N52-V60 HydrophobicContact CB-CG2 4.31Å; N52-V61 CarbonylContact C-O 3.57Å; N52-V61 VanDerWaalsContact CA-O 3.26Å; N52-V61 WeakPolarHBondContact CA-O 3.48Å; N52-V62 HydrophobicContact CB-CG1 4.34Å
53	E	90.5	Very high	89.1	Confident	122 Å²	122	62.4 Å²	62.4	57%	0.57	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.8	123.1	-177.4	-170.5	179.1	173.5	0	0	110.1	V60 V61	E53-V60 CarbonylContact O-C 3.59Å; E53-V60 WeakPolarHBondContact O-CA 3.37Å; E53-V61 PolarHBondContact N-O 3.41Å; E53-V61 PolarHBondContact O-N 2.94Å
54	Q	90.8	Very high	89.1	Confident	112 Å²	112	58.7 Å²	58.7	52%	0.523	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	135.6	174.8	-72.6	179.6	19.5	0	0	110.4	I40 G59	I40-Q54 VanDerWaalsContact C-NE2 3.34Å; I40-Q54 PolarHBondContact O-NE2 3.38Å; Q54-G59 WeakPolarHBondContact CA-O 3.36Å
55	T	89.6	Confident	89.2	Confident	37 Å²	37	61.7 Å²	61.7	23%	0.227	37%	0.374	C	S	.	.			trans	-90.6	152.4	177.2	72.6	0	0	0	0	110.7	L31 S57 G58 G59 V61	L31-T55 HydrophobicContact CD1-CG2 3.9Å; T55-S57 PolarHBondContact O-N 2.88Å; T55-S57 VanDerWaalsContact O-N 3.09Å; T55-S57 PolarHBondContact OG1-OG 2.85Å; T55-G58 PolarHBondContact O-N 3.13Å; T55-G58 PolarHBondContact OG1-N 2.85Å; T55-G59 PolarHBondContact N-O 2.89Å; T55-G59 WeakPolarHBondContact OG1-CA 3.14Å; T55-G59 PolarHBondContact OG1-N 2.97Å; T55-G59 PolarHBondContact OG1-O 3.42Å; T55-V61 HydrophobicContact CG2-CG2 3.77Å
56	A	84.9	Confident	89.4	Confident	101 Å²	101	57.8 Å²	57.8	84%	0.835	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-25.2	173.8	0	0	0	0	0	113.1	R38 G58	R38-A56 PolarHBondContact NH1-O 3.32Å; A56-G58 VanDerWaalsContact C-N 3.28Å; A56-G58 PolarHBondContact O-N 2.86Å
57	S	81.2	Confident	90.1	Very high	93 Å²	93	57.2 Å²	57.2	65%	0.65	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-2.3	175.4	56.2	0	0	0	0	114.5	T55	T55-S57 PolarHBondContact O-N 2.88Å; T55-S57 VanDerWaalsContact O-N 3.09Å; T55-S57 PolarHBondContact OG1-OG 2.85Å
58	G	85.5	Confident	90.6	Very high	6 Å²	6	61.4 Å²	61.4	6%	0.062	34%	0.342	C	S	.	.	S	Bend	trans	88.6	11.2	179.3	0	0	0	0	0	115.3	R38 I39 T55 A56	R38-G58 WeakPolarHBondContact CA-O 3.48Å; I39-G58 PolarHBondContact N-O 2.81Å; T55-G58 PolarHBondContact O-N 3.13Å; T55-G58 PolarHBondContact OG1-N 2.85Å; A56-G58 VanDerWaalsContact C-N 3.28Å; A56-G58 PolarHBondContact O-N 2.86Å
59	G	91.6	Very high	90.9	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.364	C	S	.	.			trans	-91.1	178.3	170.3	0	0	0	0	0	112.2	F32 Q54 T55	F32-G59 CarbonylContact O-C 3.39Å; F32-G59 WeakPolarHBondContact O-CA 3.31Å; Q54-G59 WeakPolarHBondContact CA-O 3.36Å; T55-G59 PolarHBondContact N-O 2.89Å; T55-G59 WeakPolarHBondContact OG1-CA 3.14Å; T55-G59 PolarHBondContact OG1-N 2.97Å; T55-G59 PolarHBondContact OG1-O 3.42Å
60	V	95.1	Very high	91.1	Very high	2 Å²	2	64.6 Å²	64.6	1%	0.012	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	129.4	169.4	68.2	0	0	0	0	111	F32 I39 V42 N52 E53 V62 L74	F32-V60 HydrophobicContact CB-CG1 3.89Å; F32-V60 PolarHBondContact N-O 2.83Å; F32-V60 PolarHBondContact O-N 2.83Å; I39-V60 HydrophobicContact CD1-CB 4.47Å; I39-V60 HydrophobicContact CD1-CG1 3.82Å; I39-V60 HydrophobicContact CG2-CB 4.25Å; I39-V60 HydrophobicContact CG2-CG1 4.05Å; V42-V60 HydrophobicContact CG2-CB 4.1Å; V42-V60 HydrophobicContact CG2-CG1 3.86Å; V42-V60 HydrophobicContact CG2-CG2 3.64Å; N52-V60 HydrophobicContact CB-CG2 4.31Å; E53-V60 CarbonylContact O-C 3.59Å; E53-V60 WeakPolarHBondContact O-CA 3.37Å; V60-V62 HydrophobicContact CG1-CG1 4.16Å; V60-V62 HydrophobicContact CG2-CG1 4.16Å; V60-L74 HydrophobicContact CG1-CD2 3.88Å
61	V	95.2	Very high	91.4	Very high	44 Å²	44	63.4 Å²	63.4	27%	0.267	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	120.2	171.3	179.2	0	0	0	0	107.7	P29 N30 L31 N52 E53 T55	P29-V61 HydrophobicContact CB-CG1 3.54Å; N30-V61 CarbonylContact O-C 3.43Å; N30-V61 WeakPolarHBondContact O-CA 3.32Å; L31-V61 HydrophobicContact CD1-CG2 3.88Å; N52-V61 CarbonylContact C-O 3.57Å; N52-V61 VanDerWaalsContact CA-O 3.26Å; N52-V61 WeakPolarHBondContact CA-O 3.48Å; E53-V61 PolarHBondContact N-O 3.41Å; E53-V61 PolarHBondContact O-N 2.94Å; T55-V61 HydrophobicContact CG2-CG2 3.77Å
62	V	94.5	Very high	91.6	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.006	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137.4	177.4	-58	0	0	0	0	111	N30 F32 L49 N51 N52 V60	N30-V62 HydrophobicContact CB-CG2 4.15Å; N30-V62 PolarHBondContact N-O 2.84Å; N30-V62 PolarHBondContact O-N 3.35Å; F32-V62 HydrophobicContact CD2-CG1 4.49Å; F32-V62 HydrophobicContact CD2-CG2 3.59Å; F32-V62 HydrophobicContact CE2-CG2 3.37Å; L49-V62 HydrophobicContact CD1-CG1 4.29Å; L49-V62 HydrophobicContact CD2-CB 4.15Å; N51-V62 WeakPolarHBondContact O-CA 3.41Å; N52-V62 HydrophobicContact CB-CG1 4.34Å; V60-V62 HydrophobicContact CG1-CG1 4.16Å; V60-V62 HydrophobicContact CG2-CG1 4.16Å
63	A	94.1	Very high	91.8	Very high	21 Å²	21	58.8 Å²	58.8	17%	0.174	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	145.6	171.5	0	0	0	0	0	109.7	L49 T50 N51	L49-A63 CarbonylContact C-O 3.53Å; L49-A63 WeakPolarHBondContact CA-O 3.46Å; T50-A63 PolarHBondContact N-O 2.87Å; T50-A63 VanDerWaalsContact OG1-C 3.27Å; T50-A63 PolarHBondContact OG1-O 3.06Å; T50-A63 VanDerWaalsContact OG1-O 3.13Å; N51-A63 HydrophobicContact CB-CB 4.16Å; N51-A63 PolarHBondContact N-O 3.02Å; N51-A63 PolarHBondContact O-N 2.77Å
64	T	93.8	Very high	91.9	Very high	4 Å²	4	53 Å²	53	3%	0.025	30%	0.302	C	S	.	.			trans	-144.3	147.1	173.8	-175.4	0	0	0	0	109.3	I24 N26 A48 N66 F70 P88	I24-T64 HydrophobicContact CD1-CG2 3.64Å; I24-T64 HydrophobicContact CG1-CG2 4.38Å; N26-T64 CarbonylContact C-O 3.5Å; N26-T64 WeakPolarHBondContact CA-O 3.16Å; N26-T64 HydrophobicContact CB-CG2 4.38Å; N26-T64 VanDerWaalsContact O-O 3.09Å; A48-T64 WeakPolarHBondContact O-CB 3.11Å; A48-T64 PolarHBondContact O-OG1 3.3Å; T64-N66 VanDerWaalsContact OG1-CB 3.28Å; T64-N66 WeakPolarHBondContact OG1-CB 3.22Å; T64-N66 PolarHBondContact OG1-N 3.14Å; T64-F70 HydrophobicContact CG2-CE1 3.98Å; T64-F70 HydrophobicContact CG2-CZ 4.01Å; T64-P88 HydrophobicContact CG2-CG 4.5Å
65	V	93.1	Very high	92	Very high	104 Å²	104	50.8 Å²	50.8	63%	0.63	29%	0.292	S	S	*	.			trans	-108.2	4.9	167.1	-61.2	0	0	0	0	111.4	T50	T50-V65 HydrophobicContact CG2-CB 4.25Å; T50-V65 HydrophobicContact CG2-CG1 4Å; T50-V65 HydrophobicContact CG2-CG2 3.58Å
66	N	91.3	Very high	92	Very high	52 Å²	52	49.2 Å²	49.2	28%	0.278	28%	0.282	S	S	.	.			trans	-67.7	146.3	-179.1	-157.6	-15.5	0	0	0	110	T64 K68 F70 P88	T64-N66 VanDerWaalsContact OG1-CB 3.28Å; T64-N66 WeakPolarHBondContact OG1-CB 3.22Å; T64-N66 PolarHBondContact OG1-N 3.14Å; N66-K68 PolarHBondContact OD1-N 3.21Å; N66-K68 VanDerWaalsContact OD1-N 3.08Å; N66-F70 HydrophobicContact CB-CD1 4.14Å; N66-F70 HydrophobicContact CB-CE1 4.07Å; N66-P88 WeakPolarHBondContact O-CB 3.5Å; N66-P88 WeakPolarHBondContact O-CG 3.36Å
67	K	92.8	Very high	92	Very high	160 Å²	160	50.5 Å²	50.5	70%	0.696	27%	0.27	S	S	*	.			trans	-106.9	-14.5	176.5	-62.2	-170.6	178.9	-167.9	0	112.4
68	K	93.2	Very high	91.8	Very high	156 Å²	156	49 Å²	49	68%	0.678	25%	0.25	S	S	*	.	S	Bend	trans	-96.1	147.5	177.6	-66.7	-175.3	179.7	180	0	110	N66	N66-K68 PolarHBondContact OD1-N 3.21Å; N66-K68 VanDerWaalsContact OD1-N 3.08Å
69	P	93.6	Very high	91.6	Very high	80 Å²	80	50.6 Å²	50.6	52%	0.519	27%	0.268	S	S	.	.			trans	-56.6	142.8	170.1	-23.4	33.7	0	0	0	111.6	A86	P69-A86 WeakPolarHBondContact CA-O 3.39Å
70	F	94.8	Very high	91.2	Very high	17 Å²	17	50.7 Å²	50.7	8%	0.075	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	164.4	177.1	64.4	-89.5	0	0	0	110	I24 A48 L49 T64 N66 F72 Q85 A86 P88	I24-F70 HydrophobicContact CD1-CE1 4.36Å; I24-F70 HydrophobicContact CD1-CZ 4Å; A48-F70 HydrophobicContact CB-CB 4.23Å; A48-F70 HydrophobicContact CB-CD2 3.66Å; A48-F70 HydrophobicContact CB-CE2 4.11Å; A48-F70 HydrophobicContact CB-CG 3.92Å; A48-F70 WeakPolarHBondContact O-CZ 3.35Å; L49-F70 HydrophobicContact CD2-CE2 3.59Å; L49-F70 HydrophobicContact CD2-CZ 3.66Å; L49-F70 HydrophobicContact CG-CE2 4.08Å; T64-F70 HydrophobicContact CG2-CE1 3.98Å; T64-F70 HydrophobicContact CG2-CZ 4.01Å; N66-F70 HydrophobicContact CB-CD1 4.14Å; N66-F70 HydrophobicContact CB-CE1 4.07Å; F70-F72 HydrophobicContact CD2-CD1 4.27Å; F70-F72 AromaticContact CE2-CD1 3.71Å; F70-F72 HydrophobicContact CE2-CD1 3.71Å; F70-F72 HydrophobicContact CE2-CE1 4.34Å; F70-Q85 CarbonylContact O-C 3.43Å; F70-A86 HydrophobicContact CD1-CB 4.21Å; F70-A86 HydrophobicContact CD2-CB 4.22Å; F70-A86 HydrophobicContact CE1-CB 3.92Å; F70-A86 HydrophobicContact CE2-CB 3.93Å; F70-A86 HydrophobicContact CG-CB 4.36Å; F70-A86 HydrophobicContact CZ-CB 3.75Å; F70-A86 PolarHBondContact N-O 3.37Å; F70-A86 VanDerWaalsContact N-O 3.11Å; F70-A86 WeakPolarHBondContact O-CB 3.5Å; F70-A86 PolarHBondContact O-N 3.06Å; F70-P88 HydrophobicContact CD1-CG 4.06Å; F70-P88 HydrophobicContact CE1-CG 3.72Å
71	T	93.9	Very high	90.9	Very high	52 Å²	52	54.2 Å²	54.2	32%	0.319	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	136.7	-179.6	-53.8	0	0	0	0	110	S83 I84	T71-S83 WeakPolarHBondContact CG2-OG 3.41Å; T71-I84 VanDerWaalsContact CA-O 3.26Å; T71-I84 WeakPolarHBondContact CA-O 3.46Å
72	F	94.7	Very high	90.7	Very high	1 Å²	1	52.1 Å²	52.1	0%	0.004	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	154.5	165.4	65.6	-92.5	0	0	0	109.7	F32 V42 N43 L49 F70 L74 I84 A86	F32-F72 HydrophobicContact CD2-CZ 4.42Å; F32-F72 HydrophobicContact CE1-CZ 4.09Å; F32-F72 AromaticContact CE2-CZ 3.88Å; F32-F72 HydrophobicContact CE2-CZ 3.88Å; F32-F72 HydrophobicContact CZ-CE1 4.5Å; F32-F72 AromaticContact CZ-CZ 3.69Å; F32-F72 HydrophobicContact CZ-CZ 3.69Å; V42-F72 HydrophobicContact CG1-CD2 4.03Å; N43-F72 CarbonylContact O-C 3.57Å; N43-F72 VanDerWaalsContact O-CA 3.25Å; N43-F72 WeakPolarHBondContact O-CA 3.36Å; N43-F72 WeakPolarHBondContact O-CB 3.46Å; L49-F72 HydrophobicContact CD1-CB 4.43Å; L49-F72 HydrophobicContact CD1-CG 4.42Å; F70-F72 HydrophobicContact CD2-CD1 4.27Å; F70-F72 AromaticContact CE2-CD1 3.71Å; F70-F72 HydrophobicContact CE2-CD1 3.71Å; F70-F72 HydrophobicContact CE2-CE1 4.34Å; F72-L74 HydrophobicContact CD2-CD2 3.89Å; F72-L74 HydrophobicContact CD2-CG 4.04Å; F72-L74 HydrophobicContact CE2-CD1 4.03Å; F72-L74 HydrophobicContact CE2-CD2 3.69Å; F72-L74 HydrophobicContact CE2-CG 3.76Å; F72-I84 HydrophobicContact CD1-CB 4.26Å; F72-I84 HydrophobicContact CD1-CG2 4.47Å; F72-I84 HydrophobicContact CD2-CB 4.15Å; F72-I84 HydrophobicContact CD2-CG1 4.31Å; F72-I84 HydrophobicContact CE1-CB 3.92Å; F72-I84 HydrophobicContact CE1-CG2 3.74Å; F72-I84 HydrophobicContact CE2-CB 3.76Å; F72-I84 HydrophobicContact CE2-CG1 3.74Å; F72-I84 HydrophobicContact CE2-CG2 4.21Å; F72-I84 HydrophobicContact CG-CB 4.4Å; F72-I84 HydrophobicContact CZ-CB 3.65Å; F72-I84 HydrophobicContact CZ-CG1 3.99Å; F72-I84 HydrophobicContact CZ-CG2 3.58Å; F72-I84 PolarHBondContact N-O 3Å; F72-I84 PolarHBondContact O-N 2.7Å; F72-A86 HydrophobicContact CD1-CB 4.25Å; F72-A86 HydrophobicContact CE1-CB 3.93Å
73	I	93.4	Very high	90.6	Very high	70 Å²	70	53.1 Å²	53.1	36%	0.359	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	134.4	-179.2	-59.4	169.9	0	0	0	108	V42 N43 E75 L82	V42-I73 CarbonylContact C-O 3.5Å; V42-I73 WeakPolarHBondContact CA-O 3.4Å; N43-I73 HydrophobicContact CB-CB 4.33Å; N43-I73 PolarHBondContact N-O 3.29Å; N43-I73 PolarHBondContact O-N 2.86Å; I73-E75 HydrophobicContact CG2-CG 4.45Å; I73-L82 WeakPolarHBondContact CA-O 3.46Å
74	L	93.7	Very high	90.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.9	171.2	-60.4	175	0	0	0	108.6	F32 I39 V42 V60 F72 L82 I84 L98	F32-L74 HydrophobicContact CB-CD1 4.18Å; F32-L74 HydrophobicContact CD1-CD1 4.09Å; F32-L74 HydrophobicContact CG-CD1 4.3Å; I39-L74 HydrophobicContact CD1-CD1 4.26Å; I39-L74 HydrophobicContact CG2-CB 4.44Å; I39-L74 HydrophobicContact CG2-CD2 4.12Å; V42-L74 HydrophobicContact CB-CD2 4.15Å; V42-L74 HydrophobicContact CG1-CD2 3.97Å; V42-L74 HydrophobicContact CG2-CD2 3.47Å; V42-L74 VanDerWaalsContact CG2-CD2 3.47Å; V60-L74 HydrophobicContact CG1-CD2 3.88Å; F72-L74 HydrophobicContact CD2-CD2 3.89Å; F72-L74 HydrophobicContact CD2-CG 4.04Å; F72-L74 HydrophobicContact CE2-CD1 4.03Å; F72-L74 HydrophobicContact CE2-CD2 3.69Å; F72-L74 HydrophobicContact CE2-CG 3.76Å; L74-L82 HydrophobicContact CB-CB 4.37Å; L74-L82 PolarHBondContact N-O 3.2Å; L74-L82 PolarHBondContact O-N 3.12Å; L74-I84 HydrophobicContact CD1-CG1 4.03Å; L74-I84 HydrophobicContact CG-CG1 4.32Å; L74-L98 HydrophobicContact CD1-CD1 3.42Å; L74-L98 VanDerWaalsContact CD1-CD1 3.42Å
75	E	91.3	Very high	90.7	Very high	66 Å²	66	55.4 Å²	55.4	31%	0.308	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	136.8	173	-48.6	-177.3	174.7	0	0	108.7	I40 A41 N43 I73 L80 N81	I40-E75 HydrophobicContact CG1-CB 4.43Å; I40-E75 WeakPolarHBondContact CG1-O 3.4Å; I40-E75 PolarHBondContact N-O 2.99Å; A41-E75 HydrophobicContact CB-CB 4.03Å; A41-E75 HydrophobicContact CB-CG 4.22Å; A41-E75 PolarHBondContact N-O 2.83Å; A41-E75 PolarHBondContact O-N 3.04Å; N43-E75 PolarHBondContact ND2-OE1 2.94Å; I73-E75 HydrophobicContact CG2-CG 4.45Å; E75-L80 WeakPolarHBondContact CA-O 3.45Å; E75-N81 WeakPolarHBondContact CG-OD1 3.4Å
76	T	89.4	Confident	90.7	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.018	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	159.9	-179.8	75.2	0	0	0	0	112.7	V34 D37 R38 I39 R78 G79 L80	V34-T76 HydrophobicContact CB-CG2 4.42Å; V34-T76 HydrophobicContact CG2-CG2 3.88Å; D37-T76 VanDerWaalsContact CG-CB 3.44Å; D37-T76 WeakPolarHBondContact OD2-CB 2.91Å; D37-T76 WeakPolarHBondContact OD2-CG2 3.4Å; D37-T76 PolarHBondContact OD2-OG1 3.09Å; R38-T76 CarbonylContact O-C 3.59Å; R38-T76 WeakPolarHBondContact O-CA 3.41Å; R38-T76 WeakPolarHBondContact O-CB 3.22Å; I39-T76 HydrophobicContact CG1-CG2 4.44Å; T76-R78 PolarHBondContact O-N 2.87Å; T76-G79 PolarHBondContact O-N 2.65Å; T76-G79 PolarHBondContact OG1-N 3.14Å; T76-L80 HydrophobicContact CG2-CB 3.97Å; T76-L80 PolarHBondContact N-O 3.07Å; T76-L80 VanDerWaalsContact OG1-CB 3.31Å; T76-L80 WeakPolarHBondContact OG1-CB 3.48Å; T76-L80 PolarHBondContact OG1-N 2.94Å
77	E	85	Confident	90.9	Very high	128 Å²	128	49.6 Å²	49.6	60%	0.598	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-32.5	177.1	-173.8	173.3	-161	0	0	111.8	R38 I40 G79	R38-E77 HydrophobicContact CB-CB 4.18Å; R38-E77 WeakPolarHBondContact CD-OE2 3.43Å; R38-E77 PolarHBondContact O-N 2.84Å; I40-E77 HydrophobicContact CG2-CB 3.75Å; I40-E77 HydrophobicContact CG2-CG 4.49Å; E77-G79 VanDerWaalsContact C-N 3.29Å; E77-G79 PolarHBondContact O-N 3.43Å
78	R	77.7	Confident	91	Very high	61 Å²	61	42.6 Å²	42.6	23%	0.23	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	0.1	175.9	-85.2	176.6	-177.9	-169.9	6.5	113.9	G36 D37 T76 T105 H139	G36-R78 PolarHBondContact O-NH1 3.02Å; G36-R78 PolarHBondContact O-NH2 3.26Å; D37-R78 WeakPolarHBondContact OD1-CB 3.48Å; D37-R78 PolarHBondContact OD1-N 2.94Å; D37-R78 WeakPolarHBondContact OD2-CB 3.14Å; T76-R78 PolarHBondContact O-N 2.87Å; R78-T105 VanDerWaalsContact CB-CB 3.49Å; R78-T105 HydrophobicContact CB-CG2 4.37Å; R78-T105 VanDerWaalsContact CD-O 3.23Å; R78-T105 WeakPolarHBondContact CD-O 3.34Å; R78-T105 PolarHBondContact NE-O 2.82Å; R78-T105 WeakPolarHBondContact O-CB 3.39Å; R78-T105 WeakPolarHBondContact O-CG2 3.5Å; R78-H139 PolarHBondContact NH1-CE1 3.26Å
79	G	80.8	Confident	91	Very high	41 Å²	41	43 Å²	43	42%	0.423	22%	0.222	S	C	.	.			trans	84.5	19.5	174.6	0	0	0	0	0	114.9	T76 E77	T76-G79 PolarHBondContact O-N 2.65Å; T76-G79 PolarHBondContact OG1-N 3.14Å; E77-G79 VanDerWaalsContact C-N 3.29Å; E77-G79 PolarHBondContact O-N 3.43Å
80	L	83.8	Confident	90.9	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.01	23%	0.23	C	C	.	.			trans	-76.5	131.9	168.7	-61.9	175.3	0	0	0	109.9	N16 V34 E75 T76 L82 L102	N16-L80 HydrophobicContact CB-CD2 3.8Å; V34-L80 HydrophobicContact CG1-CD1 4.17Å; E75-L80 WeakPolarHBondContact CA-O 3.45Å; T76-L80 HydrophobicContact CG2-CB 3.97Å; T76-L80 PolarHBondContact N-O 3.07Å; T76-L80 VanDerWaalsContact OG1-CB 3.31Å; T76-L80 WeakPolarHBondContact OG1-CB 3.48Å; T76-L80 PolarHBondContact OG1-N 2.94Å; L80-L82 HydrophobicContact CB-CD2 4.39Å; L80-L82 HydrophobicContact CB-CG 4.3Å; L80-L102 HydrophobicContact CD1-CD2 3.57Å; L80-L102 HydrophobicContact CD1-CG 4.48Å; L80-L102 HydrophobicContact CG-CD2 4.37Å
81	N	88.9	Confident	90.6	Very high	76 Å²	76	47 Å²	47	41%	0.406	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	106.4	172.1	-70.1	-39	0	0	0	109.1	N16 G17 E75	N16-N81 PolarHBondContact OD1-N 3.17Å; G17-N81 VanDerWaalsContact CA-O 3.29Å; G17-N81 WeakPolarHBondContact CA-O 3.34Å; G17-N81 PolarHBondContact N-O 3.16Å; E75-N81 WeakPolarHBondContact CG-OD1 3.4Å
82	L	90.4	Very high	90.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118	-172.8	-54.9	175.9	0	0	0	110.4	M14 V34 I73 L74 L80 L98	M14-L82 HydrophobicContact CB-CD2 4.09Å; M14-L82 HydrophobicContact CE-CB 4Å; M14-L82 HydrophobicContact CE-CD2 4.27Å; M14-L82 HydrophobicContact SD-CB 4.25Å; M14-L82 HydrophobicContact SD-CD2 4.41Å; V34-L82 HydrophobicContact CG2-CD1 3.99Å; I73-L82 WeakPolarHBondContact CA-O 3.46Å; L74-L82 HydrophobicContact CB-CB 4.37Å; L74-L82 PolarHBondContact N-O 3.2Å; L74-L82 PolarHBondContact O-N 3.12Å; L80-L82 HydrophobicContact CB-CD2 4.39Å; L80-L82 HydrophobicContact CB-CG 4.3Å; L82-L98 HydrophobicContact CD1-CB 4.03Å; L82-L98 HydrophobicContact CD1-CD1 3.74Å
83	S	92.7	Very high	90	Very high	21 Å²	21	49.1 Å²	49.1	15%	0.147	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	120.8	178.5	-172.9	0	0	0	0	111	M14 G18 Q19 A20 T71	M14-S83 WeakPolarHBondContact CE-O 3.37Å; G18-S83 PolarHBondContact O-N 3.49Å; Q19-S83 CarbonylContact C-O 3.47Å; Q19-S83 VanDerWaalsContact CA-O 3.23Å; Q19-S83 WeakPolarHBondContact CA-O 3.32Å; Q19-S83 PolarHBondContact NE2-OG 3.08Å; Q19-S83 VanDerWaalsContact NE2-OG 3.1Å; A20-S83 PolarHBondContact N-O 2.84Å; T71-S83 WeakPolarHBondContact CG2-OG 3.41Å
84	I	94.6	Very high	89.8	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	111.9	-179.5	-51	-57.3	0	0	0	109.5	M14 I22 F32 T71 F72 L74 A86 L98	M14-I84 HydrophobicContact CE-CD1 4Å; M14-I84 HydrophobicContact SD-CD1 3.69Å; I22-I84 HydrophobicContact CB-CG2 4.27Å; I22-I84 HydrophobicContact CD1-CD1 3.96Å; I22-I84 HydrophobicContact CD1-CG2 3.99Å; I22-I84 HydrophobicContact CG1-CG2 4.3Å; F32-I84 HydrophobicContact CE1-CG1 4.48Å; F32-I84 HydrophobicContact CE1-CG2 4.14Å; F32-I84 HydrophobicContact CZ-CG2 4.35Å; T71-I84 VanDerWaalsContact CA-O 3.26Å; T71-I84 WeakPolarHBondContact CA-O 3.46Å; F72-I84 HydrophobicContact CD1-CB 4.26Å; F72-I84 HydrophobicContact CD1-CG2 4.47Å; F72-I84 HydrophobicContact CD2-CB 4.15Å; F72-I84 HydrophobicContact CD2-CG1 4.31Å; F72-I84 HydrophobicContact CE1-CB 3.92Å; F72-I84 HydrophobicContact CE1-CG2 3.74Å; F72-I84 HydrophobicContact CE2-CB 3.76Å; F72-I84 HydrophobicContact CE2-CG1 3.74Å; F72-I84 HydrophobicContact CE2-CG2 4.21Å; F72-I84 HydrophobicContact CG-CB 4.4Å; F72-I84 HydrophobicContact CZ-CB 3.65Å; F72-I84 HydrophobicContact CZ-CG1 3.99Å; F72-I84 HydrophobicContact CZ-CG2 3.58Å; F72-I84 PolarHBondContact N-O 3Å; F72-I84 PolarHBondContact O-N 2.7Å; L74-I84 HydrophobicContact CD1-CG1 4.03Å; L74-I84 HydrophobicContact CG-CG1 4.32Å; I84-A86 PolarHBondContact O-N 3.21Å; I84-L98 HydrophobicContact CD1-CD1 3.93Å; I84-L98 HydrophobicContact CD1-CD2 4.03Å
85	Q	94.6	Very high	89.7	Confident	73 Å²	73	54.7 Å²	54.7	34%	0.341	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	93	166.7	-172	-169.8	34.9	0	0	108.5	Q19 A20 S21 I22 F70	Q19-Q85 HydrophobicContact CG-CB 4.47Å; A20-Q85 PolarHBondContact O-N 3.46Å; S21-Q85 CarbonylContact C-O 3.57Å; S21-Q85 WeakPolarHBondContact CA-O 3.35Å; S21-Q85 PolarHBondContact OG-OE1 2.86Å; I22-Q85 PolarHBondContact N-O 2.99Å; F70-Q85 CarbonylContact O-C 3.43Å
86	A	94.4	Very high	89.8	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	131	177.6	0	0	0	0	0	111.4	I24 P69 F70 F72 I84 P88	I24-A86 HydrophobicContact CD1-CB 3.58Å; I24-A86 HydrophobicContact CG1-CB 4.04Å; P69-A86 WeakPolarHBondContact CA-O 3.39Å; F70-A86 HydrophobicContact CD1-CB 4.21Å; F70-A86 HydrophobicContact CD2-CB 4.22Å; F70-A86 HydrophobicContact CE1-CB 3.92Å; F70-A86 HydrophobicContact CE2-CB 3.93Å; F70-A86 HydrophobicContact CG-CB 4.36Å; F70-A86 HydrophobicContact CZ-CB 3.75Å; F70-A86 PolarHBondContact N-O 3.37Å; F70-A86 VanDerWaalsContact N-O 3.11Å; F70-A86 WeakPolarHBondContact O-CB 3.5Å; F70-A86 PolarHBondContact O-N 3.06Å; F72-A86 HydrophobicContact CD1-CB 4.25Å; F72-A86 HydrophobicContact CE1-CB 3.93Å; I84-A86 PolarHBondContact O-N 3.21Å; A86-P88 WeakPolarHBondContact O-CD 3.47Å
87	V	95.2	Very high	89.8	Confident	34 Å²	34	53.8 Å²	53.8	21%	0.206	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	94	172.5	-176.1	0	0	0	0	108.5	I22 A23 I24	I22-V87 PolarHBondContact O-N 2.71Å; A23-V87 WeakPolarHBondContact CA-O 3.49Å; I24-V87 PolarHBondContact N-O 3.06Å; I24-V87 VanDerWaalsContact N-O 3.12Å
88	P	94.8	Very high	90.1	Very high	13 Å²	13	47.7 Å²	47.7	8%	0.084	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	135.9	-175	-20.2	33.3	0	0	0	112.4	I24 N26 T64 N66 F70 A86	I24-P88 CarbonylContact O-C 3.51Å; I24-P88 WeakPolarHBondContact O-CA 3.31Å; N26-P88 HydrophobicContact CB-CB 3.97Å; T64-P88 HydrophobicContact CG2-CG 4.5Å; N66-P88 WeakPolarHBondContact O-CB 3.5Å; N66-P88 WeakPolarHBondContact O-CG 3.36Å; F70-P88 HydrophobicContact CD1-CG 4.06Å; F70-P88 HydrophobicContact CE1-CG 3.72Å; A86-P88 WeakPolarHBondContact O-CD 3.47Å
89	R	93.4	Very high	90.3	Very high	165 Å²	165	45.4 Å²	45.4	62%	0.623	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.8	148.5	175.2	-60.8	-172.7	-174.9	-164.5	1.4	110.6	I24 S25 N26	I24-R89 PolarHBondContact O-N 3.02Å; S25-R89 VanDerWaalsContact CA-O 3.31Å; S25-R89 WeakPolarHBondContact CA-O 3.15Å; N26-R89 PolarHBondContact N-O 2.71Å; N26-R89 PolarHBondContact OD1-O 2.84Å; N26-R89 VanDerWaalsContact OD1-O 3.05Å
90	E	91.7	Very high	90	Very high	145 Å²	145	43.8 Å²	43.8	68%	0.678	24%	0.235	S	C	*	.	S	Bend	trans	-67.7	133.5	172.9	-67.7	-179.6	-178.8	0	0	110	N26 T27	N26-E90 WeakPolarHBondContact OD1-CA 3.43Å; N26-E90 WeakPolarHBondContact OD1-CG 3.28Å; N26-E90 PolarHBondContact OD1-N 3.48Å; T27-E90 HydrophobicContact CG2-CB 4.4Å; T27-E90 HydrophobicContact CG2-CG 4.14Å
91	G	88.5	Confident	89	Confident	37 Å²	37	46.4 Å²	46.4	38%	0.381	25%	0.249	S	C	.	.	S	Bend	trans	154.5	-175.2	179.7	0	0	0	0	0	114.5	S25 T27	S25-G91 WeakPolarHBondContact CB-O 3.35Å; S25-G91 PolarHBondContact OG-O 3.43Å; T27-G91 PolarHBondContact OG1-N 2.96Å; T27-G91 PolarHBondContact OG1-O 3.47Å
92	A	88.7	Confident	87.5	Confident	68 Å²	68	43 Å²	43	56%	0.562	23%	0.231	S	C	*	.			trans	-67.4	144.7	176.2	0	0	0	0	0	111.6
93	G	87.6	Confident	85.8	Confident	28 Å²	28	47.8 Å²	47.8	29%	0.289	25%	0.249	S	C	.	.			trans	-60.3	150.7	172.4	0	0	0	0	0	111.6	S28 P29	S28-G93 VanDerWaalsContact CB-N 3.31Å; P29-G93 VanDerWaalsContact O-CA 3.24Å; P29-G93 WeakPolarHBondContact O-CA 3.47Å
94	R	88.3	Confident	83.7	Confident	131 Å²	131	49.7 Å²	49.7	49%	0.494	27%	0.272	S	S	.	.			trans	-124.2	153.2	-178.6	-63.1	-178	-179.9	178.7	-2.7	111.2	N30 L31 I96	N30-R94 CarbonylContact C-O 3.48Å; N30-R94 WeakPolarHBondContact CA-O 2.94Å; N30-R94 PolarHBondContact OD1-N 2.79Å; L31-R94 PolarHBondContact N-O 2.74Å; R94-I96 HydrophobicContact CB-CD1 4.16Å; R94-I96 WeakPolarHBondContact O-CD1 3.48Å
95	T	91.9	Very high	81.6	Confident	57 Å²	57	50.6 Å²	50.6	35%	0.35	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.7	164.7	-56.9	0	0	0	0	108.5	P9 T10 L31	P9-T95 CarbonylContact C-O 3.49Å; P9-T95 VanDerWaalsContact CA-O 3.3Å; P9-T95 WeakPolarHBondContact CA-O 3.48Å; P9-T95 HydrophobicContact CB-CG2 4Å; T10-T95 PolarHBondContact N-O 2.89Å; L31-T95 HydrophobicContact CB-CG2 4.39Å; L31-T95 HydrophobicContact CD2-CG2 3.97Å; L31-T95 HydrophobicContact CG-CG2 4.21Å; L31-T95 CarbonylContact O-C 3.44Å; L31-T95 WeakPolarHBondContact O-CA 3.23Å
96	I	93.4	Very high	79.7	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	120.8	179.7	-60.1	94.6	0	0	0	108	T10 V12 I22 N30 L31 F32 T33 R94 L98	T10-I96 CarbonylContact O-C 3.31Å; T10-I96 WeakPolarHBondContact O-CA 3.38Å; V12-I96 HydrophobicContact CG2-CG2 4.04Å; I22-I96 HydrophobicContact CD1-CG2 4.06Å; I22-I96 HydrophobicContact CG2-CG1 4.12Å; I22-I96 HydrophobicContact CG2-CG2 4.45Å; N30-I96 HydrophobicContact CB-CD1 4.15Å; L31-I96 PolarHBondContact O-N 3.26Å; F32-I96 WeakPolarHBondContact CA-O 3.39Å; F32-I96 HydrophobicContact CD1-CB 3.87Å; F32-I96 HydrophobicContact CD1-CG2 3.94Å; F32-I96 HydrophobicContact CD2-CD1 4.39Å; F32-I96 HydrophobicContact CE1-CB 3.9Å; F32-I96 HydrophobicContact CE1-CD1 4.19Å; F32-I96 HydrophobicContact CE1-CG1 4.17Å; F32-I96 HydrophobicContact CE1-CG2 3.85Å; F32-I96 HydrophobicContact CE2-CD1 3.94Å; F32-I96 HydrophobicContact CG-CB 4.41Å; F32-I96 HydrophobicContact CZ-CB 4.43Å; F32-I96 HydrophobicContact CZ-CD1 3.84Å; F32-I96 HydrophobicContact CZ-CG1 4.27Å; T33-I96 PolarHBondContact N-O 3.42Å; R94-I96 HydrophobicContact CB-CD1 4.16Å; R94-I96 WeakPolarHBondContact O-CD1 3.48Å; I96-L98 HydrophobicContact CG2-CD2 3.67Å; I96-L98 HydrophobicContact CG2-CG 4.4Å
97	Q	90.3	Very high	78.2	Confident	48 Å²	48	56 Å²	56	22%	0.224	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	110	174.4	-78.8	178.3	-17.1	0	0	109	P9 T10 V11 V12 T33 P35 P142	P9-Q97 HydrophobicContact CB-CG 4.08Å; P9-Q97 HydrophobicContact CG-CG 4.5Å; T10-Q97 PolarHBondContact O-N 3.45Å; V11-Q97 WeakPolarHBondContact CA-O 3.49Å; V12-Q97 PolarHBondContact N-O 3.33Å; T33-Q97 CarbonylContact O-C 3.57Å; T33-Q97 WeakPolarHBondContact O-CA 3.41Å; T33-Q97 WeakPolarHBondContact OG1-CG 3.21Å; P35-Q97 HydrophobicContact CG-CB 4.27Å; P35-Q97 HydrophobicContact CG-CG 4.33Å; Q97-P142 VanDerWaalsContact OE1-CG 3.31Å
98	L	90.1	Very high	76.8	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	109.6	176.3	-52.6	177.4	0	0	0	108	V12 M14 I22 F32 T33 V34 P35 L74 L82 I84 I96	V12-L98 HydrophobicContact CB-CD2 4.13Å; V12-L98 WeakPolarHBondContact O-CA 3.34Å; M14-L98 HydrophobicContact SD-CB 4.43Å; M14-L98 HydrophobicContact SD-CD1 4.36Å; M14-L98 HydrophobicContact SD-CD2 3.79Å; M14-L98 HydrophobicContact SD-CG 4.42Å; I22-L98 HydrophobicContact CD1-CD2 3.88Å; F32-L98 HydrophobicContact CD1-CD1 4.11Å; F32-L98 HydrophobicContact CD1-CD2 4.33Å; F32-L98 HydrophobicContact CD1-CG 4.32Å; T33-L98 PolarHBondContact O-N 2.94Å; V34-L98 HydrophobicContact CG2-CB 4.22Å; V34-L98 HydrophobicContact CG2-CD1 4.46Å; P35-L98 WeakPolarHBondContact CD-O 3.33Å; L74-L98 HydrophobicContact CD1-CD1 3.42Å; L74-L98 VanDerWaalsContact CD1-CD1 3.42Å; L82-L98 HydrophobicContact CD1-CB 4.03Å; L82-L98 HydrophobicContact CD1-CD1 3.74Å; I84-L98 HydrophobicContact CD1-CD1 3.93Å; I84-L98 HydrophobicContact CD1-CD2 4.03Å; I96-L98 HydrophobicContact CG2-CD2 3.67Å; I96-L98 HydrophobicContact CG2-CG 4.4Å
99	V	83.2	Confident	75.2	Confident	14 Å²	14	60 Å²	60	9%	0.085	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	109.4	-177.4	-177.9	0	0	0	0	107.8	V11 V12 P13 M14 P35 V141 P142 T144	V11-V99 HydrophobicContact CG1-CB 4.47Å; V11-V99 HydrophobicContact CG1-CG2 3.65Å; V12-V99 PolarHBondContact O-N 3.05Å; P13-V99 CarbonylContact C-O 3.52Å; P13-V99 VanDerWaalsContact CA-O 3.29Å; P13-V99 WeakPolarHBondContact CA-O 3.47Å; M14-V99 PolarHBondContact N-O 3.3Å; P35-V99 HydrophobicContact CG-CG2 4.28Å; V99-V141 HydrophobicContact CG1-CB 4.31Å; V99-P142 HydrophobicContact CG2-CB 4.34Å; V99-P142 HydrophobicContact CG2-CG 3.91Å; V99-T144 HydrophobicContact CB-CG2 4.19Å; V99-T144 HydrophobicContact CG1-CG2 4.05Å; V99-T144 HydrophobicContact CG2-CG2 4.46Å
100	S	73.8	Confident	73.8	Confident	7 Å²	7	52.5 Å²	52.5	5%	0.049	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	151.1	174	-173.7	0	0	0	0	110.2	M14 L102	M14-S100 VanDerWaalsContact O-CA 3.26Å; M14-S100 WeakPolarHBondContact O-CA 3.17Å; M14-S100 PolarHBondContact O-OG 3.01Å; S100-L102 PolarHBondContact O-N 3.19Å
101	D	62.2	Low	72.8	Confident	57 Å²	57	48.2 Å²	48.2	31%	0.305	28%	0.284	S	S	.	.			trans	-63.2	103.6	163.3	-65.8	5.3	0	0	0	106.9	R103 V221	D101-R103 PolarHBondContact O-N 3.11Å; D101-R103 IonicContact OD2-CZ 3.22Å; D101-R103 IonicContact OD2-NE 3.75Å; D101-R103 IonicContact OD2-NH2 2.76Å; D101-R103 PolarHBondContact OD2-NH2 3.46Å; D101-V221 HydrophobicContact CB-CG1 4.02Å
102	L	58.8	Low	71.7	Confident	4 Å²	4	49 Å²	49	2%	0.021	28%	0.276	C	S	.	.			trans	-73	29.6	-177.1	-75.5	156.5	0	0	0	113.2	P35 D37 L80 S100 G104 T105 H139	P35-L102 WeakPolarHBondContact O-CD1 3.34Å; D37-L102 HydrophobicContact CB-CD2 3.99Å; L80-L102 HydrophobicContact CD1-CD2 3.57Å; L80-L102 HydrophobicContact CD1-CG 4.48Å; L80-L102 HydrophobicContact CG-CD2 4.37Å; S100-L102 PolarHBondContact O-N 3.19Å; L102-G104 PolarHBondContact O-N 2.94Å; L102-T105 VanDerWaalsContact C-OG1 3.32Å; L102-T105 PolarHBondContact O-N 2.99Å; L102-T105 VanDerWaalsContact O-N 3.08Å; L102-T105 PolarHBondContact O-OG1 3.13Å; L102-H139 WeakPolarHBondContact CD1-NE2 3.06Å
103	R	53	Low	71	Confident	100 Å²	100	46.4 Å²	46.4	38%	0.377	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	130.3	-175.8	-85.3	-171	-110	-170.2	-8.4	112.2	D101 T105 V221 D222	D101-R103 PolarHBondContact O-N 3.11Å; D101-R103 IonicContact OD2-CZ 3.22Å; D101-R103 IonicContact OD2-NE 3.75Å; D101-R103 IonicContact OD2-NH2 2.76Å; D101-R103 PolarHBondContact OD2-NH2 3.46Å; R103-T105 PolarHBondContact O-N 3.16Å; R103-V221 WeakPolarHBondContact CD-O 3.36Å; R103-V221 HydrophobicContact CG-CB 3.62Å; R103-V221 HydrophobicContact CG-CG1 3.5Å; R103-V221 HydrophobicContact CG-CG2 4.45Å; R103-V221 PolarHBondContact NE-O 3.45Å; R103-V221 PolarHBondContact NH1-O 3.06Å; R103-V221 PolarHBondContact NH2-O 3.14Å; R103-D222 VanDerWaalsContact CZ-C 3.49Å; R103-D222 PolarHBondContact NH1-O 3.06Å; R103-D222 VanDerWaalsContact NH2-C 3.27Å; R103-D222 PolarHBondContact NH2-O 2.68Å
104	G	50.3	Low	70.2	Confident	62 Å²	62	50.1 Å²	50.1	64%	0.639	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	7	178.6	0	0	0	0	0	113.4	L102 N165	L102-G104 PolarHBondContact O-N 2.94Å; G104-N165 WeakPolarHBondContact CA-OD1 3.37Å; G104-N165 PolarHBondContact N-OD1 3.28Å
105	T	49.2	Very low	69.1	Low	18 Å²	18	48 Å²	48	11%	0.11	27%	0.274	C	S	.	.			trans	-129.2	91.8	-171.3	74.7	0	0	0	0	110.5	R78 L102 R103	R78-T105 VanDerWaalsContact CB-CB 3.49Å; R78-T105 HydrophobicContact CB-CG2 4.37Å; R78-T105 VanDerWaalsContact CD-O 3.23Å; R78-T105 WeakPolarHBondContact CD-O 3.34Å; R78-T105 PolarHBondContact NE-O 2.82Å; R78-T105 WeakPolarHBondContact O-CB 3.39Å; R78-T105 WeakPolarHBondContact O-CG2 3.5Å; L102-T105 VanDerWaalsContact C-OG1 3.32Å; L102-T105 PolarHBondContact O-N 2.99Å; L102-T105 VanDerWaalsContact O-N 3.08Å; L102-T105 PolarHBondContact O-OG1 3.13Å; R103-T105 PolarHBondContact O-N 3.16Å
106	G	55.3	Low	67.7	Low	10 Å²	10	47.2 Å²	47.2	10%	0.103	27%	0.27	C	S	.	.			trans	152.7	70.1	-171.6	0	0	0	0	0	109.8	E108 A109 G110 N165	G106-E108 PolarHBondContact O-N 3.14Å; G106-A109 PolarHBondContact O-N 2.94Å; G106-A109 VanDerWaalsContact O-N 3.13Å; G106-G110 PolarHBondContact O-N 3.27Å; G106-N165 PolarHBondContact O-ND2 3.49Å
107	E	62	Low	66.8	Low	178 Å²	178	51.8 Å²	51.8	83%	0.832	30%	0.299	S	S	*	.	H	α-helix	trans	-57.3	-37.4	-177.8	-163.6	174.7	-171.4	0	0	111.7	G110 A111	E107-G110 PolarHBondContact O-N 2.81Å; E107-A111 VanDerWaalsContact O-CB 3.27Å; E107-A111 WeakPolarHBondContact O-CB 3.03Å; E107-A111 PolarHBondContact O-N 2.78Å
108	E	66.6	Low	65.8	Low	130 Å²	130	54.5 Å²	54.5	61%	0.607	31%	0.308	S	S	*	.	H	α-helix	trans	-66.4	-44.6	175.4	-169.3	-177.6	-170.2	0	0	112.6	G106 G110 W112 A136	G106-E108 PolarHBondContact O-N 3.14Å; E108-G110 VanDerWaalsContact C-N 3.34Å; E108-W112 WeakPolarHBondContact O-CB 3.45Å; E108-W112 PolarHBondContact O-N 2.85Å; E108-A136 HydrophobicContact CG-CB 4.25Å
109	A	60.3	Low	64.5	Low	1 Å²	1	59.7 Å²	59.7	1%	0.008	33%	0.332	C	S	.	.	H	α-helix	trans	-66.4	-39.1	175.1	0	0	0	0	0	111	G106 W112 E113 N165	G106-A109 PolarHBondContact O-N 2.94Å; G106-A109 VanDerWaalsContact O-N 3.13Å; A109-W112 PolarHBondContact O-N 3.41Å; A109-E113 VanDerWaalsContact O-CB 3.27Å; A109-E113 WeakPolarHBondContact O-CB 3.34Å; A109-E113 WeakPolarHBondContact O-CG 3.39Å; A109-E113 PolarHBondContact O-N 2.95Å; A109-N165 HydrophobicContact CB-CB 4.07Å
110	G	65.4	Low	63.9	Low	7 Å²	7	60.9 Å²	60.9	7%	0.072	34%	0.342	C	S	.	.	H	α-helix	trans	-62.4	-50.2	175.8	0	0	0	0	0	112.2	G106 E107 E108 W112 E113 T114 N165	G106-G110 PolarHBondContact O-N 3.27Å; E107-G110 PolarHBondContact O-N 2.81Å; E108-G110 VanDerWaalsContact C-N 3.34Å; G110-W112 VanDerWaalsContact C-N 3.28Å; G110-W112 PolarHBondContact O-N 2.85Å; G110-E113 PolarHBondContact O-N 3.08Å; G110-T114 WeakPolarHBondContact O-CB 3.42Å; G110-T114 WeakPolarHBondContact O-CG2 3.47Å; G110-T114 PolarHBondContact O-N 2.93Å; G110-T114 PolarHBondContact O-OG1 2.85Å; G110-N165 VanDerWaalsContact CA-ND2 3.29Å; G110-N165 WeakPolarHBondContact CA-ND2 3.47Å
111	A	69	Low	64.1	Low	55 Å²	55	60.8 Å²	60.8	46%	0.455	34%	0.34	S	S	.	.	H	α-helix	trans	-60.2	-39.1	176.6	0	0	0	0	0	111.6	E107 T114 S115	E107-A111 VanDerWaalsContact O-CB 3.27Å; E107-A111 WeakPolarHBondContact O-CB 3.03Å; E107-A111 PolarHBondContact O-N 2.78Å; A111-T114 PolarHBondContact O-OG1 3.09Å; A111-S115 WeakPolarHBondContact O-CB 3.19Å; A111-S115 PolarHBondContact O-N 3.3Å; A111-S115 PolarHBondContact O-OG 2.92Å
112	W	67.3	Low	64.7	Low	53 Å²	53	59.4 Å²	59.4	20%	0.201	33%	0.333	C	S	.	.	H	α-helix	trans	-69	-43.3	175.3	-173.6	76.7	0	0	0	112.6	E108 A109 G110 T114 S115 T116 L121 T124 I125 P135 W138	E108-W112 WeakPolarHBondContact O-CB 3.45Å; E108-W112 PolarHBondContact O-N 2.85Å; A109-W112 PolarHBondContact O-N 3.41Å; G110-W112 VanDerWaalsContact C-N 3.28Å; G110-W112 PolarHBondContact O-N 2.85Å; W112-T114 VanDerWaalsContact C-N 3.32Å; W112-T114 PolarHBondContact O-N 2.82Å; W112-S115 WeakPolarHBondContact CA-OG 3.31Å; W112-S115 PolarHBondContact O-OG 3.31Å; W112-S115 VanDerWaalsContact O-OG 3.09Å; W112-T116 PolarHBondContact O-OG1 3.26Å; W112-L121 HydrophobicContact CD2-CD1 4.27Å; W112-L121 HydrophobicContact CE3-CD1 3.6Å; W112-L121 HydrophobicContact CH2-CD1 3.54Å; W112-L121 HydrophobicContact CZ2-CD1 4.19Å; W112-L121 HydrophobicContact CZ3-CD1 3.2Å; W112-L121 HydrophobicContact CZ3-CG 4.39Å; W112-T124 HydrophobicContact CH2-CG2 4.2Å; W112-T124 HydrophobicContact CZ2-CG2 3.72Å; W112-I125 HydrophobicContact CH2-CD1 4.33Å; W112-I125 HydrophobicContact CH2-CG1 3.42Å; W112-I125 VanDerWaalsContact CH2-CG1 3.42Å; W112-I125 HydrophobicContact CZ3-CD1 3.96Å; W112-I125 HydrophobicContact CZ3-CG1 3.45Å; W112-I125 VanDerWaalsContact CZ3-CG1 3.45Å; W112-P135 HydrophobicContact CD2-CB 3.85Å; W112-P135 HydrophobicContact CE3-CB 3.69Å; W112-P135 HydrophobicContact CE3-CG 4.36Å; W112-P135 HydrophobicContact CH2-CB 3.37Å; W112-P135 HydrophobicContact CH2-CG 3.31Å; W112-P135 HydrophobicContact CZ2-CB 3.55Å; W112-P135 HydrophobicContact CZ2-CG 3.86Å; W112-P135 HydrophobicContact CZ3-CB 3.43Å; W112-P135 VanDerWaalsContact CZ3-CB 3.43Å; W112-P135 HydrophobicContact CZ3-CG 3.6Å; W112-W138 AromaticContact CE3-NE1 3.77Å; W112-W138 AromaticContact CZ3-NE1 3.63Å
113	E	72.5	Confident	65.5	Low	13 Å²	13	61.6 Å²	61.6	6%	0.061	35%	0.346	C	S	.	.	H	α-helix	trans	-65.1	-30.7	176.4	-74.6	172.7	-170.7	0	0	113.4	A109 G110 L121 W138 G164 N165 H166	A109-E113 VanDerWaalsContact O-CB 3.27Å; A109-E113 WeakPolarHBondContact O-CB 3.34Å; A109-E113 WeakPolarHBondContact O-CG 3.39Å; A109-E113 PolarHBondContact O-N 2.95Å; G110-E113 PolarHBondContact O-N 3.08Å; E113-L121 HydrophobicContact CB-CD1 4.39Å; E113-L121 HydrophobicContact CB-CD2 4.03Å; E113-L121 HydrophobicContact CG-CD1 4.24Å; E113-L121 HydrophobicContact CG-CD2 4.15Å; E113-L121 WeakPolarHBondContact O-CD2 3.31Å; E113-W138 PolarHBondContact OE1-NE1 3.2Å; E113-G164 VanDerWaalsContact OE1-CA 3.3Å; E113-G164 WeakPolarHBondContact OE1-CA 3.3Å; E113-N165 PolarHBondContact OE1-N 2.8Å; E113-H166 WeakPolarHBondContact OE2-CB 3Å; E113-H166 IonicContact OE2-CG 3.69Å; E113-H166 PolarHBondContact OE2-N 2.86Å; E113-H166 IonicContact OE2-ND1 2.62Å; E113-H166 PolarHBondContact OE2-ND1 2.97Å
114	T	71.4	Confident	66.5	Low	106 Å²	106	59.5 Å²	59.5	65%	0.65	35%	0.345	S	S	*	.	H	α-helix	trans	-93.7	-20.1	-179.7	57	0	0	0	0	114.1	G110 A111 W112 T116	G110-T114 WeakPolarHBondContact O-CB 3.42Å; G110-T114 WeakPolarHBondContact O-CG2 3.47Å; G110-T114 PolarHBondContact O-N 2.93Å; G110-T114 PolarHBondContact O-OG1 2.85Å; A111-T114 PolarHBondContact O-OG1 3.09Å; W112-T114 VanDerWaalsContact C-N 3.32Å; W112-T114 PolarHBondContact O-N 2.82Å; T114-T116 VanDerWaalsContact C-N 3.35Å
115	S	64.2	Low	67.8	Low	87 Å²	87	56.6 Å²	56.6	61%	0.608	31%	0.314	S	S	*	.	H	α-helix	trans	-79.4	-14	-178.1	56.1	0	0	0	0	114.6	A111 W112	A111-S115 WeakPolarHBondContact O-CB 3.19Å; A111-S115 PolarHBondContact O-N 3.3Å; A111-S115 PolarHBondContact O-OG 2.92Å; W112-S115 WeakPolarHBondContact CA-OG 3.31Å; W112-S115 PolarHBondContact O-OG 3.31Å; W112-S115 VanDerWaalsContact O-OG 3.09Å
116	T	63.9	Low	69	Low	41 Å²	41	56.5 Å²	56.5	25%	0.252	32%	0.315	S	S	.	.	S	Bend	trans	-114.9	136.2	-178.9	-19.3	0	0	0	0	109	W112 T114 Y118 S120	W112-T116 PolarHBondContact O-OG1 3.26Å; T114-T116 VanDerWaalsContact C-N 3.35Å; T116-Y118 PolarHBondContact O-N 3.05Å; T116-S120 WeakPolarHBondContact CG2-OG 3.27Å
117	P	74.8	Confident	69.9	Low	96 Å²	96	61.3 Å²	61.3	62%	0.623	34%	0.335	S	S	*	.			trans	-48.5	135.1	172.8	-29	34.8	0	0	0	111	E119 S120 L121	P117-E119 PolarHBondContact O-N 3.41Å; P117-S120 WeakPolarHBondContact CD-OG 3.44Å; P117-S120 WeakPolarHBondContact O-CA 3.4Å; P117-S120 PolarHBondContact O-N 3.03Å; P117-S120 PolarHBondContact O-OG 2.64Å; P117-L121 PolarHBondContact O-N 3.44Å
118	Y	67.8	Low	70.6	Confident	105 Å²	105	53.7 Å²	53.7	41%	0.412	30%	0.302	S	S	.	.	H	α-helix	trans	-48.5	-39.4	-168.5	-176.6	-107.7	0	0	0	113.9	T116 L121 L122 R195	T116-Y118 PolarHBondContact O-N 3.05Å; Y118-L121 WeakPolarHBondContact O-CB 3.31Å; Y118-L121 PolarHBondContact O-N 3.2Å; Y118-L122 HydrophobicContact CD1-CD1 4.13Å; Y118-L122 HydrophobicContact CE1-CD1 3.67Å; Y118-L122 HydrophobicContact CE1-CD2 4.47Å; Y118-L122 HydrophobicContact CE1-CG 4.24Å; Y118-L122 HydrophobicContact CE2-CD2 4.44Å; Y118-L122 WeakPolarHBondContact O-CG 3.46Å; Y118-L122 PolarHBondContact O-N 3Å; Y118-L122 VanDerWaalsContact O-N 3.11Å; Y118-R195 WeakPolarHBondContact OH-CB 3.39Å; Y118-R195 WeakPolarHBondContact OH-CD 3.31Å; Y118-R195 WeakPolarHBondContact OH-CG 3.48Å; Y118-R195 PolarHBondContact OH-NE 3.44Å
119	E	63.4	Low	71	Confident	109 Å²	109	48.4 Å²	48.4	51%	0.509	28%	0.278	S	S	.	.	H	α-helix	trans	-67.1	-43.3	178.9	-62.5	166.7	167.3	0	0	112.7	P117 L121 L122 V123	P117-E119 PolarHBondContact O-N 3.41Å; E119-L121 VanDerWaalsContact C-N 3.3Å; E119-L121 PolarHBondContact O-N 3.26Å; E119-L122 PolarHBondContact O-N 3.19Å; E119-V123 WeakPolarHBondContact O-CG2 3.27Å; E119-V123 PolarHBondContact O-N 3.04Å; E119-V123 VanDerWaalsContact O-N 3.15Å
120	S	71.4	Confident	71.5	Confident	40 Å²	40	54.8 Å²	54.8	28%	0.28	30%	0.302	S	S	.	.	H	α-helix	trans	-65.9	-35.5	175.3	63.2	0	0	0	0	111.6	T116 P117 V123 T124	T116-S120 WeakPolarHBondContact CG2-OG 3.27Å; P117-S120 WeakPolarHBondContact CD-OG 3.44Å; P117-S120 WeakPolarHBondContact O-CA 3.4Å; P117-S120 PolarHBondContact O-N 3.03Å; P117-S120 PolarHBondContact O-OG 2.64Å; S120-V123 PolarHBondContact O-N 3.32Å; S120-T124 VanDerWaalsContact O-CB 3.3Å; S120-T124 WeakPolarHBondContact O-CB 3.18Å; S120-T124 PolarHBondContact O-N 3.23Å; S120-T124 PolarHBondContact O-OG1 3.23Å
121	L	76.9	Confident	71.9	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.021	33%	0.331	C	S	.	.	H	α-helix	trans	-58.2	-52.9	173.5	179.9	72.9	0	0	0	111.1	W112 E113 P117 Y118 E119 V123 T124 I125 L167	W112-L121 HydrophobicContact CD2-CD1 4.27Å; W112-L121 HydrophobicContact CE3-CD1 3.6Å; W112-L121 HydrophobicContact CH2-CD1 3.54Å; W112-L121 HydrophobicContact CZ2-CD1 4.19Å; W112-L121 HydrophobicContact CZ3-CD1 3.2Å; W112-L121 HydrophobicContact CZ3-CG 4.39Å; E113-L121 HydrophobicContact CB-CD1 4.39Å; E113-L121 HydrophobicContact CB-CD2 4.03Å; E113-L121 HydrophobicContact CG-CD1 4.24Å; E113-L121 HydrophobicContact CG-CD2 4.15Å; E113-L121 WeakPolarHBondContact O-CD2 3.31Å; P117-L121 PolarHBondContact O-N 3.44Å; Y118-L121 WeakPolarHBondContact O-CB 3.31Å; Y118-L121 PolarHBondContact O-N 3.2Å; E119-L121 VanDerWaalsContact C-N 3.3Å; E119-L121 PolarHBondContact O-N 3.26Å; L121-V123 VanDerWaalsContact C-N 3.31Å; L121-V123 PolarHBondContact O-N 3.19Å; L121-T124 PolarHBondContact O-N 2.95Å; L121-I125 HydrophobicContact CD1-CD1 4.06Å; L121-I125 HydrophobicContact CD1-CG1 4.35Å; L121-I125 HydrophobicContact CD2-CD1 4.46Å; L121-I125 HydrophobicContact CG-CD1 3.79Å; L121-I125 HydrophobicContact CG-CG1 4.44Å; L121-I125 VanDerWaalsContact O-CG1 3.22Å; L121-I125 WeakPolarHBondContact O-CG1 3.5Å; L121-I125 PolarHBondContact O-N 3.17Å; L121-L167 HydrophobicContact CD2-CD1 3.57Å; L121-L167 HydrophobicContact CG-CD1 4.29Å
122	L	75.5	Confident	72.2	Confident	28 Å²	28	58.4 Å²	58.4	15%	0.147	35%	0.345	C	S	.	.	H	α-helix	trans	-57.2	-45.2	179.4	-62.2	177.7	0	0	0	111.5	Y118 E119 S126 R195 L218	Y118-L122 HydrophobicContact CD1-CD1 4.13Å; Y118-L122 HydrophobicContact CE1-CD1 3.67Å; Y118-L122 HydrophobicContact CE1-CD2 4.47Å; Y118-L122 HydrophobicContact CE1-CG 4.24Å; Y118-L122 HydrophobicContact CE2-CD2 4.44Å; Y118-L122 WeakPolarHBondContact O-CG 3.46Å; Y118-L122 PolarHBondContact O-N 3Å; Y118-L122 VanDerWaalsContact O-N 3.11Å; E119-L122 PolarHBondContact O-N 3.19Å; L122-S126 VanDerWaalsContact O-CB 3.25Å; L122-S126 WeakPolarHBondContact O-CB 3.41Å; L122-S126 PolarHBondContact O-N 3.48Å; L122-S126 PolarHBondContact O-OG 3.33Å; L122-R195 HydrophobicContact CD2-CB 4.17Å; L122-L218 HydrophobicContact CD2-CD2 3.09Å
123	V	74.5	Confident	72.6	Confident	50 Å²	50	64 Å²	64	30%	0.303	37%	0.371	S	S	.	.	H	α-helix	trans	-64.9	-46.8	178.5	174.6	0	0	0	0	110.9	E119 S120 L121 S126 Q127 W512	E119-V123 WeakPolarHBondContact O-CG2 3.27Å; E119-V123 PolarHBondContact O-N 3.04Å; E119-V123 VanDerWaalsContact O-N 3.15Å; S120-V123 PolarHBondContact O-N 3.32Å; L121-V123 VanDerWaalsContact C-N 3.31Å; L121-V123 PolarHBondContact O-N 3.19Å; V123-S126 PolarHBondContact O-N 2.86Å; V123-S126 PolarHBondContact O-OG 2.7Å; V123-Q127 HydrophobicContact CG1-CG 4.35Å; V123-Q127 WeakPolarHBondContact O-CG 3.4Å; V123-Q127 PolarHBondContact O-N 2.9Å; V123-W512 HydrophobicContact CG2-CZ2 4.24Å
124	T	75.4	Confident	72.8	Confident	57 Å²	57	66.1 Å²	66.1	35%	0.35	38%	0.382	S	S	.	.	H	α-helix	trans	-63.6	-44.8	-179.4	-60.7	0	0	0	0	111.6	W112 S120 L121 S126 Q127 A128	W112-T124 HydrophobicContact CH2-CG2 4.2Å; W112-T124 HydrophobicContact CZ2-CG2 3.72Å; S120-T124 VanDerWaalsContact O-CB 3.3Å; S120-T124 WeakPolarHBondContact O-CB 3.18Å; S120-T124 PolarHBondContact O-N 3.23Å; S120-T124 PolarHBondContact O-OG1 3.23Å; L121-T124 PolarHBondContact O-N 2.95Å; T124-S126 VanDerWaalsContact C-N 3.32Å; T124-S126 PolarHBondContact O-N 3.05Å; T124-Q127 PolarHBondContact O-N 2.84Å; T124-A128 WeakPolarHBondContact O-CB 3.45Å; T124-A128 PolarHBondContact O-N 3.14Å
125	I	77	Confident	72.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-60.5	-44.9	175.4	-57.6	161.6	0	0	0	110	W112 L121 Q127 A128 V129 P135 W138 L167 M169 L218	W112-I125 HydrophobicContact CH2-CD1 4.33Å; W112-I125 HydrophobicContact CH2-CG1 3.42Å; W112-I125 VanDerWaalsContact CH2-CG1 3.42Å; W112-I125 HydrophobicContact CZ3-CD1 3.96Å; W112-I125 HydrophobicContact CZ3-CG1 3.45Å; W112-I125 VanDerWaalsContact CZ3-CG1 3.45Å; L121-I125 HydrophobicContact CD1-CD1 4.06Å; L121-I125 HydrophobicContact CD1-CG1 4.35Å; L121-I125 HydrophobicContact CD2-CD1 4.46Å; L121-I125 HydrophobicContact CG-CD1 3.79Å; L121-I125 HydrophobicContact CG-CG1 4.44Å; L121-I125 VanDerWaalsContact O-CG1 3.22Å; L121-I125 WeakPolarHBondContact O-CG1 3.5Å; L121-I125 PolarHBondContact O-N 3.17Å; I125-Q127 VanDerWaalsContact C-N 3.34Å; I125-Q127 PolarHBondContact O-N 3.41Å; I125-A128 WeakPolarHBondContact O-CB 3.23Å; I125-A128 PolarHBondContact O-N 2.92Å; I125-V129 HydrophobicContact CG2-CG2 4.3Å; I125-V129 WeakPolarHBondContact O-CG2 3.3Å; I125-V129 PolarHBondContact O-N 3.4Å; I125-P135 HydrophobicContact CG1-CG 4.22Å; I125-W138 HydrophobicContact CD1-CH2 3.91Å; I125-W138 HydrophobicContact CD1-CZ2 3.36Å; I125-W138 HydrophobicContact CG1-CZ2 4.03Å; I125-W138 HydrophobicContact CG2-CE3 4.32Å; I125-W138 HydrophobicContact CG2-CH2 3.92Å; I125-W138 HydrophobicContact CG2-CZ2 4.12Å; I125-W138 HydrophobicContact CG2-CZ3 4.03Å; I125-L167 HydrophobicContact CD1-CD1 3.75Å; I125-M169 HydrophobicContact CB-CE 4.18Å; I125-M169 HydrophobicContact CG2-CE 3.42Å; I125-M169 VanDerWaalsContact CG2-CE 3.42Å; I125-L218 HydrophobicContact CG2-CD1 4.29Å
126	S	74	Confident	73.3	Confident	16 Å²	16	59.8 Å²	59.8	11%	0.112	34%	0.344	C	S	.	.	H	α-helix	trans	-63.2	-38.6	-178.4	81.5	0	0	0	0	112.7	L122 V123 T124 R130 M198	L122-S126 VanDerWaalsContact O-CB 3.25Å; L122-S126 WeakPolarHBondContact O-CB 3.41Å; L122-S126 PolarHBondContact O-N 3.48Å; L122-S126 PolarHBondContact O-OG 3.33Å; V123-S126 PolarHBondContact O-N 2.86Å; V123-S126 PolarHBondContact O-OG 2.7Å; T124-S126 VanDerWaalsContact C-N 3.32Å; T124-S126 PolarHBondContact O-N 3.05Å; S126-R130 WeakPolarHBondContact O-CB 3.41Å; S126-R130 PolarHBondContact O-N 2.69Å; S126-R130 VanDerWaalsContact O-N 3.14Å; S126-M198 VanDerWaalsContact CB-SD 3.59Å; S126-M198 WeakPolarHBondContact OG-CE 2.97Å
127	Q	75.6	Confident	73.6	Confident	112 Å²	112	58.6 Å²	58.6	52%	0.523	34%	0.34	S	S	.	.	H	α-helix	trans	-73.3	-41.5	175.1	-71.7	178.6	-1.6	0	0	111.8	V123 T124 I125 R130 G131	V123-Q127 HydrophobicContact CG1-CG 4.35Å; V123-Q127 WeakPolarHBondContact O-CG 3.4Å; V123-Q127 PolarHBondContact O-N 2.9Å; T124-Q127 PolarHBondContact O-N 2.84Å; I125-Q127 VanDerWaalsContact C-N 3.34Å; I125-Q127 PolarHBondContact O-N 3.41Å; Q127-R130 PolarHBondContact O-N 2.77Å; Q127-G131 PolarHBondContact O-N 3.19Å
128	A	75.9	Confident	73.7	Confident	18 Å²	18	54.7 Å²	54.7	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-56.6	-49.3	176.4	0	0	0	0	0	111	T124 I125 G131 G132 K133 P135	T124-A128 WeakPolarHBondContact O-CB 3.45Å; T124-A128 PolarHBondContact O-N 3.14Å; I125-A128 WeakPolarHBondContact O-CB 3.23Å; I125-A128 PolarHBondContact O-N 2.92Å; A128-G131 CarbonylContact O-C 3.5Å; A128-G131 PolarHBondContact O-N 3.07Å; A128-G132 PolarHBondContact O-N 3.05Å; A128-K133 CarbonylContact C-O 3.57Å; A128-K133 VanDerWaalsContact C-O 3.25Å; A128-K133 VanDerWaalsContact CA-O 3.29Å; A128-K133 WeakPolarHBondContact CA-O 3.35Å; A128-K133 WeakPolarHBondContact CB-O 3.14Å; A128-K133 CarbonylContact O-C 3.52Å; A128-K133 PolarHBondContact O-N 2.93Å; A128-K133 VanDerWaalsContact O-O 3.06Å; A128-P135 HydrophobicContact CB-CG 3.99Å
129	V	74.2	Confident	74.2	Confident	18 Å²	18	50.7 Å²	50.7	11%	0.109	30%	0.298	C	S	.	.	H	α-helix	trans	-66.1	-41.1	176.6	173.4	0	0	0	0	111.8	I125 G131 G132 L134 W162 M169 L216	I125-V129 HydrophobicContact CG2-CG2 4.3Å; I125-V129 WeakPolarHBondContact O-CG2 3.3Å; I125-V129 PolarHBondContact O-N 3.4Å; V129-G131 VanDerWaalsContact C-N 3.3Å; V129-G131 PolarHBondContact O-N 3.15Å; V129-G132 PolarHBondContact O-N 3.48Å; V129-G132 VanDerWaalsContact O-N 3.12Å; V129-L134 HydrophobicContact CG2-CD2 3.77Å; V129-W162 HydrophobicContact CG1-CD2 4.42Å; V129-W162 HydrophobicContact CG1-CE3 4.1Å; V129-W162 HydrophobicContact CG1-CH2 3.51Å; V129-W162 HydrophobicContact CG1-CZ2 3.93Å; V129-W162 HydrophobicContact CG1-CZ3 3.63Å; V129-M169 HydrophobicContact CB-SD 3.81Å; V129-M169 HydrophobicContact CG1-SD 3.8Å; V129-M169 HydrophobicContact CG2-CE 4.28Å; V129-M169 HydrophobicContact CG2-SD 3.6Å; V129-L216 HydrophobicContact CG1-CD1 4.17Å; V129-L216 HydrophobicContact CG1-CD2 3.93Å
130	R	72	Confident	75.1	Confident	136 Å²	136	51 Å²	51	51%	0.513	30%	0.299	S	S	.	.	H	α-helix	trans	-64	-35.2	175.7	-160.4	-170.5	-33.2	178.5	13.4	112.8	S126 Q127 G132	S126-R130 WeakPolarHBondContact O-CB 3.41Å; S126-R130 PolarHBondContact O-N 2.69Å; S126-R130 VanDerWaalsContact O-N 3.14Å; Q127-R130 PolarHBondContact O-N 2.77Å; R130-G132 VanDerWaalsContact C-N 3.29Å
131	G	73.1	Confident	75.5	Confident	65 Å²	65	49.6 Å²	49.6	67%	0.67	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-0.3	175.4	0	0	0	0	0	114.3	Q127 A128 V129 K133	Q127-G131 PolarHBondContact O-N 3.19Å; A128-G131 CarbonylContact O-C 3.5Å; A128-G131 PolarHBondContact O-N 3.07Å; V129-G131 VanDerWaalsContact C-N 3.3Å; V129-G131 PolarHBondContact O-N 3.15Å; G131-K133 VanDerWaalsContact C-N 3.28Å; G131-K133 PolarHBondContact O-N 3.24Å
132	G	74.9	Confident	75.7	Confident	73 Å²	73	50.8 Å²	50.8	75%	0.753	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	13.8	179.5	0	0	0	0	0	115.1	A128 V129 R130	A128-G132 PolarHBondContact O-N 3.05Å; V129-G132 PolarHBondContact O-N 3.48Å; V129-G132 VanDerWaalsContact O-N 3.12Å; R130-G132 VanDerWaalsContact C-N 3.29Å
133	K	76.6	Confident	76.2	Confident	170 Å²	170	52.1 Å²	52.1	74%	0.739	31%	0.306	S	S	*	.			trans	-121.3	103.4	-179.8	-171.2	179.9	-178.3	-177	0	109.7	A128 G131	A128-K133 CarbonylContact C-O 3.57Å; A128-K133 VanDerWaalsContact C-O 3.25Å; A128-K133 VanDerWaalsContact CA-O 3.29Å; A128-K133 WeakPolarHBondContact CA-O 3.35Å; A128-K133 WeakPolarHBondContact CB-O 3.14Å; A128-K133 CarbonylContact O-C 3.52Å; A128-K133 PolarHBondContact O-N 2.93Å; A128-K133 VanDerWaalsContact O-O 3.06Å; G131-K133 VanDerWaalsContact C-N 3.28Å; G131-K133 PolarHBondContact O-N 3.24Å
134	L	76.2	Confident	76.5	Confident	58 Å²	58	52.2 Å²	52.2	30%	0.304	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-66.3	148.1	179.3	-68.7	164.8	0	0	0	112	V129 W138 W162	V129-L134 HydrophobicContact CG2-CD2 3.77Å; L134-W138 HydrophobicContact CB-CB 4.21Å; L134-W138 HydrophobicContact CD2-CB 4.47Å; L134-W162 HydrophobicContact CD2-CB 4.19Å; L134-W162 VanDerWaalsContact CD2-CD1 3.4Å; L134-W162 HydrophobicContact CD2-CD2 4.45Å; L134-W162 HydrophobicContact CD2-CG 3.76Å
135	P	73.8	Confident	76.7	Confident	17 Å²	17	57.6 Å²	57.6	11%	0.11	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-61.8	165.6	169.8	-19.9	32.6	0	0	0	113.2	W112 I125 A128 G137 W138	W112-P135 HydrophobicContact CD2-CB 3.85Å; W112-P135 HydrophobicContact CE3-CB 3.69Å; W112-P135 HydrophobicContact CE3-CG 4.36Å; W112-P135 HydrophobicContact CH2-CB 3.37Å; W112-P135 HydrophobicContact CH2-CG 3.31Å; W112-P135 HydrophobicContact CZ2-CB 3.55Å; W112-P135 HydrophobicContact CZ2-CG 3.86Å; W112-P135 HydrophobicContact CZ3-CB 3.43Å; W112-P135 VanDerWaalsContact CZ3-CB 3.43Å; W112-P135 HydrophobicContact CZ3-CG 3.6Å; I125-P135 HydrophobicContact CG1-CG 4.22Å; A128-P135 HydrophobicContact CB-CG 3.99Å; P135-G137 PolarHBondContact O-N 2.94Å; P135-W138 HydrophobicContact CB-CG 4.26Å; P135-W138 HydrophobicContact CG-CG 4.28Å; P135-W138 WeakPolarHBondContact O-CB 3.26Å; P135-W138 PolarHBondContact O-N 2.93Å
136	A	71.7	Confident	77	Confident	43 Å²	43	58.9 Å²	58.9	36%	0.355	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	137.3	176.4	0	0	0	0	0	111.2	E108 W138	E108-A136 HydrophobicContact CG-CB 4.25Å; A136-W138 PolarHBondContact O-N 3.42Å; A136-W138 VanDerWaalsContact O-N 3.1Å
137	G	71.4	Confident	77.4	Confident	15 Å²	15	63.9 Å²	63.9	16%	0.155	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	-15.1	-178.5	0	0	0	0	0	116.5	P135 H139	P135-G137 PolarHBondContact O-N 2.94Å; G137-H139 PolarHBondContact O-ND1 3.22Å
138	W	77.5	Confident	77.8	Confident	14 Å²	14	59.1 Å²	59.1	5%	0.053	34%	0.34	C	S	.	.			trans	-75.1	140.1	173.6	-79.7	65.5	0	0	0	111.4	W112 E113 I125 L134 P135 A136 W162 T163 L167 M169 L218	W112-W138 AromaticContact CE3-NE1 3.77Å; W112-W138 AromaticContact CZ3-NE1 3.63Å; E113-W138 PolarHBondContact OE1-NE1 3.2Å; I125-W138 HydrophobicContact CD1-CH2 3.91Å; I125-W138 HydrophobicContact CD1-CZ2 3.36Å; I125-W138 HydrophobicContact CG1-CZ2 4.03Å; I125-W138 HydrophobicContact CG2-CE3 4.32Å; I125-W138 HydrophobicContact CG2-CH2 3.92Å; I125-W138 HydrophobicContact CG2-CZ2 4.12Å; I125-W138 HydrophobicContact CG2-CZ3 4.03Å; L134-W138 HydrophobicContact CB-CB 4.21Å; L134-W138 HydrophobicContact CD2-CB 4.47Å; P135-W138 HydrophobicContact CB-CG 4.26Å; P135-W138 HydrophobicContact CG-CG 4.28Å; P135-W138 WeakPolarHBondContact O-CB 3.26Å; P135-W138 PolarHBondContact O-N 2.93Å; A136-W138 PolarHBondContact O-N 3.42Å; A136-W138 VanDerWaalsContact O-N 3.1Å; W138-W162 HydrophobicContact CE3-CB 3.97Å; W138-W162 HydrophobicContact CZ3-CB 4.23Å; W138-T163 WeakPolarHBondContact CA-O 3.3Å; W138-L167 HydrophobicContact CH2-CB 3.56Å; W138-L167 HydrophobicContact CZ2-CB 3.63Å; W138-L167 HydrophobicContact CZ2-CD1 4.3Å; W138-M169 HydrophobicContact CZ3-CB 4.06Å; W138-L218 HydrophobicContact CH2-CD1 4.21Å
139	H	77.1	Confident	78	Confident	21 Å²	21	65.3 Å²	65.3	10%	0.097	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	151	-176.7	48.2	-77.9	0	0	0	110.4	R78 L102 G137 W162 T163	R78-H139 PolarHBondContact NH1-CE1 3.26Å; L102-H139 WeakPolarHBondContact CD1-NE2 3.06Å; G137-H139 PolarHBondContact O-ND1 3.22Å; H139-W162 CarbonylContact O-C 3.55Å; H139-W162 VanDerWaalsContact O-CA 3.29Å; H139-W162 WeakPolarHBondContact O-CA 3.21Å; H139-T163 PolarHBondContact CD2-OG1 2.96Å; H139-T163 VanDerWaalsContact CD2-OG1 3.27Å; H139-T163 PolarHBondContact CE1-O 3.05Å; H139-T163 PolarHBondContact N-O 2.95Å; H139-T163 VanDerWaalsContact N-O 3.12Å; H139-T163 PolarHBondContact ND1-O 2.83Å; H139-T163 PolarHBondContact NE2-OG1 2.8Å; H139-T163 PolarHBondContact O-N 3.43Å
140	Q	82.3	Confident	78.4	Confident	117 Å²	117	65.7 Å²	65.7	55%	0.547	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	133.4	175.9	-169.9	176.5	-8.8	0	0	109.6	V161	Q140-V161 CarbonylContact C-O 3.57Å; Q140-V161 WeakPolarHBondContact CA-O 3.21Å; Q140-V161 WeakPolarHBondContact CG-O 3.39Å
141	V	80.6	Confident	78.9	Confident	10 Å²	10	61.1 Å²	61.1	6%	0.061	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	150.6	172.9	-61.3	0	0	0	0	109.9	P35 V99 V161 T163	P35-V141 HydrophobicContact CB-CG1 4.33Å; V99-V141 HydrophobicContact CG1-CB 4.31Å; V141-V161 HydrophobicContact CG2-CB 3.65Å; V141-V161 HydrophobicContact CG2-CG1 3.38Å; V141-V161 PolarHBondContact N-O 3.48Å; V141-T163 WeakPolarHBondContact CG1-OG1 3.26Å; V141-T163 HydrophobicContact CG2-CG2 3.94Å
142	P	81.5	Confident	79.4	Confident	29 Å²	29	62.8 Å²	62.8	19%	0.188	37%	0.365	C	S	.	.			trans	-57.6	144	173.1	-22.5	32.6	0	0	0	111.6	V11 P35 Q97 V99 T144	V11-P142 HydrophobicContact CG1-CB 4.03Å; V11-P142 HydrophobicContact CG1-CG 4.48Å; V11-P142 HydrophobicContact CG2-CB 3.94Å; V11-P142 HydrophobicContact CG2-CG 4.28Å; P35-P142 HydrophobicContact CG-CG 4.28Å; Q97-P142 VanDerWaalsContact OE1-CG 3.31Å; V99-P142 HydrophobicContact CG2-CB 4.34Å; V99-P142 HydrophobicContact CG2-CG 3.91Å; P142-T144 PolarHBondContact O-N 2.76Å
143	V	84.7	Confident	79.8	Confident	55 Å²	55	60.8 Å²	60.8	33%	0.333	35%	0.345	S	S	.	.			trans	-62.6	131.7	169.7	179.6	0	0	0	0	108.7	A158 D159 V161	V143-A158 HydrophobicContact CG1-CB 3.55Å; V143-A158 HydrophobicContact CG2-CB 4.3Å; V143-D159 WeakPolarHBondContact CG2-O 3.3Å; V143-V161 HydrophobicContact CB-CG2 4.43Å; V143-V161 HydrophobicContact CG2-CG2 3.97Å
144	T	81.2	Confident	80.4	Confident	52 Å²	52	53.6 Å²	53.6	32%	0.319	32%	0.315	S	S	.	.			trans	-119.9	-89.2	179.1	59.4	0	0	0	0	111.1	V11 P13 V99 P142 E146	V11-T144 HydrophobicContact CG1-CG2 3.89Å; P13-T144 HydrophobicContact CB-CG2 4.47Å; V99-T144 HydrophobicContact CB-CG2 4.19Å; V99-T144 HydrophobicContact CG1-CG2 4.05Å; V99-T144 HydrophobicContact CG2-CG2 4.46Å; P142-T144 PolarHBondContact O-N 2.76Å; T144-E146 WeakPolarHBondContact CA-OE2 3.43Å; T144-E146 PolarHBondContact N-OE2 3.22Å; T144-E146 PolarHBondContact OG1-OE1 3.37Å; T144-E146 PolarHBondContact OG1-OE2 3.1Å
145	K	80.1	Confident	80.9	Confident	170 Å²	170	52.6 Å²	52.6	74%	0.739	31%	0.312	S	S	*	.	S	Bend	trans	-117.5	17	-175	-65.2	-176.5	179.5	177.7	0	113.2	T147	K145-T147 PolarHBondContact O-N 2.91Å
146	E	82.8	Confident	81.6	Confident	27 Å²	27	53.2 Å²	53.2	13%	0.126	32%	0.317	C	S	.	.			trans	-66.3	118	-178.2	-65.5	73	-163.9	0	0	111.1	T144 A158 V161 K168 V170 F172	T144-E146 WeakPolarHBondContact CA-OE2 3.43Å; T144-E146 PolarHBondContact N-OE2 3.22Å; T144-E146 PolarHBondContact OG1-OE1 3.37Å; T144-E146 PolarHBondContact OG1-OE2 3.1Å; E146-A158 HydrophobicContact CB-CB 3.93Å; E146-V161 HydrophobicContact CG-CG2 3.89Å; E146-K168 VanDerWaalsContact OE1-CE 3.27Å; E146-K168 WeakPolarHBondContact OE1-CE 3.44Å; E146-K168 IonicContact OE1-NZ 2.64Å; E146-K168 PolarHBondContact OE1-NZ 2.86Å; E146-V170 HydrophobicContact CB-CG1 3.99Å; E146-V170 HydrophobicContact CB-CG2 4.32Å; E146-V170 HydrophobicContact CG-CG1 4.18Å; E146-V170 HydrophobicContact CG-CG2 3.77Å; E146-F172 HydrophobicContact CB-CZ 4.2Å
147	T	82.5	Confident	82.4	Confident	122 Å²	122	55.8 Å²	55.8	75%	0.748	33%	0.328	S	S	*	.			trans	-123.9	140.1	176.8	58	0	0	0	0	110.1	K145	K145-T147 PolarHBondContact O-N 2.91Å
148	L	82.8	Confident	83.2	Confident	12 Å²	12	55.8 Å²	55.8	6%	0.063	33%	0.327	C	S	.	.			trans	-115.1	134.7	171.6	-178.5	65.9	0	0	0	108.4	A150 S156 F172 F189 V215 Y217	L148-A150 PolarHBondContact O-N 2.99Å; L148-A150 VanDerWaalsContact O-N 3.08Å; L148-S156 PolarHBondContact O-OG 3.03Å; L148-F172 HydrophobicContact CB-CD1 3.74Å; L148-F172 HydrophobicContact CB-CD2 3.98Å; L148-F172 HydrophobicContact CB-CE1 3.58Å; L148-F172 HydrophobicContact CB-CE2 3.8Å; L148-F172 HydrophobicContact CB-CG 3.94Å; L148-F172 HydrophobicContact CB-CZ 3.61Å; L148-F172 HydrophobicContact CD2-CB 4.05Å; L148-F172 HydrophobicContact CD2-CD1 4.42Å; L148-F172 HydrophobicContact CD2-CD2 3.77Å; L148-F172 HydrophobicContact CD2-CE2 4.3Å; L148-F172 HydrophobicContact CD2-CG 3.83Å; L148-F172 HydrophobicContact CG-CD2 4.39Å; L148-F172 HydrophobicContact CG-CE2 4.46Å; L148-F189 HydrophobicContact CD2-CB 4.47Å; L148-F189 HydrophobicContact CD2-CD1 3.78Å; L148-F189 HydrophobicContact CG-CD1 4.5Å; L148-V215 HydrophobicContact CD2-CG1 4.4Å; L148-Y217 HydrophobicContact CD1-CD2 3.64Å; L148-Y217 HydrophobicContact CD1-CE2 3.74Å; L148-Y217 HydrophobicContact CD1-CG 4.43Å
149	Q	81.9	Confident	83.7	Confident	148 Å²	148	59 Å²	59	69%	0.692	35%	0.345	S	S	*	.			trans	-80.6	92.3	173.8	-164.9	172.7	10.7	0	0	109
150	A	80.7	Confident	84.1	Confident	25 Å²	25	58.2 Å²	58.2	21%	0.207	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-69	144.3	178.3	0	0	0	0	0	111.4	L148 L154	L148-A150 PolarHBondContact O-N 2.99Å; L148-A150 VanDerWaalsContact O-N 3.08Å; A150-L154 HydrophobicContact CB-CB 3.96Å
151	P	82.9	Confident	84.3	Confident	40 Å²	40	52.7 Å²	52.7	26%	0.26	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-52.7	156.3	169.9	-28	33.8	0	0	0	113.4	G153 L154 D188 F189	P151-G153 PolarHBondContact O-N 2.79Å; P151-L154 HydrophobicContact CB-CD1 4.15Å; P151-L154 HydrophobicContact CG-CD1 4.18Å; P151-L154 WeakPolarHBondContact O-CB 3.3Å; P151-L154 PolarHBondContact O-N 3.39Å; P151-D188 HydrophobicContact CG-CB 3.93Å; P151-D188 WeakPolarHBondContact CG-O 3.49Å; P151-F189 HydrophobicContact CG-CE1 4.45Å
152	A	83.8	Confident	84.5	Confident	100 Å²	100	53.1 Å²	53.1	83%	0.826	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	129.8	-178.9	0	0	0	0	0	112.1	L154	A152-L154 VanDerWaalsContact C-N 3.34Å
153	G	83.9	Confident	84.4	Confident	31 Å²	31	52.2 Å²	52.2	32%	0.32	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	-7	-177.5	0	0	0	0	0	115	P151 K177	P151-G153 PolarHBondContact O-N 2.79Å; G153-K177 PolarHBondContact O-N 3.47Å
154	L	88.2	Confident	84.1	Confident	20 Å²	20	49.7 Å²	49.7	11%	0.105	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	148.4	174.1	-57.5	-177.8	0	0	0	111	A150 P151 A152 V174 E175 N176 L182 I184 F189 L206	A150-L154 HydrophobicContact CB-CB 3.96Å; P151-L154 HydrophobicContact CB-CD1 4.15Å; P151-L154 HydrophobicContact CG-CD1 4.18Å; P151-L154 WeakPolarHBondContact O-CB 3.3Å; P151-L154 PolarHBondContact O-N 3.39Å; A152-L154 VanDerWaalsContact C-N 3.34Å; L154-V174 HydrophobicContact CB-CG1 4.03Å; L154-V174 HydrophobicContact CD1-CG1 4.05Å; L154-V174 HydrophobicContact CD2-CG1 4.48Å; L154-V174 HydrophobicContact CG-CG1 4.42Å; L154-E175 CarbonylContact C-O 3.58Å; L154-E175 WeakPolarHBondContact CA-O 3.38Å; L154-N176 HydrophobicContact CD2-CB 3.88Å; L154-L182 HydrophobicContact CD2-CD1 3.66Å; L154-L182 HydrophobicContact CG-CD1 4.16Å; L154-I184 HydrophobicContact CD1-CG2 3.88Å; L154-F189 HydrophobicContact CD1-CE1 4.22Å; L154-F189 HydrophobicContact CD1-CZ 3.8Å; L154-L206 HydrophobicContact CD2-CD2 3.85Å
155	S	88	Confident	83.7	Confident	36 Å²	36	48 Å²	48	25%	0.252	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	137.9	167.1	63.4	0	0	0	0	110.2	V174 E175 K177	S155-V174 CarbonylContact O-C 3.59Å; S155-V174 VanDerWaalsContact O-CA 3.31Å; S155-V174 WeakPolarHBondContact O-CA 3.39Å; S155-E175 PolarHBondContact N-O 3.17Å; S155-E175 PolarHBondContact O-N 2.97Å; S155-K177 WeakPolarHBondContact OG-CE 3.32Å
156	S	88.3	Confident	83.4	Confident	30 Å²	30	44.5 Å²	44.5	21%	0.21	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.6	177.7	55.3	0	0	0	0	111.5	L148 A173	L148-S156 PolarHBondContact O-OG 3.03Å; S156-A173 WeakPolarHBondContact CA-O 3.32Å
157	V	88.3	Confident	83.2	Confident	97 Å²	97	43.4 Å²	43.4	59%	0.588	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	128.5	174.3	-178.6	0	0	0	0	108.8	D159 F172 A173	V157-D159 PolarHBondContact O-N 2.64Å; V157-F172 CarbonylContact O-C 3.53Å; V157-F172 WeakPolarHBondContact O-CA 3.27Å; V157-A173 PolarHBondContact N-O 3.1Å; V157-A173 PolarHBondContact O-N 2.9Å
158	A	88.2	Confident	83.3	Confident	15 Å²	15	38.7 Å²	38.7	12%	0.124	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	129.5	174.5	0	0	0	0	0	110	V143 E146 V170 F172	V143-A158 HydrophobicContact CG1-CB 3.55Å; V143-A158 HydrophobicContact CG2-CB 4.3Å; E146-A158 HydrophobicContact CB-CB 3.93Å; A158-V170 HydrophobicContact CB-CG1 3.94Å; A158-F172 HydrophobicContact CB-CD1 3.97Å; A158-F172 HydrophobicContact CB-CE1 3.66Å; A158-F172 HydrophobicContact CB-CZ 4.34Å
159	D	87.2	Confident	83.4	Confident	83 Å²	83	38.3 Å²	38.3	44%	0.444	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-40	-175.7	176.6	33.6	0	0	0	111.2	V143 V157 R171	V143-D159 WeakPolarHBondContact CG2-O 3.3Å; V157-D159 PolarHBondContact O-N 2.64Å; D159-R171 PolarHBondContact N-O 2.83Å; D159-R171 IonicContact OD2-CZ 3.79Å; D159-R171 IonicContact OD2-NE 3.13Å; D159-R171 PolarHBondContact OD2-NE 3.25Å; D159-R171 IonicContact OD2-NH2 3.91Å; D159-R171 PolarHBondContact OD2-NH2 3.46Å
160	S	85.9	Confident	83.6	Confident	4 Å²	4	31.5 Å²	31.5	3%	0.028	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	146.5	177.7	56.2	0	0	0	0	112.1	W162 V170 R171	S160-W162 WeakPolarHBondContact OG-CH2 3.48Å; S160-W162 VanDerWaalsContact OG-CZ2 3.29Å; S160-W162 WeakPolarHBondContact OG-CZ2 3.45Å; S160-W162 WeakPolarHBondContact OG-CZ3 3.5Å; S160-V170 CarbonylContact O-C 3.54Å; S160-V170 WeakPolarHBondContact O-CA 3.33Å; S160-R171 PolarHBondContact O-N 2.97Å; S160-R171 VanDerWaalsContact OG-CB 3.22Å; S160-R171 WeakPolarHBondContact OG-CB 3.2Å; S160-R171 PolarHBondContact OG-NE 2.9Å
161	V	86.7	Confident	84	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.5	179.2	-175.2	0	0	0	0	109	Q140 V141 V143 E146 T163 K168 M169 V170	Q140-V161 CarbonylContact C-O 3.57Å; Q140-V161 WeakPolarHBondContact CA-O 3.21Å; Q140-V161 WeakPolarHBondContact CG-O 3.39Å; V141-V161 HydrophobicContact CG2-CB 3.65Å; V141-V161 HydrophobicContact CG2-CG1 3.38Å; V141-V161 PolarHBondContact N-O 3.48Å; V143-V161 HydrophobicContact CB-CG2 4.43Å; V143-V161 HydrophobicContact CG2-CG2 3.97Å; E146-V161 HydrophobicContact CG-CG2 3.89Å; V161-T163 HydrophobicContact CG1-CG2 4.43Å; V161-K168 HydrophobicContact CG1-CD 4.39Å; V161-K168 VanDerWaalsContact CG1-CE 3.5Å; V161-K168 HydrophobicContact CG1-CG 4.1Å; V161-M169 CarbonylContact C-O 3.56Å; V161-M169 WeakPolarHBondContact CA-O 3.28Å; V161-V170 HydrophobicContact CG1-CG2 4.3Å; V161-V170 HydrophobicContact CG2-CG1 4.19Å; V161-V170 HydrophobicContact CG2-CG2 4.35Å
162	W	84.8	Confident	84.2	Confident	20 Å²	20	32.5 Å²	32.5	8%	0.076	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.7	172.7	-55.1	-85.5	0	0	0	109.9	V129 L134 W138 H139 S160 K168 M169 R171 L216	V129-W162 HydrophobicContact CG1-CD2 4.42Å; V129-W162 HydrophobicContact CG1-CE3 4.1Å; V129-W162 HydrophobicContact CG1-CH2 3.51Å; V129-W162 HydrophobicContact CG1-CZ2 3.93Å; V129-W162 HydrophobicContact CG1-CZ3 3.63Å; L134-W162 HydrophobicContact CD2-CB 4.19Å; L134-W162 VanDerWaalsContact CD2-CD1 3.4Å; L134-W162 HydrophobicContact CD2-CD2 4.45Å; L134-W162 HydrophobicContact CD2-CG 3.76Å; W138-W162 HydrophobicContact CE3-CB 3.97Å; W138-W162 HydrophobicContact CZ3-CB 4.23Å; H139-W162 CarbonylContact O-C 3.55Å; H139-W162 VanDerWaalsContact O-CA 3.29Å; H139-W162 WeakPolarHBondContact O-CA 3.21Å; S160-W162 WeakPolarHBondContact OG-CH2 3.48Å; S160-W162 VanDerWaalsContact OG-CZ2 3.29Å; S160-W162 WeakPolarHBondContact OG-CZ2 3.45Å; S160-W162 WeakPolarHBondContact OG-CZ3 3.5Å; W162-K168 CarbonylContact O-C 3.6Å; W162-K168 WeakPolarHBondContact O-CA 3.41Å; W162-M169 HydrophobicContact CB-CB 4.41Å; W162-M169 HydrophobicContact CE3-CB 4.07Å; W162-M169 HydrophobicContact CE3-CG 4.06Å; W162-M169 HydrophobicContact CE3-SD 4.29Å; W162-M169 HydrophobicContact CZ3-CG 4.4Å; W162-M169 HydrophobicContact CZ3-SD 4.42Å; W162-M169 PolarHBondContact N-O 2.81Å; W162-M169 PolarHBondContact O-N 3.04Å; W162-R171 HydrophobicContact CH2-CB 3.98Å; W162-R171 HydrophobicContact CZ3-CB 3.81Å; W162-L216 HydrophobicContact CH2-CD2 4.3Å; W162-L216 HydrophobicContact CZ3-CD2 3.82Å
163	T	80.3	Confident	84.4	Confident	9 Å²	9	29.4 Å²	29.4	6%	0.055	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.5	-176.5	43.6	0	0	0	0	109.9	W138 H139 V141 V161 K168	W138-T163 WeakPolarHBondContact CA-O 3.3Å; H139-T163 PolarHBondContact CD2-OG1 2.96Å; H139-T163 VanDerWaalsContact CD2-OG1 3.27Å; H139-T163 PolarHBondContact CE1-O 3.05Å; H139-T163 PolarHBondContact N-O 2.95Å; H139-T163 VanDerWaalsContact N-O 3.12Å; H139-T163 PolarHBondContact ND1-O 2.83Å; H139-T163 PolarHBondContact NE2-OG1 2.8Å; H139-T163 PolarHBondContact O-N 3.43Å; V141-T163 WeakPolarHBondContact CG1-OG1 3.26Å; V141-T163 HydrophobicContact CG2-CG2 3.94Å; V161-T163 HydrophobicContact CG1-CG2 4.43Å; T163-K168 HydrophobicContact CG2-CB 4.48Å; T163-K168 HydrophobicContact CG2-CG 4.09Å
164	G	77.8	Confident	84.6	Confident	2 Å²	2	28 Å²	28	2%	0.021	15%	0.154	C	C	.	.			trans	-102.2	-142.7	166.4	0	0	0	0	0	110.7	E113 L167	E113-G164 VanDerWaalsContact OE1-CA 3.3Å; E113-G164 WeakPolarHBondContact OE1-CA 3.3Å; G164-L167 PolarHBondContact N-O 2.93Å
165	N	72.9	Confident	84.6	Confident	16 Å²	16	30.2 Å²	30.2	9%	0.086	16%	0.164	C	C	.	.	S	Bend	trans	-88	-51.4	176.6	-172.2	-3.6	0	0	0	111.2	G104 G106 A109 G110 E113	G104-N165 WeakPolarHBondContact CA-OD1 3.37Å; G104-N165 PolarHBondContact N-OD1 3.28Å; G106-N165 PolarHBondContact O-ND2 3.49Å; A109-N165 HydrophobicContact CB-CB 4.07Å; G110-N165 VanDerWaalsContact CA-ND2 3.29Å; G110-N165 WeakPolarHBondContact CA-ND2 3.47Å; E113-N165 PolarHBondContact OE1-N 2.8Å
166	H	74	Confident	84.6	Confident	98 Å²	98	28.5 Å²	28.5	45%	0.454	15%	0.152	S	C	.	.	S	Bend	trans	-109.4	-16.7	-178.7	-52.3	90.6	0	0	0	113.3	E113 D220 V221	E113-H166 WeakPolarHBondContact OE2-CB 3Å; E113-H166 IonicContact OE2-CG 3.69Å; E113-H166 PolarHBondContact OE2-N 2.86Å; E113-H166 IonicContact OE2-ND1 2.62Å; E113-H166 PolarHBondContact OE2-ND1 2.97Å; H166-D220 WeakPolarHBondContact O-CA 3.32Å; H166-V221 PolarHBondContact O-N 3.1Å
167	L	78.4	Confident	84.6	Confident	4 Å²	4	33 Å²	33	2%	0.021	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	142.7	-171.9	-62.5	169.6	0	0	0	111.9	L121 I125 W138 G164 R195 L218 S219	L121-L167 HydrophobicContact CD2-CD1 3.57Å; L121-L167 HydrophobicContact CG-CD1 4.29Å; I125-L167 HydrophobicContact CD1-CD1 3.75Å; W138-L167 HydrophobicContact CH2-CB 3.56Å; W138-L167 HydrophobicContact CZ2-CB 3.63Å; W138-L167 HydrophobicContact CZ2-CD1 4.3Å; G164-L167 PolarHBondContact N-O 2.93Å; L167-R195 HydrophobicContact CD2-CG 4.33Å; L167-L218 HydrophobicContact CB-CD2 4.4Å; L167-L218 HydrophobicContact CD1-CD2 4.12Å; L167-L218 HydrophobicContact CD2-CD2 3.95Å; L167-L218 HydrophobicContact CG-CD2 4.38Å; L167-S219 WeakPolarHBondContact CA-O 3.04Å
168	K	83.5	Confident	84.6	Confident	23 Å²	23	30.2 Å²	30.2	10%	0.1	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	131.1	173.4	-178.1	174.9	-179.2	173.6	0	108.5	E146 V161 W162 T163 V170 L218 S219 V221	E146-K168 VanDerWaalsContact OE1-CE 3.27Å; E146-K168 WeakPolarHBondContact OE1-CE 3.44Å; E146-K168 IonicContact OE1-NZ 2.64Å; E146-K168 PolarHBondContact OE1-NZ 2.86Å; V161-K168 HydrophobicContact CG1-CD 4.39Å; V161-K168 VanDerWaalsContact CG1-CE 3.5Å; V161-K168 HydrophobicContact CG1-CG 4.1Å; W162-K168 CarbonylContact O-C 3.6Å; W162-K168 WeakPolarHBondContact O-CA 3.41Å; T163-K168 HydrophobicContact CG2-CB 4.48Å; T163-K168 HydrophobicContact CG2-CG 4.09Å; K168-V170 HydrophobicContact CG-CG2 4.24Å; K168-L218 CarbonylContact O-C 3.6Å; K168-L218 WeakPolarHBondContact O-CA 3.46Å; K168-S219 PolarHBondContact N-O 2.82Å; K168-S219 PolarHBondContact O-N 3.41Å; K168-V221 HydrophobicContact CB-CG2 4.08Å
169	M	85.4	Confident	84.4	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.02	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.4	171.1	-167.2	175.9	-74.9	0	0	110.2	I125 V129 W138 V161 W162 L216 Y217 L218	I125-M169 HydrophobicContact CB-CE 4.18Å; I125-M169 HydrophobicContact CG2-CE 3.42Å; I125-M169 VanDerWaalsContact CG2-CE 3.42Å; V129-M169 HydrophobicContact CB-SD 3.81Å; V129-M169 HydrophobicContact CG1-SD 3.8Å; V129-M169 HydrophobicContact CG2-CE 4.28Å; V129-M169 HydrophobicContact CG2-SD 3.6Å; W138-M169 HydrophobicContact CZ3-CB 4.06Å; V161-M169 CarbonylContact C-O 3.56Å; V161-M169 WeakPolarHBondContact CA-O 3.28Å; W162-M169 HydrophobicContact CB-CB 4.41Å; W162-M169 HydrophobicContact CE3-CB 4.07Å; W162-M169 HydrophobicContact CE3-CG 4.06Å; W162-M169 HydrophobicContact CE3-SD 4.29Å; W162-M169 HydrophobicContact CZ3-CG 4.4Å; W162-M169 HydrophobicContact CZ3-SD 4.42Å; W162-M169 PolarHBondContact N-O 2.81Å; W162-M169 PolarHBondContact O-N 3.04Å; M169-L216 HydrophobicContact CG-CD2 4.35Å; M169-L216 HydrophobicContact SD-CB 4.23Å; M169-L216 HydrophobicContact SD-CD1 4.34Å; M169-L216 HydrophobicContact SD-CD2 3.87Å; M169-L216 HydrophobicContact SD-CG 4.37Å; M169-Y217 CarbonylContact C-O 3.54Å; M169-Y217 VanDerWaalsContact CA-O 3.32Å; M169-Y217 WeakPolarHBondContact CA-O 3.18Å; M169-L218 HydrophobicContact CB-CD1 3.71Å; M169-L218 HydrophobicContact CE-CD1 3.17Å; M169-L218 HydrophobicContact CG-CD1 3.96Å; M169-L218 HydrophobicContact SD-CD1 4.4Å
170	V	87.3	Confident	84.4	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.024	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131	174.9	-172.4	0	0	0	0	109	E146 A158 S160 V161 K168 F172 L216 Y217	E146-V170 HydrophobicContact CB-CG1 3.99Å; E146-V170 HydrophobicContact CB-CG2 4.32Å; E146-V170 HydrophobicContact CG-CG1 4.18Å; E146-V170 HydrophobicContact CG-CG2 3.77Å; A158-V170 HydrophobicContact CB-CG1 3.94Å; S160-V170 CarbonylContact O-C 3.54Å; S160-V170 WeakPolarHBondContact O-CA 3.33Å; V161-V170 HydrophobicContact CG1-CG2 4.3Å; V161-V170 HydrophobicContact CG2-CG1 4.19Å; V161-V170 HydrophobicContact CG2-CG2 4.35Å; K168-V170 HydrophobicContact CG-CG2 4.24Å; V170-F172 HydrophobicContact CB-CD2 4.2Å; V170-F172 HydrophobicContact CB-CE2 3.59Å; V170-F172 HydrophobicContact CB-CZ 4.11Å; V170-F172 HydrophobicContact CG1-CD2 3.85Å; V170-F172 HydrophobicContact CG1-CE1 4.12Å; V170-F172 HydrophobicContact CG1-CE2 3.33Å; V170-F172 HydrophobicContact CG1-CG 4.45Å; V170-F172 HydrophobicContact CG1-CZ 3.48Å; V170-F172 VanDerWaalsContact CG1-CZ 3.48Å; V170-L216 WeakPolarHBondContact O-CA 3.35Å; V170-Y217 PolarHBondContact N-O 2.97Å; V170-Y217 PolarHBondContact O-N 2.99Å
171	R	87.7	Confident	84.4	Confident	82 Å²	82	39.1 Å²	39.1	31%	0.309	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	121.8	168.3	-171.4	170.2	71.1	-166.1	1.3	109.1	D159 S160 W162 L216	D159-R171 PolarHBondContact N-O 2.83Å; D159-R171 IonicContact OD2-CZ 3.79Å; D159-R171 IonicContact OD2-NE 3.13Å; D159-R171 PolarHBondContact OD2-NE 3.25Å; D159-R171 IonicContact OD2-NH2 3.91Å; D159-R171 PolarHBondContact OD2-NH2 3.46Å; S160-R171 PolarHBondContact O-N 2.97Å; S160-R171 VanDerWaalsContact OG-CB 3.22Å; S160-R171 WeakPolarHBondContact OG-CB 3.2Å; S160-R171 PolarHBondContact OG-NE 2.9Å; W162-R171 HydrophobicContact CH2-CB 3.98Å; W162-R171 HydrophobicContact CZ3-CB 3.81Å; R171-L216 HydrophobicContact CB-CD2 3.76Å; R171-L216 HydrophobicContact CG-CD2 3.95Å
172	F	88.3	Confident	84.3	Confident	4 Å²	4	41.3 Å²	41.3	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.9	171.6	-67.6	-87.6	0	0	0	110.8	E146 L148 V157 A158 V170 V174 G214 V215 Y217	E146-F172 HydrophobicContact CB-CZ 4.2Å; L148-F172 HydrophobicContact CB-CD1 3.74Å; L148-F172 HydrophobicContact CB-CD2 3.98Å; L148-F172 HydrophobicContact CB-CE1 3.58Å; L148-F172 HydrophobicContact CB-CE2 3.8Å; L148-F172 HydrophobicContact CB-CG 3.94Å; L148-F172 HydrophobicContact CB-CZ 3.61Å; L148-F172 HydrophobicContact CD2-CB 4.05Å; L148-F172 HydrophobicContact CD2-CD1 4.42Å; L148-F172 HydrophobicContact CD2-CD2 3.77Å; L148-F172 HydrophobicContact CD2-CE2 4.3Å; L148-F172 HydrophobicContact CD2-CG 3.83Å; L148-F172 HydrophobicContact CG-CD2 4.39Å; L148-F172 HydrophobicContact CG-CE2 4.46Å; V157-F172 CarbonylContact O-C 3.53Å; V157-F172 WeakPolarHBondContact O-CA 3.27Å; A158-F172 HydrophobicContact CB-CD1 3.97Å; A158-F172 HydrophobicContact CB-CE1 3.66Å; A158-F172 HydrophobicContact CB-CZ 4.34Å; V170-F172 HydrophobicContact CB-CD2 4.2Å; V170-F172 HydrophobicContact CB-CE2 3.59Å; V170-F172 HydrophobicContact CB-CZ 4.11Å; V170-F172 HydrophobicContact CG1-CD2 3.85Å; V170-F172 HydrophobicContact CG1-CE1 4.12Å; V170-F172 HydrophobicContact CG1-CE2 3.33Å; V170-F172 HydrophobicContact CG1-CG 4.45Å; V170-F172 HydrophobicContact CG1-CZ 3.48Å; V170-F172 VanDerWaalsContact CG1-CZ 3.48Å; F172-V174 HydrophobicContact CB-CG2 4.33Å; F172-G214 VanDerWaalsContact O-CA 3.32Å; F172-G214 WeakPolarHBondContact O-CA 3.01Å; F172-G214 PolarHBondContact O-N 3.22Å; F172-V215 HydrophobicContact CB-CB 4.47Å; F172-V215 PolarHBondContact N-O 3.23Å; F172-V215 PolarHBondContact O-N 2.86Å; F172-Y217 HydrophobicContact CE2-CD1 4.5Å; F172-Y217 HydrophobicContact CE2-CG 4.21Å
173	A	88.4	Confident	84.4	Confident	35 Å²	35	46.4 Å²	46.4	29%	0.289	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	120	161.5	0	0	0	0	0	108.1	S156 V157	S156-A173 WeakPolarHBondContact CA-O 3.32Å; V157-A173 PolarHBondContact N-O 3.1Å; V157-A173 PolarHBondContact O-N 2.9Å
174	V	87.7	Confident	84.6	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	124.1	-178.8	-179.8	0	0	0	0	109.5	L154 S155 F172 F189 L206 A211 I212 V215	L154-V174 HydrophobicContact CB-CG1 4.03Å; L154-V174 HydrophobicContact CD1-CG1 4.05Å; L154-V174 HydrophobicContact CD2-CG1 4.48Å; L154-V174 HydrophobicContact CG-CG1 4.42Å; S155-V174 CarbonylContact O-C 3.59Å; S155-V174 VanDerWaalsContact O-CA 3.31Å; S155-V174 WeakPolarHBondContact O-CA 3.39Å; F172-V174 HydrophobicContact CB-CG2 4.33Å; V174-F189 HydrophobicContact CB-CE1 4.48Å; V174-F189 HydrophobicContact CG1-CE1 3.9Å; V174-F189 HydrophobicContact CG1-CZ 3.99Å; V174-F189 HydrophobicContact CG2-CE1 3.88Å; V174-F189 HydrophobicContact CG2-CZ 4.38Å; V174-L206 HydrophobicContact CG1-CD2 4.42Å; V174-A211 CarbonylContact O-C 3.6Å; V174-A211 WeakPolarHBondContact O-CA 3.36Å; V174-I212 PolarHBondContact N-O 2.95Å; V174-I212 PolarHBondContact O-N 2.86Å; V174-V215 HydrophobicContact CB-CG2 4.32Å; V174-V215 HydrophobicContact CG2-CB 4.22Å; V174-V215 HydrophobicContact CG2-CG2 3.52Å
175	E	87.5	Confident	85	Confident	67 Å²	67	53.7 Å²	53.7	31%	0.313	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.9	-178.1	-169.2	-171.8	153.2	0	0	110.8	L154 S155 K177 A211	L154-E175 CarbonylContact C-O 3.58Å; L154-E175 WeakPolarHBondContact CA-O 3.38Å; S155-E175 PolarHBondContact N-O 3.17Å; S155-E175 PolarHBondContact O-N 2.97Å; E175-K177 VanDerWaalsContact CD-CE 3.41Å; E175-K177 HydrophobicContact CG-CD 4.44Å; E175-K177 PolarHBondContact O-N 3.35Å; E175-K177 WeakPolarHBondContact OE1-CE 3.5Å; E175-K177 IonicContact OE1-NZ 3.57Å; E175-K177 PolarHBondContact OE1-NZ 2.88Å; E175-K177 VanDerWaalsContact OE2-CE 3.27Å; E175-K177 WeakPolarHBondContact OE2-CE 3.44Å; E175-K177 IonicContact OE2-NZ 2.86Å; E175-K177 PolarHBondContact OE2-NZ 2.97Å; E175-A211 HydrophobicContact CB-CB 4.14Å; E175-A211 HydrophobicContact CG-CB 4.22Å
176	N	88.9	Confident	85.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	108.2	171.4	179.5	0.6	0	0	0	109.9	L154 T178 S180 L182 L206 L207 A209 S210	L154-N176 HydrophobicContact CD2-CB 3.88Å; N176-T178 VanDerWaalsContact C-N 3.31Å; N176-T178 WeakPolarHBondContact OD1-CA 3.17Å; N176-T178 WeakPolarHBondContact OD1-CB 3.38Å; N176-T178 PolarHBondContact OD1-N 3.03Å; N176-T178 PolarHBondContact OD1-OG1 2.84Å; N176-S180 PolarHBondContact ND2-O 3.05Å; N176-L182 WeakPolarHBondContact OD1-CD1 3.38Å; N176-L206 HydrophobicContact CB-CB 4.38Å; N176-L206 HydrophobicContact CB-CD2 3.64Å; N176-L206 HydrophobicContact CB-CG 3.66Å; N176-L206 PolarHBondContact ND2-O 3.33Å; N176-L207 WeakPolarHBondContact CB-O 3.42Å; N176-L207 PolarHBondContact ND2-O 2.76Å; N176-A209 VanDerWaalsContact O-CA 3.22Å; N176-A209 WeakPolarHBondContact O-CA 3.43Å; N176-A209 PolarHBondContact O-N 3.41Å; N176-S210 PolarHBondContact N-O 3.43Å
177	K	88.4	Confident	85.9	Confident	125 Å²	125	55.7 Å²	55.7	54%	0.543	29%	0.29	S	S	.	.			trans	-86.7	0.6	179.3	-64.5	-66.2	-175.8	-173	0	113.3	G153 S155 E175	G153-K177 PolarHBondContact O-N 3.47Å; S155-K177 WeakPolarHBondContact OG-CE 3.32Å; E175-K177 VanDerWaalsContact CD-CE 3.41Å; E175-K177 HydrophobicContact CG-CD 4.44Å; E175-K177 PolarHBondContact O-N 3.35Å; E175-K177 WeakPolarHBondContact OE1-CE 3.5Å; E175-K177 IonicContact OE1-NZ 3.57Å; E175-K177 PolarHBondContact OE1-NZ 2.88Å; E175-K177 VanDerWaalsContact OE2-CE 3.27Å; E175-K177 WeakPolarHBondContact OE2-CE 3.44Å; E175-K177 IonicContact OE2-NZ 2.86Å; E175-K177 PolarHBondContact OE2-NZ 2.97Å
178	T	86.7	Confident	86.2	Confident	38 Å²	38	58 Å²	58	23%	0.233	30%	0.302	C	S	.	.	S	Bend	trans	-89.5	163.5	178.7	74.9	0	0	0	0	112	N176 S180 L182 A208	N176-T178 VanDerWaalsContact C-N 3.31Å; N176-T178 WeakPolarHBondContact OD1-CA 3.17Å; N176-T178 WeakPolarHBondContact OD1-CB 3.38Å; N176-T178 PolarHBondContact OD1-N 3.03Å; N176-T178 PolarHBondContact OD1-OG1 2.84Å; T178-S180 PolarHBondContact O-N 3.19Å; T178-S180 PolarHBondContact OG1-N 3.22Å; T178-S180 PolarHBondContact OG1-O 3.26Å; T178-L182 HydrophobicContact CG2-CD1 3.95Å; T178-A208 WeakPolarHBondContact O-CB 3.5Å
179	L	85.5	Confident	86.2	Confident	180 Å²	180	57 Å²	57	94%	0.942	30%	0.298	S	S	*	.	S	Bend	trans	-81.2	-1.3	176.1	-64.3	172.2	0	0	0	113.2	A208	L179-A208 VanDerWaalsContact C-CB 3.47Å
180	S	86.4	Confident	86.1	Confident	69 Å²	69	64.2 Å²	64.2	48%	0.483	33%	0.325	S	S	.	.	S	Bend	trans	-124.7	153.5	-176.2	50.5	0	0	0	0	111	N176 T178	N176-S180 PolarHBondContact ND2-O 3.05Å; T178-S180 PolarHBondContact O-N 3.19Å; T178-S180 PolarHBondContact OG1-N 3.22Å; T178-S180 PolarHBondContact OG1-O 3.26Å
181	A	85.4	Confident	85.6	Confident	40 Å²	40	65.9 Å²	65.9	33%	0.331	33%	0.333	S	S	.	.			trans	-66.6	135.9	171.3	0	0	0	0	0	110.4	Q205 L206 L207	A181-Q205 HydrophobicContact CB-CG 3.93Å; A181-Q205 VanDerWaalsContact CB-NE2 3.28Å; A181-L206 WeakPolarHBondContact CA-O 3.34Å; A181-L207 HydrophobicContact CB-CD2 4.2Å
182	L	85.2	Confident	85	Confident	45 Å²	45	67.4 Å²	67.4	24%	0.236	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.4	177.5	-72.1	171.8	0	0	0	109.3	L154 N176 T178 Q205 L206	L154-L182 HydrophobicContact CD2-CD1 3.66Å; L154-L182 HydrophobicContact CG-CD1 4.16Å; N176-L182 WeakPolarHBondContact OD1-CD1 3.38Å; T178-L182 HydrophobicContact CG2-CD1 3.95Å; L182-Q205 CarbonylContact O-C 3.47Å; L182-Q205 WeakPolarHBondContact O-CA 3.23Å; L182-L206 PolarHBondContact N-O 3.29Å; L182-L206 PolarHBondContact O-N 2.82Å
183	N	87.1	Confident	84.1	Confident	128 Å²	128	69.3 Å²	69.3	68%	0.684	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	132.5	168	-68.6	-33.5	0	0	0	108.4	G204	N183-G204 WeakPolarHBondContact CA-O 3.32Å
184	I	85.3	Confident	83.5	Confident	8 Å²	8	68.1 Å²	68.1	4%	0.041	36%	0.364	C	S	.	.			trans	-129.3	145.3	-178.8	57.8	164.9	0	0	0	109.5	L154 F189 F199 G204 L206 I212	L154-I184 HydrophobicContact CD1-CG2 3.88Å; I184-F189 HydrophobicContact CB-CE2 4.43Å; I184-F199 HydrophobicContact CB-CZ 4.34Å; I184-F199 HydrophobicContact CD1-CE2 3.95Å; I184-F199 HydrophobicContact CD1-CZ 3.93Å; I184-F199 HydrophobicContact CG1-CE2 4.13Å; I184-F199 HydrophobicContact CG1-CZ 4.24Å; I184-G204 PolarHBondContact N-O 3.26Å; I184-G204 VanDerWaalsContact N-O 3.09Å; I184-L206 HydrophobicContact CD1-CB 4.17Å; I184-L206 HydrophobicContact CG2-CB 4.41Å; I184-I212 HydrophobicContact CD1-CD1 3.39Å
185	R	84.6	Confident	83.1	Confident	155 Å²	155	73.7 Å²	73.7	59%	0.585	38%	0.384	S	S	*	.			trans	-133.1	153.2	171.4	-60.9	169.2	-64.2	179.2	6.5	108.7	S187 D188 F189	R185-S187 PolarHBondContact O-N 2.98Å; R185-D188 WeakPolarHBondContact CB-OD2 3.38Å; R185-D188 IonicContact CZ-OD1 2.95Å; R185-D188 PolarHBondContact N-OD2 2.72Å; R185-D188 IonicContact NE-OD1 3.14Å; R185-D188 PolarHBondContact NE-OD1 3Å; R185-D188 IonicContact NE-OD2 2.71Å; R185-D188 IonicContact NH2-OD1 2.98Å; R185-D188 PolarHBondContact NH2-OD1 2.98Å; R185-D188 WeakPolarHBondContact O-CB 3.38Å; R185-D188 PolarHBondContact O-N 3.37Å; R185-F189 WeakPolarHBondContact O-CD2 3.31Å
186	E	83.6	Confident	82.9	Confident	81 Å²	81	72.2 Å²	72.2	38%	0.379	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-56.6	-34.5	177.1	-67.6	84.1	169.5	0	0	111.5	D188 F189 V197 F199	E186-D188 PolarHBondContact O-N 3.34Å; E186-F189 PolarHBondContact O-N 2.79Å; E186-V197 HydrophobicContact CB-CB 4.36Å; E186-V197 HydrophobicContact CB-CG1 4.1Å; E186-V197 WeakPolarHBondContact O-CG1 3.22Å; E186-F199 HydrophobicContact CB-CZ 4.48Å; E186-F199 VanDerWaalsContact CD-CD2 3.49Å; E186-F199 HydrophobicContact CG-CD1 3.97Å; E186-F199 HydrophobicContact CG-CD2 3.91Å; E186-F199 HydrophobicContact CG-CE1 4.04Å; E186-F199 HydrophobicContact CG-CE2 3.98Å; E186-F199 HydrophobicContact CG-CG 3.93Å; E186-F199 HydrophobicContact CG-CZ 4.05Å; E186-F199 VanDerWaalsContact OE1-CD2 3.23Å; E186-F199 WeakPolarHBondContact OE1-CD2 3.46Å
187	S	83.2	Confident	82.7	Confident	76 Å²	76	73.6 Å²	73.6	53%	0.531	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-62.1	-25.1	176.5	63.5	0	0	0	0	114	R185 F189 W190	R185-S187 PolarHBondContact O-N 2.98Å; S187-F189 PolarHBondContact O-N 2.97Å; S187-W190 PolarHBondContact O-N 3.01Å
188	D	83.7	Confident	82.4	Confident	52 Å²	52	69.2 Å²	69.2	28%	0.278	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-73.1	-13.9	-178.2	-54.9	-33.4	0	0	0	111.5	P151 R185 E186	P151-D188 HydrophobicContact CG-CB 3.93Å; P151-D188 WeakPolarHBondContact CG-O 3.49Å; R185-D188 WeakPolarHBondContact CB-OD2 3.38Å; R185-D188 IonicContact CZ-OD1 2.95Å; R185-D188 PolarHBondContact N-OD2 2.72Å; R185-D188 IonicContact NE-OD1 3.14Å; R185-D188 PolarHBondContact NE-OD1 3Å; R185-D188 IonicContact NE-OD2 2.71Å; R185-D188 IonicContact NH2-OD1 2.98Å; R185-D188 PolarHBondContact NH2-OD1 2.98Å; R185-D188 WeakPolarHBondContact O-CB 3.38Å; R185-D188 PolarHBondContact O-N 3.37Å; E186-D188 PolarHBondContact O-N 3.34Å
189	F	84.3	Confident	82.2	Confident	1 Å²	1	67.9 Å²	67.9	0%	0.004	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-105.9	5.5	177.3	-59.5	-90.1	0	0	0	113.3	L148 P151 L154 V174 I184 R185 E186 S187 V197 F199 V215	L148-F189 HydrophobicContact CD2-CB 4.47Å; L148-F189 HydrophobicContact CD2-CD1 3.78Å; L148-F189 HydrophobicContact CG-CD1 4.5Å; P151-F189 HydrophobicContact CG-CE1 4.45Å; L154-F189 HydrophobicContact CD1-CE1 4.22Å; L154-F189 HydrophobicContact CD1-CZ 3.8Å; V174-F189 HydrophobicContact CB-CE1 4.48Å; V174-F189 HydrophobicContact CG1-CE1 3.9Å; V174-F189 HydrophobicContact CG1-CZ 3.99Å; V174-F189 HydrophobicContact CG2-CE1 3.88Å; V174-F189 HydrophobicContact CG2-CZ 4.38Å; I184-F189 HydrophobicContact CB-CE2 4.43Å; R185-F189 WeakPolarHBondContact O-CD2 3.31Å; E186-F189 PolarHBondContact O-N 2.79Å; S187-F189 PolarHBondContact O-N 2.97Å; F189-V197 HydrophobicContact CB-CG1 4.02Å; F189-F199 AromaticContact CD2-CE1 3.69Å; F189-F199 HydrophobicContact CD2-CE1 3.69Å; F189-F199 AromaticContact CD2-CZ 3.99Å; F189-F199 HydrophobicContact CD2-CZ 3.99Å; F189-F199 AromaticContact CE2-CE1 3.55Å; F189-F199 HydrophobicContact CE2-CE1 3.55Å; F189-F199 AromaticContact CE2-CZ 3.66Å; F189-F199 HydrophobicContact CE2-CZ 3.66Å; F189-V215 HydrophobicContact CB-CG1 4.22Å; F189-V215 HydrophobicContact CD1-CG1 4.48Å; F189-V215 HydrophobicContact CD1-CG2 4.44Å; F189-V215 HydrophobicContact CD2-CG2 4.49Å; F189-V215 HydrophobicContact CE1-CG2 4.26Å; F189-V215 HydrophobicContact CE2-CG2 4.34Å; F189-V215 HydrophobicContact CG-CG1 4.17Å; F189-V215 HydrophobicContact CZ-CG2 4.21Å
190	W	82.5	Confident	81.4	Confident	156 Å²	156	60.9 Å²	60.9	59%	0.591	33%	0.331	S	S	*	.			trans	-73.2	136.2	179	-178.1	88.7	0	0	0	111.3	S187 T194	S187-W190 PolarHBondContact O-N 3.01Å; W190-T194 PolarHBondContact NE1-O 3.15Å
191	Q	78.3	Confident	80.6	Confident	39 Å²	39	63.8 Å²	63.8	18%	0.182	34%	0.337	C	S	.	.			trans	-130	161.7	174.7	-60.4	-167.2	-74.3	0	0	110.9	G193 T194	Q191-G193 PolarHBondContact O-N 3.27Å; Q191-T194 PolarHBondContact N-OG1 3.05Å; Q191-T194 VanDerWaalsContact O-CB 3.32Å; Q191-T194 WeakPolarHBondContact O-CB 3.3Å; Q191-T194 PolarHBondContact O-N 3.44Å; Q191-T194 PolarHBondContact O-OG1 3.34Å
192	P	73.7	Confident	79.8	Confident	114 Å²	114	68.2 Å²	68.2	74%	0.74	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	130.6	169.2	-25.2	35.3	0	0	0	111
193	G	68.9	Low	78.9	Confident	45 Å²	45	67.4 Å²	67.4	46%	0.464	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	-7	-175.6	0	0	0	0	0	115.2	Q191	Q191-G193 PolarHBondContact O-N 3.27Å
194	T	76.8	Confident	78.5	Confident	10 Å²	10	63.9 Å²	63.9	6%	0.061	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	127.2	171.3	-40.2	0	0	0	0	111	W190 Q191 A196 V197 Y217 L218	W190-T194 PolarHBondContact NE1-O 3.15Å; Q191-T194 PolarHBondContact N-OG1 3.05Å; Q191-T194 VanDerWaalsContact O-CB 3.32Å; Q191-T194 WeakPolarHBondContact O-CB 3.3Å; Q191-T194 PolarHBondContact O-N 3.44Å; Q191-T194 PolarHBondContact O-OG1 3.34Å; T194-A196 WeakPolarHBondContact CG2-O 3.19Å; T194-V197 HydrophobicContact CG2-CG2 3.56Å; T194-Y217 HydrophobicContact CG2-CD2 3.71Å; T194-Y217 HydrophobicContact CG2-CE1 4.41Å; T194-Y217 HydrophobicContact CG2-CE2 3.36Å; T194-Y217 HydrophobicContact CG2-CG 4.37Å; T194-Y217 WeakPolarHBondContact OG1-CE2 3.12Å; T194-Y217 PolarHBondContact OG1-OH 2.91Å; T194-L218 WeakPolarHBondContact CG2-O 3.32Å
195	R	79.7	Confident	78.3	Confident	119 Å²	119	68.5 Å²	68.5	45%	0.449	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-37.1	175.9	-59.3	-50.3	-165.6	-172.5	-1.5	112.6	Y118 L122 L167 L218 D220	Y118-R195 WeakPolarHBondContact OH-CB 3.39Å; Y118-R195 WeakPolarHBondContact OH-CD 3.31Å; Y118-R195 WeakPolarHBondContact OH-CG 3.48Å; Y118-R195 PolarHBondContact OH-NE 3.44Å; L122-R195 HydrophobicContact CD2-CB 4.17Å; L167-R195 HydrophobicContact CD2-CG 4.33Å; R195-L218 HydrophobicContact CB-CD2 4.14Å; R195-L218 PolarHBondContact N-O 3.12Å; R195-D220 IonicContact CZ-OD1 3.05Å; R195-D220 IonicContact CZ-OD2 2.64Å; R195-D220 VanDerWaalsContact NE-CG 3.34Å; R195-D220 IonicContact NE-OD1 2.7Å; R195-D220 PolarHBondContact NE-OD1 3.48Å; R195-D220 IonicContact NE-OD2 2.69Å; R195-D220 PolarHBondContact NE-OD2 3.14Å; R195-D220 VanDerWaalsContact NE-OD2 3.14Å; R195-D220 IonicContact NH2-OD1 3.79Å; R195-D220 IonicContact NH2-OD2 3.51Å; R195-D220 PolarHBondContact NH2-OD2 3.15Å
196	A	82	Confident	78.2	Confident	35 Å²	35	61.3 Å²	61.3	29%	0.289	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	144.8	175.3	0	0	0	0	0	111.3	T194 L218	T194-A196 WeakPolarHBondContact CG2-O 3.19Å; A196-L218 HydrophobicContact CB-CB 4.07Å; A196-L218 PolarHBondContact N-O 3.15Å; A196-L218 PolarHBondContact O-N 3.13Å
197	V	84.8	Confident	78.3	Confident	29 Å²	29	62.7 Å²	62.7	18%	0.176	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	135.8	168	-178.4	0	0	0	0	108	E186 F189 T194 V215 L216 Y217	E186-V197 HydrophobicContact CB-CB 4.36Å; E186-V197 HydrophobicContact CB-CG1 4.1Å; E186-V197 WeakPolarHBondContact O-CG1 3.22Å; F189-V197 HydrophobicContact CB-CG1 4.02Å; T194-V197 HydrophobicContact CG2-CG2 3.56Å; V197-V215 HydrophobicContact CG1-CG1 3.6Å; V197-L216 WeakPolarHBondContact CA-O 3.48Å; V197-Y217 HydrophobicContact CG2-CD2 4.33Å
198	M	82.2	Confident	78.3	Confident	34 Å²	34	61 Å²	61	17%	0.167	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	146.2	176.5	124.5	-174.7	-56.4	0	0	111	S126 V215 L216	S126-M198 VanDerWaalsContact CB-SD 3.59Å; S126-M198 WeakPolarHBondContact OG-CE 2.97Å; M198-V215 CarbonylContact O-C 3.6Å; M198-V215 WeakPolarHBondContact O-CA 3.28Å; M198-L216 HydrophobicContact CB-CB 4.5Å; M198-L216 HydrophobicContact CG-CB 4Å; M198-L216 HydrophobicContact CG-CD1 3.94Å; M198-L216 HydrophobicContact CG-CG 4.37Å; M198-L216 PolarHBondContact N-O 2.91Å; M198-L216 PolarHBondContact O-N 3.43Å; M198-L216 HydrophobicContact SD-CB 4.37Å; M198-L216 HydrophobicContact SD-CD1 3.5Å; M198-L216 WeakPolarHBondContact SD-CD1 3.5Å; M198-L216 HydrophobicContact SD-CG 4.48Å
199	F	83.3	Confident	78.1	Confident	9 Å²	9	62.4 Å²	62.4	4%	0.039	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	135.7	164.2	-58.5	-26.6	0	0	0	111.1	I184 E186 F189 Q201 A203 G214 V215	I184-F199 HydrophobicContact CB-CZ 4.34Å; I184-F199 HydrophobicContact CD1-CE2 3.95Å; I184-F199 HydrophobicContact CD1-CZ 3.93Å; I184-F199 HydrophobicContact CG1-CE2 4.13Å; I184-F199 HydrophobicContact CG1-CZ 4.24Å; E186-F199 HydrophobicContact CB-CZ 4.48Å; E186-F199 VanDerWaalsContact CD-CD2 3.49Å; E186-F199 HydrophobicContact CG-CD1 3.97Å; E186-F199 HydrophobicContact CG-CD2 3.91Å; E186-F199 HydrophobicContact CG-CE1 4.04Å; E186-F199 HydrophobicContact CG-CE2 3.98Å; E186-F199 HydrophobicContact CG-CG 3.93Å; E186-F199 HydrophobicContact CG-CZ 4.05Å; E186-F199 VanDerWaalsContact OE1-CD2 3.23Å; E186-F199 WeakPolarHBondContact OE1-CD2 3.46Å; F189-F199 AromaticContact CD2-CE1 3.69Å; F189-F199 HydrophobicContact CD2-CE1 3.69Å; F189-F199 AromaticContact CD2-CZ 3.99Å; F189-F199 HydrophobicContact CD2-CZ 3.99Å; F189-F199 AromaticContact CE2-CE1 3.55Å; F189-F199 HydrophobicContact CE2-CE1 3.55Å; F189-F199 AromaticContact CE2-CZ 3.66Å; F189-F199 HydrophobicContact CE2-CZ 3.66Å; F199-Q201 WeakPolarHBondContact CB-O 3.5Å; F199-Q201 PolarHBondContact O-N 2.88Å; F199-A203 WeakPolarHBondContact CD2-O 3.05Å; F199-A203 WeakPolarHBondContact CE2-O 3.32Å; F199-G214 CarbonylContact C-O 3.51Å; F199-V215 HydrophobicContact CD1-CB 4.49Å; F199-V215 HydrophobicContact CD1-CG1 4.45Å; F199-V215 HydrophobicContact CD1-CG2 3.79Å; F199-V215 HydrophobicContact CE1-CG1 4.44Å; F199-V215 HydrophobicContact CE1-CG2 3.78Å
200	S	69.3	Low	77.8	Confident	33 Å²	33	64.1 Å²	64.1	23%	0.231	38%	0.381	C	S	.	.	S	Bend	trans	-63.3	-25.7	175.8	60.2	0	0	0	0	112.2	G214	S200-G214 VanDerWaalsContact CB-O 3.27Å; S200-G214 WeakPolarHBondContact CB-O 3.29Å; S200-G214 PolarHBondContact N-O 3.42Å; S200-G214 WeakPolarHBondContact OG-CA 3.04Å; S200-G214 PolarHBondContact OG-N 3.07Å; S200-G214 PolarHBondContact OG-O 3.13Å
201	Q	69.3	Low	77.3	Confident	130 Å²	130	59.8 Å²	59.8	61%	0.607	38%	0.378	S	S	*	.	S	Bend	trans	-133	137.3	172.1	-65.6	-179.1	-27.3	0	0	109.2	F199 A203	F199-Q201 WeakPolarHBondContact CB-O 3.5Å; F199-Q201 PolarHBondContact O-N 2.88Å; Q201-A203 PolarHBondContact O-N 3.08Å
202	P	67.5	Low	76.8	Confident	133 Å²	133	58.5 Å²	58.5	86%	0.864	37%	0.373	S	S	*	.			trans	-63.5	112.4	177.4	25	-31.7	0	0	0	109.6
203	A	67.9	Low	76.1	Confident	28 Å²	28	55.3 Å²	55.3	23%	0.231	36%	0.36	C	S	.	.			trans	-142.6	117.7	-179.2	0	0	0	0	0	109.7	F199 Q201 I212	F199-A203 WeakPolarHBondContact CD2-O 3.05Å; F199-A203 WeakPolarHBondContact CE2-O 3.32Å; Q201-A203 PolarHBondContact O-N 3.08Å; A203-I212 HydrophobicContact CB-CD1 3.41Å; A203-I212 VanDerWaalsContact CB-CD1 3.41Å; A203-I212 HydrophobicContact CB-CG1 4.33Å
204	G	77.1	Confident	76	Confident	54 Å²	54	53.1 Å²	53.1	56%	0.557	34%	0.338	S	S	*	.	S	Bend	trans	-90.4	-8.9	172.3	0	0	0	0	0	113.6	N183 I184	N183-G204 WeakPolarHBondContact CA-O 3.32Å; I184-G204 PolarHBondContact N-O 3.26Å; I184-G204 VanDerWaalsContact N-O 3.09Å
205	Q	82.2	Confident	75.6	Confident	106 Å²	106	52.7 Å²	52.7	50%	0.495	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	132.8	-175.6	-166.6	176.2	30.7	0	0	110.5	A181 L182	A181-Q205 HydrophobicContact CB-CG 3.93Å; A181-Q205 VanDerWaalsContact CB-NE2 3.28Å; L182-Q205 CarbonylContact O-C 3.47Å; L182-Q205 WeakPolarHBondContact O-CA 3.23Å
206	L	83.1	Confident	75.2	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.016	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	115.4	174.7	-170.9	61.4	0	0	0	109.1	L154 V174 N176 A181 L182 I184 S210 I212	L154-L206 HydrophobicContact CD2-CD2 3.85Å; V174-L206 HydrophobicContact CG1-CD2 4.42Å; N176-L206 HydrophobicContact CB-CB 4.38Å; N176-L206 HydrophobicContact CB-CD2 3.64Å; N176-L206 HydrophobicContact CB-CG 3.66Å; N176-L206 PolarHBondContact ND2-O 3.33Å; A181-L206 WeakPolarHBondContact CA-O 3.34Å; L182-L206 PolarHBondContact N-O 3.29Å; L182-L206 PolarHBondContact O-N 2.82Å; I184-L206 HydrophobicContact CD1-CB 4.17Å; I184-L206 HydrophobicContact CG2-CB 4.41Å; L206-S210 VanDerWaalsContact CD1-OG 3.27Å; L206-S210 WeakPolarHBondContact CD1-OG 3.47Å; L206-I212 HydrophobicContact CB-CD1 4.41Å; L206-I212 HydrophobicContact CD1-CB 4.18Å; L206-I212 HydrophobicContact CD1-CD1 3.56Å; L206-I212 HydrophobicContact CD1-CG1 3.5Å; L206-I212 HydrophobicContact CG-CD1 4.44Å
207	L	84.3	Confident	74.9	Confident	111 Å²	111	47 Å²	47	58%	0.581	31%	0.307	S	S	*	.			trans	-64.9	156.3	-179.5	-64.3	174	0	0	0	111.3	N176 A181 A209 S210	N176-L207 WeakPolarHBondContact CB-O 3.42Å; N176-L207 PolarHBondContact ND2-O 2.76Å; A181-L207 HydrophobicContact CB-CD2 4.2Å; L207-A209 PolarHBondContact O-N 2.94Å; L207-S210 VanDerWaalsContact C-OG 3.32Å; L207-S210 WeakPolarHBondContact CA-OG 3.07Å; L207-S210 PolarHBondContact N-OG 3.36Å; L207-S210 VanDerWaalsContact N-OG 3.07Å; L207-S210 WeakPolarHBondContact O-CB 3.38Å; L207-S210 PolarHBondContact O-N 2.93Å; L207-S210 VanDerWaalsContact O-N 3.14Å; L207-S210 PolarHBondContact O-OG 2.99Å
208	A	83.7	Confident	74.5	Confident	41 Å²	41	45.8 Å²	45.8	34%	0.339	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	134.5	176.4	0	0	0	0	0	111.1	T178 L179 S210	T178-A208 WeakPolarHBondContact O-CB 3.5Å; L179-A208 VanDerWaalsContact C-CB 3.47Å; A208-S210 PolarHBondContact O-N 3.06Å; A208-S210 VanDerWaalsContact O-N 3.12Å
209	A	79.4	Confident	74	Confident	81 Å²	81	45 Å²	45	67%	0.669	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	22.5	-178.2	0	0	0	0	0	115.1	N176 L207	N176-A209 VanDerWaalsContact O-CA 3.22Å; N176-A209 WeakPolarHBondContact O-CA 3.43Å; N176-A209 PolarHBondContact O-N 3.41Å; L207-A209 PolarHBondContact O-N 2.94Å
210	S	77.4	Confident	73.2	Confident	37 Å²	37	46.6 Å²	46.6	26%	0.259	31%	0.307	S	S	.	.			trans	-105.8	154.1	174.2	74	0	0	0	0	111.2	N176 L206 L207 A208	N176-S210 PolarHBondContact N-O 3.43Å; L206-S210 VanDerWaalsContact CD1-OG 3.27Å; L206-S210 WeakPolarHBondContact CD1-OG 3.47Å; L207-S210 VanDerWaalsContact C-OG 3.32Å; L207-S210 WeakPolarHBondContact CA-OG 3.07Å; L207-S210 PolarHBondContact N-OG 3.36Å; L207-S210 VanDerWaalsContact N-OG 3.07Å; L207-S210 WeakPolarHBondContact O-CB 3.38Å; L207-S210 PolarHBondContact O-N 2.93Å; L207-S210 VanDerWaalsContact O-N 3.14Å; L207-S210 PolarHBondContact O-OG 2.99Å; A208-S210 PolarHBondContact O-N 3.06Å; A208-S210 VanDerWaalsContact O-N 3.12Å
211	A	72.4	Confident	72.7	Confident	64 Å²	64	45.4 Å²	45.4	53%	0.529	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	139.9	176	0	0	0	0	0	110.9	V174 E175	V174-A211 CarbonylContact O-C 3.6Å; V174-A211 WeakPolarHBondContact O-CA 3.36Å; E175-A211 HydrophobicContact CB-CB 4.14Å; E175-A211 HydrophobicContact CG-CB 4.22Å
212	I	68.8	Low	72	Confident	13 Å²	13	43.1 Å²	43.1	7%	0.067	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	120.2	161.5	-76.9	159.9	0	0	0	107.6	V174 I184 A203 L206 G214	V174-I212 PolarHBondContact N-O 2.95Å; V174-I212 PolarHBondContact O-N 2.86Å; I184-I212 HydrophobicContact CD1-CD1 3.39Å; A203-I212 HydrophobicContact CB-CD1 3.41Å; A203-I212 VanDerWaalsContact CB-CD1 3.41Å; A203-I212 HydrophobicContact CB-CG1 4.33Å; L206-I212 HydrophobicContact CB-CD1 4.41Å; L206-I212 HydrophobicContact CD1-CB 4.18Å; L206-I212 HydrophobicContact CD1-CD1 3.56Å; L206-I212 HydrophobicContact CD1-CG1 3.5Å; L206-I212 HydrophobicContact CG-CD1 4.44Å; I212-G214 PolarHBondContact O-N 3.28Å
213	G	58.9	Low	70.4	Confident	46 Å²	46	44.4 Å²	44.4	47%	0.474	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	36	-174.5	0	0	0	0	0	115.2
214	G	65.9	Low	68.4	Low	0 Å²	0	48.7 Å²	48.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.4	74.5	171.2	0	0	0	0	0	116.8	F172 F199 S200 I212 L216	F172-G214 VanDerWaalsContact O-CA 3.32Å; F172-G214 WeakPolarHBondContact O-CA 3.01Å; F172-G214 PolarHBondContact O-N 3.22Å; F199-G214 CarbonylContact C-O 3.51Å; S200-G214 VanDerWaalsContact CB-O 3.27Å; S200-G214 WeakPolarHBondContact CB-O 3.29Å; S200-G214 PolarHBondContact N-O 3.42Å; S200-G214 WeakPolarHBondContact OG-CA 3.04Å; S200-G214 PolarHBondContact OG-N 3.07Å; S200-G214 PolarHBondContact OG-O 3.13Å; I212-G214 PolarHBondContact O-N 3.28Å; G214-L216 PolarHBondContact O-N 2.9Å
215	V	68	Low	66.1	Low	1 Å²	1	49.1 Å²	49.1	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	109.1	152	-175.6	0	0	0	0	106.7	L148 F172 V174 F189 V197 M198 F199	L148-V215 HydrophobicContact CD2-CG1 4.4Å; F172-V215 HydrophobicContact CB-CB 4.47Å; F172-V215 PolarHBondContact N-O 3.23Å; F172-V215 PolarHBondContact O-N 2.86Å; V174-V215 HydrophobicContact CB-CG2 4.32Å; V174-V215 HydrophobicContact CG2-CB 4.22Å; V174-V215 HydrophobicContact CG2-CG2 3.52Å; F189-V215 HydrophobicContact CB-CG1 4.22Å; F189-V215 HydrophobicContact CD1-CG1 4.48Å; F189-V215 HydrophobicContact CD1-CG2 4.44Å; F189-V215 HydrophobicContact CD2-CG2 4.49Å; F189-V215 HydrophobicContact CE1-CG2 4.26Å; F189-V215 HydrophobicContact CE2-CG2 4.34Å; F189-V215 HydrophobicContact CG-CG1 4.17Å; F189-V215 HydrophobicContact CZ-CG2 4.21Å; V197-V215 HydrophobicContact CG1-CG1 3.6Å; M198-V215 CarbonylContact O-C 3.6Å; M198-V215 WeakPolarHBondContact O-CA 3.28Å; F199-V215 HydrophobicContact CD1-CB 4.49Å; F199-V215 HydrophobicContact CD1-CG1 4.45Å; F199-V215 HydrophobicContact CD1-CG2 3.79Å; F199-V215 HydrophobicContact CE1-CG1 4.44Å; F199-V215 HydrophobicContact CE1-CG2 3.78Å
216	L	72.8	Confident	63.4	Low	8 Å²	8	52.5 Å²	52.5	4%	0.042	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	119	171.7	-66.9	169.7	0	0	0	108	V129 W162 M169 V170 R171 V197 M198 G214	V129-L216 HydrophobicContact CG1-CD1 4.17Å; V129-L216 HydrophobicContact CG1-CD2 3.93Å; W162-L216 HydrophobicContact CH2-CD2 4.3Å; W162-L216 HydrophobicContact CZ3-CD2 3.82Å; M169-L216 HydrophobicContact CG-CD2 4.35Å; M169-L216 HydrophobicContact SD-CB 4.23Å; M169-L216 HydrophobicContact SD-CD1 4.34Å; M169-L216 HydrophobicContact SD-CD2 3.87Å; M169-L216 HydrophobicContact SD-CG 4.37Å; V170-L216 WeakPolarHBondContact O-CA 3.35Å; R171-L216 HydrophobicContact CB-CD2 3.76Å; R171-L216 HydrophobicContact CG-CD2 3.95Å; V197-L216 WeakPolarHBondContact CA-O 3.48Å; M198-L216 HydrophobicContact CB-CB 4.5Å; M198-L216 HydrophobicContact CG-CB 4Å; M198-L216 HydrophobicContact CG-CD1 3.94Å; M198-L216 HydrophobicContact CG-CG 4.37Å; M198-L216 PolarHBondContact N-O 2.91Å; M198-L216 PolarHBondContact O-N 3.43Å; M198-L216 HydrophobicContact SD-CB 4.37Å; M198-L216 HydrophobicContact SD-CD1 3.5Å; M198-L216 WeakPolarHBondContact SD-CD1 3.5Å; M198-L216 HydrophobicContact SD-CG 4.48Å; G214-L216 PolarHBondContact O-N 2.9Å
217	Y	74.6	Confident	60.7	Low	25 Å²	25	55.4 Å²	55.4	10%	0.098	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	114.5	-176.3	-177.1	-89.8	0	0	0	108.3	L148 M169 V170 F172 T194 V197	L148-Y217 HydrophobicContact CD1-CD2 3.64Å; L148-Y217 HydrophobicContact CD1-CE2 3.74Å; L148-Y217 HydrophobicContact CD1-CG 4.43Å; M169-Y217 CarbonylContact C-O 3.54Å; M169-Y217 VanDerWaalsContact CA-O 3.32Å; M169-Y217 WeakPolarHBondContact CA-O 3.18Å; V170-Y217 PolarHBondContact N-O 2.97Å; V170-Y217 PolarHBondContact O-N 2.99Å; F172-Y217 HydrophobicContact CE2-CD1 4.5Å; F172-Y217 HydrophobicContact CE2-CG 4.21Å; T194-Y217 HydrophobicContact CG2-CD2 3.71Å; T194-Y217 HydrophobicContact CG2-CE1 4.41Å; T194-Y217 HydrophobicContact CG2-CE2 3.36Å; T194-Y217 HydrophobicContact CG2-CG 4.37Å; T194-Y217 WeakPolarHBondContact OG1-CE2 3.12Å; T194-Y217 PolarHBondContact OG1-OH 2.91Å; V197-Y217 HydrophobicContact CG2-CD2 4.33Å
218	L	77	Confident	57.9	Low	4 Å²	4	59.4 Å²	59.4	2%	0.021	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.7	175.9	-154.1	100.9	0	0	0	109.8	L122 I125 W138 L167 K168 M169 T194 R195 A196	L122-L218 HydrophobicContact CD2-CD2 3.09Å; I125-L218 HydrophobicContact CG2-CD1 4.29Å; W138-L218 HydrophobicContact CH2-CD1 4.21Å; L167-L218 HydrophobicContact CB-CD2 4.4Å; L167-L218 HydrophobicContact CD1-CD2 4.12Å; L167-L218 HydrophobicContact CD2-CD2 3.95Å; L167-L218 HydrophobicContact CG-CD2 4.38Å; K168-L218 CarbonylContact O-C 3.6Å; K168-L218 WeakPolarHBondContact O-CA 3.46Å; M169-L218 HydrophobicContact CB-CD1 3.71Å; M169-L218 HydrophobicContact CE-CD1 3.17Å; M169-L218 HydrophobicContact CG-CD1 3.96Å; M169-L218 HydrophobicContact SD-CD1 4.4Å; T194-L218 WeakPolarHBondContact CG2-O 3.32Å; R195-L218 HydrophobicContact CB-CD2 4.14Å; R195-L218 PolarHBondContact N-O 3.12Å; A196-L218 HydrophobicContact CB-CB 4.07Å; A196-L218 PolarHBondContact N-O 3.15Å; A196-L218 PolarHBondContact O-N 3.13Å
219	S	70.9	Confident	55.2	Low	17 Å²	17	62 Å²	62	12%	0.119	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	167.3	174	64.3	0	0	0	0	110.3	L167 K168	L167-S219 WeakPolarHBondContact CA-O 3.04Å; K168-S219 PolarHBondContact N-O 2.82Å; K168-S219 PolarHBondContact O-N 3.41Å
220	D	65.8	Low	52.9	Low	44 Å²	44	64.1 Å²	64.1	24%	0.235	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	154.5	160.6	-61.1	-24.3	0	0	0	108.9	H166 R195 D222	H166-D220 WeakPolarHBondContact O-CA 3.32Å; R195-D220 IonicContact CZ-OD1 3.05Å; R195-D220 IonicContact CZ-OD2 2.64Å; R195-D220 VanDerWaalsContact NE-CG 3.34Å; R195-D220 IonicContact NE-OD1 2.7Å; R195-D220 PolarHBondContact NE-OD1 3.48Å; R195-D220 IonicContact NE-OD2 2.69Å; R195-D220 PolarHBondContact NE-OD2 3.14Å; R195-D220 VanDerWaalsContact NE-OD2 3.14Å; R195-D220 IonicContact NH2-OD1 3.79Å; R195-D220 IonicContact NH2-OD2 3.51Å; R195-D220 PolarHBondContact NH2-OD2 3.15Å; D220-D222 VanDerWaalsContact C-N 3.28Å; D220-D222 PolarHBondContact O-N 3.21Å
221	V	60.5	Low	50.6	Low	8 Å²	8	66.9 Å²	66.9	5%	0.048	44%	0.437	C	S	.	.	S	Bend	trans	-69.3	93.5	169.2	-167.4	0	0	0	0	106.7	D101 R103 H166 K168 M223	D101-V221 HydrophobicContact CB-CG1 4.02Å; R103-V221 WeakPolarHBondContact CD-O 3.36Å; R103-V221 HydrophobicContact CG-CB 3.62Å; R103-V221 HydrophobicContact CG-CG1 3.5Å; R103-V221 HydrophobicContact CG-CG2 4.45Å; R103-V221 PolarHBondContact NE-O 3.45Å; R103-V221 PolarHBondContact NH1-O 3.06Å; R103-V221 PolarHBondContact NH2-O 3.14Å; H166-V221 PolarHBondContact O-N 3.1Å; K168-V221 HydrophobicContact CB-CG2 4.08Å; V221-M223 PolarHBondContact O-N 3.35Å
222	D	54.3	Low	48.6	Very low	82 Å²	82	72.6 Å²	72.6	44%	0.439	45%	0.453	S	S	.	.			trans	30.5	69.5	170.6	-98.6	-34.2	0	0	0	120.6	R103 D220 S224	R103-D222 VanDerWaalsContact CZ-C 3.49Å; R103-D222 PolarHBondContact NH1-O 3.06Å; R103-D222 VanDerWaalsContact NH2-C 3.27Å; R103-D222 PolarHBondContact NH2-O 2.68Å; D220-D222 VanDerWaalsContact C-N 3.28Å; D220-D222 PolarHBondContact O-N 3.21Å; D222-S224 PolarHBondContact O-N 3.31Å
223	M	32.7	Very low	46.7	Very low	160 Å²	160	81.2 Å²	81.2	79%	0.788	49%	0.493	S	S	*	.	S	Bend	trans	-71.4	105.8	148.8	-78.4	-82.6	-133	0	0	108.1	V221	V221-M223 PolarHBondContact O-N 3.35Å
224	S	27.2	Very low	45.5	Very low	118 Å²	118	87.5 Å²	87.5	83%	0.825	51%	0.51	S	S	*	.			trans	70.1	95	170.2	67.1	0	0	0	0	118.8	D222	D222-S224 PolarHBondContact O-N 3.31Å
225	G	28.3	Very low	44.1	Very low	62 Å²	62	93 Å²	93	64%	0.639	55%	0.546	S	S	*	.			trans	-119.9	109.1	157.6	0	0	0	0	0	109.9	G227	G225-G227 PolarHBondContact O-N 2.91Å; G225-G227 VanDerWaalsContact O-N 3.15Å
226	N	26.3	Very low	42.8	Very low	178 Å²	178	99.4 Å²	99.4	95%	0.952	58%	0.584	S	S	*	*			trans	-38.8	109.8	177.3	-75.8	-29.7	0	0	0	114
227	G	26.4	Very low	41.2	Very low	64 Å²	64	104 Å²	104	66%	0.66	62%	0.615	S	S	*	*			trans	-114.3	121.3	155.8	0	0	0	0	0	107.8	G225 A229	G225-G227 PolarHBondContact O-N 2.91Å; G225-G227 VanDerWaalsContact O-N 3.15Å; G227-A229 VanDerWaalsContact C-N 3.33Å; G227-A229 PolarHBondContact O-N 2.88Å
228	E	25.7	Very low	39.3	Very low	194 Å²	194	109 Å²	109	91%	0.907	64%	0.643	S	S	*	*			trans	-48	98.1	164.9	-78.8	158.8	102.5	0	0	109.4	V230	E228-V230 VanDerWaalsContact C-N 3.29Å; E228-V230 PolarHBondContact O-N 2.87Å
229	A	26.3	Very low	37.6	Very low	96 Å²	96	117.3 Å²	117.3	79%	0.793	68%	0.684	S	S	*	*			trans	-72.2	95.8	161.1	0	0	0	0	0	105.8	G227 A231	G227-A229 VanDerWaalsContact C-N 3.33Å; G227-A229 PolarHBondContact O-N 2.88Å; A229-A231 PolarHBondContact O-N 3.13Å
230	V	31.8	Very low	36	Very low	126 Å²	126	122.2 Å²	122.2	76%	0.764	71%	0.714	S	S	*	*			trans	-51.6	113.4	160.3	179.1	0	0	0	0	105.9	E228 E232	E228-V230 VanDerWaalsContact C-N 3.29Å; E228-V230 PolarHBondContact O-N 2.87Å; V230-E232 VanDerWaalsContact C-N 3.33Å; V230-E232 PolarHBondContact O-N 2.95Å
231	A	27.7	Very low	34.6	Very low	94 Å²	94	123 Å²	123	78%	0.777	73%	0.732	S	S	*	*			trans	-64.7	92.2	177.3	0	0	0	0	0	109.3	A229	A229-A231 PolarHBondContact O-N 3.13Å
232	E	31.2	Very low	33.4	Very low	184 Å²	184	129.2 Å²	129.2	86%	0.86	77%	0.77	S	S	*	*			trans	-83.1	110.1	157.1	-97.9	177	136.6	0	0	107.9	V230 E234	V230-E232 VanDerWaalsContact C-N 3.33Å; V230-E232 PolarHBondContact O-N 2.95Å; E232-E234 PolarHBondContact O-N 2.86Å; E232-E234 VanDerWaalsContact O-N 3.09Å
233	Q	28.7	Very low	32.8	Very low	195 Å²	195	131.4 Å²	131.4	91%	0.911	79%	0.786	S	S	*	*			trans	-61.8	104.5	169.7	-76.6	174.1	-28.6	0	0	109.1
234	E	34.5	Very low	33.3	Very low	178 Å²	178	129.5 Å²	129.5	83%	0.832	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-77	131	165.3	-156.5	171.5	-167.7	0	0	108.8	E232	E232-E234 PolarHBondContact O-N 2.86Å; E232-E234 VanDerWaalsContact O-N 3.09Å
235	P	34.8	Very low	34.3	Very low	114 Å²	114	130.2 Å²	130.2	74%	0.74	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-68	138.3	-175.2	26.5	-32.5	0	0	0	111.3
236	V	40.7	Very low	35.4	Very low	136 Å²	136	132.5 Å²	132.5	82%	0.824	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-52.9	127.2	-179.6	-177.2	0	0	0	0	110.6	D238	V236-D238 PolarHBondContact O-N 3.33Å
237	P	39.7	Very low	36.5	Very low	105 Å²	105	130.9 Å²	130.9	68%	0.682	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-63.1	127.2	174.3	-18.3	30	0	0	0	110.7	M239	P237-M239 PolarHBondContact O-N 3.3Å
238	D	35.5	Very low	37.9	Very low	130 Å²	130	133.8 Å²	133.8	70%	0.695	77%	0.765	S	S	*	*			trans	-67	111.3	175.7	-172.4	-8.8	0	0	0	110.2	V236 T240	V236-D238 PolarHBondContact O-N 3.33Å; D238-T240 VanDerWaalsContact CG-OG1 3.22Å; D238-T240 PolarHBondContact O-N 2.9Å; D238-T240 WeakPolarHBondContact OD1-CB 3.48Å; D238-T240 WeakPolarHBondContact OD1-CG2 3.5Å; D238-T240 PolarHBondContact OD1-N 3.42Å; D238-T240 VanDerWaalsContact OD1-N 3.1Å; D238-T240 PolarHBondContact OD1-OG1 3.39Å; D238-T240 PolarHBondContact OD2-OG1 3.31Å
239	M	41.5	Very low	39.2	Very low	178 Å²	178	129.4 Å²	129.4	88%	0.877	75%	0.748	S	S	*	*			trans	-83.9	20.6	-178.8	-68.4	-75.5	-74	0	0	112.9	P237 G241	P237-M239 PolarHBondContact O-N 3.3Å; M239-G241 PolarHBondContact O-N 3.46Å
240	T	36.3	Very low	40.5	Very low	120 Å²	120	132.6 Å²	132.6	74%	0.736	74%	0.744	S	S	*	*			trans	-92.7	69.6	176.3	61.4	0	0	0	0	111.4	D238	D238-T240 VanDerWaalsContact CG-OG1 3.22Å; D238-T240 PolarHBondContact O-N 2.9Å; D238-T240 WeakPolarHBondContact OD1-CB 3.48Å; D238-T240 WeakPolarHBondContact OD1-CG2 3.5Å; D238-T240 PolarHBondContact OD1-N 3.42Å; D238-T240 VanDerWaalsContact OD1-N 3.1Å; D238-T240 PolarHBondContact OD1-OG1 3.39Å; D238-T240 PolarHBondContact OD2-OG1 3.31Å
241	G	36.1	Very low	41.6	Very low	60 Å²	60	130.2 Å²	130.2	62%	0.619	73%	0.73	S	S	*	*			trans	-140.2	117.6	175.1	0	0	0	0	0	111.2	M239 V243	M239-G241 PolarHBondContact O-N 3.46Å; G241-V243 PolarHBondContact O-N 3.35Å
242	V	36.8	Very low	42.9	Very low	140 Å²	140	134.3 Å²	134.3	85%	0.848	73%	0.725	S	S	*	*			trans	-57.7	126.9	-172.7	-145.6	0	0	0	0	111.3	D244	V242-D244 PolarHBondContact O-N 2.92Å
243	V	41.6	Very low	44.1	Very low	127 Å²	127	131.9 Å²	131.9	77%	0.77	71%	0.714	S	S	*	*			trans	-81.1	108.4	176.3	-178.1	0	0	0	0	108.7	G241	G241-V243 PolarHBondContact O-N 3.35Å
244	D	42	Very low	45.4	Very low	121 Å²	121	128.8 Å²	128.8	65%	0.647	70%	0.699	S	S	*	*			trans	-77.2	145.5	173.4	-78.4	-35.6	0	0	0	111.8	V242 T246 F247	V242-D244 PolarHBondContact O-N 2.92Å; D244-T246 PolarHBondContact O-N 3.19Å; D244-F247 PolarHBondContact O-N 3.02Å
245	T	49.3	Very low	46.5	Very low	133 Å²	133	122.8 Å²	122.8	82%	0.816	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	10.4	-171	54.1	0	0	0	0	115.9
246	T	50.6	Low	47.8	Very low	110 Å²	110	121.3 Å²	121.3	68%	0.675	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-3.1	178.7	50.5	0	0	0	0	113.9	D244	D244-T246 PolarHBondContact O-N 3.19Å
247	F	48.8	Very low	49.2	Very low	144 Å²	144	118.7 Å²	118.7	63%	0.632	65%	0.654	S	S	*	*	H	α-helix	trans	-76.6	-29.6	-178.4	-155.7	-99.4	0	0	0	113	D244 V251	D244-F247 PolarHBondContact O-N 3.02Å; F247-V251 HydrophobicContact CD1-CG2 3.92Å; F247-V251 HydrophobicContact CE1-CG2 3.73Å; F247-V251 HydrophobicContact CZ-CG2 4.35Å; F247-V251 WeakPolarHBondContact O-CG2 3.37Å; F247-V251 PolarHBondContact O-N 2.8Å
248	D	55.6	Low	50.5	Low	125 Å²	125	119.3 Å²	119.3	67%	0.668	65%	0.647	S	S	*	*	H	α-helix	trans	-70.9	-33.7	-177	-84	-34.4	0	0	0	114.2	R252	D248-R252 PolarHBondContact O-N 2.77Å
249	D	54.2	Low	52.1	Low	102 Å²	102	120.3 Å²	120.3	55%	0.545	65%	0.65	S	S	.	*	H	α-helix	trans	-77.2	-33.2	-177.3	-81.6	-27.4	0	0	0	112.9	Q253	D249-Q253 WeakPolarHBondContact O-CG 3.37Å; D249-Q253 PolarHBondContact O-N 3.25Å
250	K	53.5	Low	53.6	Low	162 Å²	162	118.8 Å²	118.8	70%	0.704	64%	0.64	S	S	*	*	H	α-helix	trans	-72.8	-37.6	176.3	-96.5	-175.9	177.8	179.8	0	112.5	Q253 H254	K250-Q253 PolarHBondContact O-N 2.98Å; K250-H254 PolarHBondContact O-N 2.85Å; K250-H254 VanDerWaalsContact O-N 3.12Å
251	V	54.3	Low	55.5	Low	77 Å²	77	116.7 Å²	116.7	47%	0.467	63%	0.627	S	S	.	*	H	α-helix	trans	-69.8	-37.1	178.3	177.1	0	0	0	0	111.1	F247 H254 A255	F247-V251 HydrophobicContact CD1-CG2 3.92Å; F247-V251 HydrophobicContact CE1-CG2 3.73Å; F247-V251 HydrophobicContact CZ-CG2 4.35Å; F247-V251 WeakPolarHBondContact O-CG2 3.37Å; F247-V251 PolarHBondContact O-N 2.8Å; V251-H254 PolarHBondContact O-N 3.14Å; V251-A255 WeakPolarHBondContact O-CB 3.34Å; V251-A255 PolarHBondContact O-N 3.5Å; V251-A255 VanDerWaalsContact O-N 3.1Å
252	R	56.2	Low	57.2	Low	179 Å²	179	117.6 Å²	117.6	68%	0.675	62%	0.621	S	S	*	*	H	α-helix	trans	-64.8	-41.9	173.1	-93.6	175.4	64.6	-160.6	-0.6	113.4	D248 H254 T256	D248-R252 PolarHBondContact O-N 2.77Å; R252-H254 VanDerWaalsContact C-N 3.34Å; R252-T256 PolarHBondContact O-N 3.3Å; R252-T256 PolarHBondContact O-OG1 2.85Å
253	Q	55.9	Low	59.1	Low	133 Å²	133	113.4 Å²	113.4	62%	0.621	60%	0.601	S	S	*	*	H	α-helix	trans	-67.8	-33.2	178.5	-75.1	-179.6	-1.5	0	0	112.5	D249 K250 T256 T257	D249-Q253 WeakPolarHBondContact O-CG 3.37Å; D249-Q253 PolarHBondContact O-N 3.25Å; K250-Q253 PolarHBondContact O-N 2.98Å; Q253-T256 PolarHBondContact O-OG1 3.09Å; Q253-T257 PolarHBondContact O-N 2.85Å; Q253-T257 PolarHBondContact O-OG1 2.86Å
254	H	56.6	Low	60.8	Low	130 Å²	130	110.2 Å²	110.2	60%	0.602	59%	0.588	S	S	*	*	H	α-helix	trans	-71.3	-42.9	176.3	-131.8	-89.5	0	0	0	112.2	K250 V251 R252 T256 T257 E258	K250-H254 PolarHBondContact O-N 2.85Å; K250-H254 VanDerWaalsContact O-N 3.12Å; V251-H254 PolarHBondContact O-N 3.14Å; R252-H254 VanDerWaalsContact C-N 3.34Å; H254-T256 PolarHBondContact O-N 2.87Å; H254-T257 PolarHBondContact O-N 3.49Å; H254-E258 PolarHBondContact O-N 3.02Å
255	A	55.9	Low	62.5	Low	53 Å²	53	110.1 Å²	110.1	44%	0.438	58%	0.583	S	S	.	*	H	α-helix	trans	-64.2	-36.3	-179.3	0	0	0	0	0	113.6	V251 M259	V251-A255 WeakPolarHBondContact O-CB 3.34Å; V251-A255 PolarHBondContact O-N 3.5Å; V251-A255 VanDerWaalsContact O-N 3.1Å; A255-M259 PolarHBondContact O-N 3.26Å; A255-M259 VanDerWaalsContact O-N 3.17Å
256	T	62.8	Low	63.8	Low	83 Å²	83	108.4 Å²	108.4	51%	0.509	57%	0.567	S	S	.	*	H	α-helix	trans	-73.9	-33.1	176.8	47.4	0	0	0	0	112.9	R252 Q253 H254 Q260	R252-T256 PolarHBondContact O-N 3.3Å; R252-T256 PolarHBondContact O-OG1 2.85Å; Q253-T256 PolarHBondContact O-OG1 3.09Å; H254-T256 PolarHBondContact O-N 2.87Å; T256-Q260 WeakPolarHBondContact O-CG 3.25Å; T256-Q260 PolarHBondContact O-N 2.62Å
257	T	70.3	Confident	65.1	Low	81 Å²	81	109.7 Å²	109.7	50%	0.497	57%	0.566	S	S	.	*	H	α-helix	trans	-73.3	-42	179.4	-50.5	0	0	0	0	110.3	Q253 H254 Q260 V261	Q253-T257 PolarHBondContact O-N 2.85Å; Q253-T257 PolarHBondContact O-OG1 2.86Å; H254-T257 PolarHBondContact O-N 3.49Å; T257-Q260 PolarHBondContact O-N 3.4Å; T257-V261 VanDerWaalsContact O-CG2 3.29Å; T257-V261 WeakPolarHBondContact O-CG2 3.33Å; T257-V261 PolarHBondContact O-N 3.23Å
258	E	66.7	Low	66.8	Low	118 Å²	118	110.1 Å²	110.1	55%	0.551	57%	0.567	S	S	*	*	H	α-helix	trans	-61.7	-45.1	173.5	-82.3	-176.2	154.9	0	0	111.9	H254 Q260 V261 T262	H254-E258 PolarHBondContact O-N 3.02Å; E258-Q260 VanDerWaalsContact C-N 3.3Å; E258-Q260 PolarHBondContact O-N 3.14Å; E258-V261 PolarHBondContact O-N 3.04Å; E258-T262 WeakPolarHBondContact O-CB 3.22Å; E258-T262 PolarHBondContact O-N 2.82Å; E258-T262 PolarHBondContact O-OG1 3.15Å
259	M	69.6	Low	67.8	Low	151 Å²	151	109.9 Å²	109.9	74%	0.744	56%	0.562	S	S	*	*	H	α-helix	trans	-58.4	-39.5	176.3	-90.8	-169.5	-170.1	0	0	113.2	A255 A263	A255-M259 PolarHBondContact O-N 3.26Å; A255-M259 VanDerWaalsContact O-N 3.17Å; M259-A263 VanDerWaalsContact O-CB 3.31Å; M259-A263 WeakPolarHBondContact O-CB 3.27Å; M259-A263 PolarHBondContact O-N 3.22Å
260	Q	73.5	Confident	69	Low	146 Å²	146	112.6 Å²	112.6	68%	0.682	57%	0.566	S	S	*	*	H	α-helix	trans	-71.5	-36.5	178.6	-73.6	-177.2	-1.7	0	0	112.4	T256 T257 E258 A264	T256-Q260 WeakPolarHBondContact O-CG 3.25Å; T256-Q260 PolarHBondContact O-N 2.62Å; T257-Q260 PolarHBondContact O-N 3.4Å; E258-Q260 VanDerWaalsContact C-N 3.3Å; E258-Q260 PolarHBondContact O-N 3.14Å; Q260-A264 WeakPolarHBondContact O-CB 3.36Å; Q260-A264 PolarHBondContact O-N 2.95Å
261	V	76.1	Confident	70.5	Confident	76 Å²	76	111.5 Å²	111.5	46%	0.461	56%	0.563	S	S	.	*	H	α-helix	trans	-69	-42.5	175.9	174.5	0	0	0	0	110.9	T257 E258 A264 Q265	T257-V261 VanDerWaalsContact O-CG2 3.29Å; T257-V261 WeakPolarHBondContact O-CG2 3.33Å; T257-V261 PolarHBondContact O-N 3.23Å; E258-V261 PolarHBondContact O-N 3.04Å; V261-A264 PolarHBondContact O-N 3.42Å; V261-Q265 PolarHBondContact O-N 2.89Å
262	T	71.8	Confident	72	Confident	78 Å²	78	114.4 Å²	114.4	48%	0.479	57%	0.572	S	S	.	*	H	α-helix	trans	-64.9	-40.7	175.8	-48.8	0	0	0	0	111.6	E258 A264 Q265 M266	E258-T262 WeakPolarHBondContact O-CB 3.22Å; E258-T262 PolarHBondContact O-N 2.82Å; E258-T262 PolarHBondContact O-OG1 3.15Å; T262-A264 PolarHBondContact O-N 3.31Å; T262-Q265 PolarHBondContact O-N 2.75Å; T262-M266 HydrophobicContact CG2-CG 4.48Å; T262-M266 WeakPolarHBondContact O-CB 3.47Å; T262-M266 VanDerWaalsContact O-CG 3.25Å; T262-M266 WeakPolarHBondContact O-CG 3.42Å; T262-M266 PolarHBondContact O-N 2.85Å
263	A	75.3	Confident	73.2	Confident	53 Å²	53	110.2 Å²	110.2	44%	0.438	56%	0.562	S	S	.	*	H	α-helix	trans	-63.1	-41.5	175.3	0	0	0	0	0	112.1	M259 M266 Q267	M259-A263 VanDerWaalsContact O-CB 3.31Å; M259-A263 WeakPolarHBondContact O-CB 3.27Å; M259-A263 PolarHBondContact O-N 3.22Å; A263-M266 PolarHBondContact O-N 2.8Å; A263-Q267 PolarHBondContact O-N 3.5Å
264	A	78.7	Confident	74.5	Confident	59 Å²	59	113.4 Å²	113.4	49%	0.488	57%	0.568	S	S	.	*	H	α-helix	trans	-67.3	-36.9	176.8	0	0	0	0	0	112.8	Q260 V261 T262 K268	Q260-A264 WeakPolarHBondContact O-CB 3.36Å; Q260-A264 PolarHBondContact O-N 2.95Å; V261-A264 PolarHBondContact O-N 3.42Å; T262-A264 PolarHBondContact O-N 3.31Å; A264-K268 PolarHBondContact O-N 3.22Å
265	Q	77.8	Confident	75.9	Confident	120 Å²	120	116.9 Å²	116.9	56%	0.561	58%	0.576	S	S	*	*	H	α-helix	trans	-67.9	-42.5	174.1	-80.7	177.7	-37.2	0	0	112.2	V261 T262 Q267 K268 Q269	V261-Q265 PolarHBondContact O-N 2.89Å; T262-Q265 PolarHBondContact O-N 2.75Å; Q265-Q267 VanDerWaalsContact C-N 3.32Å; Q265-Q267 PolarHBondContact O-N 3.05Å; Q265-K268 PolarHBondContact O-N 2.8Å; Q265-Q269 PolarHBondContact O-N 2.85Å
266	M	74.9	Confident	77	Confident	97 Å²	97	120.4 Å²	120.4	48%	0.478	58%	0.583	S	S	.	*	H	α-helix	trans	-60.4	-40.4	175.5	-75.4	-70.1	-71.2	0	0	112	T262 A263 Q269 Y270	T262-M266 HydrophobicContact CG2-CG 4.48Å; T262-M266 WeakPolarHBondContact O-CB 3.47Å; T262-M266 VanDerWaalsContact O-CG 3.25Å; T262-M266 WeakPolarHBondContact O-CG 3.42Å; T262-M266 PolarHBondContact O-N 2.85Å; A263-M266 PolarHBondContact O-N 2.8Å; M266-Q269 PolarHBondContact O-N 2.79Å; M266-Y270 PolarHBondContact O-N 3.18Å
267	Q	79.2	Confident	77.7	Confident	136 Å²	136	121.3 Å²	121.3	64%	0.636	58%	0.584	S	S	*	*	H	α-helix	trans	-63.2	-41.7	176.8	-133.6	80.1	12.4	0	0	112	A263 Q265 Y270 E271	A263-Q267 PolarHBondContact O-N 3.5Å; Q265-Q267 VanDerWaalsContact C-N 3.32Å; Q265-Q267 PolarHBondContact O-N 3.05Å; Q267-Y270 PolarHBondContact O-N 2.74Å; Q267-E271 PolarHBondContact O-N 3.47Å
268	K	84	Confident	78.2	Confident	154 Å²	154	121.5 Å²	121.5	67%	0.67	58%	0.583	S	S	*	*	H	α-helix	trans	-64.4	-45.9	176.3	-85.7	-173.5	174.3	-178.1	0	112.3	A264 Q265 Y270 E271 E272	A264-K268 PolarHBondContact O-N 3.22Å; Q265-K268 PolarHBondContact O-N 2.8Å; K268-Y270 VanDerWaalsContact C-N 3.27Å; K268-Y270 PolarHBondContact O-N 3.37Å; K268-E271 PolarHBondContact O-N 3.49Å; K268-E272 PolarHBondContact O-N 2.83Å; K268-E272 VanDerWaalsContact O-N 3.08Å
269	Q	76.8	Confident	78.9	Confident	119 Å²	119	119.9 Å²	119.9	56%	0.556	58%	0.581	S	S	*	*	H	α-helix	trans	-61	-37.1	176.2	-82.8	-172.8	-42.8	0	0	111.9	Q265 M266 E272 I273	Q265-Q269 PolarHBondContact O-N 2.85Å; M266-Q269 PolarHBondContact O-N 2.79Å; Q269-E272 PolarHBondContact O-N 2.83Å; Q269-I273 WeakPolarHBondContact O-CB 3.45Å; Q269-I273 VanDerWaalsContact O-CG1 3.3Å; Q269-I273 WeakPolarHBondContact O-CG1 3.06Å; Q269-I273 PolarHBondContact O-N 3.33Å
270	Y	79.6	Confident	79.2	Confident	159 Å²	159	116.8 Å²	116.8	62%	0.624	57%	0.566	S	S	*	*	H	α-helix	trans	-65.6	-37.8	176.8	-115.6	-83.1	0	0	0	113.4	M266 Q267 K268 R274	M266-Y270 PolarHBondContact O-N 3.18Å; Q267-Y270 PolarHBondContact O-N 2.74Å; K268-Y270 VanDerWaalsContact C-N 3.27Å; K268-Y270 PolarHBondContact O-N 3.37Å; Y270-R274 WeakPolarHBondContact O-CB 3.43Å; Y270-R274 PolarHBondContact O-N 3.02Å
271	E	85.3	Confident	79.3	Confident	140 Å²	140	113.7 Å²	113.7	65%	0.654	55%	0.554	S	S	*	*	H	α-helix	trans	-68.5	-36.3	175.1	-74.5	-174.1	164.5	0	0	112	Q267 K268 R274 R275	Q267-E271 PolarHBondContact O-N 3.47Å; K268-E271 PolarHBondContact O-N 3.49Å; E271-R274 PolarHBondContact O-N 3.36Å; E271-R275 PolarHBondContact O-N 3.32Å
272	E	84.4	Confident	79.4	Confident	137 Å²	137	116.1 Å²	116.1	64%	0.64	56%	0.559	S	S	*	*	H	α-helix	trans	-68.9	-46.7	177.4	-163.1	158.1	-148.8	0	0	111.6	K268 Q269 R274 R275 E276	K268-E272 PolarHBondContact O-N 2.83Å; K268-E272 VanDerWaalsContact O-N 3.08Å; Q269-E272 PolarHBondContact O-N 2.83Å; E272-R274 VanDerWaalsContact C-N 3.28Å; E272-R274 PolarHBondContact O-N 3.23Å; E272-R275 WeakPolarHBondContact O-CB 3.26Å; E272-R275 PolarHBondContact O-N 3.42Å; E272-E276 PolarHBondContact O-N 2.93Å
273	I	82.4	Confident	79.7	Confident	91 Å²	91	117.8 Å²	117.8	47%	0.467	56%	0.561	S	S	.	*	H	α-helix	trans	-58	-40.7	172.6	-70.3	167.1	0	0	0	110.9	Q269 R275 E276 L277	Q269-I273 WeakPolarHBondContact O-CB 3.45Å; Q269-I273 VanDerWaalsContact O-CG1 3.3Å; Q269-I273 WeakPolarHBondContact O-CG1 3.06Å; Q269-I273 PolarHBondContact O-N 3.33Å; I273-R275 PolarHBondContact O-N 3.09Å; I273-E276 PolarHBondContact O-N 3.26Å; I273-L277 HydrophobicContact CG2-CD1 4.42Å; I273-L277 WeakPolarHBondContact O-CB 3.47Å; I273-L277 PolarHBondContact O-N 2.92Å
274	R	82.1	Confident	79.8	Confident	200 Å²	200	122.6 Å²	122.6	76%	0.755	57%	0.568	S	S	*	*	H	α-helix	trans	-63.4	-40	175.8	-101.7	-171	174	-170	0.1	112.5	Y270 E271 E272 D278	Y270-R274 WeakPolarHBondContact O-CB 3.43Å; Y270-R274 PolarHBondContact O-N 3.02Å; E271-R274 PolarHBondContact O-N 3.36Å; E272-R274 VanDerWaalsContact C-N 3.28Å; E272-R274 PolarHBondContact O-N 3.23Å; R274-D278 PolarHBondContact O-N 3.3Å; R274-D278 VanDerWaalsContact O-N 3.15Å
275	R	85.9	Confident	79.9	Confident	203 Å²	203	121.2 Å²	121.2	77%	0.766	56%	0.56	S	S	*	*	H	α-helix	trans	-64.8	-42.2	175.5	-106.4	-179.1	166.7	157.1	-2.1	111.3	E271 E272 I273 D278 V279	E271-R275 PolarHBondContact O-N 3.32Å; E272-R275 WeakPolarHBondContact O-CB 3.26Å; E272-R275 PolarHBondContact O-N 3.42Å; I273-R275 PolarHBondContact O-N 3.09Å; R275-D278 PolarHBondContact O-N 3.36Å; R275-V279 WeakPolarHBondContact O-CG2 3.48Å; R275-V279 PolarHBondContact O-N 2.81Å
276	E	80.1	Confident	80.1	Confident	127 Å²	127	120 Å²	120	59%	0.593	56%	0.557	S	S	*	*	H	α-helix	trans	-66.4	-40.7	178.5	-154.3	172.3	-155.9	0	0	111.5	E272 I273 D278 V279 L280	E272-E276 PolarHBondContact O-N 2.93Å; I273-E276 PolarHBondContact O-N 3.26Å; E276-D278 VanDerWaalsContact C-N 3.33Å; E276-D278 PolarHBondContact O-N 3.26Å; E276-V279 PolarHBondContact O-N 3.38Å; E276-L280 PolarHBondContact O-N 3.15Å
277	L	77	Confident	80	Confident	102 Å²	102	119.4 Å²	119.4	53%	0.534	56%	0.556	S	S	.	*	H	α-helix	trans	-61.5	-37.9	174	-122.8	82.8	0	0	0	112.8	I273 L280 N281	I273-L277 HydrophobicContact CG2-CD1 4.42Å; I273-L277 WeakPolarHBondContact O-CB 3.47Å; I273-L277 PolarHBondContact O-N 2.92Å; L277-L280 PolarHBondContact O-N 3.09Å; L277-N281 WeakPolarHBondContact O-CB 3.49Å; L277-N281 PolarHBondContact O-N 3.27Å; L277-N281 PolarHBondContact O-ND2 3.42Å
278	D	80.5	Confident	79.9	Confident	86 Å²	86	119.5 Å²	119.5	46%	0.46	56%	0.556	S	S	.	*	H	α-helix	trans	-69.6	-35.7	178.9	-162.8	58.6	0	0	0	111.8	R274 R275 E276 K282	R274-D278 PolarHBondContact O-N 3.3Å; R274-D278 VanDerWaalsContact O-N 3.15Å; R275-D278 PolarHBondContact O-N 3.36Å; E276-D278 VanDerWaalsContact C-N 3.33Å; E276-D278 PolarHBondContact O-N 3.26Å; D278-K282 PolarHBondContact O-N 3.07Å; D278-K282 VanDerWaalsContact O-N 3.15Å; D278-K282 IonicContact OD2-NZ 2.78Å; D278-K282 PolarHBondContact OD2-NZ 3.23Å
279	V	81.5	Confident	80	Confident	84 Å²	84	120.4 Å²	120.4	51%	0.509	56%	0.555	S	S	.	*	H	α-helix	trans	-69.3	-43.8	173.7	176	0	0	0	0	110.8	R275 E276 N281 K282 Q283	R275-V279 WeakPolarHBondContact O-CG2 3.48Å; R275-V279 PolarHBondContact O-N 2.81Å; E276-V279 PolarHBondContact O-N 3.38Å; V279-N281 VanDerWaalsContact C-N 3.34Å; V279-N281 PolarHBondContact O-N 3.23Å; V279-K282 PolarHBondContact O-N 2.67Å; V279-Q283 PolarHBondContact O-N 3.39Å
280	L	75.4	Confident	80.2	Confident	85 Å²	85	123 Å²	123	45%	0.445	56%	0.56	S	S	.	*	H	α-helix	trans	-63.3	-39.1	177.6	-119.9	90.7	0	0	0	112.3	E276 L277 Q283 R284	E276-L280 PolarHBondContact O-N 3.15Å; L277-L280 PolarHBondContact O-N 3.09Å; L280-Q283 PolarHBondContact O-N 2.91Å; L280-R284 PolarHBondContact O-N 3.08Å
281	N	77.2	Confident	80	Confident	81 Å²	81	121.1 Å²	121.1	43%	0.433	56%	0.56	S	S	.	*	H	α-helix	trans	-67.7	-37	176.9	-79.4	-29.7	0	0	0	112	L277 V279 R284 G285	L277-N281 WeakPolarHBondContact O-CB 3.49Å; L277-N281 PolarHBondContact O-N 3.27Å; L277-N281 PolarHBondContact O-ND2 3.42Å; V279-N281 VanDerWaalsContact C-N 3.34Å; V279-N281 PolarHBondContact O-N 3.23Å; N281-R284 PolarHBondContact O-N 3.09Å; N281-G285 PolarHBondContact O-N 2.65Å
282	K	78.5	Confident	79.9	Confident	128 Å²	128	121.1 Å²	121.1	56%	0.557	56%	0.559	S	S	*	*	H	α-helix	trans	-64.2	-45.4	172	-81.1	169.5	179.4	140.7	0	111.8	D278 V279 R284 G285 D286	D278-K282 PolarHBondContact O-N 3.07Å; D278-K282 VanDerWaalsContact O-N 3.15Å; D278-K282 IonicContact OD2-NZ 2.78Å; D278-K282 PolarHBondContact OD2-NZ 3.23Å; V279-K282 PolarHBondContact O-N 2.67Å; K282-R284 PolarHBondContact O-N 2.88Å; K282-G285 PolarHBondContact O-N 2.98Å; K282-D286 PolarHBondContact O-N 3.4Å; K282-D286 VanDerWaalsContact O-N 3.15Å
283	Q	77	Confident	79.9	Confident	113 Å²	113	121 Å²	121	53%	0.528	56%	0.557	S	S	.	*	H	α-helix	trans	-60.4	-42.7	175.9	-83.8	-177.3	-27.8	0	0	112.4	V279 L280 G285 D286 D287	V279-Q283 PolarHBondContact O-N 3.39Å; L280-Q283 PolarHBondContact O-N 2.91Å; Q283-G285 VanDerWaalsContact C-N 3.29Å; Q283-G285 PolarHBondContact O-N 3.4Å; Q283-D286 PolarHBondContact O-N 3.4Å; Q283-D287 PolarHBondContact O-N 2.99Å
284	R	78.6	Confident	79.8	Confident	154 Å²	154	121.4 Å²	121.4	58%	0.581	56%	0.559	S	S	*	*	H	α-helix	trans	-59.7	-37.1	175.7	-99.2	-166.5	-85.6	171.5	-8.2	113.2	L280 N281 K282 Q288	L280-R284 PolarHBondContact O-N 3.08Å; N281-R284 PolarHBondContact O-N 3.09Å; K282-R284 PolarHBondContact O-N 2.88Å; R284-Q288 WeakPolarHBondContact O-CG 3.12Å; R284-Q288 PolarHBondContact O-N 2.71Å
285	G	80.6	Confident	79.8	Confident	30 Å²	30	113.8 Å²	113.8	31%	0.309	54%	0.544	S	S	.	.	H	α-helix	trans	-67.7	-39	176.5	0	0	0	0	0	113	N281 K282 Q283 R289	N281-G285 PolarHBondContact O-N 2.65Å; K282-G285 PolarHBondContact O-N 2.98Å; Q283-G285 VanDerWaalsContact C-N 3.29Å; Q283-G285 PolarHBondContact O-N 3.4Å; G285-R289 WeakPolarHBondContact O-CG 3.4Å; G285-R289 PolarHBondContact O-N 2.94Å
286	D	80.6	Confident	79.7	Confident	94 Å²	94	110.6 Å²	110.6	50%	0.503	54%	0.537	S	S	.	.	H	α-helix	trans	-71.8	-38.3	176.8	-72.3	-27.3	0	0	0	111.9	K282 Q283 R289 R290	K282-D286 PolarHBondContact O-N 3.4Å; K282-D286 VanDerWaalsContact O-N 3.15Å; Q283-D286 PolarHBondContact O-N 3.4Å; D286-R289 PolarHBondContact O-N 3.45Å; D286-R289 IonicContact OD1-NH1 3.82Å; D286-R290 WeakPolarHBondContact O-CB 3.34Å; D286-R290 PolarHBondContact O-N 2.88Å
287	D	74.4	Confident	79.7	Confident	85 Å²	85	108 Å²	108	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-66	-40.1	175.6	-76.7	-26.4	0	0	0	112.2	Q283 R289 R290 I291	Q283-D287 PolarHBondContact O-N 2.99Å; D287-R289 PolarHBondContact O-N 3.31Å; D287-R290 WeakPolarHBondContact O-CB 3.19Å; D287-R290 PolarHBondContact O-N 2.96Å; D287-R290 VanDerWaalsContact O-N 3.15Å; D287-I291 WeakPolarHBondContact O-CG1 3.34Å; D287-I291 PolarHBondContact O-N 3Å
288	Q	76.6	Confident	79.5	Confident	137 Å²	137	108.6 Å²	108.6	64%	0.64	53%	0.531	S	S	*	.	H	α-helix	trans	-59.7	-43.9	173.6	-83.6	-179.9	-23.8	0	0	112.1	R284 R290 I291 E292	R284-Q288 WeakPolarHBondContact O-CG 3.12Å; R284-Q288 PolarHBondContact O-N 2.71Å; Q288-R290 VanDerWaalsContact C-N 3.29Å; Q288-R290 PolarHBondContact O-N 3.48Å; Q288-I291 PolarHBondContact O-N 2.86Å; Q288-E292 PolarHBondContact O-N 3.11Å
289	R	84.9	Confident	79.5	Confident	174 Å²	174	107.1 Å²	107.1	66%	0.657	53%	0.531	S	S	*	.	H	α-helix	trans	-63.6	-36.2	175	-73.4	174.8	178.3	162.6	-1.1	112.3	G285 D286 D287 K293	G285-R289 WeakPolarHBondContact O-CG 3.4Å; G285-R289 PolarHBondContact O-N 2.94Å; D286-R289 PolarHBondContact O-N 3.45Å; D286-R289 IonicContact OD1-NH1 3.82Å; D287-R289 PolarHBondContact O-N 3.31Å; R289-K293 WeakPolarHBondContact O-CB 3.38Å; R289-K293 PolarHBondContact O-N 2.83Å
290	R	80.8	Confident	79.5	Confident	174 Å²	174	106.4 Å²	106.4	66%	0.657	53%	0.527	S	S	*	.	H	α-helix	trans	-68.5	-40.4	178	-133.6	174.9	169	-157.7	-4.3	111.6	D286 D287 Q288 K293 L294	D286-R290 WeakPolarHBondContact O-CB 3.34Å; D286-R290 PolarHBondContact O-N 2.88Å; D287-R290 WeakPolarHBondContact O-CB 3.19Å; D287-R290 PolarHBondContact O-N 2.96Å; D287-R290 VanDerWaalsContact O-N 3.15Å; Q288-R290 VanDerWaalsContact C-N 3.29Å; Q288-R290 PolarHBondContact O-N 3.48Å; R290-K293 PolarHBondContact O-N 3.34Å; R290-L294 WeakPolarHBondContact O-CB 3.49Å; R290-L294 WeakPolarHBondContact O-CD1 3.42Å; R290-L294 VanDerWaalsContact O-CG 3.28Å; R290-L294 WeakPolarHBondContact O-CG 3.47Å; R290-L294 PolarHBondContact O-N 3.42Å
291	I	76.5	Confident	79.5	Confident	119 Å²	119	107 Å²	107	61%	0.61	53%	0.53	S	S	*	.	H	α-helix	trans	-65.9	-43.6	175.5	-69	172.2	0	0	0	110.8	D287 Q288 K293 L294 G295	D287-I291 WeakPolarHBondContact O-CG1 3.34Å; D287-I291 PolarHBondContact O-N 3Å; Q288-I291 PolarHBondContact O-N 2.86Å; I291-K293 PolarHBondContact O-N 3.15Å; I291-L294 PolarHBondContact O-N 3.39Å; I291-G295 PolarHBondContact O-N 2.97Å
292	E	83.1	Confident	79.2	Confident	139 Å²	139	106.2 Å²	106.2	65%	0.65	53%	0.534	S	S	*	.	H	α-helix	trans	-61.1	-43.6	174.5	-82.5	-176.8	154.6	0	0	112.1	Q288 G295 Q296	Q288-E292 PolarHBondContact O-N 3.11Å; E292-G295 PolarHBondContact O-N 2.71Å; E292-Q296 PolarHBondContact O-N 2.89Å
293	K	85	Confident	79.1	Confident	134 Å²	134	106.9 Å²	106.9	58%	0.583	54%	0.539	S	S	*	.	H	α-helix	trans	-62.7	-45.7	176.6	-172.5	174.7	-178.7	178.5	0	112	R289 R290 I291 G295 Q296 D297	R289-K293 WeakPolarHBondContact O-CB 3.38Å; R289-K293 PolarHBondContact O-N 2.83Å; R290-K293 PolarHBondContact O-N 3.34Å; I291-K293 PolarHBondContact O-N 3.15Å; K293-G295 VanDerWaalsContact C-N 3.26Å; K293-G295 PolarHBondContact O-N 2.72Å; K293-Q296 PolarHBondContact O-N 3.38Å; K293-D297 PolarHBondContact O-N 2.61Å
294	L	80.4	Confident	78.7	Confident	100 Å²	100	107.4 Å²	107.4	52%	0.524	54%	0.542	S	S	.	.	H	α-helix	trans	-63.5	-32.3	175.3	-75.6	163.3	0	0	0	112.4	R290 I291 N298	R290-L294 WeakPolarHBondContact O-CB 3.49Å; R290-L294 WeakPolarHBondContact O-CD1 3.42Å; R290-L294 VanDerWaalsContact O-CG 3.28Å; R290-L294 WeakPolarHBondContact O-CG 3.47Å; R290-L294 PolarHBondContact O-N 3.42Å; I291-L294 PolarHBondContact O-N 3.39Å; L294-N298 WeakPolarHBondContact O-CB 3.36Å; L294-N298 PolarHBondContact O-N 3.27Å
295	G	82.2	Confident	78	Confident	41 Å²	41	104.9 Å²	104.9	42%	0.423	54%	0.544	S	S	.	.	H	α-helix	trans	-66.3	-44.2	173.3	0	0	0	0	0	112.7	I291 E292 K293 A299	I291-G295 PolarHBondContact O-N 2.97Å; E292-G295 PolarHBondContact O-N 2.71Å; K293-G295 VanDerWaalsContact C-N 3.26Å; K293-G295 PolarHBondContact O-N 2.72Å; G295-A299 PolarHBondContact O-N 2.78Å
296	Q	82.8	Confident	77.3	Confident	136 Å²	136	112 Å²	112	64%	0.636	57%	0.566	S	S	*	*	H	α-helix	trans	-65.6	-43.3	174.5	-73.6	179.8	-1.8	0	0	112.1	E292 K293 A299 T300	E292-Q296 PolarHBondContact O-N 2.89Å; K293-Q296 PolarHBondContact O-N 3.38Å; Q296-A299 PolarHBondContact O-N 3.35Å; Q296-T300 WeakPolarHBondContact O-CG2 3.32Å; Q296-T300 PolarHBondContact O-N 2.92Å; Q296-T300 PolarHBondContact O-OG1 3.04Å
297	D	80.7	Confident	76.4	Confident	73 Å²	73	111.7 Å²	111.7	39%	0.39	58%	0.576	S	S	.	*	H	α-helix	trans	-62	-46.2	176.9	-70.5	-17.4	0	0	0	110.3	K293 A299 T300 L301	K293-D297 PolarHBondContact O-N 2.61Å; D297-A299 VanDerWaalsContact C-N 3.31Å; D297-A299 PolarHBondContact O-N 3.37Å; D297-T300 PolarHBondContact O-N 3.03Å; D297-T300 PolarHBondContact O-OG1 3.23Å; D297-L301 HydrophobicContact CB-CD1 4.49Å; D297-L301 WeakPolarHBondContact O-CB 3.27Å; D297-L301 WeakPolarHBondContact O-CD1 3.49Å; D297-L301 PolarHBondContact O-N 2.78Å
298	N	73.1	Confident	75.3	Confident	113 Å²	113	114.2 Å²	114.2	60%	0.604	59%	0.589	S	S	*	*	H	α-helix	trans	-60.9	-36.4	174.8	-96.6	-42.6	0	0	0	113.5	L294 A302	L294-N298 WeakPolarHBondContact O-CB 3.36Å; L294-N298 PolarHBondContact O-N 3.27Å; N298-A302 WeakPolarHBondContact O-CB 3.25Å; N298-A302 PolarHBondContact O-N 2.81Å
299	A	79.9	Confident	73.7	Confident	55 Å²	55	110.5 Å²	110.5	46%	0.455	59%	0.588	S	S	.	*	H	α-helix	trans	-66.1	-45.2	176.2	0	0	0	0	0	111.7	G295 Q296 D297 L301 A302 E303	G295-A299 PolarHBondContact O-N 2.78Å; Q296-A299 PolarHBondContact O-N 3.35Å; D297-A299 VanDerWaalsContact C-N 3.31Å; D297-A299 PolarHBondContact O-N 3.37Å; A299-L301 PolarHBondContact O-N 3.41Å; A299-A302 PolarHBondContact O-N 3.36Å; A299-E303 PolarHBondContact O-N 2.71Å
300	T	80.7	Confident	71.6	Confident	70 Å²	70	106.6 Å²	106.6	43%	0.429	59%	0.592	S	S	.	*	H	α-helix	trans	-66.9	-36.3	177.6	58.4	0	0	0	0	112.7	Q296 D297 E303 Q304	Q296-T300 WeakPolarHBondContact O-CG2 3.32Å; Q296-T300 PolarHBondContact O-N 2.92Å; Q296-T300 PolarHBondContact O-OG1 3.04Å; D297-T300 PolarHBondContact O-N 3.03Å; D297-T300 PolarHBondContact O-OG1 3.23Å; T300-E303 PolarHBondContact O-N 3.14Å; T300-Q304 WeakPolarHBondContact O-CG 3.47Å; T300-Q304 PolarHBondContact O-N 3.45Å
301	L	75.3	Confident	69.7	Low	98 Å²	98	105.1 Å²	105.1	51%	0.513	60%	0.598	S	S	.	*	H	α-helix	trans	-65.3	-43	171.9	-90.3	119.5	0	0	0	111.8	D297 A299 E303 Q304 V305	D297-L301 HydrophobicContact CB-CD1 4.49Å; D297-L301 WeakPolarHBondContact O-CB 3.27Å; D297-L301 WeakPolarHBondContact O-CD1 3.49Å; D297-L301 PolarHBondContact O-N 2.78Å; A299-L301 PolarHBondContact O-N 3.41Å; L301-E303 PolarHBondContact O-N 3.43Å; L301-Q304 PolarHBondContact O-N 3.25Å; L301-V305 VanDerWaalsContact O-CG2 3.25Å; L301-V305 WeakPolarHBondContact O-CG2 3.43Å; L301-V305 PolarHBondContact O-N 3.33Å
302	A	71	Confident	68	Low	63 Å²	63	105.8 Å²	105.8	52%	0.521	61%	0.609	S	S	.	*	H	α-helix	trans	-61	-34.6	175.7	0	0	0	0	0	112	N298 A299 K306	N298-A302 WeakPolarHBondContact O-CB 3.25Å; N298-A302 PolarHBondContact O-N 2.81Å; A299-A302 PolarHBondContact O-N 3.36Å; A302-K306 WeakPolarHBondContact O-CB 3.22Å; A302-K306 PolarHBondContact O-N 2.92Å
303	E	76.2	Confident	65.9	Low	142 Å²	142	105.6 Å²	105.6	66%	0.664	62%	0.618	S	S	*	*	H	α-helix	trans	-74.8	-37.7	178	-143.2	139.5	-150.7	0	0	112.3	A299 T300 L301 K306 A307	A299-E303 PolarHBondContact O-N 2.71Å; T300-E303 PolarHBondContact O-N 3.14Å; L301-E303 PolarHBondContact O-N 3.43Å; E303-K306 PolarHBondContact O-N 2.93Å; E303-A307 WeakPolarHBondContact O-CB 3.35Å; E303-A307 PolarHBondContact O-N 3.05Å
304	Q	69.6	Low	63.8	Low	124 Å²	124	105 Å²	105	58%	0.579	63%	0.626	S	S	*	*	H	α-helix	trans	-64.6	-40.9	171.2	-76.8	-179.8	28	0	0	112.4	T300 L301 K306 A307 L308	T300-Q304 WeakPolarHBondContact O-CG 3.47Å; T300-Q304 PolarHBondContact O-N 3.45Å; L301-Q304 PolarHBondContact O-N 3.25Å; Q304-K306 VanDerWaalsContact C-N 3.3Å; Q304-K306 PolarHBondContact O-N 3.37Å; Q304-A307 PolarHBondContact O-N 2.89Å; Q304-L308 WeakPolarHBondContact O-CD1 3.48Å; Q304-L308 WeakPolarHBondContact O-CG 3.3Å; Q304-L308 PolarHBondContact O-N 3.3Å; Q304-L308 VanDerWaalsContact O-N 3.09Å
305	V	63.1	Low	61.7	Low	102 Å²	102	104.5 Å²	104.5	62%	0.618	64%	0.636	S	S	*	*	H	α-helix	trans	-65.7	-35.7	175.9	175.1	0	0	0	0	110.8	L301 L308	L301-V305 VanDerWaalsContact O-CG2 3.25Å; L301-V305 WeakPolarHBondContact O-CG2 3.43Å; L301-V305 PolarHBondContact O-N 3.33Å; V305-L308 PolarHBondContact O-N 3.22Å
306	K	66.3	Low	59.4	Low	180 Å²	180	108.4 Å²	108.4	78%	0.783	65%	0.651	S	S	*	*	H	α-helix	trans	-71	-32.5	174.7	-158.2	177.4	-175.6	-176.2	0	112.8	A302 E303 Q304 L308	A302-K306 WeakPolarHBondContact O-CB 3.22Å; A302-K306 PolarHBondContact O-N 2.92Å; E303-K306 PolarHBondContact O-N 2.93Å; Q304-K306 VanDerWaalsContact C-N 3.3Å; Q304-K306 PolarHBondContact O-N 3.37Å; K306-L308 VanDerWaalsContact C-N 3.34Å
307	A	61.7	Low	57.1	Low	86 Å²	86	106 Å²	106	71%	0.711	66%	0.663	S	S	*	*	H	α-helix	trans	-74.5	-21.1	175.1	0	0	0	0	0	113.6	E303 Q304 G309	E303-A307 WeakPolarHBondContact O-CB 3.35Å; E303-A307 PolarHBondContact O-N 3.05Å; Q304-A307 PolarHBondContact O-N 2.89Å; A307-G309 VanDerWaalsContact C-N 3.28Å; A307-G309 PolarHBondContact O-N 3.33Å
308	L	52.5	Low	54.9	Low	139 Å²	139	110.5 Å²	110.5	73%	0.728	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	2.8	178.3	-80	159.7	0	0	0	114.6	Q304 V305 K306 A310	Q304-L308 WeakPolarHBondContact O-CD1 3.48Å; Q304-L308 WeakPolarHBondContact O-CG 3.3Å; Q304-L308 PolarHBondContact O-N 3.3Å; Q304-L308 VanDerWaalsContact O-N 3.09Å; V305-L308 PolarHBondContact O-N 3.22Å; K306-L308 VanDerWaalsContact C-N 3.34Å; L308-A310 VanDerWaalsContact C-N 3.29Å; L308-A310 PolarHBondContact O-N 3.28Å; L308-A310 VanDerWaalsContact O-N 3.07Å
309	G	41.8	Very low	53	Low	59 Å²	59	111 Å²	111	61%	0.608	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.8	19.5	159.2	0	0	0	0	0	117.4	A307 N311	A307-G309 VanDerWaalsContact C-N 3.28Å; A307-G309 PolarHBondContact O-N 3.33Å; G309-N311 PolarHBondContact O-N 3.5Å; G309-N311 VanDerWaalsContact O-N 3.14Å
310	A	40.2	Very low	51.4	Low	91 Å²	91	114.9 Å²	114.9	75%	0.752	71%	0.709	S	S	*	*			trans	-82.8	91.1	-177.9	0	0	0	0	0	111.9	L308	L308-A310 VanDerWaalsContact C-N 3.29Å; L308-A310 PolarHBondContact O-N 3.28Å; L308-A310 VanDerWaalsContact O-N 3.07Å
311	N	41.3	Very low	49.3	Very low	144 Å²	144	116.9 Å²	116.9	77%	0.77	72%	0.723	S	S	*	*			trans	-69.1	127.5	162.8	-72.1	-31.4	0	0	0	109.1	G309 V313	G309-N311 PolarHBondContact O-N 3.5Å; G309-N311 VanDerWaalsContact O-N 3.14Å; N311-V313 PolarHBondContact O-N 2.91Å; N311-V313 VanDerWaalsContact O-N 3.17Å
312	P	41.7	Very low	47.3	Very low	132 Å²	132	121.6 Å²	121.6	86%	0.857	74%	0.743	S	S	*	*			trans	-71.2	113.3	173.2	26.5	-29.7	0	0	0	109.7
313	V	39.5	Very low	45.8	Very low	136 Å²	136	127.1 Å²	127.1	82%	0.824	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-86.1	121.5	171.5	-175.1	0	0	0	0	108	N311	N311-V313 PolarHBondContact O-N 2.91Å; N311-V313 VanDerWaalsContact O-N 3.17Å
314	T	38.9	Very low	43.8	Very low	122 Å²	122	125.9 Å²	125.9	75%	0.748	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-78.9	118.5	169.6	34.3	0	0	0	0	110
315	A	36.8	Very low	42.1	Very low	89 Å²	89	124.7 Å²	124.7	74%	0.736	78%	0.776	S	S	*	*	S	Bend	trans	-72.4	127.3	158.6	0	0	0	0	0	107.4
316	T	35.1	Very low	41.1	Very low	122 Å²	122	125.1 Å²	125.1	75%	0.748	78%	0.783	S	S	*	*	S	Bend	trans	85.1	101.1	-176.5	73.9	0	0	0	0	114.7	E318	T316-E318 VanDerWaalsContact C-N 3.28Å; T316-E318 PolarHBondContact O-N 2.98Å
317	G	34.9	Very low	39.9	Very low	86 Å²	86	122.1 Å²	122.1	89%	0.887	78%	0.782	S	S	*	*			trans	-80.4	55.6	-178	0	0	0	0	0	114.6
318	E	33.8	Very low	38.6	Very low	167 Å²	167	124.5 Å²	124.5	78%	0.78	79%	0.79	S	S	*	*	S	Bend	trans	-126.4	144.6	174.1	-88.4	172.7	118.9	0	0	112.2	T316	T316-E318 VanDerWaalsContact C-N 3.28Å; T316-E318 PolarHBondContact O-N 2.98Å
319	P	33.9	Very low	37.9	Very low	123 Å²	123	121 Å²	121	80%	0.799	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-72.8	132.7	-171.7	30.1	-32.9	0	0	0	111.2
320	V	45.2	Very low	37.9	Very low	137 Å²	137	124.4 Å²	124.4	83%	0.83	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-66.4	130.1	178.6	-175.1	0	0	0	0	110.1
321	P	37.4	Very low	37.6	Very low	113 Å²	113	129.5 Å²	129.5	73%	0.734	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-69.5	133.9	-178.9	23.2	-28.3	0	0	0	112.4	M323	P321-M323 PolarHBondContact O-N 3.25Å
322	Q	33	Very low	37.2	Very low	196 Å²	196	125.7 Å²	125.7	92%	0.916	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-58.7	120.4	169.6	-80.2	170.4	-54.8	0	0	110.3
323	M	38.3	Very low	37.1	Very low	179 Å²	179	128.8 Å²	128.8	88%	0.882	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72.4	147.1	168.6	-80.9	179.5	69.6	0	0	111	P321	P321-M323 PolarHBondContact O-N 3.25Å
324	P	36	Very low	37.3	Very low	116 Å²	116	128.2 Å²	128.2	75%	0.753	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-75.5	143.8	-163.6	-8.2	25.9	0	0	0	112.2	S326	P324-S326 PolarHBondContact O-N 2.98Å
325	A	33.5	Very low	37.3	Very low	100 Å²	100	129.7 Å²	129.7	83%	0.826	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-60	130.2	169.8	0	0	0	0	0	111
326	S	42.3	Very low	37.2	Very low	110 Å²	110	131.6 Å²	131.6	77%	0.769	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-60.4	145.2	172.3	-49.6	0	0	0	0	111.1	P324	P324-S326 PolarHBondContact O-N 2.98Å
327	P	40.6	Very low	37.2	Very low	118 Å²	118	128.8 Å²	128.8	77%	0.766	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-68.6	150.2	-178.7	-8.1	23.5	0	0	0	111.6	G329	P327-G329 PolarHBondContact O-N 3.39Å
328	P	34.7	Very low	37.1	Very low	135 Å²	135	132.8 Å²	132.8	88%	0.877	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-76.1	124.5	178.6	30.6	-30.9	0	0	0	110.9
329	G	37.7	Very low	37.4	Very low	67 Å²	67	129.6 Å²	129.6	69%	0.691	80%	0.796	S	S	*	*			trans	-114	155.1	167.4	0	0	0	0	0	110.5	P327	P327-G329 PolarHBondContact O-N 3.39Å
330	P	41.3	Very low	37.3	Very low	130 Å²	130	130.3 Å²	130.3	84%	0.844	80%	0.801	S	S	*	*			trans	-78.9	151.9	-137.6	29.7	-34.8	0	0	0	116
331	E	34.3	Very low	36.9	Very low	197 Å²	197	129.2 Å²	129.2	92%	0.921	79%	0.794	S	S	*	*			trans	-30.8	140.1	175.8	-82.2	144.4	116.1	0	0	118.8
332	G	33	Very low	36.7	Very low	64 Å²	64	128.8 Å²	128.8	66%	0.66	79%	0.794	S	S	*	*			trans	126.8	76.4	143.2	0	0	0	0	0	115.5
333	E	40.1	Very low	36.9	Very low	197 Å²	197	128.5 Å²	128.5	92%	0.921	79%	0.79	S	S	*	*				171.9	140.8	123.6	-94.5	163.7	91.9	0	0	112.4
334	P	43.3	Very low	37.5	Very low	124 Å²	124	125.4 Å²	125.4	81%	0.805	78%	0.783	S	S	*	*			trans	-90	138.7	-164.1	34.5	-30.1	0	0	0	113.1
335	Q	37.6	Very low	37.6	Very low	154 Å²	154	125.3 Å²	125.3	72%	0.72	78%	0.782	S	S	*	*			trans	-84.5	137.7	-179.9	-162.7	167.4	-16	0	0	111.3	G337	Q335-G337 PolarHBondContact O-N 2.93Å; Q335-G337 VanDerWaalsContact O-N 3.14Å
336	P	35.2	Very low	37.8	Very low	129 Å²	129	130 Å²	130	84%	0.838	79%	0.787	S	S	*	*			trans	-75.1	106.3	-177	28.9	-31.7	0	0	0	110.5
337	G	36.4	Very low	37.4	Very low	62 Å²	62	128.4 Å²	128.4	64%	0.639	79%	0.789	S	S	*	*			trans	-108.2	109.2	179.2	0	0	0	0	0	112.1	Q335 T339	Q335-G337 PolarHBondContact O-N 2.93Å; Q335-G337 VanDerWaalsContact O-N 3.14Å; G337-T339 PolarHBondContact O-N 3.42Å
338	N	32.6	Very low	37.2	Very low	170 Å²	170	128.5 Å²	128.5	91%	0.909	79%	0.792	S	S	*	*			trans	-60.8	97.9	164.1	-79.1	-19	0	0	0	110.2
339	T	39.4	Very low	37.2	Very low	100 Å²	100	128.5 Å²	128.5	61%	0.613	79%	0.789	S	S	*	*			trans	-148.2	135	160.9	46.9	0	0	0	0	108.7	G337 V341	G337-T339 PolarHBondContact O-N 3.42Å; T339-V341 VanDerWaalsContact C-N 3.35Å; T339-V341 PolarHBondContact O-N 2.81Å; T339-V341 WeakPolarHBondContact OG1-CG2 3.34Å
340	P	31.4	Very low	37.2	Very low	139 Å²	139	129.9 Å²	129.9	90%	0.903	79%	0.794	S	S	*	*			trans	-75.7	92.5	170.4	30.1	-27.9	0	0	0	107.3	S342	P340-S342 PolarHBondContact O-N 3.31Å
341	V	37.4	Very low	37.3	Very low	113 Å²	113	130.1 Å²	130.1	69%	0.685	79%	0.793	S	S	*	*			trans	-86.3	106.2	-178.4	-160.9	0	0	0	0	109.7	T339	T339-V341 VanDerWaalsContact C-N 3.35Å; T339-V341 PolarHBondContact O-N 2.81Å; T339-V341 WeakPolarHBondContact OG1-CG2 3.34Å
342	S	33.6	Very low	38.2	Very low	105 Å²	105	125.7 Å²	125.7	73%	0.734	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-47.2	125.5	162.7	175.3	0	0	0	0	111.7	P340	P340-S342 PolarHBondContact O-N 3.31Å
343	F	36.1	Very low	38.6	Very low	189 Å²	189	127.4 Å²	127.4	83%	0.829	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-64.9	141.1	169.8	-79.7	-93.7	0	0	0	111.4
344	P	51	Low	39.1	Very low	115 Å²	115	124.4 Å²	124.4	75%	0.747	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-73.9	147.8	169.2	29.8	-31.6	0	0	0	111.2
345	P	37.8	Very low	38.7	Very low	113 Å²	113	124.6 Å²	124.6	73%	0.734	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-87.2	149.1	-175	34	-32.6	0	0	0	113.4
346	Q	37.5	Very low	38.7	Very low	198 Å²	198	121.1 Å²	121.1	93%	0.925	78%	0.775	S	S	*	*			trans	73.7	106.6	152	-69.5	175.4	-13	0	0	119.6
347	G	35.5	Very low	38.6	Very low	78 Å²	78	124.3 Å²	124.3	80%	0.804	78%	0.776	S	S	*	*			trans	-157.6	89.9	155.2	0	0	0	0	0	108.8	V349	G347-V349 PolarHBondContact O-N 3.27Å
348	S	35.2	Very low	38.9	Very low	120 Å²	120	132.1 Å²	132.1	84%	0.839	79%	0.788	S	S	*	*			trans	-65	113.1	-172.4	48.4	0	0	0	0	114.3
349	V	34.9	Very low	39.4	Very low	134 Å²	134	129.7 Å²	129.7	81%	0.812	78%	0.782	S	S	*	*			trans	-144.4	108.1	151.3	-170.5	0	0	0	0	109	G347	G347-V349 PolarHBondContact O-N 3.27Å
350	A	37.5	Very low	39.4	Very low	97 Å²	97	128.6 Å²	128.6	80%	0.802	79%	0.79	S	S	*	*			trans	-83.1	120.6	176.5	0	0	0	0	0	110.1
351	V	43.1	Very low	39.9	Very low	134 Å²	134	130.5 Å²	130.5	81%	0.812	79%	0.793	S	S	*	*			trans	-100.4	111.9	165	-178.5	0	0	0	0	107.1
352	P	53.5	Low	40.2	Very low	105 Å²	105	128.2 Å²	128.2	68%	0.682	79%	0.792	S	S	*	*			trans	-86.2	159.2	-172.6	33.3	-33.5	0	0	0	112.9
353	P	41.7	Very low	40.8	Very low	99 Å²	99	130 Å²	130	64%	0.643	80%	0.799	S	S	*	*			trans	-79.3	147.6	175.4	33.5	-32.5	0	0	0	110.8	T355	P353-T355 PolarHBondContact O-N 3.12Å
354	P	51.5	Low	41.6	Very low	134 Å²	134	127.3 Å²	127.3	87%	0.87	80%	0.797	S	S	*	*			trans	-79.1	93.9	172.2	30.9	-28.9	0	0	0	109.4
355	T	33.8	Very low	42.2	Very low	128 Å²	128	127.2 Å²	127.2	79%	0.785	80%	0.797	S	S	*	*			trans	-121	89.7	158.4	42.1	0	0	0	0	108.7	P353	P353-T355 PolarHBondContact O-N 3.12Å
356	A	37.1	Very low	43.3	Very low	81 Å²	81	127 Å²	127	67%	0.669	80%	0.796	S	S	*	*			trans	-157.3	127.8	163.5	0	0	0	0	0	112.6
357	F	34.5	Very low	44.3	Very low	197 Å²	197	123.4 Å²	123.4	86%	0.864	79%	0.79	S	S	*	*			trans	121.5	75.2	145.7	-71.1	-79.1	0	0	0	117.7
358	Y	42.5	Very low	45	Very low	225 Å²	225	128.7 Å²	128.7	88%	0.882	79%	0.793	S	S	*	*				14.6	156.4	116	-90.6	-78.7	0	0	0	120.3
359	P	41.9	Very low	45.8	Very low	120 Å²	120	127.7 Å²	127.7	78%	0.779	78%	0.782	S	S	*	*				-117.2	151.8	-103.1	38.4	-22.9	0	0	0	112.9
360	G	40.8	Very low	46.5	Very low	77 Å²	77	126.8 Å²	126.8	79%	0.794	78%	0.777	S	S	*	*			trans	-129.3	103.5	176.1	0	0	0	0	0	111.6	G362	G360-G362 PolarHBondContact O-N 3.28Å
361	N	40.8	Very low	47.1	Very low	178 Å²	178	132 Å²	132	95%	0.952	78%	0.777	S	S	*	*			trans	-51.2	130.3	161	-81.5	-12.8	0	0	0	110.1
362	G	43.5	Very low	47.5	Very low	66 Å²	66	133.5 Å²	133.5	68%	0.68	78%	0.775	S	S	*	*			trans	178	97	170.5	0	0	0	0	0	114.2	G360	G360-G362 PolarHBondContact O-N 3.28Å
363	V	47.5	Very low	47.6	Very low	143 Å²	143	133.6 Å²	133.6	87%	0.867	78%	0.779	S	S	*	*			trans	61.4	100.4	158	-80.6	0	0	0	0	118.6
364	T	52.3	Low	48.5	Very low	131 Å²	131	134.6 Å²	134.6	80%	0.804	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-50	129.2	154.8	42.6	0	0	0	0	110.9
365	P	63.6	Low	49	Very low	114 Å²	114	132.7 Å²	132.7	74%	0.74	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-63.7	144	166	-5.2	19.7	0	0	0	108.8
366	P	60.1	Low	50.3	Low	108 Å²	108	131.3 Å²	131.3	70%	0.701	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-60.8	149.9	176	25.6	-32.9	0	0	0	110.7	Q368	P366-Q368 PolarHBondContact O-N 3.34Å
367	P	58.8	Low	51.6	Low	123 Å²	123	133.5 Å²	133.5	80%	0.799	77%	0.769	S	S	*	*			trans	-58.3	115.8	178.2	23.8	-32.4	0	0	0	109.5	V369	P367-V369 PolarHBondContact O-N 2.64Å
368	Q	51.4	Low	53.2	Low	188 Å²	188	128.2 Å²	128.2	88%	0.879	77%	0.77	S	S	*	*			trans	-72.1	109.8	167.4	-67.4	-163.1	-54.6	0	0	107.7	P366 T370	P366-Q368 PolarHBondContact O-N 3.34Å; Q368-T370 PolarHBondContact O-N 3.16Å
369	V	51.1	Low	54.2	Low	100 Å²	100	127.6 Å²	127.6	61%	0.606	77%	0.766	S	S	*	*			trans	-68.4	95.7	172.1	-179.4	0	0	0	0	107.5	P367 Y371	P367-V369 PolarHBondContact O-N 2.64Å; V369-Y371 HydrophobicContact CB-CE2 4.23Å; V369-Y371 HydrophobicContact CG1-CD1 4.45Å; V369-Y371 HydrophobicContact CG1-CD2 4.03Å; V369-Y371 HydrophobicContact CG1-CE1 4.2Å; V369-Y371 HydrophobicContact CG1-CE2 3.75Å; V369-Y371 HydrophobicContact CG1-CG 4.38Å; V369-Y371 WeakPolarHBondContact O-CD2 3.35Å; V369-Y371 PolarHBondContact O-N 3.48Å
370	T	50	Low	55	Low	115 Å²	115	130 Å²	130	71%	0.706	77%	0.771	S	S	*	*			trans	-73.8	104.5	165	-65.6	0	0	0	0	107.6	Q368 Q372	Q368-T370 PolarHBondContact O-N 3.16Å; T370-Q372 VanDerWaalsContact C-N 3.33Å; T370-Q372 PolarHBondContact O-N 3Å
371	Y	49.6	Very low	56	Low	205 Å²	205	133.2 Å²	133.2	80%	0.804	77%	0.765	S	S	*	*			trans	-67.9	91.8	170.8	-70.6	-88.8	0	0	0	109.2	V369 S373	V369-Y371 HydrophobicContact CB-CE2 4.23Å; V369-Y371 HydrophobicContact CG1-CD1 4.45Å; V369-Y371 HydrophobicContact CG1-CD2 4.03Å; V369-Y371 HydrophobicContact CG1-CE1 4.2Å; V369-Y371 HydrophobicContact CG1-CE2 3.75Å; V369-Y371 HydrophobicContact CG1-CG 4.38Å; V369-Y371 WeakPolarHBondContact O-CD2 3.35Å; V369-Y371 PolarHBondContact O-N 3.48Å; Y371-S373 PolarHBondContact O-N 3.04Å
372	Q	51.2	Low	57.2	Low	166 Å²	166	135.4 Å²	135.4	78%	0.776	76%	0.76	S	S	*	*			trans	-74.6	106.5	164.8	-150.2	108.4	25	0	0	107.3	T370 V374	T370-Q372 VanDerWaalsContact C-N 3.33Å; T370-Q372 PolarHBondContact O-N 3Å; Q372-V374 PolarHBondContact O-N 3.16Å
373	S	56	Low	58.1	Low	108 Å²	108	139.7 Å²	139.7	76%	0.755	76%	0.76	S	S	*	*			trans	-65	99.8	172.9	55.1	0	0	0	0	108.9	Y371 P375	Y371-S373 PolarHBondContact O-N 3.04Å; S373-P375 WeakPolarHBondContact O-CD 3.44Å
374	V	60	Low	59	Low	119 Å²	119	138 Å²	138	72%	0.721	75%	0.75	S	S	*	*			trans	-60.6	121.1	168.3	-177	0	0	0	0	107.3	Q372 V376	Q372-V374 PolarHBondContact O-N 3.16Å; V374-V376 PolarHBondContact O-N 3.38Å
375	P	62.1	Low	59.3	Low	95 Å²	95	140.1 Å²	140.1	62%	0.617	75%	0.748	S	S	*	*			trans	-66.2	105.2	178.4	-14.2	27.6	0	0	0	109.2	S373 P377	S373-P375 WeakPolarHBondContact O-CD 3.44Å; P375-P377 WeakPolarHBondContact O-CD 3.38Å
376	V	61.1	Low	59	Low	99 Å²	99	140 Å²	140	60%	0.6	75%	0.745	S	S	*	*			trans	-69.9	122.5	168.8	-176.1	0	0	0	0	107.8	V374 G378	V374-V376 PolarHBondContact O-N 3.38Å; V376-G378 PolarHBondContact O-N 3Å
377	P	65.2	Low	58.3	Low	126 Å²	126	144.2 Å²	144.2	82%	0.818	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	130.8	175.9	-19.1	30.2	0	0	0	110.2	P375	P375-P377 WeakPolarHBondContact O-CD 3.38Å
378	G	68.4	Low	57.9	Low	87 Å²	87	144.1 Å²	144.1	90%	0.897	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	98.6	8.6	172.6	0	0	0	0	0	117.4	V376	V376-G378 PolarHBondContact O-N 3Å
379	R	63.1	Low	57.7	Low	211 Å²	211	142.7 Å²	142.7	80%	0.796	73%	0.733	S	S	*	*			trans	-101.4	135.5	167.8	-75.7	-163.9	179.6	-144.7	2	112.4	Q381	R379-Q381 PolarHBondContact O-N 3.45Å
380	I	58.8	Low	57.4	Low	170 Å²	170	140.7 Å²	140.7	87%	0.872	73%	0.733	S	S	*	*			trans	-61.4	105.2	171.2	-57.4	173.2	0	0	0	108	R382	I380-R382 PolarHBondContact O-N 2.99Å
381	Q	61.2	Low	57.3	Low	145 Å²	145	143.8 Å²	143.8	68%	0.678	74%	0.737	S	S	*	*			trans	-72.9	108.6	169.1	-71.1	-173	-5.3	0	0	108.1	R379 K383	R379-Q381 PolarHBondContact O-N 3.45Å; Q381-K383 VanDerWaalsContact C-N 3.27Å; Q381-K383 PolarHBondContact O-N 2.96Å
382	R	66.5	Low	57.5	Low	225 Å²	225	142.8 Å²	142.8	85%	0.849	74%	0.739	S	S	*	*			trans	-67.7	92.5	164.7	-179.9	-179	-84.1	166.7	-5.8	107.3	I380 V384	I380-R382 PolarHBondContact O-N 2.99Å; R382-V384 HydrophobicContact CG-CG2 4.13Å; R382-V384 PolarHBondContact O-N 3.36Å; R382-V384 VanDerWaalsContact O-N 3.13Å
383	K	62.4	Low	57.7	Low	156 Å²	156	137.4 Å²	137.4	68%	0.678	73%	0.729	S	S	*	*			trans	-70.4	101.9	162.7	-120.3	173.2	-179.1	173.9	0	106.6	Q381 F385	Q381-K383 VanDerWaalsContact C-N 3.27Å; Q381-K383 PolarHBondContact O-N 2.96Å; K383-F385 HydrophobicContact CB-CE2 4.17Å; K383-F385 HydrophobicContact CB-CZ 4.18Å; K383-F385 HydrophobicContact CD-CE1 4.48Å; K383-F385 HydrophobicContact CD-CZ 4.37Å; K383-F385 WeakPolarHBondContact O-CD2 3.37Å; K383-F385 PolarHBondContact O-N 2.83Å; K383-F385 VanDerWaalsContact O-N 3.15Å
384	V	66.3	Low	58.2	Low	107 Å²	107	136.1 Å²	136.1	65%	0.648	72%	0.718	S	S	*	*			trans	-70.9	106.2	165.3	-178.3	0	0	0	0	105.4	R382 T386	R382-V384 HydrophobicContact CG-CG2 4.13Å; R382-V384 PolarHBondContact O-N 3.36Å; R382-V384 VanDerWaalsContact O-N 3.13Å; V384-T386 VanDerWaalsContact C-N 3.28Å; V384-T386 HydrophobicContact CG1-CG2 4.45Å; V384-T386 PolarHBondContact O-N 2.9Å
385	F	58.6	Low	58.8	Low	176 Å²	176	133.3 Å²	133.3	77%	0.772	70%	0.703	S	S	*	*			trans	-74	92.5	165.4	-60.6	-82.9	0	0	0	106.3	K383 R387	K383-F385 HydrophobicContact CB-CE2 4.17Å; K383-F385 HydrophobicContact CB-CZ 4.18Å; K383-F385 HydrophobicContact CD-CE1 4.48Å; K383-F385 HydrophobicContact CD-CZ 4.37Å; K383-F385 WeakPolarHBondContact O-CD2 3.37Å; K383-F385 PolarHBondContact O-N 2.83Å; K383-F385 VanDerWaalsContact O-N 3.15Å; F385-R387 VanDerWaalsContact C-N 3.34Å; F385-R387 PolarHBondContact O-N 3.4Å; F385-R387 VanDerWaalsContact O-N 3.07Å
386	T	56.9	Low	59.9	Low	111 Å²	111	129.8 Å²	129.8	68%	0.681	68%	0.679	S	S	*	*			trans	-63.4	107.7	154.9	37.1	0	0	0	0	105.2	V384 N388	V384-T386 VanDerWaalsContact C-N 3.28Å; V384-T386 HydrophobicContact CG1-CG2 4.45Å; V384-T386 PolarHBondContact O-N 2.9Å; T386-N388 VanDerWaalsContact C-N 3.33Å; T386-N388 PolarHBondContact O-N 2.89Å
387	R	45.7	Very low	61.2	Low	197 Å²	197	127.4 Å²	127.4	74%	0.743	67%	0.666	S	S	*	*			trans	-56	113.3	158.7	-176.9	-174.7	-86	162.4	-5.4	103.7	F385 E389	F385-R387 VanDerWaalsContact C-N 3.34Å; F385-R387 PolarHBondContact O-N 3.4Å; F385-R387 VanDerWaalsContact O-N 3.07Å; R387-E389 HydrophobicContact CB-CG 3.9Å; R387-E389 WeakPolarHBondContact CD-OE1 3.49Å; R387-E389 HydrophobicContact CG-CG 3.48Å; R387-E389 VanDerWaalsContact CG-CG 3.48Å; R387-E389 IonicContact CZ-OE1 3.16Å; R387-E389 IonicContact NH1-OE1 2.93Å; R387-E389 PolarHBondContact NH1-OE1 2.86Å; R387-E389 VanDerWaalsContact NH1-OE1 3.08Å; R387-E389 PolarHBondContact O-N 2.81Å
388	N	49.8	Very low	62.5	Low	121 Å²	121	127.2 Å²	127.2	65%	0.647	65%	0.65	S	S	*	*			trans	-64.3	77.7	166.2	-100.7	-26.7	0	0	0	106.1	T386 G390	T386-N388 VanDerWaalsContact C-N 3.33Å; T386-N388 PolarHBondContact O-N 2.89Å; N388-G390 PolarHBondContact O-N 3.35Å
389	E	47.8	Very low	63.7	Low	158 Å²	158	123.1 Å²	123.1	74%	0.738	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	18.4	170.7	-69.2	-169.4	152.4	0	0	111.3	R387	R387-E389 HydrophobicContact CB-CG 3.9Å; R387-E389 WeakPolarHBondContact CD-OE1 3.49Å; R387-E389 HydrophobicContact CG-CG 3.48Å; R387-E389 VanDerWaalsContact CG-CG 3.48Å; R387-E389 IonicContact CZ-OE1 3.16Å; R387-E389 IonicContact NH1-OE1 2.93Å; R387-E389 PolarHBondContact NH1-OE1 2.86Å; R387-E389 VanDerWaalsContact NH1-OE1 3.08Å; R387-E389 PolarHBondContact O-N 2.81Å
390	G	44.8	Very low	65.2	Low	58 Å²	58	114.8 Å²	114.8	60%	0.598	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.7	6.8	-176.6	0	0	0	0	0	115.1	N388 Q392	N388-G390 PolarHBondContact O-N 3.35Å; G390-Q392 PolarHBondContact O-N 2.98Å
391	K	47.5	Very low	67	Low	179 Å²	179	109.9 Å²	109.9	78%	0.778	56%	0.561	S	S	*	*			trans	-75.1	73.8	156.9	-77.3	-164.7	178.6	-170.3	0	106.9	G393	K391-G393 PolarHBondContact O-N 3.25Å
392	Q	53.2	Low	68.5	Low	184 Å²	184	105.2 Å²	105.2	86%	0.86	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-49.5	118.8	161.8	-76.2	177.4	-7.1	0	0	105.1	G390	G390-Q392 PolarHBondContact O-N 2.98Å
393	G	56.8	Low	69.9	Low	54 Å²	54	94.5 Å²	94.5	56%	0.557	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-51.9	160.2	172.1	0	0	0	0	0	109.4	K391 S395	K391-G393 PolarHBondContact O-N 3.25Å; G393-S395 PolarHBondContact O-N 3.37Å
394	P	66.7	Low	71.5	Confident	81 Å²	81	91.7 Å²	91.7	53%	0.526	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-49.4	133.4	179.6	21.6	-31.9	0	0	0	109.5	L396 Q593	P394-L396 PolarHBondContact O-N 2.87Å; P394-Q593 HydrophobicContact CB-CG 4.08Å; P394-Q593 HydrophobicContact CG-CG 4.43Å
395	S	72.9	Confident	73	Confident	60 Å²	60	86.6 Å²	86.6	42%	0.42	47%	0.469	S	S	.	.	S	Bend	trans	-65.3	-16.9	-169.3	66.2	0	0	0	0	113.1	G393 E599	G393-S395 PolarHBondContact O-N 3.37Å; S395-E599 WeakPolarHBondContact CB-OE1 3.29Å; S395-E599 PolarHBondContact OG-OE1 3.49Å
396	L	83.4	Confident	74.8	Confident	21 Å²	21	83.9 Å²	83.9	11%	0.11	46%	0.457	C	S	.	.	S	Bend	trans	-121.3	157.5	-179.3	-62.8	167.3	0	0	0	110.4	P394 I480 Q593 L594 T596	P394-L396 PolarHBondContact O-N 2.87Å; L396-I480 HydrophobicContact CD1-CD1 3.51Å; L396-I480 HydrophobicContact CD1-CG1 3.8Å; L396-I480 HydrophobicContact CD2-CD1 4.48Å; L396-Q593 PolarHBondContact O-NE2 3.33Å; L396-L594 HydrophobicContact CB-CB 3.54Å; L396-L594 HydrophobicContact CB-CD1 4.44Å; L396-L594 HydrophobicContact CD1-CB 3.95Å; L396-L594 HydrophobicContact CG-CB 4.37Å; L396-T596 HydrophobicContact CD1-CG2 3.93Å
397	P	88.8	Confident	76.7	Confident	49 Å²	49	78.6 Å²	78.6	32%	0.318	42%	0.424	S	S	.	.			trans	-73.7	154.3	-178.7	27.5	-31.6	0	0	0	113	Y444 Q593 L594	P397-Y444 HydrophobicContact CG-CD2 3.33Å; P397-Y444 HydrophobicContact CG-CE2 3.31Å; P397-Y444 HydrophobicContact CG-CG 3.97Å; P397-Q593 PolarHBondContact O-NE2 3.22Å; P397-L594 HydrophobicContact CG-CD1 4.44Å; P397-L594 PolarHBondContact O-N 2.79Å
398	Y	91.9	Very high	79.2	Confident	121 Å²	121	73.5 Å²	73.5	48%	0.475	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	126.8	165.8	-177.4	-97.9	0	0	0	109.7	P400 G591 Q593	Y398-P400 HydrophobicContact CD1-CG 4.25Å; Y398-P400 HydrophobicContact CE1-CB 4.38Å; Y398-P400 HydrophobicContact CE1-CG 4.44Å; Y398-P400 WeakPolarHBondContact O-CD 2.83Å; Y398-G591 VanDerWaalsContact OH-C 3.23Å; Y398-G591 VanDerWaalsContact OH-CA 3.31Å; Y398-G591 WeakPolarHBondContact OH-CA 3.33Å; Y398-G591 PolarHBondContact OH-O 2.88Å; Y398-Q593 HydrophobicContact CD2-CB 4.06Å
399	I	94.2	Very high	81.4	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	113.3	173.3	-64.4	178.3	0	0	0	107.8	V436 Y444 F588 G591 F592 L594	I399-V436 HydrophobicContact CG2-CG1 4.31Å; I399-Y444 HydrophobicContact CD1-CD1 4.31Å; I399-F588 HydrophobicContact CG2-CD2 4.1Å; I399-G591 CarbonylContact O-C 3.47Å; I399-G591 WeakPolarHBondContact O-CA 3.42Å; I399-F592 HydrophobicContact CB-CE1 4.12Å; I399-F592 HydrophobicContact CB-CE2 4.35Å; I399-F592 HydrophobicContact CB-CZ 4.04Å; I399-F592 HydrophobicContact CD1-CE2 3.86Å; I399-F592 HydrophobicContact CD1-CZ 3.68Å; I399-F592 HydrophobicContact CG1-CE2 4.47Å; I399-F592 HydrophobicContact CG1-CZ 4.38Å; I399-F592 HydrophobicContact CG2-CE1 4.05Å; I399-F592 HydrophobicContact CG2-CZ 4.19Å; I399-F592 PolarHBondContact N-O 3.42Å; I399-F592 PolarHBondContact O-N 3.22Å; I399-L594 HydrophobicContact CD1-CD1 3.85Å; I399-L594 HydrophobicContact CD1-CD2 4.35Å; I399-L594 HydrophobicContact CD1-CG 4.04Å; I399-L594 HydrophobicContact CG1-CD1 4.28Å; I399-L594 HydrophobicContact CG1-CG 4.42Å
400	P	95.7	Very high	83.6	Confident	36 Å²	36	63.8 Å²	63.8	23%	0.234	36%	0.362	C	S	.	.			trans	-67.6	157.8	179	-21.1	34.8	0	0	0	113	Y398 S403 P439	Y398-P400 HydrophobicContact CD1-CG 4.25Å; Y398-P400 HydrophobicContact CE1-CB 4.38Å; Y398-P400 HydrophobicContact CE1-CG 4.44Å; Y398-P400 WeakPolarHBondContact O-CD 2.83Å; P400-S403 WeakPolarHBondContact O-CB 3.21Å; P400-S403 PolarHBondContact O-N 2.81Å; P400-S403 PolarHBondContact O-OG 2.93Å; P400-P439 HydrophobicContact CB-CG 4.05Å; P400-P439 HydrophobicContact CG-CG 4.4Å
401	S	95.2	Very high	86	Confident	68 Å²	68	66 Å²	66	48%	0.476	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	149	168.1	48	0	0	0	0	111.2	S403 Q589	S401-S403 PolarHBondContact O-N 3.27Å; S401-Q589 WeakPolarHBondContact CB-O 3.36Å
402	G	93.7	Very high	88.1	Confident	46 Å²	46	58.4 Å²	58.4	47%	0.474	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	-2.2	-176.7	0	0	0	0	0	114.6	F588	G402-F588 WeakPolarHBondContact CA-O 3.25Å; G402-F588 PolarHBondContact N-O 2.86Å
403	S	96.2	Very high	90	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.007	30%	0.296	C	S	.	.			trans	-65	147.8	170.6	-53.7	0	0	0	0	110	P400 S401 E437 F588	P400-S403 WeakPolarHBondContact O-CB 3.21Å; P400-S403 PolarHBondContact O-N 2.81Å; P400-S403 PolarHBondContact O-OG 2.93Å; S401-S403 PolarHBondContact O-N 3.27Å; S403-E437 WeakPolarHBondContact CA-O 3.47Å; S403-E437 VanDerWaalsContact CB-O 3.3Å; S403-E437 WeakPolarHBondContact CB-O 3.29Å; S403-F588 VanDerWaalsContact O-CD2 3.26Å; S403-F588 WeakPolarHBondContact O-CD2 3.39Å; S403-F588 PolarHBondContact O-N 3Å
404	F	96.2	Very high	91.6	Very high	97 Å²	97	51 Å²	51	43%	0.425	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	155.2	-178.3	62.3	-90.2	0	0	0	112.1	E437 T585 V586 V587	F404-E437 HydrophobicContact CD1-CB 4.44Å; F404-E437 HydrophobicContact CD2-CB 4.26Å; F404-E437 HydrophobicContact CD2-CG 4.5Å; F404-E437 HydrophobicContact CE1-CB 4.07Å; F404-E437 HydrophobicContact CE2-CB 3.88Å; F404-E437 HydrophobicContact CE2-CG 3.91Å; F404-E437 HydrophobicContact CZ-CB 3.77Å; F404-E437 HydrophobicContact CZ-CG 4.12Å; F404-E437 PolarHBondContact N-O 2.88Å; F404-E437 PolarHBondContact O-N 3.04Å; F404-T585 HydrophobicContact CB-CG2 3.88Å; F404-T585 HydrophobicContact CD2-CG2 3.88Å; F404-T585 HydrophobicContact CG-CG2 4.25Å; F404-V586 CarbonylContact C-O 3.59Å; F404-V586 WeakPolarHBondContact CA-O 3.43Å; F404-V586 VanDerWaalsContact CB-O 3.31Å; F404-V586 WeakPolarHBondContact CB-O 3.42Å; F404-V587 HydrophobicContact CB-CB 4.5Å; F404-V587 HydrophobicContact CB-CG2 4.04Å
405	A	96.8	Very high	92.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	145.3	178.7	0	0	0	0	0	111	I432 V436 T585 V586	A405-I432 HydrophobicContact CB-CG2 3.95Å; A405-V436 HydrophobicContact CB-CB 4.49Å; A405-V436 HydrophobicContact CB-CG2 4.03Å; A405-T585 WeakPolarHBondContact O-CA 3.46Å; A405-V586 HydrophobicContact CB-CG1 4Å; A405-V586 PolarHBondContact N-O 2.95Å; A405-V586 PolarHBondContact O-N 2.9Å
406	K	97.1	Very high	93.7	Very high	119 Å²	119	45.3 Å²	45.3	52%	0.517	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	137.7	168.6	-68.6	-172.2	174.7	-163.6	0	109.9	T433 G434 E583	K406-T433 PolarHBondContact O-N 2.85Å; K406-T433 PolarHBondContact O-OG1 3.08Å; K406-G434 PolarHBondContact O-N 3.38Å; K406-G434 VanDerWaalsContact O-N 3.14Å; K406-E583 IonicContact NZ-OE1 3.97Å
407	A	97.3	Very high	93.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	159.6	-176.7	0	0	0	0	0	111.3	L430 R431 E583 V584	A407-L430 HydrophobicContact CB-CB 4.33Å; A407-L430 HydrophobicContact CB-CD1 3.62Å; A407-L430 HydrophobicContact CB-CD2 3.91Å; A407-L430 HydrophobicContact CB-CG 4.17Å; A407-R431 CarbonylContact C-O 3.52Å; A407-R431 WeakPolarHBondContact CA-O 3.28Å; A407-R431 VanDerWaalsContact CB-O 3.31Å; A407-R431 WeakPolarHBondContact CB-O 3.37Å; A407-E583 WeakPolarHBondContact O-CA 3.43Å; A407-V584 CarbonylContact C-O 3.57Å; A407-V584 HydrophobicContact CB-CG2 4.04Å; A407-V584 PolarHBondContact N-O 3.25Å; A407-V584 PolarHBondContact O-N 3.46Å
408	M	96.5	Very high	93.4	Very high	89 Å²	89	43 Å²	43	44%	0.438	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	129.1	172.6	-176.1	173	-74.9	0	0	108.8	I410 L430 R431 T433	M408-I410 PolarHBondContact O-N 3.38Å; M408-L430 CarbonylContact O-C 3.59Å; M408-L430 WeakPolarHBondContact O-CA 3.26Å; M408-R431 PolarHBondContact N-O 2.88Å; M408-R431 PolarHBondContact O-N 3.3Å; M408-T433 HydrophobicContact CB-CG2 3.84Å
409	L	96.5	Very high	92.6	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	125.2	176.4	-168.1	68	0	0	0	109.7	E411 M428 Q429 L430 L453 I496 I578 G579 G581 N582	L409-E411 WeakPolarHBondContact CD1-O 3.3Å; L409-M428 HydrophobicContact CD1-CE 3.55Å; L409-M428 HydrophobicContact CD2-CE 3.35Å; L409-M428 HydrophobicContact CG-CE 4.01Å; L409-Q429 WeakPolarHBondContact CD1-O 3.34Å; L409-L430 HydrophobicContact CD1-CB 4.3Å; L409-L453 HydrophobicContact CD1-CD1 3.96Å; L409-I496 HydrophobicContact CD2-CD1 4.13Å; L409-I578 HydrophobicContact CD2-CG2 3.6Å; L409-G579 WeakPolarHBondContact CD2-O 3.48Å; L409-G581 PolarHBondContact O-N 2.98Å; L409-N582 HydrophobicContact CB-CB 4.36Å; L409-N582 PolarHBondContact N-O 2.78Å
410	I	94.5	Very high	91.7	Very high	74 Å²	74	47.5 Å²	47.5	38%	0.379	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-44	-179.4	-46.6	176	0	0	0	109.8	M408 Q429 R431 F450 A580	M408-I410 PolarHBondContact O-N 3.38Å; I410-Q429 PolarHBondContact N-O 3.23Å; I410-R431 HydrophobicContact CD1-CB 3.59Å; I410-R431 HydrophobicContact CD1-CG 4.39Å; I410-R431 HydrophobicContact CG1-CB 3.9Å; I410-F450 HydrophobicContact CD1-CD1 3.44Å; I410-F450 VanDerWaalsContact CD1-CD1 3.44Å; I410-F450 HydrophobicContact CD1-CE1 3.28Å; I410-A580 WeakPolarHBondContact O-CB 3.4Å
411	E	94.5	Very high	90.4	Very high	103 Å²	103	45.9 Å²	45.9	48%	0.481	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	108.9	178.5	-173	177.6	-175.4	0	0	107.9	L409 Q429	L409-E411 WeakPolarHBondContact CD1-O 3.3Å; E411-Q429 HydrophobicContact CB-CB 3.98Å; E411-Q429 PolarHBondContact N-O 3.38Å; E411-Q429 PolarHBondContact O-N 3.01Å
412	G	92.3	Very high	89.6	Confident	21 Å²	21	47 Å²	47	22%	0.216	26%	0.263	C	S	.	.			trans	-77.8	170.7	167.8	0	0	0	0	0	111.6	I578	G412-I578 CarbonylContact C-O 3.53Å; G412-I578 WeakPolarHBondContact CA-O 3.37Å
413	A	92.1	Very high	89.1	Confident	17 Å²	17	52.4 Å²	52.4	14%	0.14	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	158	174.9	0	0	0	0	0	111.4	A415 V426 M428 I578	A413-A415 PolarHBondContact O-N 2.9Å; A413-V426 HydrophobicContact CB-CB 4.02Å; A413-V426 HydrophobicContact CB-CG2 3.48Å; A413-V426 VanDerWaalsContact CB-CG2 3.48Å; A413-M428 HydrophobicContact CB-CG 3.39Å; A413-M428 HydrophobicContact CB-SD 4Å; A413-I578 PolarHBondContact N-O 3.18Å; A413-I578 VanDerWaalsContact N-O 3.09Å; A413-I578 PolarHBondContact O-N 3.33Å
414	D	92.1	Very high	88.3	Confident	65 Å²	65	55.1 Å²	55.1	35%	0.348	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	93.8	168.2	-68.1	-50.2	0	0	0	108.7	N416 R503 V575 P577	D414-N416 PolarHBondContact O-N 3.45Å; D414-R503 IonicContact OD1-NH2 3.54Å; D414-R503 PolarHBondContact OD1-NH2 3.32Å; D414-R503 IonicContact OD2-CZ 3.84Å; D414-R503 IonicContact OD2-NH1 3.79Å; D414-R503 IonicContact OD2-NH2 3.37Å; D414-R503 PolarHBondContact OD2-NH2 3.15Å; D414-V575 HydrophobicContact CB-CB 4.42Å; D414-P577 WeakPolarHBondContact OD1-CA 3.25Å; D414-P577 WeakPolarHBondContact OD1-CB 3.41Å
415	A	92.5	Very high	88	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	118.8	-176.4	0	0	0	0	0	110.3	A413 A417 V426 A464 V575 I576	A413-A415 PolarHBondContact O-N 2.9Å; A415-A417 PolarHBondContact O-N 2.87Å; A415-V426 HydrophobicContact CB-CG2 4.32Å; A415-A464 HydrophobicContact CB-CB 3.8Å; A415-V575 WeakPolarHBondContact O-CA 3.18Å; A415-I576 HydrophobicContact CB-CB 4.48Å; A415-I576 PolarHBondContact N-O 3.06Å; A415-I576 PolarHBondContact O-N 2.83Å
416	N	89.5	Confident	87.8	Confident	22 Å²	22	54.3 Å²	54.3	12%	0.118	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	119.8	176.7	-175.8	-5.8	0	0	0	109.5	D414 S418 S424 G457 H573	D414-N416 PolarHBondContact O-N 3.45Å; N416-S418 VanDerWaalsContact OD1-CB 3.26Å; N416-S418 WeakPolarHBondContact OD1-CB 3.27Å; N416-S418 PolarHBondContact OD1-N 2.87Å; N416-S424 PolarHBondContact ND2-OG 3.1Å; N416-G457 PolarHBondContact O-N 3.01Å; N416-H573 VanDerWaalsContact OD1-CB 3.3Å; N416-H573 WeakPolarHBondContact OD1-CB 3.31Å
417	A	87.6	Confident	87.7	Confident	5 Å²	5	52.7 Å²	52.7	4%	0.041	30%	0.3	C	S	.	.			trans	-104.9	24.2	-178	0	0	0	0	0	112.4	A415 G457 V459 P574 I576	A415-A417 PolarHBondContact O-N 2.87Å; A417-G457 WeakPolarHBondContact CA-O 3.07Å; A417-V459 HydrophobicContact CB-CG2 3.54Å; A417-V459 WeakPolarHBondContact O-CG2 3.48Å; A417-P574 WeakPolarHBondContact CA-O 3.24Å; A417-P574 HydrophobicContact CB-CB 4.22Å; A417-P574 HydrophobicContact CB-CG 4.13Å; A417-P574 WeakPolarHBondContact CB-O 3.34Å; A417-P574 PolarHBondContact N-O 3.03Å; A417-P574 WeakPolarHBondContact O-CG 3.38Å; A417-I576 HydrophobicContact CB-CD1 4.17Å; A417-I576 HydrophobicContact CB-CG1 4.1Å
418	S	79.4	Confident	87.6	Confident	17 Å²	17	52.9 Å²	52.9	12%	0.119	30%	0.301	C	S	.	.	S	Bend	trans	-59.9	162	171.6	-169.3	0	0	0	0	111.9	N416 T420 G421 H573	N416-S418 VanDerWaalsContact OD1-CB 3.26Å; N416-S418 WeakPolarHBondContact OD1-CB 3.27Å; N416-S418 PolarHBondContact OD1-N 2.87Å; S418-T420 PolarHBondContact O-N 2.87Å; S418-T420 VanDerWaalsContact O-N 3.08Å; S418-G421 PolarHBondContact O-N 3.38Å; S418-H573 PolarHBondContact OG-CE1 3.06Å; S418-H573 PolarHBondContact OG-ND1 3.32Å
419	V	74.6	Confident	87.6	Confident	149 Å²	149	51.8 Å²	51.8	90%	0.903	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-23.1	172.5	-68.4	0	0	0	0	112.9
420	T	75.8	Confident	87.7	Confident	67 Å²	67	51.7 Å²	51.7	41%	0.411	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	20.4	173.8	54.9	0	0	0	0	113.2	S418 N422 E423 S424	S418-T420 PolarHBondContact O-N 2.87Å; S418-T420 VanDerWaalsContact O-N 3.08Å; T420-N422 PolarHBondContact O-N 3.05Å; T420-N422 VanDerWaalsContact O-N 3.09Å; T420-N422 PolarHBondContact O-OD1 3.21Å; T420-E423 PolarHBondContact O-N 3.37Å; T420-S424 PolarHBondContact O-N 2.66Å
421	G	68	Low	87.8	Confident	2 Å²	2	54.2 Å²	54.2	2%	0.021	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-29.5	-174.5	0	0	0	0	0	113.8	S418 E423 S424 W456	S418-G421 PolarHBondContact O-N 3.38Å; G421-E423 PolarHBondContact O-N 3.3Å; G421-S424 CarbonylContact O-C 3.25Å; G421-S424 VanDerWaalsContact O-C 3.31Å; G421-S424 PolarHBondContact O-N 3.28Å; G421-S424 VanDerWaalsContact O-N 3.14Å; G421-W456 WeakPolarHBondContact O-CB 3.37Å
422	N	79.5	Confident	87.9	Confident	90 Å²	90	49.4 Å²	49.4	48%	0.481	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.2	176	64.8	-35.8	0	0	0	114.4	T420	T420-N422 PolarHBondContact O-N 3.05Å; T420-N422 VanDerWaalsContact O-N 3.09Å; T420-N422 PolarHBondContact O-OD1 3.21Å
423	E	82.3	Confident	88.1	Confident	160 Å²	160	51.5 Å²	51.5	75%	0.748	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-26.5	175.5	-62.6	-179.2	171.5	0	0	111.9	T420 G421	T420-E423 PolarHBondContact O-N 3.37Å; G421-E423 PolarHBondContact O-N 3.3Å
424	S	79.3	Confident	88.2	Confident	58 Å²	58	51.6 Å²	51.6	41%	0.406	29%	0.288	S	S	.	.	S	Bend	trans	-106.2	67.2	-179.3	-169.4	0	0	0	0	110.5	N416 T420 G421	N416-S424 PolarHBondContact ND2-OG 3.1Å; T420-S424 PolarHBondContact O-N 2.66Å; G421-S424 CarbonylContact O-C 3.25Å; G421-S424 VanDerWaalsContact O-C 3.31Å; G421-S424 PolarHBondContact O-N 3.28Å; G421-S424 VanDerWaalsContact O-N 3.14Å
425	T	90.6	Very high	88.4	Confident	49 Å²	49	52 Å²	52	30%	0.301	29%	0.29	S	S	.	.			trans	-78.2	145.7	178.1	65.3	0	0	0	0	111.7	A455 W456	T425-A455 CarbonylContact C-O 3.39Å; T425-A455 VanDerWaalsContact CA-O 3.27Å; T425-A455 WeakPolarHBondContact CA-O 3.5Å; T425-W456 HydrophobicContact CG2-CB 4.41Å; T425-W456 HydrophobicContact CG2-CE3 3.91Å
426	V	92.7	Very high	88.6	Confident	32 Å²	32	52 Å²	52	19%	0.194	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	138.8	175.4	-66.1	0	0	0	0	110.4	A413 A415 E454 A455	A413-V426 HydrophobicContact CB-CB 4.02Å; A413-V426 HydrophobicContact CB-CG2 3.48Å; A413-V426 VanDerWaalsContact CB-CG2 3.48Å; A415-V426 HydrophobicContact CB-CG2 4.32Å; V426-E454 CarbonylContact O-C 3.58Å; V426-E454 WeakPolarHBondContact O-CA 3.47Å; V426-A455 HydrophobicContact CG2-CB 4.2Å; V426-A455 WeakPolarHBondContact CG2-O 3.1Å; V426-A455 PolarHBondContact N-O 2.82Å; V426-A455 PolarHBondContact O-N 3.28Å
427	P	94.4	Very high	88.9	Confident	84 Å²	84	54.7 Å²	54.7	55%	0.545	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	143.8	177.7	30.2	-34.3	0	0	0	110.9	L453	P427-L453 WeakPolarHBondContact CA-O 3.47Å
428	M	95.6	Very high	89.3	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.025	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	165.1	173.4	-70.5	177.7	69.1	0	0	109.5	L409 A413 L453 A455 V466 I496 I578	L409-M428 HydrophobicContact CD1-CE 3.55Å; L409-M428 HydrophobicContact CD2-CE 3.35Å; L409-M428 HydrophobicContact CG-CE 4.01Å; A413-M428 HydrophobicContact CB-CG 3.39Å; A413-M428 HydrophobicContact CB-SD 4Å; M428-L453 HydrophobicContact CB-CB 3.84Å; M428-L453 HydrophobicContact CB-CD1 4.13Å; M428-L453 PolarHBondContact N-O 3.39Å; M428-L453 WeakPolarHBondContact O-CA 3.34Å; M428-L453 WeakPolarHBondContact O-CB 3.36Å; M428-L453 PolarHBondContact O-N 3.22Å; M428-A455 HydrophobicContact CG-CB 4.27Å; M428-A455 HydrophobicContact SD-CB 3.34Å; M428-A455 WeakPolarHBondContact SD-CB 3.29Å; M428-V466 HydrophobicContact SD-CG2 4.45Å; M428-I496 HydrophobicContact CE-CD1 4.25Å; M428-I578 HydrophobicContact CE-CB 4.11Å; M428-I578 HydrophobicContact CE-CG2 3.82Å
429	Q	96.5	Very high	90	Very high	66 Å²	66	58 Å²	58	31%	0.308	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	135.4	178.2	-166.5	178.2	43.5	0	0	112.1	L409 I410 E411 F450	L409-Q429 WeakPolarHBondContact CD1-O 3.34Å; I410-Q429 PolarHBondContact N-O 3.23Å; E411-Q429 HydrophobicContact CB-CB 3.98Å; E411-Q429 PolarHBondContact N-O 3.38Å; E411-Q429 PolarHBondContact O-N 3.01Å; Q429-F450 HydrophobicContact CG-CD1 4.39Å
430	L	97.2	Very high	90.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	157.6	171.2	66.5	72.5	0	0	0	112.2	A407 M408 L409 I432 F450 V451 L453 V488 V584 V586	A407-L430 HydrophobicContact CB-CB 4.33Å; A407-L430 HydrophobicContact CB-CD1 3.62Å; A407-L430 HydrophobicContact CB-CD2 3.91Å; A407-L430 HydrophobicContact CB-CG 4.17Å; M408-L430 CarbonylContact O-C 3.59Å; M408-L430 WeakPolarHBondContact O-CA 3.26Å; L409-L430 HydrophobicContact CD1-CB 4.3Å; L430-I432 HydrophobicContact CD1-CG1 4.17Å; L430-F450 WeakPolarHBondContact O-CA 3.46Å; L430-V451 HydrophobicContact CD1-CB 3.51Å; L430-V451 HydrophobicContact CD1-CG2 3.68Å; L430-V451 HydrophobicContact CG-CB 3.92Å; L430-V451 PolarHBondContact N-O 3Å; L430-V451 VanDerWaalsContact N-O 3.08Å; L430-V451 PolarHBondContact O-N 2.85Å; L430-L453 HydrophobicContact CB-CD1 4.03Å; L430-L453 HydrophobicContact CD2-CD1 3.75Å; L430-L453 HydrophobicContact CD2-CD2 4Å; L430-L453 HydrophobicContact CD2-CG 4.35Å; L430-L453 HydrophobicContact CG-CD1 3.84Å; L430-L453 HydrophobicContact CG-CD2 4.34Å; L430-L453 HydrophobicContact CG-CG 4.33Å; L430-V488 HydrophobicContact CD2-CG2 4.16Å; L430-V584 HydrophobicContact CD2-CG2 4.03Å; L430-V586 HydrophobicContact CD2-CB 4.21Å
431	R	97.3	Very high	91.7	Very high	127 Å²	127	60.4 Å²	60.4	48%	0.479	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	131	167.8	-161.5	172	177.3	-178.9	-4.5	109.3	A407 M408 I410 T433 C449 F450	A407-R431 CarbonylContact C-O 3.52Å; A407-R431 WeakPolarHBondContact CA-O 3.28Å; A407-R431 VanDerWaalsContact CB-O 3.31Å; A407-R431 WeakPolarHBondContact CB-O 3.37Å; M408-R431 PolarHBondContact N-O 2.88Å; M408-R431 PolarHBondContact O-N 3.3Å; I410-R431 HydrophobicContact CD1-CB 3.59Å; I410-R431 HydrophobicContact CD1-CG 4.39Å; I410-R431 HydrophobicContact CG1-CB 3.9Å; R431-T433 PolarHBondContact O-N 3.37Å; R431-C449 WeakPolarHBondContact CA-O 3.25Å; R431-F450 HydrophobicContact CG-CE1 4.47Å
432	I	97.1	Very high	92.9	Very high	1 Å²	1	67 Å²	67	1%	0.005	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	124.9	169.4	-60.7	-176.6	0	0	0	108.7	A405 L430 G434 A446 G448 C449 V451 I471	A405-I432 HydrophobicContact CB-CG2 3.95Å; L430-I432 HydrophobicContact CD1-CG1 4.17Å; I432-G434 WeakPolarHBondContact CG2-O 3.38Å; I432-A446 WeakPolarHBondContact CB-O 3.46Å; I432-A446 HydrophobicContact CD1-CB 4.17Å; I432-A446 WeakPolarHBondContact CG2-O 3.47Å; I432-G448 PolarHBondContact O-N 3.45Å; I432-C449 HydrophobicContact CB-CB 4.47Å; I432-C449 HydrophobicContact CD1-CB 4.05Å; I432-C449 HydrophobicContact CG1-CB 4.38Å; I432-C449 PolarHBondContact N-O 2.96Å; I432-V451 HydrophobicContact CD1-CG2 4.04Å; I432-V451 HydrophobicContact CG1-CG2 4.17Å; I432-I471 HydrophobicContact CD1-CD1 4.12Å
433	T	96.9	Very high	93.5	Very high	65 Å²	65	66.1 Å²	66.1	40%	0.399	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-21	-176.8	53.8	0	0	0	0	113.2	K406 M408 R431	K406-T433 PolarHBondContact O-N 2.85Å; K406-T433 PolarHBondContact O-OG1 3.08Å; M408-T433 HydrophobicContact CB-CG2 3.84Å; R431-T433 PolarHBondContact O-N 3.37Å
434	G	94.1	Very high	94.1	Very high	19 Å²	19	60.1 Å²	60.1	20%	0.196	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	175.5	175.9	0	0	0	0	0	113.3	K406 I432	K406-G434 PolarHBondContact O-N 3.38Å; K406-G434 VanDerWaalsContact O-N 3.14Å; I432-G434 WeakPolarHBondContact CG2-O 3.38Å
435	L	96.3	Very high	94.7	Very high	74 Å²	74	60.6 Å²	60.6	39%	0.387	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	151	170.9	-57.5	176.7	0	0	0	110.5	E437 T443 D445	L435-E437 PolarHBondContact O-N 3.42Å; L435-T443 HydrophobicContact CD1-CG2 4.46Å; L435-D445 HydrophobicContact CD2-CB 3.73Å
436	V	96.2	Very high	94.8	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.006	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	114.5	169.2	-178.8	0	0	0	0	107.8	I399 A405 M438 T443 Y444 A446 F588	I399-V436 HydrophobicContact CG2-CG1 4.31Å; A405-V436 HydrophobicContact CB-CB 4.49Å; A405-V436 HydrophobicContact CB-CG2 4.03Å; V436-M438 HydrophobicContact CG1-CG 4.22Å; V436-T443 CarbonylContact O-C 3.52Å; V436-T443 VanDerWaalsContact O-CA 3.23Å; V436-T443 WeakPolarHBondContact O-CA 3.1Å; V436-Y444 WeakPolarHBondContact CB-O 3.29Å; V436-Y444 PolarHBondContact N-O 3.23Å; V436-Y444 PolarHBondContact O-N 2.8Å; V436-A446 HydrophobicContact CG2-CB 3.57Å; V436-F588 HydrophobicContact CG1-CD2 4.47Å; V436-F588 HydrophobicContact CG1-CE2 3.99Å; V436-F588 HydrophobicContact CG2-CE2 4.45Å
437	E	96.5	Very high	94.9	Very high	77 Å²	77	60.3 Å²	60.3	36%	0.36	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	120.9	173.4	-63.7	-63.7	156.5	0	0	109.1	S403 F404 L435 T443	S403-E437 WeakPolarHBondContact CA-O 3.47Å; S403-E437 VanDerWaalsContact CB-O 3.3Å; S403-E437 WeakPolarHBondContact CB-O 3.29Å; F404-E437 HydrophobicContact CD1-CB 4.44Å; F404-E437 HydrophobicContact CD2-CB 4.26Å; F404-E437 HydrophobicContact CD2-CG 4.5Å; F404-E437 HydrophobicContact CE1-CB 4.07Å; F404-E437 HydrophobicContact CE2-CB 3.88Å; F404-E437 HydrophobicContact CE2-CG 3.91Å; F404-E437 HydrophobicContact CZ-CB 3.77Å; F404-E437 HydrophobicContact CZ-CG 4.12Å; F404-E437 PolarHBondContact N-O 2.88Å; F404-E437 PolarHBondContact O-N 3.04Å; L435-E437 PolarHBondContact O-N 3.42Å; E437-T443 WeakPolarHBondContact OE2-CG2 3.02Å
438	M	95.5	Very high	94.9	Very high	30 Å²	30	57.4 Å²	57.4	15%	0.148	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	162.2	179.9	-61.6	-176.3	-73.7	0	0	110.5	V436 S441 K442	V436-M438 HydrophobicContact CG1-CG 4.22Å; M438-S441 PolarHBondContact O-N 3.4Å; M438-K442 WeakPolarHBondContact CA-O 3.34Å; M438-K442 HydrophobicContact CB-CB 4.24Å; M438-K442 VanDerWaalsContact CB-O 3.3Å; M438-K442 WeakPolarHBondContact CB-O 3.32Å; M438-K442 HydrophobicContact CE-CB 3.95Å; M438-K442 PolarHBondContact N-O 3.43Å
439	P	94	Very high	94.9	Very high	61 Å²	61	57.5 Å²	57.5	40%	0.396	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-49.5	147.5	174	-28.5	35.2	0	0	0	113.2	P400	P400-P439 HydrophobicContact CB-CG 4.05Å; P400-P439 HydrophobicContact CG-CG 4.4Å
440	N	94.2	Very high	94.9	Very high	152 Å²	152	58.1 Å²	58.1	81%	0.813	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	62.7	36.4	-177.4	-52.8	-42.4	0	0	0	114.6	K442	N440-K442 PolarHBondContact O-N 2.87Å; N440-K442 VanDerWaalsContact O-N 3.1Å
441	S	90.8	Very high	94.9	Very high	116 Å²	116	58.1 Å²	58.1	81%	0.811	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	57	27.1	175.8	-54.5	0	0	0	0	113.9	M438	M438-S441 PolarHBondContact O-N 3.4Å
442	K	93.3	Very high	94.9	Very high	140 Å²	140	52.8 Å²	52.8	61%	0.609	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	144.5	171.6	-69.3	-168.8	176.2	-174.8	0	109	M438 N440	M438-K442 WeakPolarHBondContact CA-O 3.34Å; M438-K442 HydrophobicContact CB-CB 4.24Å; M438-K442 VanDerWaalsContact CB-O 3.3Å; M438-K442 WeakPolarHBondContact CB-O 3.32Å; M438-K442 HydrophobicContact CE-CB 3.95Å; M438-K442 PolarHBondContact N-O 3.43Å; N440-K442 PolarHBondContact O-N 2.87Å; N440-K442 VanDerWaalsContact O-N 3.1Å
443	T	94	Very high	94.9	Very high	71 Å²	71	52.9 Å²	52.9	44%	0.436	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	146.5	179.3	58	0	0	0	0	111.2	L435 V436 E437	L435-T443 HydrophobicContact CD1-CG2 4.46Å; V436-T443 CarbonylContact O-C 3.52Å; V436-T443 VanDerWaalsContact O-CA 3.23Å; V436-T443 WeakPolarHBondContact O-CA 3.1Å; E437-T443 WeakPolarHBondContact OE2-CG2 3.02Å
444	Y	93.1	Very high	94.8	Very high	35 Å²	35	52.2 Å²	52.2	14%	0.137	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.8	170.8	177.5	-107.4	0	0	0	110.5	P397 I399 V436 A446 L594	P397-Y444 HydrophobicContact CG-CD2 3.33Å; P397-Y444 HydrophobicContact CG-CE2 3.31Å; P397-Y444 HydrophobicContact CG-CG 3.97Å; I399-Y444 HydrophobicContact CD1-CD1 4.31Å; V436-Y444 WeakPolarHBondContact CB-O 3.29Å; V436-Y444 PolarHBondContact N-O 3.23Å; V436-Y444 PolarHBondContact O-N 2.8Å; Y444-A446 HydrophobicContact CD1-CB 4.16Å; Y444-A446 HydrophobicContact CE1-CB 4.19Å; Y444-A446 PolarHBondContact O-N 2.98Å; Y444-A446 VanDerWaalsContact O-N 3.16Å; Y444-L594 HydrophobicContact CD1-CD1 4.15Å; Y444-L594 HydrophobicContact CE1-CD1 3.4Å; Y444-L594 VanDerWaalsContact CE1-CD1 3.4Å
445	D	93.6	Very high	94.8	Very high	68 Å²	68	51.3 Å²	51.3	36%	0.364	28%	0.284	S	S	.	.			trans	-82.6	95.6	179.9	176.8	28.3	0	0	0	111.1	L435 T447 K475	L435-D445 HydrophobicContact CD2-CB 3.73Å; D445-T447 WeakPolarHBondContact OD1-CB 3.16Å; D445-T447 PolarHBondContact OD1-N 2.95Å; D445-T447 PolarHBondContact OD1-OG1 3.39Å; D445-K475 VanDerWaalsContact CG-NZ 3.33Å; D445-K475 PolarHBondContact O-NZ 2.86Å; D445-K475 IonicContact OD2-NZ 2.79Å; D445-K475 PolarHBondContact OD2-NZ 2.85Å
446	A	91.9	Very high	94.7	Very high	3 Å²	3	49.2 Å²	49.2	3%	0.025	27%	0.271	C	S	.	.			trans	-105.8	21.7	167.7	0	0	0	0	0	111.8	I432 V436 Y444 G448 C449	I432-A446 WeakPolarHBondContact CB-O 3.46Å; I432-A446 HydrophobicContact CD1-CB 4.17Å; I432-A446 WeakPolarHBondContact CG2-O 3.47Å; V436-A446 HydrophobicContact CG2-CB 3.57Å; Y444-A446 HydrophobicContact CD1-CB 4.16Å; Y444-A446 HydrophobicContact CE1-CB 4.19Å; Y444-A446 PolarHBondContact O-N 2.98Å; Y444-A446 VanDerWaalsContact O-N 3.16Å; A446-G448 PolarHBondContact O-N 3.49Å; A446-C449 VanDerWaalsContact O-CB 3.25Å; A446-C449 WeakPolarHBondContact O-CB 3.23Å; A446-C449 PolarHBondContact O-N 3.03Å; A446-C449 VanDerWaalsContact O-N 3.13Å; A446-C449 PolarHBondContact O-SG 2.84Å
447	T	94.9	Very high	94.5	Very high	71 Å²	71	49.3 Å²	49.3	44%	0.436	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	130.1	-179.1	-47.6	0	0	0	0	110	D445	D445-T447 WeakPolarHBondContact OD1-CB 3.16Å; D445-T447 PolarHBondContact OD1-N 2.95Å; D445-T447 PolarHBondContact OD1-OG1 3.39Å
448	G	94.6	Very high	94.3	Very high	23 Å²	23	48.5 Å²	48.5	24%	0.237	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	-7.8	-179.5	0	0	0	0	0	115.3	I432 A446	I432-G448 PolarHBondContact O-N 3.45Å; A446-G448 PolarHBondContact O-N 3.49Å
449	C	95.7	Very high	93.9	Very high	8 Å²	8	50.3 Å²	50.3	5%	0.054	28%	0.284	C	S	.	.			trans	-62.4	144.9	169.5	-68.1	0	0	0	0	111.5	R431 I432 A446 I471 S472 C473	R431-C449 WeakPolarHBondContact CA-O 3.25Å; I432-C449 HydrophobicContact CB-CB 4.47Å; I432-C449 HydrophobicContact CD1-CB 4.05Å; I432-C449 HydrophobicContact CG1-CB 4.38Å; I432-C449 PolarHBondContact N-O 2.96Å; A446-C449 VanDerWaalsContact O-CB 3.25Å; A446-C449 WeakPolarHBondContact O-CB 3.23Å; A446-C449 PolarHBondContact O-N 3.03Å; A446-C449 VanDerWaalsContact O-N 3.13Å; A446-C449 PolarHBondContact O-SG 2.84Å; C449-I471 HydrophobicContact CB-CD1 4.37Å; C449-I471 HydrophobicContact CB-CG1 4.3Å; C449-S472 WeakPolarHBondContact CA-O 3.35Å; C449-C473 HydrophobicContact CB-CB 4.09Å; C449-C473 WeakPolarHBondContact CB-SG 3.47Å; C449-C473 WeakPolarHBondContact SG-CB 3.42Å; C449-C473 CovalentContact SG-SG 2.01Å; C449-C473 PolarHBondContact SG-SG 2.96Å
450	F	96.8	Very high	93.6	Very high	79 Å²	79	52.8 Å²	52.8	35%	0.346	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	140.7	171.4	-62.4	-86.1	0	0	0	109.7	I410 Q429 L430 R431 I471 S472	I410-F450 HydrophobicContact CD1-CD1 3.44Å; I410-F450 VanDerWaalsContact CD1-CD1 3.44Å; I410-F450 HydrophobicContact CD1-CE1 3.28Å; Q429-F450 HydrophobicContact CG-CD1 4.39Å; L430-F450 WeakPolarHBondContact O-CA 3.46Å; R431-F450 HydrophobicContact CG-CE1 4.47Å; F450-I471 WeakPolarHBondContact O-CA 3.29Å; F450-S472 PolarHBondContact N-O 3.1Å; F450-S472 PolarHBondContact O-N 3.26Å
451	V	97.1	Very high	93.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	121.4	171.1	179.8	0	0	0	0	107.9	L430 I432 L453 T468 N470 I471 I484	L430-V451 HydrophobicContact CD1-CB 3.51Å; L430-V451 HydrophobicContact CD1-CG2 3.68Å; L430-V451 HydrophobicContact CG-CB 3.92Å; L430-V451 PolarHBondContact N-O 3Å; L430-V451 VanDerWaalsContact N-O 3.08Å; L430-V451 PolarHBondContact O-N 2.85Å; I432-V451 HydrophobicContact CD1-CG2 4.04Å; I432-V451 HydrophobicContact CG1-CG2 4.17Å; V451-L453 HydrophobicContact CG1-CD2 3.84Å; V451-T468 HydrophobicContact CG1-CG2 3.84Å; V451-N470 CarbonylContact C-O 3.55Å; V451-N470 WeakPolarHBondContact CA-O 3.22Å; V451-I471 HydrophobicContact CG2-CB 4.42Å; V451-I471 HydrophobicContact CG2-CD1 4.29Å; V451-I471 HydrophobicContact CG2-CG1 4.04Å; V451-I484 HydrophobicContact CG1-CD1 3.87Å; V451-I484 HydrophobicContact CG2-CD1 4.44Å
452	G	96.5	Very high	93.4	Very high	15 Å²	15	46.7 Å²	46.7	16%	0.155	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	137.3	168.6	0	0	0	0	0	109.6	R469 N470	G452-R469 PolarHBondContact O-N 2.79Å; G452-N470 PolarHBondContact N-O 2.81Å
453	L	96.8	Very high	93.4	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	157.8	-173.8	-54.8	166.6	0	0	0	109.8	L409 P427 M428 L430 V451 V466 R467 T468 V488	L409-L453 HydrophobicContact CD1-CD1 3.96Å; P427-L453 WeakPolarHBondContact CA-O 3.47Å; M428-L453 HydrophobicContact CB-CB 3.84Å; M428-L453 HydrophobicContact CB-CD1 4.13Å; M428-L453 PolarHBondContact N-O 3.39Å; M428-L453 WeakPolarHBondContact O-CA 3.34Å; M428-L453 WeakPolarHBondContact O-CB 3.36Å; M428-L453 PolarHBondContact O-N 3.22Å; L430-L453 HydrophobicContact CB-CD1 4.03Å; L430-L453 HydrophobicContact CD2-CD1 3.75Å; L430-L453 HydrophobicContact CD2-CD2 4Å; L430-L453 HydrophobicContact CD2-CG 4.35Å; L430-L453 HydrophobicContact CG-CD1 3.84Å; L430-L453 HydrophobicContact CG-CD2 4.34Å; L430-L453 HydrophobicContact CG-CG 4.33Å; V451-L453 HydrophobicContact CG1-CD2 3.84Å; L453-V466 HydrophobicContact CB-CG1 3.71Å; L453-V466 HydrophobicContact CD1-CG1 3.95Å; L453-V466 HydrophobicContact CD2-CG1 4.06Å; L453-V466 HydrophobicContact CG-CG1 4.11Å; L453-R467 CarbonylContact C-O 3.58Å; L453-R467 WeakPolarHBondContact CA-O 3.29Å; L453-T468 HydrophobicContact CD2-CG2 3.9Å; L453-V488 HydrophobicContact CD1-CG2 4.38Å; L453-V488 HydrophobicContact CD2-CG2 3.89Å
454	E	94.7	Very high	93.5	Very high	51 Å²	51	38.3 Å²	38.3	24%	0.238	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.4	167.9	63.1	-172.2	-170.3	0	0	108.6	V426 V466 R467 R469	V426-E454 CarbonylContact O-C 3.58Å; V426-E454 WeakPolarHBondContact O-CA 3.47Å; E454-V466 CarbonylContact O-C 3.51Å; E454-V466 WeakPolarHBondContact O-CA 3.45Å; E454-R467 HydrophobicContact CG-CB 3.74Å; E454-R467 PolarHBondContact N-O 3.31Å; E454-R467 PolarHBondContact O-N 3.14Å; E454-R469 HydrophobicContact CB-CG 4.1Å; E454-R469 HydrophobicContact CG-CG 4.1Å
455	A	94.9	Very high	93.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	148	-176.7	0	0	0	0	0	112.3	T425 V426 M428 I465 V466	T425-A455 CarbonylContact C-O 3.39Å; T425-A455 VanDerWaalsContact CA-O 3.27Å; T425-A455 WeakPolarHBondContact CA-O 3.5Å; V426-A455 HydrophobicContact CG2-CB 4.2Å; V426-A455 WeakPolarHBondContact CG2-O 3.1Å; V426-A455 PolarHBondContact N-O 2.82Å; V426-A455 PolarHBondContact O-N 3.28Å; M428-A455 HydrophobicContact CG-CB 4.27Å; M428-A455 HydrophobicContact SD-CB 3.34Å; M428-A455 WeakPolarHBondContact SD-CB 3.29Å; A455-I465 WeakPolarHBondContact CA-O 3.35Å; A455-V466 HydrophobicContact CB-CB 4.46Å; A455-V466 HydrophobicContact CB-CG1 4.43Å; A455-V466 HydrophobicContact CB-CG2 3.93Å
456	W	94.1	Very high	93.6	Very high	30 Å²	30	34.6 Å²	34.6	11%	0.114	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	155	166.7	68.5	97.4	0	0	0	109.9	G421 T425 A464 I465 R467	G421-W456 WeakPolarHBondContact O-CB 3.37Å; T425-W456 HydrophobicContact CG2-CB 4.41Å; T425-W456 HydrophobicContact CG2-CE3 3.91Å; W456-A464 CarbonylContact O-C 3.6Å; W456-A464 WeakPolarHBondContact O-CA 3.49Å; W456-I465 HydrophobicContact CD2-CB 4.16Å; W456-I465 HydrophobicContact CE3-CB 4.46Å; W456-I465 HydrophobicContact CH2-CB 3.82Å; W456-I465 HydrophobicContact CH2-CG2 3.33Å; W456-I465 HydrophobicContact CZ2-CB 3.54Å; W456-I465 HydrophobicContact CZ2-CG1 4.22Å; W456-I465 HydrophobicContact CZ2-CG2 3.35Å; W456-I465 HydrophobicContact CZ3-CB 4.3Å; W456-I465 HydrophobicContact CZ3-CG2 4.11Å; W456-I465 PolarHBondContact N-O 3.41Å; W456-I465 PolarHBondContact O-N 2.84Å; W456-R467 HydrophobicContact CH2-CG 3.89Å; W456-R467 VanDerWaalsContact CH2-NH2 3.33Å; W456-R467 HydrophobicContact CZ3-CB 4.49Å; W456-R467 HydrophobicContact CZ3-CG 3.74Å
457	G	92.5	Very high	93.8	Very high	4 Å²	4	39.9 Å²	39.9	4%	0.041	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	141.8	-178.8	0	0	0	0	0	111.7	N416 A417	N416-G457 PolarHBondContact O-N 3.01Å; A417-G457 WeakPolarHBondContact CA-O 3.07Å
458	D	90.9	Very high	93.9	Very high	60 Å²	60	36.9 Å²	36.9	32%	0.321	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	111	164.7	173	14	0	0	0	108.4	S460 S461 E462 R463 I465	D458-S460 PolarHBondContact O-N 3.09Å; D458-S460 WeakPolarHBondContact OD1-CB 3.46Å; D458-S460 PolarHBondContact OD1-N 2.78Å; D458-S461 VanDerWaalsContact CG-OG 3.26Å; D458-S461 PolarHBondContact O-N 3.15Å; D458-S461 WeakPolarHBondContact OD2-CB 3.36Å; D458-S461 PolarHBondContact OD2-OG 2.9Å; D458-E462 PolarHBondContact O-N 2.98Å; D458-E462 VanDerWaalsContact O-N 3.07Å; D458-R463 PolarHBondContact N-O 3.42Å; D458-R463 PolarHBondContact O-N 3.34Å; D458-I465 HydrophobicContact CB-CG1 4.33Å
459	V	87.5	Confident	93.9	Very high	68 Å²	68	42.8 Å²	42.8	41%	0.412	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-33.8	179.5	-177.5	0	0	0	0	110.9	A417 S461 V500 P574	A417-V459 HydrophobicContact CB-CG2 3.54Å; A417-V459 WeakPolarHBondContact O-CG2 3.48Å; V459-S461 VanDerWaalsContact C-N 3.3Å; V459-S461 PolarHBondContact O-N 3.45Å; V459-V500 HydrophobicContact CG1-CG1 4.43Å; V459-V500 HydrophobicContact CG1-CG2 4.42Å; V459-P574 HydrophobicContact CG2-CB 4.38Å; V459-P574 HydrophobicContact CG2-CG 3.99Å
460	S	88.5	Confident	93.8	Very high	113 Å²	113	44.8 Å²	44.8	79%	0.79	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-30.8	-176.8	-174.7	0	0	0	0	112.5	D458	D458-S460 PolarHBondContact O-N 3.09Å; D458-S460 WeakPolarHBondContact OD1-CB 3.46Å; D458-S460 PolarHBondContact OD1-N 2.78Å
461	S	88.7	Confident	93.7	Very high	45 Å²	45	41.1 Å²	41.1	32%	0.315	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	1.4	-178.5	64.3	0	0	0	0	114	D458 V459 R463	D458-S461 VanDerWaalsContact CG-OG 3.26Å; D458-S461 PolarHBondContact O-N 3.15Å; D458-S461 WeakPolarHBondContact OD2-CB 3.36Å; D458-S461 PolarHBondContact OD2-OG 2.9Å; V459-S461 VanDerWaalsContact C-N 3.3Å; V459-S461 PolarHBondContact O-N 3.45Å; S461-R463 WeakPolarHBondContact O-CD 3.18Å; S461-R463 VanDerWaalsContact O-CG 3.28Å; S461-R463 WeakPolarHBondContact O-CG 3.47Å; S461-R463 PolarHBondContact O-N 3.19Å
462	E	92.2	Very high	93.7	Very high	95 Å²	95	43.1 Å²	43.1	44%	0.444	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	41.4	-175.1	-59.1	178.7	161.4	0	0	111.8	D458 K497 G498 V500	D458-E462 PolarHBondContact O-N 2.98Å; D458-E462 VanDerWaalsContact O-N 3.07Å; E462-K497 IonicContact OE2-NZ 3.56Å; E462-G498 PolarHBondContact O-N 3.27Å; E462-V500 HydrophobicContact CG-CG2 4.28Å
463	R	93.3	Very high	93.5	Very high	35 Å²	35	42.9 Å²	42.9	13%	0.132	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	140.5	-172.2	-78.7	164.2	175.5	-92.5	-14.4	111.7	D458 S461 I465 K493 N494 G495 I496 K497	D458-R463 PolarHBondContact N-O 3.42Å; D458-R463 PolarHBondContact O-N 3.34Å; S461-R463 WeakPolarHBondContact O-CD 3.18Å; S461-R463 VanDerWaalsContact O-CG 3.28Å; S461-R463 WeakPolarHBondContact O-CG 3.47Å; S461-R463 PolarHBondContact O-N 3.19Å; R463-I465 HydrophobicContact CB-CD1 4.25Å; R463-K493 PolarHBondContact NH1-O 3.02Å; R463-N494 PolarHBondContact NH1-O 2.99Å; R463-G495 PolarHBondContact NH1-O 2.92Å; R463-I496 CarbonylContact C-O 3.48Å; R463-I496 VanDerWaalsContact CA-O 3.29Å; R463-I496 WeakPolarHBondContact CA-O 3.14Å; R463-K497 HydrophobicContact CG-CB 4.4Å
464	A	94.5	Very high	93.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	113.7	160.8	0	0	0	0	0	108.4	A415 W456 G495 I496 I578	A415-A464 HydrophobicContact CB-CB 3.8Å; W456-A464 CarbonylContact O-C 3.6Å; W456-A464 WeakPolarHBondContact O-CA 3.49Å; A464-G495 CarbonylContact O-C 3.57Å; A464-G495 WeakPolarHBondContact O-CA 2.89Å; A464-I496 PolarHBondContact N-O 3.15Å; A464-I496 PolarHBondContact O-N 3.25Å; A464-I578 HydrophobicContact CB-CD1 3.78Å; A464-I578 HydrophobicContact CB-CG1 3.5Å; A464-I578 VanDerWaalsContact CB-CG1 3.5Å
465	I	94.7	Very high	92.8	Very high	25 Å²	25	49.8 Å²	49.8	13%	0.128	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	125.1	173.1	-49.6	-56.6	0	0	0	107.5	A455 W456 D458 R463	A455-I465 WeakPolarHBondContact CA-O 3.35Å; W456-I465 HydrophobicContact CD2-CB 4.16Å; W456-I465 HydrophobicContact CE3-CB 4.46Å; W456-I465 HydrophobicContact CH2-CB 3.82Å; W456-I465 HydrophobicContact CH2-CG2 3.33Å; W456-I465 HydrophobicContact CZ2-CB 3.54Å; W456-I465 HydrophobicContact CZ2-CG1 4.22Å; W456-I465 HydrophobicContact CZ2-CG2 3.35Å; W456-I465 HydrophobicContact CZ3-CB 4.3Å; W456-I465 HydrophobicContact CZ3-CG2 4.11Å; W456-I465 PolarHBondContact N-O 3.41Å; W456-I465 PolarHBondContact O-N 2.84Å; D458-I465 HydrophobicContact CB-CG1 4.33Å; R463-I465 HydrophobicContact CB-CD1 4.25Å
466	V	95.8	Very high	92.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.2	-171.7	-170.8	0	0	0	0	110.2	M428 L453 E454 A455 H487 V488 I496	M428-V466 HydrophobicContact SD-CG2 4.45Å; L453-V466 HydrophobicContact CB-CG1 3.71Å; L453-V466 HydrophobicContact CD1-CG1 3.95Å; L453-V466 HydrophobicContact CD2-CG1 4.06Å; L453-V466 HydrophobicContact CG-CG1 4.11Å; E454-V466 CarbonylContact O-C 3.51Å; E454-V466 WeakPolarHBondContact O-CA 3.45Å; A455-V466 HydrophobicContact CB-CB 4.46Å; A455-V466 HydrophobicContact CB-CG1 4.43Å; A455-V466 HydrophobicContact CB-CG2 3.93Å; V466-H487 WeakPolarHBondContact O-CA 3.45Å; V466-V488 HydrophobicContact CB-CB 3.95Å; V466-V488 HydrophobicContact CB-CG2 3.9Å; V466-V488 HydrophobicContact CG1-CB 4.27Å; V466-V488 HydrophobicContact CG1-CG2 3.66Å; V466-V488 PolarHBondContact O-N 3.44Å; V466-I496 HydrophobicContact CG2-CD1 4Å; V466-I496 HydrophobicContact CG2-CG1 4.14Å
467	R	95	Very high	91.8	Very high	113 Å²	113	59 Å²	59	43%	0.426	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	151.9	173.6	-70.6	175.9	-178.9	139.8	5.3	110.5	L453 E454 W456 G486	L453-R467 CarbonylContact C-O 3.58Å; L453-R467 WeakPolarHBondContact CA-O 3.29Å; E454-R467 HydrophobicContact CG-CB 3.74Å; E454-R467 PolarHBondContact N-O 3.31Å; E454-R467 PolarHBondContact O-N 3.14Å; W456-R467 HydrophobicContact CH2-CG 3.89Å; W456-R467 VanDerWaalsContact CH2-NH2 3.33Å; W456-R467 HydrophobicContact CZ3-CB 4.49Å; W456-R467 HydrophobicContact CZ3-CG 3.74Å; R467-G486 WeakPolarHBondContact CA-O 3.49Å
468	T	96.5	Very high	91.6	Very high	9 Å²	9	62.6 Å²	62.6	6%	0.055	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	142.9	173	63.8	0	0	0	0	110.9	V451 L453 I484 K485 G486 V586	V451-T468 HydrophobicContact CG1-CG2 3.84Å; L453-T468 HydrophobicContact CD2-CG2 3.9Å; T468-I484 CarbonylContact C-O 3.55Å; T468-I484 HydrophobicContact CG2-CD1 4.23Å; T468-I484 VanDerWaalsContact O-O 3.11Å; T468-I484 PolarHBondContact OG1-O 3.27Å; T468-K485 VanDerWaalsContact OG1-C 3.28Å; T468-K485 WeakPolarHBondContact OG1-CA 3.37Å; T468-G486 PolarHBondContact N-O 3.12Å; T468-G486 VanDerWaalsContact OG1-CA 3.3Å; T468-G486 WeakPolarHBondContact OG1-CA 2.98Å; T468-G486 PolarHBondContact OG1-N 3.11Å; T468-G486 PolarHBondContact OG1-O 3.02Å; T468-V586 HydrophobicContact CG2-CG2 3.71Å
469	R	94.4	Very high	91.6	Very high	146 Å²	146	62.6 Å²	62.6	55%	0.551	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	-61.3	172.4	-69.3	-171.3	62.8	-161	-1.7	111.5	G452 E454 P483 I484	G452-R469 PolarHBondContact O-N 2.79Å; E454-R469 HydrophobicContact CB-CG 4.1Å; E454-R469 HydrophobicContact CG-CG 4.1Å; R469-P483 VanDerWaalsContact O-CA 3.3Å; R469-P483 WeakPolarHBondContact O-CA 3.3Å; R469-I484 PolarHBondContact O-N 3.4Å
470	N	94.9	Very high	91.9	Very high	51 Å²	51	59.5 Å²	59.5	27%	0.273	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	157.3	-176.8	68.3	-43.3	0	0	0	111.7	V451 G452 D481 M482	V451-N470 CarbonylContact C-O 3.55Å; V451-N470 WeakPolarHBondContact CA-O 3.22Å; G452-N470 PolarHBondContact N-O 2.81Å; N470-D481 PolarHBondContact ND2-OD1 3.33Å; N470-M482 VanDerWaalsContact CA-O 3.28Å; N470-M482 WeakPolarHBondContact CA-O 3.36Å; N470-M482 WeakPolarHBondContact CB-O 3.43Å
471	I	95.4	Very high	92.1	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	133.2	171.2	-171.3	167.5	0	0	0	109	I432 C449 F450 V451 D481 M482 I484	I432-I471 HydrophobicContact CD1-CD1 4.12Å; C449-I471 HydrophobicContact CB-CD1 4.37Å; C449-I471 HydrophobicContact CB-CG1 4.3Å; F450-I471 WeakPolarHBondContact O-CA 3.29Å; V451-I471 HydrophobicContact CG2-CB 4.42Å; V451-I471 HydrophobicContact CG2-CD1 4.29Å; V451-I471 HydrophobicContact CG2-CG1 4.04Å; I471-D481 VanDerWaalsContact O-CA 3.32Å; I471-D481 WeakPolarHBondContact O-CA 3.36Å; I471-M482 HydrophobicContact CG2-CG 3.84Å; I471-M482 PolarHBondContact N-O 2.87Å; I471-M482 PolarHBondContact O-N 3.49Å; I471-M482 VanDerWaalsContact O-N 3.13Å; I471-I484 HydrophobicContact CB-CD1 3.81Å; I471-I484 HydrophobicContact CB-CG1 4.12Å; I471-I484 HydrophobicContact CB-CG2 4.21Å; I471-I484 HydrophobicContact CG2-CD1 4.37Å; I471-I484 HydrophobicContact CG2-CG1 4.36Å; I471-I484 HydrophobicContact CG2-CG2 3.54Å
472	S	95.3	Very high	92.4	Very high	41 Å²	41	56.3 Å²	56.3	29%	0.287	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	124.6	177.9	-173.2	0	0	0	0	110.8	C449 F450 I480	C449-S472 WeakPolarHBondContact CA-O 3.35Å; F450-S472 PolarHBondContact N-O 3.1Å; F450-S472 PolarHBondContact O-N 3.26Å; S472-I480 CarbonylContact C-O 3.56Å; S472-I480 VanDerWaalsContact CA-O 3.23Å; S472-I480 WeakPolarHBondContact CA-O 3.49Å
473	C	93.7	Very high	92.5	Very high	10 Å²	10	56.6 Å²	56.6	7%	0.068	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	150.5	-178.6	-48.4	0	0	0	0	111.4	C449 I480	C449-C473 HydrophobicContact CB-CB 4.09Å; C449-C473 WeakPolarHBondContact CB-SG 3.47Å; C449-C473 WeakPolarHBondContact SG-CB 3.42Å; C449-C473 CovalentContact SG-SG 2.01Å; C449-C473 PolarHBondContact SG-SG 2.96Å; C473-I480 HydrophobicContact CB-CB 4.15Å; C473-I480 HydrophobicContact CB-CD1 4.22Å; C473-I480 PolarHBondContact N-O 3.44Å; C473-I480 PolarHBondContact O-N 3.43Å
474	L	92	Very high	92.6	Very high	148 Å²	148	55.2 Å²	55.2	78%	0.775	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.4	108.1	166	-71.3	148.9	0	0	0	107.4
475	K	84.7	Confident	92.6	Very high	50 Å²	50	61.4 Å²	61.4	22%	0.217	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.2	-178.1	-162.9	90.9	-176.6	177.2	0	108.9	D445 G477 K478 I480	D445-K475 VanDerWaalsContact CG-NZ 3.33Å; D445-K475 PolarHBondContact O-NZ 2.86Å; D445-K475 IonicContact OD2-NZ 2.79Å; D445-K475 PolarHBondContact OD2-NZ 2.85Å; K475-G477 PolarHBondContact O-N 2.88Å; K475-G477 VanDerWaalsContact O-N 3.16Å; K475-K478 PolarHBondContact N-O 3.5Å; K475-K478 PolarHBondContact O-N 3.34Å; K475-I480 HydrophobicContact CB-CD1 4.24Å
476	D	83.1	Confident	92.7	Very high	142 Å²	142	60.3 Å²	60.3	76%	0.759	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	38.5	176.7	-53.2	-39.4	0	0	0	114.4	K478	D476-K478 PolarHBondContact O-N 3.4Å
477	G	84.1	Confident	92.7	Very high	81 Å²	81	62.3 Å²	62.3	84%	0.835	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	-2.2	-178.4	0	0	0	0	0	114.9	K475	K475-G477 PolarHBondContact O-N 2.88Å; K475-G477 VanDerWaalsContact O-N 3.16Å
478	K	87.9	Confident	92.8	Very high	81 Å²	81	57 Å²	57	35%	0.352	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	142.2	177.6	-51.8	-169.5	-169.4	177.8	0	111.1	K475 D476 T596	K475-K478 PolarHBondContact N-O 3.5Å; K475-K478 PolarHBondContact O-N 3.34Å; D476-K478 PolarHBondContact O-N 3.4Å; K478-T596 HydrophobicContact CB-CG2 3.71Å; K478-T596 HydrophobicContact CD-CG2 3.65Å; K478-T596 HydrophobicContact CG-CG2 4.33Å
479	T	92.5	Very high	92.7	Very high	60 Å²	60	57.3 Å²	57.3	37%	0.368	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	128.5	176.8	-53.3	0	0	0	0	110	T596 V597	T479-T596 CarbonylContact O-C 3.51Å; T479-T596 VanDerWaalsContact O-CA 3.32Å; T479-T596 WeakPolarHBondContact O-CA 3.47Å; T479-V597 HydrophobicContact CG2-CG2 3.96Å; T479-V597 PolarHBondContact O-N 3.05Å
480	I	92.5	Very high	92.7	Very high	3 Å²	3	52 Å²	52	2%	0.015	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	119.8	171.5	-58	165.4	0	0	0	105.9	L396 S472 C473 K475 M482 L594	L396-I480 HydrophobicContact CD1-CD1 3.51Å; L396-I480 HydrophobicContact CD1-CG1 3.8Å; L396-I480 HydrophobicContact CD2-CD1 4.48Å; S472-I480 CarbonylContact C-O 3.56Å; S472-I480 VanDerWaalsContact CA-O 3.23Å; S472-I480 WeakPolarHBondContact CA-O 3.49Å; C473-I480 HydrophobicContact CB-CB 4.15Å; C473-I480 HydrophobicContact CB-CD1 4.22Å; C473-I480 PolarHBondContact N-O 3.44Å; C473-I480 PolarHBondContact O-N 3.43Å; K475-I480 HydrophobicContact CB-CD1 4.24Å; I480-M482 HydrophobicContact CG2-CG 4.36Å; I480-L594 HydrophobicContact CG2-CD2 4.02Å
481	D	93.7	Very high	92.4	Very high	72 Å²	72	60.3 Å²	60.3	39%	0.385	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	99.3	171.2	-175.7	9	0	0	0	109	N470 I471 V597 M600	N470-D481 PolarHBondContact ND2-OD1 3.33Å; I471-D481 VanDerWaalsContact O-CA 3.32Å; I471-D481 WeakPolarHBondContact O-CA 3.36Å; D481-V597 HydrophobicContact CB-CG2 4.06Å; D481-M600 WeakPolarHBondContact O-CE 3.39Å
482	M	93.3	Very high	92.2	Very high	18 Å²	18	63.6 Å²	63.6	9%	0.089	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	149.8	-172.4	64.3	178	-70.6	0	0	111.9	N470 I471 I480 F592 Q593 L594 M600	N470-M482 VanDerWaalsContact CA-O 3.28Å; N470-M482 WeakPolarHBondContact CA-O 3.36Å; N470-M482 WeakPolarHBondContact CB-O 3.43Å; I471-M482 HydrophobicContact CG2-CG 3.84Å; I471-M482 PolarHBondContact N-O 2.87Å; I471-M482 PolarHBondContact O-N 3.49Å; I471-M482 VanDerWaalsContact O-N 3.13Å; I480-M482 HydrophobicContact CG2-CG 4.36Å; M482-F592 HydrophobicContact CE-CB 4.07Å; M482-F592 HydrophobicContact CE-CD2 3.76Å; M482-F592 HydrophobicContact CE-CG 4.28Å; M482-F592 HydrophobicContact SD-CD2 4.05Å; M482-Q593 WeakPolarHBondContact CE-O 3.36Å; M482-L594 HydrophobicContact SD-CD2 4.35Å; M482-M600 HydrophobicContact CB-CE 4.04Å; M482-M600 HydrophobicContact CB-SD 3.85Å
483	P	94.9	Very high	92.1	Very high	101 Å²	101	68.1 Å²	68.1	66%	0.656	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.7	141.2	175.2	28.2	-34.6	0	0	0	110.8	R469	R469-P483 VanDerWaalsContact O-CA 3.3Å; R469-P483 WeakPolarHBondContact O-CA 3.3Å
484	I	95.2	Very high	92.1	Very high	7 Å²	7	71.4 Å²	71.4	4%	0.036	39%	0.387	C	S	.	.			trans	-137.1	147	176.9	54.4	156	0	0	0	110.4	V451 T468 R469 I471 F588 F592	V451-I484 HydrophobicContact CG1-CD1 3.87Å; V451-I484 HydrophobicContact CG2-CD1 4.44Å; T468-I484 CarbonylContact C-O 3.55Å; T468-I484 HydrophobicContact CG2-CD1 4.23Å; T468-I484 VanDerWaalsContact O-O 3.11Å; T468-I484 PolarHBondContact OG1-O 3.27Å; R469-I484 PolarHBondContact O-N 3.4Å; I471-I484 HydrophobicContact CB-CD1 3.81Å; I471-I484 HydrophobicContact CB-CG1 4.12Å; I471-I484 HydrophobicContact CB-CG2 4.21Å; I471-I484 HydrophobicContact CG2-CD1 4.37Å; I471-I484 HydrophobicContact CG2-CG1 4.36Å; I471-I484 HydrophobicContact CG2-CG2 3.54Å; I484-F588 HydrophobicContact CD1-CD1 3.98Å; I484-F588 HydrophobicContact CD1-CE1 3.56Å; I484-F592 HydrophobicContact CB-CE1 4.44Å; I484-F592 HydrophobicContact CG2-CD1 4.08Å; I484-F592 HydrophobicContact CG2-CD2 3.98Å; I484-F592 HydrophobicContact CG2-CE1 3.89Å; I484-F592 HydrophobicContact CG2-CE2 3.76Å; I484-F592 HydrophobicContact CG2-CG 4.14Å; I484-F592 HydrophobicContact CG2-CZ 3.71Å
485	K	95.9	Very high	92.1	Very high	129 Å²	129	64.4 Å²	64.4	56%	0.561	35%	0.35	S	S	*	.			trans	-108.1	132	175.8	-72.2	170.3	173.7	-175.9	0	110.5	T468 Q589 D590	T468-K485 VanDerWaalsContact OG1-C 3.28Å; T468-K485 WeakPolarHBondContact OG1-CA 3.37Å; K485-Q589 PolarHBondContact O-N 2.84Å; K485-D590 HydrophobicContact CB-CB 4.26Å; K485-D590 HydrophobicContact CD-CB 4.37Å; K485-D590 WeakPolarHBondContact CD-OD2 3.3Å; K485-D590 IonicContact NZ-OD2 3.08Å; K485-D590 PolarHBondContact NZ-OD2 2.9Å; K485-D590 VanDerWaalsContact NZ-OD2 3.13Å
486	G	95.7	Very high	92.7	Very high	2 Å²	2	62 Å²	62	2%	0.021	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.6	169.8	-167.8	0	0	0	0	0	111	R467 T468 V587	R467-G486 WeakPolarHBondContact CA-O 3.49Å; T468-G486 PolarHBondContact N-O 3.12Å; T468-G486 VanDerWaalsContact OG1-CA 3.3Å; T468-G486 WeakPolarHBondContact OG1-CA 2.98Å; T468-G486 PolarHBondContact OG1-N 3.11Å; T468-G486 PolarHBondContact OG1-O 3.02Å; G486-V587 CarbonylContact C-O 3.56Å; G486-V587 WeakPolarHBondContact CA-O 3.48Å
487	H	95.8	Very high	93.2	Very high	43 Å²	43	61.1 Å²	61.1	20%	0.199	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	166.2	175.6	67.2	-75.2	0	0	0	110.2	V466 N494 V587 Q589	V466-H487 WeakPolarHBondContact O-CA 3.45Å; H487-N494 PolarHBondContact CD2-OD1 3.24Å; H487-N494 VanDerWaalsContact CD2-OD1 3.3Å; H487-V587 PolarHBondContact N-O 2.83Å; H487-V587 PolarHBondContact O-N 2.77Å; H487-Q589 PolarHBondContact ND1-NE2 2.95Å
488	V	96.6	Very high	93.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.7	177.1	-175.5	0	0	0	0	110	L430 L453 V466 G495 I496 V584	L430-V488 HydrophobicContact CD2-CG2 4.16Å; L453-V488 HydrophobicContact CD1-CG2 4.38Å; L453-V488 HydrophobicContact CD2-CG2 3.89Å; V466-V488 HydrophobicContact CB-CB 3.95Å; V466-V488 HydrophobicContact CB-CG2 3.9Å; V466-V488 HydrophobicContact CG1-CB 4.27Å; V466-V488 HydrophobicContact CG1-CG2 3.66Å; V466-V488 PolarHBondContact O-N 3.44Å; V488-G495 PolarHBondContact O-N 3.47Å; V488-I496 HydrophobicContact CG1-CD1 4.47Å; V488-I496 HydrophobicContact CG1-CG1 4.37Å; V488-V584 HydrophobicContact CG1-CB 3.43Å; V488-V584 VanDerWaalsContact CG1-CB 3.43Å; V488-V584 HydrophobicContact CG1-CG1 3.88Å; V488-V584 HydrophobicContact CG1-CG2 3.72Å
489	S	95	Very high	93.7	Very high	16 Å²	16	61 Å²	61	11%	0.112	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.1	173.6	-179.8	0	0	0	0	110	G492 K493 T585	S489-G492 WeakPolarHBondContact OG-CA 3.34Å; S489-K493 WeakPolarHBondContact CA-O 3.33Å; S489-K493 PolarHBondContact OG-N 3.1Å; S489-K493 PolarHBondContact OG-O 3.42Å; S489-T585 PolarHBondContact N-O 3.11Å; S489-T585 PolarHBondContact O-N 3.49Å
490	F	93.8	Very high	93.6	Very high	34 Å²	34	60.2 Å²	60.2	15%	0.149	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	116.8	173.2	-176	-105.4	0	0	0	109.3	G492 K493 G495 I496 K497 V584	F490-G492 VanDerWaalsContact C-N 3.27Å; F490-G492 PolarHBondContact O-N 2.89Å; F490-K493 PolarHBondContact N-O 2.95Å; F490-K493 PolarHBondContact O-N 3.02Å; F490-G495 WeakPolarHBondContact CB-O 3.37Å; F490-I496 HydrophobicContact CB-CG1 4.44Å; F490-I496 HydrophobicContact CD2-CG2 4.38Å; F490-I496 HydrophobicContact CG-CG2 4.31Å; F490-K497 HydrophobicContact CD1-CB 4.39Å; F490-V584 HydrophobicContact CD2-CG1 4.14Å
491	R	90.1	Very high	93.3	Very high	227 Å²	227	62.6 Å²	62.6	86%	0.857	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	42.7	-176.3	-59.6	-175.2	174.7	-178.1	-1.1	113.4	K493	R491-K493 VanDerWaalsContact C-N 3.34Å; R491-K493 PolarHBondContact O-N 2.87Å
492	G	90.1	Very high	92.7	Very high	71 Å²	71	64.6 Å²	64.6	73%	0.732	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	6.6	175.8	0	0	0	0	0	115.5	S489 F490	S489-G492 WeakPolarHBondContact OG-CA 3.34Å; F490-G492 VanDerWaalsContact C-N 3.27Å; F490-G492 PolarHBondContact O-N 2.89Å
493	K	93.4	Very high	91.3	Very high	136 Å²	136	71.1 Å²	71.1	59%	0.591	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.7	144	177.7	-65.4	-177.1	178.3	-173	0	110.4	R463 S489 F490 R491	R463-K493 PolarHBondContact NH1-O 3.02Å; S489-K493 WeakPolarHBondContact CA-O 3.33Å; S489-K493 PolarHBondContact OG-N 3.1Å; S489-K493 PolarHBondContact OG-O 3.42Å; F490-K493 PolarHBondContact N-O 2.95Å; F490-K493 PolarHBondContact O-N 3.02Å; R491-K493 VanDerWaalsContact C-N 3.34Å; R491-K493 PolarHBondContact O-N 2.87Å
494	N	93.2	Very high	89.5	Confident	79 Å²	79	68.2 Å²	68.2	42%	0.422	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	137.3	178.3	-174.9	28.7	0	0	0	111.6	R463 H487	R463-N494 PolarHBondContact NH1-O 2.99Å; H487-N494 PolarHBondContact CD2-OD1 3.24Å; H487-N494 VanDerWaalsContact CD2-OD1 3.3Å
495	G	93.4	Very high	87.2	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	76.8	163.7	-177.7	0	0	0	0	0	113.9	R463 A464 V488 F490	R463-G495 PolarHBondContact NH1-O 2.92Å; A464-G495 CarbonylContact O-C 3.57Å; A464-G495 WeakPolarHBondContact O-CA 2.89Å; V488-G495 PolarHBondContact O-N 3.47Å; F490-G495 WeakPolarHBondContact CB-O 3.37Å
496	I	95.7	Very high	84.7	Confident	1 Å²	1	73.6 Å²	73.6	1%	0.005	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.2	-179.8	-52.3	173.2	0	0	0	108	L409 M428 R463 A464 V466 V488 F490 I578 V584	L409-I496 HydrophobicContact CD2-CD1 4.13Å; M428-I496 HydrophobicContact CE-CD1 4.25Å; R463-I496 CarbonylContact C-O 3.48Å; R463-I496 VanDerWaalsContact CA-O 3.29Å; R463-I496 WeakPolarHBondContact CA-O 3.14Å; A464-I496 PolarHBondContact N-O 3.15Å; A464-I496 PolarHBondContact O-N 3.25Å; V466-I496 HydrophobicContact CG2-CD1 4Å; V466-I496 HydrophobicContact CG2-CG1 4.14Å; V488-I496 HydrophobicContact CG1-CD1 4.47Å; V488-I496 HydrophobicContact CG1-CG1 4.37Å; F490-I496 HydrophobicContact CB-CG1 4.44Å; F490-I496 HydrophobicContact CD2-CG2 4.38Å; F490-I496 HydrophobicContact CG-CG2 4.31Å; I496-I578 HydrophobicContact CB-CD1 4.13Å; I496-I578 HydrophobicContact CB-CG2 4.35Å; I496-I578 HydrophobicContact CD1-CG2 3.95Å; I496-I578 HydrophobicContact CG2-CD1 3.99Å; I496-I578 HydrophobicContact CG2-CG2 3.91Å; I496-V584 HydrophobicContact CD1-CG1 4.01Å; I496-V584 HydrophobicContact CG1-CG1 4.2Å
497	K	94.1	Very high	82.2	Confident	123 Å²	123	77.3 Å²	77.3	54%	0.535	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	135.9	178	-175.8	172.5	-177.9	172.1	0	109.9	E462 R463 F490	E462-K497 IonicContact OE2-NZ 3.56Å; R463-K497 HydrophobicContact CG-CB 4.4Å; F490-K497 HydrophobicContact CD1-CB 4.39Å
498	G	92	Very high	79.8	Confident	12 Å²	12	79.9 Å²	79.9	12%	0.124	41%	0.412	C	S	.	.			trans	-149.2	165.2	174.2	0	0	0	0	0	111.7	E462	E462-G498 PolarHBondContact O-N 3.27Å
499	E	91	Very high	77.3	Confident	148 Å²	148	82.3 Å²	82.3	69%	0.692	44%	0.436	S	S	*	.			trans	-82.7	136.3	176.1	-174.9	-178.9	164	0	0	109.9	V501 P577	E499-V501 HydrophobicContact CG-CG2 4.48Å; E499-V501 PolarHBondContact O-N 3.19Å; E499-P577 WeakPolarHBondContact O-CD 3.48Å
500	V	90.6	Very high	74.8	Confident	43 Å²	43	90.8 Å²	90.8	26%	0.261	47%	0.466	S	S	.	.			trans	-77	109.5	175.5	-177.2	0	0	0	0	108.5	V459 E462 P574 I576	V459-V500 HydrophobicContact CG1-CG1 4.43Å; V459-V500 HydrophobicContact CG1-CG2 4.42Å; E462-V500 HydrophobicContact CG-CG2 4.28Å; V500-P574 HydrophobicContact CG1-CB 3.89Å; V500-I576 HydrophobicContact CG2-CD1 4.21Å; V500-I576 HydrophobicContact CG2-CG1 4.08Å
501	V	86.2	Confident	72.5	Confident	52 Å²	52	90.6 Å²	90.6	32%	0.315	47%	0.471	S	S	.	.	B	Isolated β-bridge	trans	-103.5	122.9	179.9	-179.5	0	0	0	0	109.9	E499 V575 P577	E499-V501 HydrophobicContact CG-CG2 4.48Å; E499-V501 PolarHBondContact O-N 3.19Å; V501-V575 PolarHBondContact N-O 2.89Å; V501-V575 WeakPolarHBondContact O-CG2 3.5Å; V501-V575 PolarHBondContact O-N 3.17Å; V501-V575 VanDerWaalsContact O-N 3.1Å; V501-P577 HydrophobicContact CG2-CG 3.94Å
502	M	80.4	Confident	70.3	Confident	115 Å²	115	88.1 Å²	88.1	57%	0.567	46%	0.462	S	S	*	.			trans	-89.2	113.4	168.2	-65.7	-68.3	-82.4	0	0	108.7	N504 P574	M502-N504 PolarHBondContact O-N 3.21Å; M502-P574 HydrophobicContact SD-CB 3.6Å; M502-P574 HydrophobicContact SD-CG 4.41Å
503	R	64.8	Low	68	Low	155 Å²	155	87.7 Å²	87.7	59%	0.585	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	22.8	-177.1	-69.2	-169.3	172.7	-158.2	-0.8	114.9	D414 V575	D414-R503 IonicContact OD1-NH2 3.54Å; D414-R503 PolarHBondContact OD1-NH2 3.32Å; D414-R503 IonicContact OD2-CZ 3.84Å; D414-R503 IonicContact OD2-NH1 3.79Å; D414-R503 IonicContact OD2-NH2 3.37Å; D414-R503 PolarHBondContact OD2-NH2 3.15Å; R503-V575 HydrophobicContact CG-CG2 4.02Å
504	N	55.8	Low	65.6	Low	40 Å²	40	83.9 Å²	83.9	21%	0.214	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	11.7	-164.5	-71.6	-2.5	0	0	0	116.4	M502 K506 Y572	M502-N504 PolarHBondContact O-N 3.21Å; N504-K506 VanDerWaalsContact C-N 3.28Å; N504-K506 PolarHBondContact O-N 2.77Å; N504-Y572 VanDerWaalsContact ND2-CB 3.3Å; N504-Y572 WeakPolarHBondContact ND2-CB 3.47Å; N504-Y572 VanDerWaalsContact OD1-CD1 3.31Å; N504-Y572 WeakPolarHBondContact OD1-CD1 3.41Å; N504-Y572 VanDerWaalsContact OD1-CG 3.24Å
505	G	48	Very low	63.1	Low	82 Å²	82	83 Å²	83	85%	0.845	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-24.4	-176.8	0	0	0	0	0	115.8
506	K	43.9	Very low	60.7	Low	167 Å²	167	89.6 Å²	89.6	73%	0.726	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-33.7	-170	-156.1	172.5	179.3	179.5	0	114.8	N504	N504-K506 VanDerWaalsContact C-N 3.28Å; N504-K506 PolarHBondContact O-N 2.77Å
507	I	41.5	Very low	58.1	Low	79 Å²	79	95.5 Å²	95.5	41%	0.405	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-27.4	-174.7	-76.7	168.6	0	0	0	112.7	G509 W510 A511	I507-G509 PolarHBondContact O-N 3.25Å; I507-W510 PolarHBondContact O-N 2.93Å; I507-A511 PolarHBondContact O-N 3.01Å
508	L	46.1	Very low	55.6	Low	98 Å²	98	95.8 Å²	95.8	51%	0.513	53%	0.532	S	S	.	.	H	α-helix	trans	-58.6	-32.5	171.5	-142.6	74.2	0	0	0	111.2	W510 W512	L508-W510 PolarHBondContact O-N 2.88Å; L508-W512 WeakPolarHBondContact O-CB 3.16Å; L508-W512 PolarHBondContact O-N 2.81Å
509	G	44.1	Very low	53	Low	50 Å²	50	98.6 Å²	98.6	52%	0.515	56%	0.561	S	S	.	*	H	α-helix	trans	-69.2	-25.6	174.5	0	0	0	0	0	115.5	I507	I507-G509 PolarHBondContact O-N 3.25Å
510	W	43.6	Very low	50.6	Low	195 Å²	195	98.2 Å²	98.2	74%	0.739	56%	0.562	S	S	*	*	H	α-helix	trans	-95.1	-31.3	179.7	-65.7	91	0	0	0	112.9	I507 L508 W512 G513 A514	I507-W510 PolarHBondContact O-N 2.93Å; L508-W510 PolarHBondContact O-N 2.88Å; W510-W512 PolarHBondContact O-N 2.57Å; W510-G513 PolarHBondContact O-N 3.31Å; W510-A514 PolarHBondContact O-N 3.41Å
511	A	43.9	Very low	48.1	Very low	29 Å²	29	99.2 Å²	99.2	24%	0.24	58%	0.581	C	S	.	*	H	α-helix	trans	-64	-32.4	169.6	0	0	0	0	0	111.4	I507 G515 Y565	I507-A511 PolarHBondContact O-N 3.01Å; A511-G515 PolarHBondContact O-N 3.13Å; A511-G515 VanDerWaalsContact O-N 3.15Å; A511-Y565 HydrophobicContact CB-CD1 3.81Å; A511-Y565 HydrophobicContact CB-CE1 3.74Å
512	W	44	Very low	46	Very low	176 Å²	176	106 Å²	106	67%	0.667	61%	0.609	S	S	*	*	H	α-helix	trans	-67.6	-33.4	171.8	-122.1	41.6	0	0	0	114	V123 L508 W510 F516	V123-W512 HydrophobicContact CG2-CZ2 4.24Å; L508-W512 WeakPolarHBondContact O-CB 3.16Å; L508-W512 PolarHBondContact O-N 2.81Å; W510-W512 PolarHBondContact O-N 2.57Å; W512-F516 WeakPolarHBondContact O-CB 3.5Å
513	G	42.7	Very low	43.9	Very low	62 Å²	62	104.6 Å²	104.6	64%	0.639	62%	0.624	S	S	*	*	H	α-helix	trans	-77.6	-24.1	179.4	0	0	0	0	0	114.4	W510	W510-G513 PolarHBondContact O-N 3.31Å
514	A	42.8	Very low	42.4	Very low	56 Å²	56	105.3 Å²	105.3	46%	0.463	64%	0.636	S	S	.	*	H	α-helix	trans	-103.6	-16.1	-176.7	0	0	0	0	0	114.1	W510	W510-A514 PolarHBondContact O-N 3.41Å
515	G	40.1	Very low	41.7	Very low	59 Å²	59	111.7 Å²	111.7	61%	0.608	66%	0.664	S	S	*	*	S	Bend	trans	-101.7	1.3	-177.2	0	0	0	0	0	116.2	A511	A511-G515 PolarHBondContact O-N 3.13Å; A511-G515 VanDerWaalsContact O-N 3.15Å
516	F	43.7	Very low	41.4	Very low	140 Å²	140	120 Å²	120	61%	0.614	67%	0.67	S	S	*	*			trans	-111.4	21.2	-168.9	-164.1	-105.7	0	0	0	115.2	W512 I520	W512-F516 WeakPolarHBondContact O-CB 3.5Å; F516-I520 HydrophobicContact CE1-CD1 3.85Å; F516-I520 HydrophobicContact CZ-CD1 4.33Å
517	V	40.4	Very low	41	Very low	125 Å²	125	116.9 Å²	116.9	76%	0.758	68%	0.676	S	S	*	*	S	Bend	trans	-96.9	-9	-175.4	-179.8	0	0	0	0	114.6
518	D	41	Very low	40.5	Very low	129 Å²	129	117.6 Å²	117.6	69%	0.69	69%	0.688	S	S	*	*	S	Bend	trans	-111.1	3	-173.7	-91.8	-28.2	0	0	0	116.1
519	G	37.8	Very low	40	Very low	70 Å²	70	122.2 Å²	122.2	72%	0.722	71%	0.707	S	S	*	*	S	Bend	trans	-97.8	-7.4	-171.4	0	0	0	0	0	117.6	G521	G519-G521 PolarHBondContact O-N 3.29Å
520	I	40.9	Very low	39.6	Very low	141 Å²	141	125.3 Å²	125.3	72%	0.723	72%	0.718	S	S	*	*	S	Bend	trans	-103.5	36.9	-166.3	-48.1	-179.6	0	0	0	111.8	F516	F516-I520 HydrophobicContact CE1-CD1 3.85Å; F516-I520 HydrophobicContact CZ-CD1 4.33Å
521	G	38.9	Very low	39	Very low	63 Å²	63	121 Å²	121	65%	0.649	72%	0.723	S	S	*	*	S	Bend	trans	-114.5	-24	-169.4	0	0	0	0	0	118.3	G519	G519-G521 PolarHBondContact O-N 3.29Å
522	Q	41	Very low	38.5	Very low	195 Å²	195	126.6 Å²	126.6	91%	0.911	75%	0.754	S	S	*	*	S	Bend	trans	-118.1	2.8	-162.1	-65.4	-175	9.8	0	0	115.9
523	G	36.9	Very low	38	Very low	85 Å²	85	121.7 Å²	121.7	88%	0.876	76%	0.759	S	S	*	*	S	Bend	trans	-95.2	-4.7	-172.3	0	0	0	0	0	116.7
524	M	33.9	Very low	37.3	Very low	171 Å²	171	127.9 Å²	127.9	84%	0.842	78%	0.776	S	S	*	*	S	Bend	trans	-128.3	18	-159.1	-143.3	144.6	63.3	0	0	115.9
525	E	40	Very low	36.8	Very low	173 Å²	173	129.2 Å²	129.2	81%	0.808	80%	0.795	S	S	*	*	S	Bend	trans	-101.5	0.5	-179.1	-75.8	-172.8	154.3	0	0	115.5
526	R	42.1	Very low	36.5	Very low	256 Å²	256	131.3 Å²	131.3	97%	0.966	81%	0.807	S	S	*	*	S	Bend	trans	-106.8	2.6	-177.2	-77.2	-168.9	177.8	135.9	1.3	116.6
527	A	34.7	Very low	36	Very low	102 Å²	102	131.6 Å²	131.6	84%	0.843	82%	0.821	S	S	*	*	S	Bend	trans	-113.6	-1.4	-172.9	0	0	0	0	0	115.7
528	S	32.6	Very low	35.7	Very low	94 Å²	94	130.3 Å²	130.3	66%	0.657	82%	0.823	S	S	*	*			trans	-137.6	74.5	-177.5	63.1	0	0	0	0	111.6	P530	S528-P530 WeakPolarHBondContact O-CD 3.26Å
529	Q	35.8	Very low	35.2	Very low	196 Å²	196	128.9 Å²	128.9	92%	0.916	83%	0.829	S	S	*	*			trans	-88.5	110.1	158.6	-74.5	-169.2	-10.5	0	0	108.2
530	P	34	Very low	35.2	Very low	114 Å²	114	136.5 Å²	136.5	74%	0.74	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-79	118.7	160.3	16.5	-1.9	0	0	0	108.1	S528 V532	S528-P530 WeakPolarHBondContact O-CD 3.26Å; P530-V532 PolarHBondContact O-N 2.84Å
531	A	32.8	Very low	34.9	Very low	104 Å²	104	132.2 Å²	132.2	86%	0.86	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-59.8	123.3	169.9	0	0	0	0	0	109.9
532	V	33.5	Very low	34.8	Very low	147 Å²	147	134.2 Å²	134.2	89%	0.891	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-82.4	116.9	-179.5	-76.7	0	0	0	0	111	P530	P530-V532 PolarHBondContact O-N 2.84Å
533	G	32.3	Very low	34.8	Very low	74 Å²	74	127.6 Å²	127.6	76%	0.763	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-92.5	131.6	168.8	0	0	0	0	0	111.3	G535	G533-G535 PolarHBondContact O-N 3.44Å
534	L	29.2	Very low	35.2	Very low	191 Å²	191	128.7 Å²	128.7	100%	1	81%	0.809	S	S	*	*	S	Bend	trans	-45.6	126.1	180	-72.3	134.1	0	0	0	113.7
535	G	31.4	Very low	35.6	Very low	84 Å²	84	126.2 Å²	126.2	87%	0.866	80%	0.803	S	S	*	*			trans	130.8	8.7	149.5	0	0	0	0	0	121	G533	G533-G535 PolarHBondContact O-N 3.44Å
536	A	34.1	Very low	35.8	Very low	104 Å²	104	124.6 Å²	124.6	86%	0.86	80%	0.799	S	S	*	*			trans	-122.7	113.3	179.7	0	0	0	0	0	113.4
537	T	33	Very low	35.7	Very low	145 Å²	145	120.4 Å²	120.4	89%	0.89	79%	0.788	S	S	*	*			trans	-87.2	124.5	169.7	51.1	0	0	0	0	110.2
538	A	33.5	Very low	36.1	Very low	99 Å²	99	124 Å²	124	82%	0.818	79%	0.789	S	S	*	*			trans	-162.7	115	156.1	0	0	0	0	0	112.6
539	A	31.1	Very low	36.5	Very low	98 Å²	98	122.8 Å²	122.8	81%	0.81	79%	0.791	S	S	*	*			trans	43.2	106.9	145.6	0	0	0	0	0	119.8	G541	A539-G541 PolarHBondContact O-N 3.06Å
540	Y	36.8	Very low	36.9	Very low	231 Å²	231	120.8 Å²	120.8	91%	0.906	79%	0.786	S	S	*	*			trans	-61.2	111.4	163.1	-64.6	-81.4	0	0	0	110.7
541	G	34.8	Very low	37.1	Very low	50 Å²	50	119.2 Å²	119.2	52%	0.515	79%	0.79	S	S	.	*			trans	-83.9	147.1	169.9	0	0	0	0	0	111.3	A539 G543 D544	A539-G541 PolarHBondContact O-N 3.06Å; G541-G543 PolarHBondContact O-N 3.22Å; G541-D544 PolarHBondContact O-N 3.32Å
542	A	38	Very low	37.7	Very low	105 Å²	105	118 Å²	118	87%	0.868	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	11.6	-174.3	0	0	0	0	0	116.8
543	G	40.9	Very low	38	Very low	57 Å²	57	114.3 Å²	114.3	59%	0.588	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-20.8	177.2	0	0	0	0	0	114.9	G541	G541-G543 PolarHBondContact O-N 3.22Å
544	D	45.7	Very low	38.4	Very low	107 Å²	107	113.5 Å²	113.5	57%	0.572	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-6.1	-175.3	-87	-26.6	0	0	0	114.4	G541	G541-D544 PolarHBondContact O-N 3.32Å
545	V	42.3	Very low	39.1	Very low	119 Å²	119	108.6 Å²	108.6	72%	0.721	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-18.5	-179.5	-172.1	0	0	0	0	112.2	K547	V545-K547 VanDerWaalsContact C-N 3.35Å
546	L	42.2	Very low	39.6	Very low	140 Å²	140	112.5 Å²	112.5	73%	0.733	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-76.2	-20.2	178.4	-171.3	61	0	0	0	113.2	M548	L546-M548 VanDerWaalsContact C-N 3.31Å; L546-M548 PolarHBondContact O-N 3.02Å
547	K	41.7	Very low	40.1	Very low	167 Å²	167	110.3 Å²	110.3	73%	0.726	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-75.4	-12.9	-179.4	-85.6	-178.5	174.5	178.4	0	114.7	V545	V545-K547 VanDerWaalsContact C-N 3.35Å
548	M	41.9	Very low	40.6	Very low	178 Å²	178	105.3 Å²	105.3	88%	0.877	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-96.9	4.5	-175.4	-66	-70.4	-83.8	0	0	114	L546	L546-M548 VanDerWaalsContact C-N 3.31Å; L546-M548 PolarHBondContact O-N 3.02Å
549	G	40.9	Very low	41.2	Very low	68 Å²	68	106.9 Å²	106.9	70%	0.701	69%	0.686	S	S	*	*	S	Bend	trans	-112.2	0.6	-168.3	0	0	0	0	0	118.7
550	I	44	Very low	42.2	Very low	155 Å²	155	106.7 Å²	106.7	80%	0.795	68%	0.675	S	S	*	*			trans	-111.8	44.8	-168.7	-47.6	179.1	0	0	0	112.1
551	G	39.8	Very low	42.8	Very low	80 Å²	80	99.7 Å²	99.7	83%	0.825	65%	0.653	S	S	*	*			trans	-114.5	101	177.4	0	0	0	0	0	112.3
552	G	43.8	Very low	43.5	Very low	79 Å²	79	100.4 Å²	100.4	81%	0.814	65%	0.65	S	S	*	*	S	Bend	trans	136.9	-8.4	156.2	0	0	0	0	0	119.6
553	G	41.4	Very low	44.3	Very low	69 Å²	69	100 Å²	100	71%	0.711	63%	0.633	S	S	*	*	S	Bend	trans	-112.8	-16.6	-170.8	0	0	0	0	0	118
554	A	39.1	Very low	45.1	Very low	57 Å²	57	102.3 Å²	102.3	47%	0.471	63%	0.625	S	S	.	*	S	Bend	trans	-85.6	-19.6	-164.4	0	0	0	0	0	115.6	K556	A554-K556 PolarHBondContact O-N 3.48Å
555	S	44.8	Very low	45.7	Very low	89 Å²	89	100.7 Å²	100.7	62%	0.622	61%	0.611	S	S	*	*	H	α-helix	trans	-72.2	-25	-169.9	55.8	0	0	0	0	115.1
556	K	42	Very low	46.5	Very low	165 Å²	165	99.5 Å²	99.5	72%	0.717	60%	0.6	S	S	*	*	H	α-helix	trans	-87.9	-26.5	-174.7	-143.9	165.6	-172.9	174.4	0	113.5	A554 T560	A554-K556 PolarHBondContact O-N 3.48Å; K556-T560 PolarHBondContact O-OG1 3.38Å
557	A	43.8	Very low	47.3	Very low	58 Å²	58	99.4 Å²	99.4	48%	0.479	59%	0.593	S	S	.	*	H	α-helix	trans	-73.5	-39.4	174.5	0	0	0	0	0	111.4	T560 L561	A557-T560 PolarHBondContact O-N 3.12Å; A557-L561 PolarHBondContact O-N 2.89Å; A557-L561 VanDerWaalsContact O-N 3.14Å
558	A	44.1	Very low	48.1	Very low	41 Å²	41	96.1 Å²	96.1	34%	0.339	58%	0.576	S	S	.	*	H	α-helix	trans	-65.3	-41.1	179.4	0	0	0	0	0	113.3	L561 S562	A558-L561 PolarHBondContact O-N 3.36Å; A558-S562 PolarHBondContact O-N 2.75Å; A558-S562 PolarHBondContact O-OG 2.85Å
559	Q	46.3	Very low	49	Very low	132 Å²	132	90.5 Å²	90.5	62%	0.617	56%	0.558	S	S	*	*	H	α-helix	trans	-65.8	-39.9	177.2	-73.2	177.3	-14.1	0	0	112.5	L561 S562 D563	Q559-L561 VanDerWaalsContact C-N 3.35Å; Q559-L561 PolarHBondContact O-N 2.9Å; Q559-S562 PolarHBondContact O-N 3.06Å; Q559-D563 PolarHBondContact O-N 3.19Å
560	T	52.8	Low	50.1	Low	94 Å²	94	93.6 Å²	93.6	58%	0.577	56%	0.555	S	S	*	*	H	α-helix	trans	-67.7	-36.1	179.1	-48.3	0	0	0	0	111.9	K556 A557 Y564	K556-T560 PolarHBondContact O-OG1 3.38Å; A557-T560 PolarHBondContact O-N 3.12Å; T560-Y564 WeakPolarHBondContact O-CB 3.42Å; T560-Y564 PolarHBondContact O-N 3.05Å
561	L	48.2	Very low	51	Low	83 Å²	83	93.2 Å²	93.2	44%	0.435	55%	0.549	S	S	.	.	H	α-helix	trans	-67.3	-42.5	174.4	-96.1	143.1	0	0	0	111.8	A557 A558 Q559 Y564 Y565	A557-L561 PolarHBondContact O-N 2.89Å; A557-L561 VanDerWaalsContact O-N 3.14Å; A558-L561 PolarHBondContact O-N 3.36Å; Q559-L561 VanDerWaalsContact C-N 3.35Å; Q559-L561 PolarHBondContact O-N 2.9Å; L561-Y564 PolarHBondContact O-N 3.41Å; L561-Y565 HydrophobicContact CD2-CD2 4.2Å; L561-Y565 HydrophobicContact CD2-CE2 3.58Å; L561-Y565 WeakPolarHBondContact O-CD2 3.35Å; L561-Y565 PolarHBondContact O-N 3.44Å
562	S	49.5	Very low	52.3	Low	65 Å²	65	92.7 Å²	92.7	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-61.1	-47.4	174	-63	0	0	0	0	111.9	A558 Q559 Y564 Y565 I566	A558-S562 PolarHBondContact O-N 2.75Å; A558-S562 PolarHBondContact O-OG 2.85Å; Q559-S562 PolarHBondContact O-N 3.06Å; S562-Y564 VanDerWaalsContact C-N 3.3Å; S562-Y564 PolarHBondContact O-N 2.9Å; S562-Y565 PolarHBondContact O-N 3.36Å; S562-I566 WeakPolarHBondContact O-CB 3.38Å; S562-I566 WeakPolarHBondContact O-CG1 3.31Å; S562-I566 PolarHBondContact O-N 3.5Å
563	D	55	Low	53.8	Low	96 Å²	96	92.6 Å²	92.6	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-63.4	-35.5	177.8	-73.2	-17.6	0	0	0	112.3	Q559 K567	Q559-D563 PolarHBondContact O-N 3.19Å; D563-K567 WeakPolarHBondContact O-CB 3.32Å; D563-K567 VanDerWaalsContact O-CG 3.28Å; D563-K567 WeakPolarHBondContact O-CG 2.94Å; D563-K567 PolarHBondContact O-N 3.06Å
564	Y	58.4	Low	56	Low	106 Å²	106	90.4 Å²	90.4	42%	0.416	48%	0.475	S	S	.	.	H	α-helix	trans	-66.4	-43.8	175.3	-179.6	-95.8	0	0	0	112	T560 L561 S562 R568	T560-Y564 WeakPolarHBondContact O-CB 3.42Å; T560-Y564 PolarHBondContact O-N 3.05Å; L561-Y564 PolarHBondContact O-N 3.41Å; S562-Y564 VanDerWaalsContact C-N 3.3Å; S562-Y564 PolarHBondContact O-N 2.9Å; Y564-R568 WeakPolarHBondContact O-CB 3.23Å; Y564-R568 PolarHBondContact O-N 3.41Å; Y564-R568 PolarHBondContact OH-NH1 3.22Å
565	Y	58.1	Low	58.4	Low	73 Å²	73	88.7 Å²	88.7	29%	0.286	46%	0.458	S	S	.	.	H	α-helix	trans	-74.6	-36	178.7	-78.2	-64.4	0	0	0	113	A511 L561 S562 R568 A569	A511-Y565 HydrophobicContact CB-CD1 3.81Å; A511-Y565 HydrophobicContact CB-CE1 3.74Å; L561-Y565 HydrophobicContact CD2-CD2 4.2Å; L561-Y565 HydrophobicContact CD2-CE2 3.58Å; L561-Y565 WeakPolarHBondContact O-CD2 3.35Å; L561-Y565 PolarHBondContact O-N 3.44Å; S562-Y565 PolarHBondContact O-N 3.36Å; Y565-R568 PolarHBondContact O-N 3.02Å; Y565-A569 WeakPolarHBondContact O-CB 3.27Å; Y565-A569 PolarHBondContact O-N 2.99Å
566	I	58.9	Low	60.7	Low	94 Å²	94	84.4 Å²	84.4	48%	0.482	43%	0.428	S	S	.	.	H	α-helix	trans	-64.2	-47.9	174.7	-69.8	166.3	0	0	0	110.2	S562 R568 A569 E570	S562-I566 WeakPolarHBondContact O-CB 3.38Å; S562-I566 WeakPolarHBondContact O-CG1 3.31Å; S562-I566 PolarHBondContact O-N 3.5Å; I566-R568 PolarHBondContact O-N 3.44Å; I566-A569 WeakPolarHBondContact O-CB 3.44Å; I566-A569 PolarHBondContact O-N 3.37Å; I566-E570 PolarHBondContact O-N 3.37Å
567	K	58.8	Low	63.1	Low	139 Å²	139	79 Å²	79	60%	0.604	41%	0.41	S	S	*	.	H	α-helix	trans	-60.7	-30.9	175.5	-76.6	178.9	179.9	177.5	0	113	D563 Q571	D563-K567 WeakPolarHBondContact O-CB 3.32Å; D563-K567 VanDerWaalsContact O-CG 3.28Å; D563-K567 WeakPolarHBondContact O-CG 2.94Å; D563-K567 PolarHBondContact O-N 3.06Å; K567-Q571 WeakPolarHBondContact O-CG 3.38Å
568	R	59.3	Low	65.5	Low	98 Å²	98	76.7 Å²	76.7	37%	0.37	39%	0.39	S	S	.	.	H	α-helix	trans	-76.1	-34.9	174.9	-161.3	170.9	-174.6	128.4	3.7	111.8	Y564 Y565 I566 Q571 Y572	Y564-R568 WeakPolarHBondContact O-CB 3.23Å; Y564-R568 PolarHBondContact O-N 3.41Å; Y564-R568 PolarHBondContact OH-NH1 3.22Å; Y565-R568 PolarHBondContact O-N 3.02Å; I566-R568 PolarHBondContact O-N 3.44Å; R568-Q571 PolarHBondContact O-N 2.92Å; R568-Y572 HydrophobicContact CG-CE2 3.97Å; R568-Y572 PolarHBondContact NE-OH 3.43Å; R568-Y572 WeakPolarHBondContact O-CD2 3.32Å; R568-Y572 WeakPolarHBondContact O-CE2 3.21Å
569	A	59.3	Low	67.8	Low	60 Å²	60	76.9 Å²	76.9	50%	0.496	40%	0.395	S	S	.	.	H	α-helix	trans	-64.8	-40.2	174.8	0	0	0	0	0	112	Y565 I566 Q571 Y572	Y565-A569 WeakPolarHBondContact O-CB 3.27Å; Y565-A569 PolarHBondContact O-N 2.99Å; I566-A569 WeakPolarHBondContact O-CB 3.44Å; I566-A569 PolarHBondContact O-N 3.37Å; A569-Q571 VanDerWaalsContact C-N 3.26Å; A569-Q571 PolarHBondContact O-N 3.33Å; A569-Y572 PolarHBondContact O-N 3.08Å
570	E	65	Low	70	Confident	133 Å²	133	73.5 Å²	73.5	62%	0.621	39%	0.39	S	S	*	.	H	α-helix	trans	-64.3	-26.8	177.7	-71.9	177.5	166	0	0	113.6	I566 Y572 H573	I566-E570 PolarHBondContact O-N 3.37Å; E570-Y572 PolarHBondContact O-N 3.23Å; E570-H573 PolarHBondContact O-CE1 3.32Å
571	Q	62.9	Low	71.9	Confident	146 Å²	146	71.3 Å²	71.3	68%	0.682	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-11.3	177.1	-70.9	176.2	7.9	0	0	113.4	K567 R568 A569	K567-Q571 WeakPolarHBondContact O-CG 3.38Å; R568-Q571 PolarHBondContact O-N 2.92Å; A569-Q571 VanDerWaalsContact C-N 3.26Å; A569-Q571 PolarHBondContact O-N 3.33Å
572	Y	66.7	Low	74.1	Confident	69 Å²	69	69.8 Å²	69.8	27%	0.271	38%	0.378	S	S	.	.			trans	-95.4	106.5	-178.6	-62.5	-62.7	0	0	0	111.3	N504 R568 A569 E570	N504-Y572 VanDerWaalsContact ND2-CB 3.3Å; N504-Y572 WeakPolarHBondContact ND2-CB 3.47Å; N504-Y572 VanDerWaalsContact OD1-CD1 3.31Å; N504-Y572 WeakPolarHBondContact OD1-CD1 3.41Å; N504-Y572 VanDerWaalsContact OD1-CG 3.24Å; R568-Y572 HydrophobicContact CG-CE2 3.97Å; R568-Y572 PolarHBondContact NE-OH 3.43Å; R568-Y572 WeakPolarHBondContact O-CD2 3.32Å; R568-Y572 WeakPolarHBondContact O-CE2 3.21Å; A569-Y572 PolarHBondContact O-N 3.08Å; E570-Y572 PolarHBondContact O-N 3.23Å
573	H	76	Confident	76.3	Confident	77 Å²	77	72.1 Å²	72.1	36%	0.356	38%	0.382	S	S	.	.			trans	-102.3	149.2	171.6	-59.2	-52.9	0	0	0	111.1	N416 S418 E570	N416-H573 VanDerWaalsContact OD1-CB 3.3Å; N416-H573 WeakPolarHBondContact OD1-CB 3.31Å; S418-H573 PolarHBondContact OG-CE1 3.06Å; S418-H573 PolarHBondContact OG-ND1 3.32Å; E570-H573 PolarHBondContact O-CE1 3.32Å
574	P	86.8	Confident	78.2	Confident	24 Å²	24	67.7 Å²	67.7	16%	0.156	36%	0.358	C	S	.	.			trans	-56.8	142.8	167.1	23.1	-31.4	0	0	0	110	A417 V459 V500 M502	A417-P574 WeakPolarHBondContact CA-O 3.24Å; A417-P574 HydrophobicContact CB-CB 4.22Å; A417-P574 HydrophobicContact CB-CG 4.13Å; A417-P574 WeakPolarHBondContact CB-O 3.34Å; A417-P574 PolarHBondContact N-O 3.03Å; A417-P574 WeakPolarHBondContact O-CG 3.38Å; V459-P574 HydrophobicContact CG2-CB 4.38Å; V459-P574 HydrophobicContact CG2-CG 3.99Å; V500-P574 HydrophobicContact CG1-CB 3.89Å; M502-P574 HydrophobicContact SD-CB 3.6Å; M502-P574 HydrophobicContact SD-CG 4.41Å
575	V	89.6	Confident	80.1	Confident	20 Å²	20	64.8 Å²	64.8	12%	0.121	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147	175.3	-62.4	0	0	0	0	110.7	D414 A415 V501 R503	D414-V575 HydrophobicContact CB-CB 4.42Å; A415-V575 WeakPolarHBondContact O-CA 3.18Å; V501-V575 PolarHBondContact N-O 2.89Å; V501-V575 WeakPolarHBondContact O-CG2 3.5Å; V501-V575 PolarHBondContact O-N 3.17Å; V501-V575 VanDerWaalsContact O-N 3.1Å; R503-V575 HydrophobicContact CG-CG2 4.02Å
576	I	92.9	Very high	81.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	100.5	172.7	-59.5	176	0	0	0	107.2	A415 A417 V500 I578	A415-I576 HydrophobicContact CB-CB 4.48Å; A415-I576 PolarHBondContact N-O 3.06Å; A415-I576 PolarHBondContact O-N 2.83Å; A417-I576 HydrophobicContact CB-CD1 4.17Å; A417-I576 HydrophobicContact CB-CG1 4.1Å; V500-I576 HydrophobicContact CG2-CD1 4.21Å; V500-I576 HydrophobicContact CG2-CG1 4.08Å; I576-I578 HydrophobicContact CG2-CD1 3.88Å; I576-I578 PolarHBondContact O-N 3.15Å
577	P	92.7	Very high	83.7	Confident	52 Å²	52	58.2 Å²	58.2	34%	0.338	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	117.4	-179.8	29.2	-30.5	0	0	0	109.9	D414 E499 V501	D414-P577 WeakPolarHBondContact OD1-CA 3.25Å; D414-P577 WeakPolarHBondContact OD1-CB 3.41Å; E499-P577 WeakPolarHBondContact O-CD 3.48Å; V501-P577 HydrophobicContact CG2-CG 3.94Å
578	I	94.5	Very high	85.5	Confident	9 Å²	9	51.6 Å²	51.6	5%	0.046	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	114.9	171.8	-54.4	-57.5	0	0	0	108.3	L409 G412 A413 M428 A464 I496 I576	L409-I578 HydrophobicContact CD2-CG2 3.6Å; G412-I578 CarbonylContact C-O 3.53Å; G412-I578 WeakPolarHBondContact CA-O 3.37Å; A413-I578 PolarHBondContact N-O 3.18Å; A413-I578 VanDerWaalsContact N-O 3.09Å; A413-I578 PolarHBondContact O-N 3.33Å; M428-I578 HydrophobicContact CE-CB 4.11Å; M428-I578 HydrophobicContact CE-CG2 3.82Å; A464-I578 HydrophobicContact CB-CD1 3.78Å; A464-I578 HydrophobicContact CB-CG1 3.5Å; A464-I578 VanDerWaalsContact CB-CG1 3.5Å; I496-I578 HydrophobicContact CB-CD1 4.13Å; I496-I578 HydrophobicContact CB-CG2 4.35Å; I496-I578 HydrophobicContact CD1-CG2 3.95Å; I496-I578 HydrophobicContact CG2-CD1 3.99Å; I496-I578 HydrophobicContact CG2-CG2 3.91Å; I576-I578 HydrophobicContact CG2-CD1 3.88Å; I576-I578 PolarHBondContact O-N 3.15Å
579	G	91.8	Very high	87.2	Confident	44 Å²	44	51.8 Å²	51.8	45%	0.454	30%	0.3	S	S	.	.			trans	-75.2	159.1	176	0	0	0	0	0	113.4	L409 N582	L409-G579 WeakPolarHBondContact CD2-O 3.48Å; G579-N582 PolarHBondContact O-ND2 2.85Å
580	A	93.1	Very high	88.9	Confident	62 Å²	62	52.7 Å²	52.7	51%	0.512	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	165.8	167.5	0	0	0	0	0	112	I410 N582	I410-A580 WeakPolarHBondContact O-CB 3.4Å; A580-N582 VanDerWaalsContact C-N 3.35Å
581	G	93.3	Very high	90.2	Very high	47 Å²	47	47.5 Å²	47.5	49%	0.485	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	-5	176.5	0	0	0	0	0	115.2	L409 E583	L409-G581 PolarHBondContact O-N 2.98Å; G581-E583 PolarHBondContact O-N 2.89Å
582	N	93.1	Very high	91.6	Very high	52 Å²	52	41.4 Å²	41.4	28%	0.278	25%	0.249	S	C	.	.			trans	-67.5	126.2	176.8	-72.4	-52.7	0	0	0	111.3	L409 G579 A580 V584	L409-N582 HydrophobicContact CB-CB 4.36Å; L409-N582 PolarHBondContact N-O 2.78Å; G579-N582 PolarHBondContact O-ND2 2.85Å; A580-N582 VanDerWaalsContact C-N 3.35Å; N582-V584 HydrophobicContact CB-CG1 4.35Å
583	E	95.1	Very high	92.8	Very high	114 Å²	114	40.2 Å²	40.2	53%	0.533	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	124	168.2	-170.4	-178.3	177.8	0	0	109.1	K406 A407 G581	K406-E583 IonicContact NZ-OE1 3.97Å; A407-E583 WeakPolarHBondContact O-CA 3.43Å; G581-E583 PolarHBondContact O-N 2.89Å
584	V	96.4	Very high	93.4	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.018	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	159.3	-176	-63.2	0	0	0	0	110.2	A407 L430 V488 F490 I496 N582	A407-V584 CarbonylContact C-O 3.57Å; A407-V584 HydrophobicContact CB-CG2 4.04Å; A407-V584 PolarHBondContact N-O 3.25Å; A407-V584 PolarHBondContact O-N 3.46Å; L430-V584 HydrophobicContact CD2-CG2 4.03Å; V488-V584 HydrophobicContact CG1-CB 3.43Å; V488-V584 VanDerWaalsContact CG1-CB 3.43Å; V488-V584 HydrophobicContact CG1-CG1 3.88Å; V488-V584 HydrophobicContact CG1-CG2 3.72Å; F490-V584 HydrophobicContact CD2-CG1 4.14Å; I496-V584 HydrophobicContact CD1-CG1 4.01Å; I496-V584 HydrophobicContact CG1-CG1 4.2Å; N582-V584 HydrophobicContact CB-CG1 4.35Å
585	T	97.1	Very high	93.6	Very high	44 Å²	44	38.1 Å²	38.1	27%	0.27	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	119.1	172.8	-58.9	0	0	0	0	108.9	F404 A405 S489 V587	F404-T585 HydrophobicContact CB-CG2 3.88Å; F404-T585 HydrophobicContact CD2-CG2 3.88Å; F404-T585 HydrophobicContact CG-CG2 4.25Å; A405-T585 WeakPolarHBondContact O-CA 3.46Å; S489-T585 PolarHBondContact N-O 3.11Å; S489-T585 PolarHBondContact O-N 3.49Å; T585-V587 HydrophobicContact CG2-CG2 4.27Å
586	V	96.9	Very high	93.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	130.9	169.9	61.8	0	0	0	0	108.9	F404 A405 L430 T468 F588	F404-V586 CarbonylContact C-O 3.59Å; F404-V586 WeakPolarHBondContact CA-O 3.43Å; F404-V586 VanDerWaalsContact CB-O 3.31Å; F404-V586 WeakPolarHBondContact CB-O 3.42Å; A405-V586 HydrophobicContact CB-CG1 4Å; A405-V586 PolarHBondContact N-O 2.95Å; A405-V586 PolarHBondContact O-N 2.9Å; L430-V586 HydrophobicContact CD2-CB 4.21Å; T468-V586 HydrophobicContact CG2-CG2 3.71Å; V586-F588 HydrophobicContact CG1-CZ 4.19Å; V586-F588 HydrophobicContact CG2-CE1 4.28Å
587	V	96.5	Very high	93.5	Very high	30 Å²	30	40.3 Å²	40.3	18%	0.182	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	119.4	178.7	-177.3	0	0	0	0	108.5	F404 G486 H487 T585	F404-V587 HydrophobicContact CB-CB 4.5Å; F404-V587 HydrophobicContact CB-CG2 4.04Å; G486-V587 CarbonylContact C-O 3.56Å; G486-V587 WeakPolarHBondContact CA-O 3.48Å; H487-V587 PolarHBondContact N-O 2.83Å; H487-V587 PolarHBondContact O-N 2.77Å; T585-V587 HydrophobicContact CG2-CG2 4.27Å
588	F	96.1	Very high	93.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	119.9	178.5	-56.1	-69.6	0	0	0	109.6	I399 G402 S403 V436 I484 V586 F592	I399-F588 HydrophobicContact CG2-CD2 4.1Å; G402-F588 WeakPolarHBondContact CA-O 3.25Å; G402-F588 PolarHBondContact N-O 2.86Å; S403-F588 VanDerWaalsContact O-CD2 3.26Å; S403-F588 WeakPolarHBondContact O-CD2 3.39Å; S403-F588 PolarHBondContact O-N 3Å; V436-F588 HydrophobicContact CG1-CD2 4.47Å; V436-F588 HydrophobicContact CG1-CE2 3.99Å; V436-F588 HydrophobicContact CG2-CE2 4.45Å; I484-F588 HydrophobicContact CD1-CD1 3.98Å; I484-F588 HydrophobicContact CD1-CE1 3.56Å; V586-F588 HydrophobicContact CG1-CZ 4.19Å; V586-F588 HydrophobicContact CG2-CE1 4.28Å; F588-F592 HydrophobicContact CB-CE1 4.15Å; F588-F592 AromaticContact CD1-CE1 3.63Å; F588-F592 HydrophobicContact CD1-CE1 3.63Å; F588-F592 HydrophobicContact CD1-CZ 4.05Å; F588-F592 HydrophobicContact CE1-CE1 4.17Å; F588-F592 HydrophobicContact CE1-CZ 4.11Å; F588-F592 AromaticContact CG-CE1 3.86Å; F588-F592 HydrophobicContact CG-CE1 3.86Å; F588-F592 HydrophobicContact CG-CZ 4.46Å
589	Q	94.7	Very high	92.9	Very high	102 Å²	102	45.4 Å²	45.4	48%	0.477	27%	0.266	S	S	.	.	S	Bend	trans	-80.2	-46.8	-176.9	-75.9	174.8	-12.9	0	0	111.2	S401 K485 H487	S401-Q589 WeakPolarHBondContact CB-O 3.36Å; K485-Q589 PolarHBondContact O-N 2.84Å; H487-Q589 PolarHBondContact ND1-NE2 2.95Å
590	D	94.9	Very high	92.7	Very high	79 Å²	79	44.6 Å²	44.6	42%	0.422	25%	0.251	S	S	.	.	S	Bend	trans	-103.3	143	178	-69.4	-4.6	0	0	0	109.4	K485	K485-D590 HydrophobicContact CB-CB 4.26Å; K485-D590 HydrophobicContact CD-CB 4.37Å; K485-D590 WeakPolarHBondContact CD-OD2 3.3Å; K485-D590 IonicContact NZ-OD2 3.08Å; K485-D590 PolarHBondContact NZ-OD2 2.9Å; K485-D590 VanDerWaalsContact NZ-OD2 3.13Å
591	G	92.9	Very high	92.4	Very high	23 Å²	23	44 Å²	44	24%	0.237	25%	0.246	C	C	.	.			trans	-78.1	137.3	173.4	0	0	0	0	0	111	Y398 I399	Y398-G591 VanDerWaalsContact OH-C 3.23Å; Y398-G591 VanDerWaalsContact OH-CA 3.31Å; Y398-G591 WeakPolarHBondContact OH-CA 3.33Å; Y398-G591 PolarHBondContact OH-O 2.88Å; I399-G591 CarbonylContact O-C 3.47Å; I399-G591 WeakPolarHBondContact O-CA 3.42Å
592	F	92.8	Very high	92.1	Very high	19 Å²	19	46.7 Å²	46.7	8%	0.083	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	145.1	-175.6	60.7	-84.5	0	0	0	112	I399 M482 I484 F588 L594	I399-F592 HydrophobicContact CB-CE1 4.12Å; I399-F592 HydrophobicContact CB-CE2 4.35Å; I399-F592 HydrophobicContact CB-CZ 4.04Å; I399-F592 HydrophobicContact CD1-CE2 3.86Å; I399-F592 HydrophobicContact CD1-CZ 3.68Å; I399-F592 HydrophobicContact CG1-CE2 4.47Å; I399-F592 HydrophobicContact CG1-CZ 4.38Å; I399-F592 HydrophobicContact CG2-CE1 4.05Å; I399-F592 HydrophobicContact CG2-CZ 4.19Å; I399-F592 PolarHBondContact N-O 3.42Å; I399-F592 PolarHBondContact O-N 3.22Å; M482-F592 HydrophobicContact CE-CB 4.07Å; M482-F592 HydrophobicContact CE-CD2 3.76Å; M482-F592 HydrophobicContact CE-CG 4.28Å; M482-F592 HydrophobicContact SD-CD2 4.05Å; I484-F592 HydrophobicContact CB-CE1 4.44Å; I484-F592 HydrophobicContact CG2-CD1 4.08Å; I484-F592 HydrophobicContact CG2-CD2 3.98Å; I484-F592 HydrophobicContact CG2-CE1 3.89Å; I484-F592 HydrophobicContact CG2-CE2 3.76Å; I484-F592 HydrophobicContact CG2-CG 4.14Å; I484-F592 HydrophobicContact CG2-CZ 3.71Å; F588-F592 HydrophobicContact CB-CE1 4.15Å; F588-F592 AromaticContact CD1-CE1 3.63Å; F588-F592 HydrophobicContact CD1-CE1 3.63Å; F588-F592 HydrophobicContact CD1-CZ 4.05Å; F588-F592 HydrophobicContact CE1-CE1 4.17Å; F588-F592 HydrophobicContact CE1-CZ 4.11Å; F588-F592 AromaticContact CG-CE1 3.86Å; F588-F592 HydrophobicContact CG-CE1 3.86Å; F588-F592 HydrophobicContact CG-CZ 4.46Å; F592-L594 HydrophobicContact CD2-CD2 4.32Å; F592-L594 HydrophobicContact CE2-CD2 3.71Å; F592-L594 HydrophobicContact CE2-CG 4.18Å
593	Q	91.1	Very high	91.7	Very high	43 Å²	43	47.7 Å²	47.7	20%	0.201	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	118.8	171.3	-179.2	53.7	60.9	0	0	108.2	P394 L396 P397 Y398 M482 K595	P394-Q593 HydrophobicContact CB-CG 4.08Å; P394-Q593 HydrophobicContact CG-CG 4.43Å; L396-Q593 PolarHBondContact O-NE2 3.33Å; P397-Q593 PolarHBondContact O-NE2 3.22Å; Y398-Q593 HydrophobicContact CD2-CB 4.06Å; M482-Q593 WeakPolarHBondContact CE-O 3.36Å; Q593-K595 HydrophobicContact CG-CG 4.19Å; Q593-K595 PolarHBondContact O-N 3.08Å
594	L	90.2	Very high	91.2	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.016	26%	0.259	C	S	.	.			trans	-61.5	127.3	170.2	-76.1	171.9	0	0	0	108.8	L396 P397 I399 Y444 I480 M482 F592	L396-L594 HydrophobicContact CB-CB 3.54Å; L396-L594 HydrophobicContact CB-CD1 4.44Å; L396-L594 HydrophobicContact CD1-CB 3.95Å; L396-L594 HydrophobicContact CG-CB 4.37Å; P397-L594 HydrophobicContact CG-CD1 4.44Å; P397-L594 PolarHBondContact O-N 2.79Å; I399-L594 HydrophobicContact CD1-CD1 3.85Å; I399-L594 HydrophobicContact CD1-CD2 4.35Å; I399-L594 HydrophobicContact CD1-CG 4.04Å; I399-L594 HydrophobicContact CG1-CD1 4.28Å; I399-L594 HydrophobicContact CG1-CG 4.42Å; Y444-L594 HydrophobicContact CD1-CD1 4.15Å; Y444-L594 HydrophobicContact CE1-CD1 3.4Å; Y444-L594 VanDerWaalsContact CE1-CD1 3.4Å; I480-L594 HydrophobicContact CG2-CD2 4.02Å; M482-L594 HydrophobicContact SD-CD2 4.35Å; F592-L594 HydrophobicContact CD2-CD2 4.32Å; F592-L594 HydrophobicContact CE2-CD2 3.71Å; F592-L594 HydrophobicContact CE2-CG 4.18Å
595	K	89.7	Confident	90.7	Very high	55 Å²	55	54.9 Å²	54.9	24%	0.239	28%	0.283	C	S	.	.			trans	-132.1	142.5	178.3	-65.4	179.5	-173.2	-173	0	109.2	Q593 E599 M600 E603	Q593-K595 HydrophobicContact CG-CG 4.19Å; Q593-K595 PolarHBondContact O-N 3.08Å; K595-E599 WeakPolarHBondContact CA-OE2 3.07Å; K595-E599 HydrophobicContact CB-CB 4.45Å; K595-M600 HydrophobicContact CB-CG 3.72Å; K595-M600 HydrophobicContact CD-CG 4.2Å; K595-E603 WeakPolarHBondContact CD-OE2 3.16Å; K595-E603 VanDerWaalsContact CE-OE1 3.31Å; K595-E603 WeakPolarHBondContact CE-OE1 3.43Å; K595-E603 IonicContact NZ-OE1 2.9Å; K595-E603 PolarHBondContact NZ-OE1 3.48Å; K595-E603 IonicContact NZ-OE2 3.53Å; K595-E603 PolarHBondContact NZ-OE2 2.85Å
596	T	90.8	Very high	90	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.012	30%	0.296	C	S	.	.			trans	-75.9	157.6	172.9	60.4	0	0	0	0	110.4	L396 K478 T479 E598 E599 M600	L396-T596 HydrophobicContact CD1-CG2 3.93Å; K478-T596 HydrophobicContact CB-CG2 3.71Å; K478-T596 HydrophobicContact CD-CG2 3.65Å; K478-T596 HydrophobicContact CG-CG2 4.33Å; T479-T596 CarbonylContact O-C 3.51Å; T479-T596 VanDerWaalsContact O-CA 3.32Å; T479-T596 WeakPolarHBondContact O-CA 3.47Å; T596-E598 PolarHBondContact O-N 3.33Å; T596-E599 PolarHBondContact N-OE2 2.9Å; T596-E599 PolarHBondContact O-N 2.9Å; T596-E599 VanDerWaalsContact O-N 3.15Å; T596-E599 WeakPolarHBondContact OG1-CB 3.5Å; T596-E599 VanDerWaalsContact OG1-CD 3.23Å; T596-E599 WeakPolarHBondContact OG1-CG 3.35Å; T596-E599 PolarHBondContact OG1-N 2.85Å; T596-E599 PolarHBondContact OG1-OE2 2.79Å; T596-M600 WeakPolarHBondContact O-CG 3.28Å; T596-M600 PolarHBondContact O-N 2.84Å
597	V	90.4	Very high	89.3	Confident	63 Å²	63	62.3 Å²	62.3	38%	0.382	32%	0.318	S	S	.	.	H	α-helix	trans	-57.3	-35.1	176.3	177.4	0	0	0	0	111.2	T479 D481 M600 A601	T479-V597 HydrophobicContact CG2-CG2 3.96Å; T479-V597 PolarHBondContact O-N 3.05Å; D481-V597 HydrophobicContact CB-CG2 4.06Å; V597-M600 HydrophobicContact CG2-CE 4.4Å; V597-A601 WeakPolarHBondContact O-CB 3.42Å; V597-A601 PolarHBondContact O-N 2.91Å
598	E	87.5	Confident	88.6	Confident	121 Å²	121	68.9 Å²	68.9	57%	0.565	34%	0.339	S	S	*	.	H	α-helix	trans	-65.9	-48.1	175.3	-65.9	154.6	-169.8	0	0	112	T596 M600 A601 L602	T596-E598 PolarHBondContact O-N 3.33Å; E598-M600 PolarHBondContact O-N 2.82Å; E598-A601 PolarHBondContact O-N 2.78Å; E598-L602 WeakPolarHBondContact O-CG 3.48Å; E598-L602 PolarHBondContact O-N 2.81Å
599	E	87.8	Confident	87.7	Confident	48 Å²	48	71.1 Å²	71.1	22%	0.224	36%	0.358	C	S	.	.	H	α-helix	trans	-61.2	-42.7	176.1	-75.1	162.9	164.9	0	0	111.3	S395 K595 T596 A601 L602 E603	S395-E599 WeakPolarHBondContact CB-OE1 3.29Å; S395-E599 PolarHBondContact OG-OE1 3.49Å; K595-E599 WeakPolarHBondContact CA-OE2 3.07Å; K595-E599 HydrophobicContact CB-CB 4.45Å; T596-E599 PolarHBondContact N-OE2 2.9Å; T596-E599 PolarHBondContact O-N 2.9Å; T596-E599 VanDerWaalsContact O-N 3.15Å; T596-E599 WeakPolarHBondContact OG1-CB 3.5Å; T596-E599 VanDerWaalsContact OG1-CD 3.23Å; T596-E599 WeakPolarHBondContact OG1-CG 3.35Å; T596-E599 PolarHBondContact OG1-N 2.85Å; T596-E599 PolarHBondContact OG1-OE2 2.79Å; E599-A601 PolarHBondContact O-N 3.37Å; E599-L602 PolarHBondContact O-N 3.46Å; E599-E603 WeakPolarHBondContact O-CG 3.35Å; E599-E603 PolarHBondContact O-N 2.83Å
600	M	86.3	Confident	86.6	Confident	26 Å²	26	71.9 Å²	71.9	13%	0.128	36%	0.361	C	S	.	.	H	α-helix	trans	-67.2	-34.4	176.4	-67.2	-167	-67.2	0	0	112.8	D481 M482 K595 T596 V597 E598 R604	D481-M600 WeakPolarHBondContact O-CE 3.39Å; M482-M600 HydrophobicContact CB-CE 4.04Å; M482-M600 HydrophobicContact CB-SD 3.85Å; K595-M600 HydrophobicContact CB-CG 3.72Å; K595-M600 HydrophobicContact CD-CG 4.2Å; T596-M600 WeakPolarHBondContact O-CG 3.28Å; T596-M600 PolarHBondContact O-N 2.84Å; V597-M600 HydrophobicContact CG2-CE 4.4Å; E598-M600 PolarHBondContact O-N 2.82Å; M600-R604 WeakPolarHBondContact O-CB 3.47Å; M600-R604 VanDerWaalsContact O-CG 3.31Å; M600-R604 WeakPolarHBondContact O-CG 3.4Å; M600-R604 PolarHBondContact O-N 3.24Å
601	A	87.6	Confident	85.3	Confident	50 Å²	50	74.2 Å²	74.2	41%	0.413	37%	0.37	S	S	.	.	H	α-helix	trans	-65.7	-42.9	175	0	0	0	0	0	111.1	V597 E598 E599 R604 T605	V597-A601 WeakPolarHBondContact O-CB 3.42Å; V597-A601 PolarHBondContact O-N 2.91Å; E598-A601 PolarHBondContact O-N 2.78Å; E599-A601 PolarHBondContact O-N 3.37Å; A601-R604 PolarHBondContact O-N 3.48Å; A601-T605 WeakPolarHBondContact O-CG2 3.15Å; A601-T605 PolarHBondContact O-N 3.41Å; A601-T605 PolarHBondContact O-OG1 3.2Å
602	L	87	Confident	84	Confident	104 Å²	104	79.2 Å²	79.2	55%	0.545	39%	0.387	S	S	.	.	H	α-helix	trans	-62.2	-46.2	175.1	-69.5	168.5	0	0	0	111.5	E598 E599 R604 T605 Q606	E598-L602 WeakPolarHBondContact O-CG 3.48Å; E598-L602 PolarHBondContact O-N 2.81Å; E599-L602 PolarHBondContact O-N 3.46Å; L602-R604 PolarHBondContact O-N 2.92Å; L602-T605 WeakPolarHBondContact CA-OG1 3.2Å; L602-T605 PolarHBondContact O-N 2.8Å; L602-T605 PolarHBondContact O-OG1 3.45Å; L602-Q606 WeakPolarHBondContact O-CG 3.48Å; L602-Q606 PolarHBondContact O-N 3.3Å
603	E	84.4	Confident	82.5	Confident	72 Å²	72	84.6 Å²	84.6	34%	0.336	42%	0.417	S	S	.	.	H	α-helix	trans	-61.7	-41.1	176.7	-73.7	179.8	172.5	0	0	112.4	K595 E599 T605 Q606 N607	K595-E603 WeakPolarHBondContact CD-OE2 3.16Å; K595-E603 VanDerWaalsContact CE-OE1 3.31Å; K595-E603 WeakPolarHBondContact CE-OE1 3.43Å; K595-E603 IonicContact NZ-OE1 2.9Å; K595-E603 PolarHBondContact NZ-OE1 3.48Å; K595-E603 IonicContact NZ-OE2 3.53Å; K595-E603 PolarHBondContact NZ-OE2 2.85Å; E599-E603 WeakPolarHBondContact O-CG 3.35Å; E599-E603 PolarHBondContact O-N 2.83Å; E603-T605 VanDerWaalsContact C-N 3.32Å; E603-T605 PolarHBondContact O-N 3.09Å; E603-Q606 PolarHBondContact O-N 2.61Å; E603-N607 WeakPolarHBondContact O-CB 3.34Å; E603-N607 VanDerWaalsContact O-CG 3.23Å; E603-N607 PolarHBondContact O-N 3.39Å; E603-N607 PolarHBondContact O-OD1 2.93Å
604	R	84.7	Confident	80.9	Confident	181 Å²	181	90.4 Å²	90.4	68%	0.683	44%	0.444	S	S	*	.	H	α-helix	trans	-61.9	-39.1	174.8	-75.5	177.3	-172.5	170.2	4.5	112.2	M600 A601 L602 R608	M600-R604 WeakPolarHBondContact O-CB 3.47Å; M600-R604 VanDerWaalsContact O-CG 3.31Å; M600-R604 WeakPolarHBondContact O-CG 3.4Å; M600-R604 PolarHBondContact O-N 3.24Å; A601-R604 PolarHBondContact O-N 3.48Å; L602-R604 PolarHBondContact O-N 2.92Å; R604-R608 WeakPolarHBondContact O-CB 3.37Å; R604-R608 PolarHBondContact O-N 3.22Å; R604-R608 VanDerWaalsContact O-N 3.1Å
605	T	86.1	Confident	79	Confident	87 Å²	87	98.2 Å²	98.2	53%	0.534	48%	0.48	S	S	.	.	H	α-helix	trans	-69.5	-36.5	176.1	56.6	0	0	0	0	112.7	A601 L602 E603 A609	A601-T605 WeakPolarHBondContact O-CG2 3.15Å; A601-T605 PolarHBondContact O-N 3.41Å; A601-T605 PolarHBondContact O-OG1 3.2Å; L602-T605 WeakPolarHBondContact CA-OG1 3.2Å; L602-T605 PolarHBondContact O-N 2.8Å; L602-T605 PolarHBondContact O-OG1 3.45Å; E603-T605 VanDerWaalsContact C-N 3.32Å; E603-T605 PolarHBondContact O-N 3.09Å; T605-A609 WeakPolarHBondContact O-CB 3.29Å; T605-A609 PolarHBondContact O-N 3.46Å; T605-A609 VanDerWaalsContact O-N 3.11Å
606	Q	82.1	Confident	76.9	Confident	115 Å²	115	99.9 Å²	99.9	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-67.3	-47.7	176.3	-73	175.9	2.7	0	0	111.2	L602 E603 R608 A609 E610	L602-Q606 WeakPolarHBondContact O-CG 3.48Å; L602-Q606 PolarHBondContact O-N 3.3Å; E603-Q606 PolarHBondContact O-N 2.61Å; Q606-R608 VanDerWaalsContact C-N 3.31Å; Q606-R608 PolarHBondContact O-N 3.31Å; Q606-A609 PolarHBondContact O-N 3.4Å; Q606-A609 VanDerWaalsContact O-N 3.14Å; Q606-E610 WeakPolarHBondContact O-CG 3.47Å; Q606-E610 PolarHBondContact O-N 3.1Å
607	N	81.9	Confident	74.7	Confident	86 Å²	86	105.8 Å²	105.8	46%	0.46	54%	0.537	S	S	.	.	H	α-helix	trans	-61.7	-40.2	178.5	-66.9	-6.7	0	0	0	111.6	E603 A609 E610 E611	E603-N607 WeakPolarHBondContact O-CB 3.34Å; E603-N607 VanDerWaalsContact O-CG 3.23Å; E603-N607 PolarHBondContact O-N 3.39Å; E603-N607 PolarHBondContact O-OD1 2.93Å; N607-A609 VanDerWaalsContact C-N 3.34Å; N607-A609 PolarHBondContact O-N 3.17Å; N607-E610 PolarHBondContact O-N 3.12Å; N607-E611 WeakPolarHBondContact O-CG 3.46Å; N607-E611 PolarHBondContact O-N 3.19Å
608	R	80.7	Confident	72.7	Confident	167 Å²	167	108.5 Å²	108.5	63%	0.63	55%	0.553	S	S	*	*	H	α-helix	trans	-65.1	-36.7	176.3	-170.3	175.1	173	165.5	2.3	112.6	R604 Q606 E610 E612	R604-R608 WeakPolarHBondContact O-CB 3.37Å; R604-R608 PolarHBondContact O-N 3.22Å; R604-R608 VanDerWaalsContact O-N 3.1Å; Q606-R608 VanDerWaalsContact C-N 3.31Å; Q606-R608 PolarHBondContact O-N 3.31Å; R608-E610 VanDerWaalsContact C-N 3.33Å; R608-E612 IonicContact NE-OE1 2.64Å; R608-E612 WeakPolarHBondContact O-CB 3.42Å; R608-E612 WeakPolarHBondContact O-CG 3.31Å; R608-E612 PolarHBondContact O-N 3.01Å
609	A	77.5	Confident	70.7	Confident	47 Å²	47	108.5 Å²	108.5	39%	0.388	56%	0.564	S	S	.	*	H	α-helix	trans	-72.1	-25.9	175.5	0	0	0	0	0	113.1	T605 Q606 N607 N613	T605-A609 WeakPolarHBondContact O-CB 3.29Å; T605-A609 PolarHBondContact O-N 3.46Å; T605-A609 VanDerWaalsContact O-N 3.11Å; Q606-A609 PolarHBondContact O-N 3.4Å; Q606-A609 VanDerWaalsContact O-N 3.14Å; N607-A609 VanDerWaalsContact C-N 3.34Å; N607-A609 PolarHBondContact O-N 3.17Å; A609-N613 PolarHBondContact O-N 3.31Å; A609-N613 PolarHBondContact O-ND2 2.75Å
610	E	72.2	Confident	68.6	Low	118 Å²	118	112.2 Å²	112.2	55%	0.551	59%	0.59	S	S	*	*	H	α-helix	trans	-78.9	-39	173.5	-71.7	-177.3	175.7	0	0	112	Q606 N607 R608 N613 Q614	Q606-E610 WeakPolarHBondContact O-CG 3.47Å; Q606-E610 PolarHBondContact O-N 3.1Å; N607-E610 PolarHBondContact O-N 3.12Å; R608-E610 VanDerWaalsContact C-N 3.33Å; E610-N613 PolarHBondContact O-N 3.25Å; E610-Q614 WeakPolarHBondContact O-CG 3.49Å; E610-Q614 PolarHBondContact O-N 3.29Å; E610-Q614 VanDerWaalsContact O-N 3.12Å
611	E	67.7	Low	66.6	Low	128 Å²	128	115.8 Å²	115.8	60%	0.598	62%	0.615	S	S	*	*	H	α-helix	trans	-63.4	-45.3	173.4	-73.9	174.1	177.7	0	0	111.2	N607 N613 Q614 E615	N607-E611 WeakPolarHBondContact O-CG 3.46Å; N607-E611 PolarHBondContact O-N 3.19Å; E611-N613 PolarHBondContact O-N 3.38Å; E611-Q614 PolarHBondContact O-N 3.23Å; E611-Q614 VanDerWaalsContact O-N 3.13Å; E611-E615 PolarHBondContact O-N 2.97Å
612	E	65.7	Low	64.2	Low	129 Å²	129	119.9 Å²	119.9	60%	0.603	64%	0.637	S	S	*	*	H	α-helix	trans	-63.5	-24.9	175.9	-76.2	176.3	-176	0	0	113	R608	R608-E612 IonicContact NE-OE1 2.64Å; R608-E612 WeakPolarHBondContact O-CB 3.42Å; R608-E612 WeakPolarHBondContact O-CG 3.31Å; R608-E612 PolarHBondContact O-N 3.01Å
613	N	61.9	Low	62	Low	131 Å²	131	120.6 Å²	120.6	70%	0.701	65%	0.651	S	S	*	*	H	α-helix	trans	-87.2	-17.7	175.9	-86.4	-52.1	0	0	0	114.1	A609 E610 E611	A609-N613 PolarHBondContact O-N 3.31Å; A609-N613 PolarHBondContact O-ND2 2.75Å; E610-N613 PolarHBondContact O-N 3.25Å; E611-N613 PolarHBondContact O-N 3.38Å
614	Q	57.4	Low	59.8	Low	166 Å²	166	121.5 Å²	121.5	78%	0.776	67%	0.671	S	S	*	*	H	α-helix	trans	-91	-11.3	178.2	-73.7	-178.2	21.1	0	0	113.5	E610 E611 S616	E610-Q614 WeakPolarHBondContact O-CG 3.49Å; E610-Q614 PolarHBondContact O-N 3.29Å; E610-Q614 VanDerWaalsContact O-N 3.12Å; E611-Q614 PolarHBondContact O-N 3.23Å; E611-Q614 VanDerWaalsContact O-N 3.13Å; Q614-S616 VanDerWaalsContact C-N 3.34Å; Q614-S616 PolarHBondContact O-N 2.98Å
615	E	50.3	Low	57.6	Low	167 Å²	167	121.5 Å²	121.5	78%	0.78	68%	0.678	S	S	*	*			trans	-89.8	16.9	-178.5	-122.6	164.1	131.6	0	0	115.2	E611 P617	E611-E615 PolarHBondContact O-N 2.97Å; E615-P617 WeakPolarHBondContact O-CD 3.33Å
616	S	44.8	Very low	55.2	Low	90 Å²	90	121.9 Å²	121.9	63%	0.629	69%	0.685	S	S	*	*			trans	-73.9	118.5	169	-74.4	0	0	0	0	111	Q614 V618	Q614-S616 VanDerWaalsContact C-N 3.34Å; Q614-S616 PolarHBondContact O-N 2.98Å; S616-V618 PolarHBondContact O-N 2.85Å; S616-V618 VanDerWaalsContact O-N 3.15Å
617	P	45.6	Very low	53.3	Low	125 Å²	125	125.2 Å²	125.2	81%	0.812	70%	0.7	S	S	*	*			trans	-76.1	107.1	-176.3	29.5	-30.7	0	0	0	110	E615 P619	E615-P617 WeakPolarHBondContact O-CD 3.33Å; P617-P619 WeakPolarHBondContact O-CD 3.43Å
618	V	47.1	Very low	51.2	Low	120 Å²	120	128.6 Å²	128.6	73%	0.727	72%	0.717	S	S	*	*			trans	-89	117.1	163.3	-174	0	0	0	0	108.1	S616 V620	S616-V618 PolarHBondContact O-N 2.85Å; S616-V618 VanDerWaalsContact O-N 3.15Å; V618-V620 PolarHBondContact O-N 3.19Å
619	P	44.9	Very low	49.4	Very low	121 Å²	121	128.8 Å²	128.8	79%	0.786	73%	0.731	S	S	*	*			trans	-74.3	111.2	174.7	28.1	-28.9	0	0	0	109.1	P617	P617-P619 WeakPolarHBondContact O-CD 3.43Å
620	V	45.4	Very low	47.5	Very low	126 Å²	126	130 Å²	130	76%	0.764	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-95.2	125.3	172.5	-171.9	0	0	0	0	108.6	V618	V618-V620 PolarHBondContact O-N 3.19Å
621	P	43.3	Very low	46.2	Very low	101 Å²	101	131.9 Å²	131.9	66%	0.656	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-72.5	155.7	-179.6	30.1	-34.2	0	0	0	111.9	S623	P621-S623 PolarHBondContact O-N 2.9Å
622	P	36.8	Very low	45.4	Very low	136 Å²	136	130.6 Å²	130.6	88%	0.883	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-79.4	120.7	-169	32.2	-31.3	0	0	0	110.2
623	S	40.8	Very low	45	Very low	119 Å²	119	129.2 Å²	129.2	83%	0.832	75%	0.752	S	S	*	*			trans	-134.9	139.8	159.9	42.7	0	0	0	0	109	P621	P621-S623 PolarHBondContact O-N 2.9Å
624	A	38.1	Very low	45.1	Very low	91 Å²	91	128.4 Å²	128.4	75%	0.752	75%	0.748	S	S	*	*			trans	-70.6	171.7	-163.5	0	0	0	0	0	113.4
625	E	39.1	Very low	45.4	Very low	181 Å²	181	126 Å²	126	85%	0.846	74%	0.737	S	S	*	*			trans	103.1	100.6	160.3	-55.1	-175.7	157.9	0	0	116.6
626	S	36.6	Very low	45.8	Very low	96 Å²	96	123.1 Å²	123.1	67%	0.671	73%	0.725	S	S	*	*			trans	62.2	101.9	133.6	64.3	0	0	0	0	118.6
627	H	41.8	Very low	46.8	Very low	185 Å²	185	124.8 Å²	124.8	86%	0.856	73%	0.726	S	S	*	*				175.6	114.3	99.9	-99.8	-86.1	0	0	0	109.7	N629	H627-N629 PolarHBondContact O-N 2.94Å
628	L	38	Very low	47.6	Very low	156 Å²	156	127.1 Å²	127.1	82%	0.817	72%	0.723	S	S	*	*			trans	-73.6	116.2	174.5	-71.3	148.6	0	0	0	109.1
629	N	41.8	Very low	48.2	Very low	171 Å²	171	128.1 Å²	128.1	91%	0.914	72%	0.72	S	S	*	*			trans	-178.3	106	152.7	-89	-23.9	0	0	0	108.8	H627	H627-N629 PolarHBondContact O-N 2.94Å
630	G	39	Very low	48.7	Very low	73 Å²	73	126.7 Å²	126.7	75%	0.753	71%	0.705	S	S	*	*			trans	150.7	17.8	167.9	0	0	0	0	0	118.7	N632	G630-N632 PolarHBondContact O-N 3.32Å; G630-N632 VanDerWaalsContact O-N 3.16Å
631	F	44.6	Very low	49.2	Very low	158 Å²	158	123.7 Å²	123.7	69%	0.693	70%	0.7	S	S	*	*			trans	-73	108.9	172.2	-84.9	-80.5	0	0	0	110.6
632	N	51	Low	49.8	Very low	101 Å²	101	126 Å²	126	54%	0.54	71%	0.706	S	S	.	*			trans	-75.4	137	170.2	-165.6	-9.9	0	0	0	109.3	G630 D634 Q635	G630-N632 PolarHBondContact O-N 3.32Å; G630-N632 VanDerWaalsContact O-N 3.16Å; N632-D634 PolarHBondContact O-N 3.09Å; N632-Q635 PolarHBondContact O-N 3.34Å
633	T	57.6	Low	50.5	Low	99 Å²	99	123.4 Å²	123.4	61%	0.607	69%	0.685	S	S	*	*	H	α-helix	trans	-51.5	-28.3	-171.3	-2.3	0	0	0	0	114.2	M636 L637	T633-M636 PolarHBondContact O-N 3.04Å; T633-L637 PolarHBondContact O-N 3.25Å; T633-L637 VanDerWaalsContact O-N 3.16Å
634	D	62.6	Low	51	Low	114 Å²	114	121.1 Å²	121.1	61%	0.61	66%	0.663	S	S	*	*	H	α-helix	trans	-73.3	-27.5	-178.9	-65.9	-34.4	0	0	0	114	N632 K638	N632-D634 PolarHBondContact O-N 3.09Å; D634-K638 PolarHBondContact O-N 3.05Å
635	Q	64.2	Low	51.7	Low	117 Å²	117	121.6 Å²	121.6	55%	0.547	66%	0.658	S	S	.	*	H	α-helix	trans	-75.9	-32.8	173.8	-81	-175.9	-32.9	0	0	111.7	N632 Q639	N632-Q635 PolarHBondContact O-N 3.34Å; Q635-Q639 PolarHBondContact O-N 2.7Å; Q635-Q639 VanDerWaalsContact O-N 3.15Å
636	M	59.2	Low	52.6	Low	106 Å²	106	120.2 Å²	120.2	52%	0.522	65%	0.652	S	S	.	*	H	α-helix	trans	-68.5	-39.5	176.5	-148.3	176.5	71.3	0	0	110.9	T633 Q639 L640	T633-M636 PolarHBondContact O-N 3.04Å; M636-Q639 PolarHBondContact O-N 2.84Å; M636-L640 HydrophobicContact CG-CD1 4.35Å; M636-L640 WeakPolarHBondContact O-CB 3.45Å; M636-L640 WeakPolarHBondContact O-CD1 3.49Å; M636-L640 WeakPolarHBondContact O-CG 3.45Å; M636-L640 PolarHBondContact O-N 3.35Å
637	L	65.3	Low	53.5	Low	125 Å²	125	122.2 Å²	122.2	65%	0.654	65%	0.651	S	S	*	*	H	α-helix	trans	-71.4	-34.2	178.8	-147.9	71.3	0	0	0	112.9	T633 L640 G641	T633-L637 PolarHBondContact O-N 3.25Å; T633-L637 VanDerWaalsContact O-N 3.16Å; L637-L640 PolarHBondContact O-N 3.13Å; L637-G641 PolarHBondContact O-N 2.79Å; L637-G641 VanDerWaalsContact O-N 3.09Å
638	K	63.4	Low	54	Low	174 Å²	174	120.2 Å²	120.2	76%	0.757	64%	0.64	S	S	*	*	H	α-helix	trans	-69.5	-31.1	172.4	-86.3	178.9	175.5	175.5	0	113.5	D634	D634-K638 PolarHBondContact O-N 3.05Å
639	Q	58.9	Low	54.4	Low	141 Å²	141	120.7 Å²	120.7	66%	0.659	64%	0.64	S	S	*	*	H	α-helix	trans	-78.2	-30.5	173.4	-80.6	-178.5	-31.4	0	0	112.8	Q635 M636	Q635-Q639 PolarHBondContact O-N 2.7Å; Q635-Q639 VanDerWaalsContact O-N 3.15Å; M636-Q639 PolarHBondContact O-N 2.84Å
640	L	54.8	Low	54.3	Low	90 Å²	90	117.9 Å²	117.9	47%	0.471	63%	0.634	S	S	.	*	H	α-helix	trans	-74.9	-25.5	175.7	-72.2	163.2	0	0	0	112.9	M636 L637 N642 L643	M636-L640 HydrophobicContact CG-CD1 4.35Å; M636-L640 WeakPolarHBondContact O-CB 3.45Å; M636-L640 WeakPolarHBondContact O-CD1 3.49Å; M636-L640 WeakPolarHBondContact O-CG 3.45Å; M636-L640 PolarHBondContact O-N 3.35Å; L637-L640 PolarHBondContact O-N 3.13Å; L640-N642 PolarHBondContact O-N 3.43Å; L640-L643 HydrophobicContact CD2-CD1 3.64Å; L640-L643 PolarHBondContact O-N 2.86Å
641	G	56	Low	54.3	Low	63 Å²	63	118.3 Å²	118.3	65%	0.649	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-12	177.2	0	0	0	0	0	115.7	L637	L637-G641 PolarHBondContact O-N 2.79Å; L637-G641 VanDerWaalsContact O-N 3.09Å
642	N	56.7	Low	54	Low	149 Å²	149	116.1 Å²	116.1	80%	0.797	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	12.1	177.1	-84.6	-11.8	0	0	0	113.6	L640 N644	L640-N642 PolarHBondContact O-N 3.43Å; N642-N644 PolarHBondContact O-N 2.88Å
643	L	50.4	Low	53.5	Low	83 Å²	83	120.9 Å²	120.9	44%	0.435	66%	0.661	S	S	.	*			trans	-80.1	105.4	175.6	-74.7	171.3	0	0	0	110.2	L640 P645 F648	L640-L643 HydrophobicContact CD2-CD1 3.64Å; L640-L643 PolarHBondContact O-N 2.86Å; L643-P645 VanDerWaalsContact O-CD 3.26Å; L643-P645 WeakPolarHBondContact O-CD 3.26Å; L643-F648 HydrophobicContact CB-CE2 4.19Å; L643-F648 HydrophobicContact CD2-CE2 4.01Å; L643-F648 HydrophobicContact CD2-CZ 3.95Å
644	N	51.4	Low	52.6	Low	70 Å²	70	120 Å²	120	37%	0.374	67%	0.672	S	S	.	*			trans	-60.6	114.7	174.5	-172.4	-4.7	0	0	0	109.7	N642 Q646 Q647	N642-N644 PolarHBondContact O-N 2.88Å; N644-Q646 PolarHBondContact O-N 2.8Å; N644-Q646 WeakPolarHBondContact OD1-CB 3.44Å; N644-Q646 PolarHBondContact OD1-N 2.87Å; N644-Q647 HydrophobicContact CB-CG 4.26Å; N644-Q647 PolarHBondContact O-N 3.09Å
645	P	53.4	Low	51.5	Low	101 Å²	101	118.7 Å²	118.7	66%	0.656	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-62.6	-12.1	-178.8	22.3	-30.8	0	0	0	113.4	L643 Q647	L643-P645 VanDerWaalsContact O-CD 3.26Å; L643-P645 WeakPolarHBondContact O-CD 3.26Å; P645-Q647 VanDerWaalsContact C-N 3.33Å
646	Q	57.1	Low	50.5	Low	152 Å²	152	117 Å²	117	71%	0.71	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-78.4	-11.3	173.6	-64.1	-179.3	-19.6	0	0	114	N644	N644-Q646 PolarHBondContact O-N 2.8Å; N644-Q646 WeakPolarHBondContact OD1-CB 3.44Å; N644-Q646 PolarHBondContact OD1-N 2.87Å
647	Q	56.8	Low	49.5	Very low	139 Å²	139	119 Å²	119	65%	0.65	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-86.3	-8.8	177.9	-72.4	-178.7	-13	0	0	113.8	N644 P645	N644-Q647 HydrophobicContact CB-CG 4.26Å; N644-Q647 PolarHBondContact O-N 3.09Å; P645-Q647 VanDerWaalsContact C-N 3.33Å
648	F	52.3	Low	48.5	Very low	143 Å²	143	120 Å²	120	63%	0.627	72%	0.718	S	S	*	*	S	Bend	trans	-108.5	7.1	-178.8	-62	-77.1	0	0	0	113.5	L643	L643-F648 HydrophobicContact CB-CE2 4.19Å; L643-F648 HydrophobicContact CD2-CE2 4.01Å; L643-F648 HydrophobicContact CD2-CZ 3.95Å
649	M	46	Very low	47.7	Very low	165 Å²	165	115.6 Å²	115.6	81%	0.813	72%	0.723	S	S	*	*	S	Bend	trans	-137.6	63.7	-173.7	-70.4	-93	-86.9	0	0	110.9
650	S	40.7	Very low	46.6	Very low	113 Å²	113	122.4 Å²	122.4	79%	0.79	75%	0.75	S	S	*	*			trans	-158.9	97.5	162.9	64.1	0	0	0	0	111.1
651	G	38.7	Very low	46.2	Very low	82 Å²	82	124 Å²	124	85%	0.845	76%	0.764	S	S	*	*			trans	-168.7	47.7	-179.8	0	0	0	0	0	113.3
652	S	37.7	Very low	45.7	Very low	112 Å²	112	127.2 Å²	127.2	78%	0.783	77%	0.77	S	S	*	*	S	Bend	trans	-177.7	93.2	154.5	-172.7	0	0	0	0	110.3
653	Q	41	Very low	45.1	Very low	200 Å²	200	126 Å²	126	94%	0.935	77%	0.768	S	S	*	*			trans	163.4	135.1	143.6	-96.8	175.2	-14.7	0	0	110.9
654	G	37.4	Very low	44.8	Very low	81 Å²	81	128.5 Å²	128.5	84%	0.835	79%	0.788	S	S	*	*			trans	113.3	66.2	154	0	0	0	0	0	115.8
655	G	39.6	Very low	44.4	Very low	86 Å²	86	132.2 Å²	132.2	89%	0.887	81%	0.814	S	S	*	*			trans	-85.4	126.3	158.4	0	0	0	0	0	110.7
656	G	43	Very low	43.8	Very low	81 Å²	81	134.3 Å²	134.3	84%	0.835	82%	0.824	S	S	*	*			trans	89.1	89	146.4	0	0	0	0	0	117.2
657	N	38.4	Very low	42.8	Very low	148 Å²	148	133 Å²	133	79%	0.791	83%	0.832	S	S	*	*			trans	-84.8	150.3	153.7	-152.4	28.8	0	0	0	108.8
658	D	45.7	Very low	41.7	Very low	147 Å²	147	132.5 Å²	132.5	79%	0.786	85%	0.846	S	S	*	*			trans	138	103.5	145.3	-66.9	-18.5	0	0	0	114.7
659	G	45.7	Very low	40.9	Very low	82 Å²	82	131.7 Å²	131.7	85%	0.845	87%	0.865	S	S	*	*			trans	79.2	78.6	130	0	0	0	0	0	119.2
660	K	36.7	Very low	40.4	Very low	283 Å²	283	128.6 Å²	128.6	100%	1.23	87%	0.869	S	S	*	*				-178.4	0	113.3	-147.9	171.6	-174.5	176.9	0	110.8

Retrieved 660 of 660 residues in 3338.6 ms (Link to these results)

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