A0A077Z9F9_TRITR Loading...

Histone-lysine N-methyltransferase SETMAR

AlphaFold DB , UniProt , Accession A0A077Z9F9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 297 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.8	Very low	31.6	Very low	122 Å²	122	48.2 Å²	48.2	60%	0.601	28%	0.279	S	S	*	.				0	124.4	0	-151.6	177.5	-62	0	0	106.1	F99 T202 S203	M1-F99 HydrophobicContact CE-CE1 3.97Å; M1-F99 HydrophobicContact CE-CZ 4.4Å; M1-F99 HydrophobicContact CG-CE1 4.08Å; M1-F99 HydrophobicContact CG-CZ 4.24Å; M1-F99 HydrophobicContact SD-CE1 4.12Å; M1-T202 CarbonylContact O-C 3.49Å; M1-T202 VanDerWaalsContact O-CA 3.25Å; M1-T202 WeakPolarHBondContact O-CA 3.31Å; M1-S203 PolarHBondContact N-OG 3.27Å; M1-S203 PolarHBondContact O-N 3.07Å
2	Y	31.2	Very low	31.7	Very low	71 Å²	71	44.9 Å²	44.9	28%	0.278	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	115.3	-166	-60.4	-79.3	0	0	0	110.8	E200 H201 T202 I208 R238	Y2-E200 HydrophobicContact CD1-CB 3.45Å; Y2-E200 VanDerWaalsContact CD1-CB 3.45Å; Y2-E200 HydrophobicContact CD1-CG 4.23Å; Y2-E200 HydrophobicContact CE1-CB 4.03Å; Y2-E200 HydrophobicContact CG-CB 4.18Å; Y2-H201 CarbonylContact C-O 3.51Å; Y2-H201 WeakPolarHBondContact CA-O 3.11Å; Y2-T202 HydrophobicContact CD1-CG2 3.68Å; Y2-T202 HydrophobicContact CE1-CG2 3.46Å; Y2-T202 VanDerWaalsContact CE1-CG2 3.46Å; Y2-I208 HydrophobicContact CE1-CD1 3.79Å; Y2-R238 PolarHBondContact OH-NH2 2.99Å; Y2-R238 VanDerWaalsContact OH-NH2 3.16Å
3	D	28.8	Very low	31.4	Very low	103 Å²	103	42.8 Å²	42.8	55%	0.551	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	131.9	174.3	-67.1	-34.5	0	0	0	109.1	H201	D3-H201 PolarHBondContact N-O 2.96Å; D3-H201 WeakPolarHBondContact O-CB 3.21Å; D3-H201 PolarHBondContact O-CD2 3.36Å; D3-H201 PolarHBondContact O-N 3.16Å
4	A	29.4	Very low	31.6	Very low	73 Å²	73	43.7 Å²	43.7	60%	0.603	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	61.8	114.9	179.3	0	0	0	0	0	116.8	R199	A4-R199 VanDerWaalsContact O-O 3.08Å
5	I	30.6	Very low	31.6	Very low	81 Å²	81	48.1 Å²	48.1	42%	0.415	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	105.4	166.8	-68.4	152.3	0	0	0	107.3	L198 P236	I5-L198 HydrophobicContact CB-CD1 4.29Å; I5-L198 HydrophobicContact CG1-CD1 4.21Å; I5-L198 HydrophobicContact CG2-CD1 3.55Å; I5-P236 HydrophobicContact CD1-CG 3.58Å; I5-P236 HydrophobicContact CG1-CG 3.75Å
6	A	27.7	Very low	31.7	Very low	40 Å²	40	55.4 Å²	55.4	33%	0.331	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	105.8	159.8	0	0	0	0	0	107.2	R199	A6-R199 HydrophobicContact CB-CB 4.32Å; A6-R199 PolarHBondContact N-O 3.04Å; A6-R199 PolarHBondContact O-N 3.21Å
7	A	31.4	Very low	31.7	Very low	16 Å²	16	62.1 Å²	62.1	13%	0.132	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	117.4	165.7	0	0	0	0	0	107.2	F196 V197 G265	A7-F196 HydrophobicContact CB-CE1 3.53Å; A7-F196 HydrophobicContact CB-CE2 4.29Å; A7-F196 HydrophobicContact CB-CZ 3.29Å; A7-V197 WeakPolarHBondContact CA-O 3.35Å; A7-G265 WeakPolarHBondContact O-CA 3.5Å
8	C	30.8	Very low	32.1	Very low	5 Å²	5	65.1 Å²	65.1	3%	0.034	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	108.8	164.2	-179.8	0	0	0	0	107.4	V197 Y264 D293 C296	C8-V197 PolarHBondContact N-O 2.72Å; C8-V197 PolarHBondContact O-N 3.38Å; C8-Y264 WeakPolarHBondContact CA-O 3.46Å; C8-D293 HydrophobicContact CB-CB 4.26Å; C8-C296 HydrophobicContact CB-CB 3.66Å
9	A	34.4	Very low	32.6	Very low	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	98.4	169.9	0	0	0	0	0	106.8	T11 F196 Y262 Y264	A9-T11 PolarHBondContact O-N 2.92Å; A9-F196 HydrophobicContact CB-CD2 3.92Å; A9-F196 HydrophobicContact CB-CE2 4.37Å; A9-F196 HydrophobicContact CB-CG 4.34Å; A9-Y262 HydrophobicContact CB-CE2 3.86Å; A9-Y262 WeakPolarHBondContact CB-OH 3.41Å; A9-Y264 HydrophobicContact CB-CD1 4.29Å; A9-Y264 HydrophobicContact CB-CG 4.43Å; A9-Y264 PolarHBondContact N-O 3.26Å; A9-Y264 WeakPolarHBondContact O-CA 3.27Å; A9-Y264 WeakPolarHBondContact O-CB 3.4Å; A9-Y264 WeakPolarHBondContact O-CD2 3.45Å
10	S	32.5	Very low	33	Very low	12 Å²	12	68.9 Å²	68.9	8%	0.084	36%	0.357	C	S	.	.			trans	-84	115.4	168.7	66.6	0	0	0	0	107.3	N193	S10-N193 CarbonylContact O-C 3.56Å; S10-N193 VanDerWaalsContact O-C 3.25Å; S10-N193 WeakPolarHBondContact O-CB 3.32Å; S10-N193 PolarHBondContact OG-ND2 3.38Å
11	T	31.5	Very low	33.6	Very low	7 Å²	7	67.6 Å²	67.6	4%	0.043	35%	0.349	C	S	.	.			trans	-120.6	158.8	177.6	-12.1	0	0	0	0	112.1	A9 N193 F194 Y264 L290	A9-T11 PolarHBondContact O-N 2.92Å; T11-N193 WeakPolarHBondContact CA-O 3.37Å; T11-N193 WeakPolarHBondContact CG2-O 3.31Å; T11-F194 HydrophobicContact CG2-CD1 3.69Å; T11-F194 HydrophobicContact CG2-CE1 4.22Å; T11-F194 HydrophobicContact CG2-CG 4.47Å; T11-Y264 VanDerWaalsContact CA-CE2 3.42Å; T11-Y264 WeakPolarHBondContact CB-OH 3.47Å; T11-Y264 VanDerWaalsContact N-CD2 3.31Å; T11-Y264 WeakPolarHBondContact OG1-CD2 3.37Å; T11-Y264 WeakPolarHBondContact OG1-CE1 3.38Å; T11-Y264 WeakPolarHBondContact OG1-CE2 3.25Å; T11-Y264 PolarHBondContact OG1-OH 3.22Å; T11-L290 WeakPolarHBondContact O-CD1 3.43Å
12	A	32.8	Very low	34.1	Very low	9 Å²	9	62.7 Å²	62.7	7%	0.074	33%	0.325	C	S	.	.			trans	-67.1	131.4	-162.5	0	0	0	0	0	115.2	Y14 P192	A12-Y14 HydrophobicContact CB-CD2 4.17Å; A12-Y14 HydrophobicContact CB-CE2 4.26Å; A12-P192 VanDerWaalsContact CB-CA 3.45Å; A12-P192 HydrophobicContact CB-CB 3.38Å
13	T	27.5	Very low	35	Very low	18 Å²	18	63.3 Å²	63.3	11%	0.11	33%	0.33	C	S	.	.			trans	-78.3	119.8	143.8	-34.6	0	0	0	0	106.6	E150 S278 H280 L290	T13-E150 CarbonylContact C-O 3.54Å; T13-E150 HydrophobicContact CG2-CB 4.11Å; T13-E150 WeakPolarHBondContact CG2-O 3.27Å; T13-S278 PolarHBondContact OG1-O 2.87Å; T13-H280 VanDerWaalsContact CG2-CD2 3.46Å; T13-H280 WeakPolarHBondContact CG2-CD2 3.49Å; T13-L290 WeakPolarHBondContact OG1-CD1 3.27Å
14	Y	34.6	Very low	36.4	Very low	55 Å²	55	61 Å²	61	22%	0.216	32%	0.316	C	S	.	.			trans	-84.9	111.8	170	-94.6	-92.8	0	0	0	107.7	A12 K16 V20 L56 E150	A12-Y14 HydrophobicContact CB-CD2 4.17Å; A12-Y14 HydrophobicContact CB-CE2 4.26Å; Y14-K16 PolarHBondContact O-N 3.26Å; Y14-V20 HydrophobicContact CD1-CG2 4.4Å; Y14-V20 HydrophobicContact CE1-CG2 4.09Å; Y14-L56 WeakPolarHBondContact OH-CD1 3.49Å; Y14-E150 CarbonylContact C-O 3.58Å; Y14-E150 PolarHBondContact N-O 2.88Å; Y14-E150 CarbonylContact O-C 3.46Å
15	V	31.6	Very low	38	Very low	109 Å²	109	64.5 Å²	64.5	66%	0.661	32%	0.318	S	S	*	.			trans	-68.7	123.2	171	-175.2	0	0	0	0	107.8	E17	V15-E17 HydrophobicContact CG1-CG 4.31Å; V15-E17 PolarHBondContact O-N 3.2Å
16	K	32.3	Very low	39	Very low	165 Å²	165	62.9 Å²	62.9	72%	0.717	32%	0.316	S	S	*	.	S	Bend	trans	-73.9	59.1	-167.2	-164.9	-173.6	-175.7	174.3	0	112.9	Y14	Y14-K16 PolarHBondContact O-N 3.26Å
17	E	32.8	Very low	40.2	Very low	169 Å²	169	61.9 Å²	61.9	79%	0.79	31%	0.307	S	S	*	.	S	Bend	trans	-109.4	-16.6	-178.7	-71.8	-167.2	159.9	0	0	115.5	V15	V15-E17 HydrophobicContact CG1-CG 4.31Å; V15-E17 PolarHBondContact O-N 3.2Å
18	E	39.1	Very low	41	Very low	117 Å²	117	70.7 Å²	70.7	55%	0.547	35%	0.345	S	S	.	.	S	Bend	trans	-147.4	145.8	176.6	-64.5	-175.7	155.7	0	0	112.4	V20 N54	E18-V20 PolarHBondContact O-N 3.06Å; E18-N54 PolarHBondContact OE2-ND2 2.77Å
19	K	41.8	Very low	41.4	Very low	172 Å²	172	74.1 Å²	74.1	75%	0.748	38%	0.382	S	S	*	.			trans	-68.1	111.9	176.4	-76.6	-176.3	176.1	-179.6	0	109.7
20	V	40.7	Very low	41.9	Very low	33 Å²	33	75.6 Å²	75.6	20%	0.2	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-91.4	130.1	-179.4	176.2	0	0	0	0	110.7	Y14 E18 N54 L56 F153	Y14-V20 HydrophobicContact CD1-CG2 4.4Å; Y14-V20 HydrophobicContact CE1-CG2 4.09Å; E18-V20 PolarHBondContact O-N 3.06Å; V20-N54 VanDerWaalsContact CA-O 3.23Å; V20-N54 WeakPolarHBondContact CA-O 3.37Å; V20-N54 VanDerWaalsContact CG1-O 3.22Å; V20-N54 WeakPolarHBondContact CG1-O 3.37Å; V20-N54 HydrophobicContact CG2-CB 4.13Å; V20-L56 HydrophobicContact CG1-CB 4.32Å; V20-F153 HydrophobicContact CB-CE2 4.24Å; V20-F153 HydrophobicContact CG1-CE2 4.05Å
21	E	45.7	Very low	42.1	Very low	42 Å²	42	84.1 Å²	84.1	20%	0.196	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	132.9	173	-174.4	-179	168.2	0	0	110.7	S50 N54 T55 L56	E21-S50 WeakPolarHBondContact OE1-CB 3.37Å; E21-S50 PolarHBondContact OE1-OG 2.88Å; E21-S50 WeakPolarHBondContact OE2-CA 3.44Å; E21-S50 WeakPolarHBondContact OE2-CB 3.47Å; E21-S50 PolarHBondContact OE2-OG 3.28Å; E21-N54 PolarHBondContact N-O 3.28Å; E21-T55 HydrophobicContact CB-CG2 4.08Å; E21-T55 WeakPolarHBondContact O-CA 3.46Å; E21-L56 PolarHBondContact O-N 3.25Å
22	L	50.2	Low	42.7	Very low	20 Å²	20	84.6 Å²	84.6	11%	0.105	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	122.6	174.5	-74.3	168.1	0	0	0	110.6	L56 V144 F153 F223	L22-L56 HydrophobicContact CD2-CB 4.15Å; L22-L56 HydrophobicContact CD2-CD2 3.79Å; L22-V144 HydrophobicContact CD1-CG1 3.77Å; L22-F153 HydrophobicContact CD1-CD1 3.49Å; L22-F153 VanDerWaalsContact CD1-CD1 3.49Å; L22-F153 HydrophobicContact CD1-CD2 4.11Å; L22-F153 HydrophobicContact CD1-CE1 3.37Å; L22-F153 HydrophobicContact CD1-CE2 4Å; L22-F153 HydrophobicContact CD1-CG 3.88Å; L22-F153 HydrophobicContact CD1-CZ 3.64Å; L22-F153 HydrophobicContact CD2-CD2 4.03Å; L22-F153 HydrophobicContact CD2-CE2 3.94Å; L22-F153 HydrophobicContact CD2-CG 4.49Å; L22-F153 HydrophobicContact CD2-CZ 4.33Å; L22-F153 HydrophobicContact CG-CD1 4.29Å; L22-F153 HydrophobicContact CG-CD2 4.13Å; L22-F153 HydrophobicContact CG-CE1 3.88Å; L22-F153 HydrophobicContact CG-CE2 3.71Å; L22-F153 HydrophobicContact CG-CG 4.41Å; L22-F153 HydrophobicContact CG-CZ 3.57Å; L22-F223 HydrophobicContact CD1-CE1 4.38Å; L22-F223 HydrophobicContact CD2-CE1 3.52Å; L22-F223 HydrophobicContact CD2-CZ 3.71Å
23	K	50.2	Low	42.8	Very low	84 Å²	84	88.3 Å²	88.3	37%	0.365	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	116.6	173.9	-77.1	176.7	173.5	174.5	0	110	T55 L56 E57 F58	K23-T55 HydrophobicContact CD-CG2 3.86Å; K23-T55 HydrophobicContact CG-CG2 4.45Å; K23-L56 PolarHBondContact N-O 3.34Å; K23-L56 VanDerWaalsContact N-O 3.16Å; K23-E57 HydrophobicContact CB-CG 4.01Å; K23-E57 HydrophobicContact CD-CG 3.87Å; K23-E57 WeakPolarHBondContact CD-OE1 3.49Å; K23-E57 IonicContact NZ-OE1 3.16Å; K23-E57 PolarHBondContact NZ-OE1 3.19Å; K23-E57 WeakPolarHBondContact O-CA 3.13Å; K23-F58 PolarHBondContact O-N 3.49Å
24	M	57.1	Low	43.1	Very low	53 Å²	53	89.4 Å²	89.4	26%	0.261	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	131.9	-179.3	-63.7	178.3	61.4	0	0	109.9	M35 F58 Y60 L220	M24-M35 HydrophobicContact CB-CE 3.82Å; M24-M35 HydrophobicContact CE-CE 4.12Å; M24-M35 HydrophobicContact SD-CE 4.41Å; M24-F58 HydrophobicContact CE-CE1 4.48Å; M24-F58 HydrophobicContact CE-CE2 4.16Å; M24-F58 HydrophobicContact CE-CZ 3.61Å; M24-F58 HydrophobicContact CG-CD1 4.29Å; M24-F58 HydrophobicContact CG-CE1 3.41Å; M24-F58 VanDerWaalsContact CG-CE1 3.41Å; M24-F58 HydrophobicContact CG-CE2 4.43Å; M24-F58 HydrophobicContact CG-CZ 3.5Å; M24-F58 VanDerWaalsContact CG-CZ 3.5Å; M24-F58 HydrophobicContact SD-CE1 4.13Å; M24-F58 HydrophobicContact SD-CZ 3.78Å; M24-Y60 HydrophobicContact CE-CD2 3.42Å; M24-Y60 VanDerWaalsContact CE-CD2 3.42Å; M24-Y60 HydrophobicContact CE-CE2 4.19Å; M24-Y60 HydrophobicContact CE-CG 4.1Å; M24-L220 HydrophobicContact CE-CD2 4.35Å
25	K	63.4	Low	43	Very low	147 Å²	147	89.4 Å²	89.4	64%	0.639	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	123.1	169.8	-65.6	177.2	-177.9	168.8	0	108.5	F58 E59 Y60	K25-F58 PolarHBondContact N-O 3.41Å; K25-E59 CarbonylContact O-C 3.57Å; K25-E59 VanDerWaalsContact O-CA 3.27Å; K25-E59 WeakPolarHBondContact O-CA 3.16Å; K25-Y60 PolarHBondContact O-N 2.8Å
26	A	51.2	Low	42.9	Very low	47 Å²	47	89.8 Å²	89.8	39%	0.388	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	141.9	175.4	0	0	0	0	0	110.8	I32 M35	A26-I32 HydrophobicContact CB-CD1 3.79Å; A26-M35 HydrophobicContact CB-SD 4.35Å
27	S	53.7	Low	42.7	Very low	20 Å²	20	86.3 Å²	86.3	14%	0.14	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-69.2	155.9	167.2	90.2	0	0	0	0	111.1	G29 D30 E59 Y60	S27-G29 PolarHBondContact O-N 3.18Å; S27-D30 PolarHBondContact O-N 3.2Å; S27-D30 VanDerWaalsContact OG-CG 3.23Å; S27-D30 PolarHBondContact OG-OD2 3.39Å; S27-E59 WeakPolarHBondContact CB-OE1 3.39Å; S27-Y60 PolarHBondContact N-O 2.92Å
28	E	46.5	Very low	42.3	Very low	200 Å²	200	82.4 Å²	82.4	94%	0.935	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	120.1	175.4	-73.5	-174.4	167.6	0	0	110.7
29	G	39.9	Very low	41.7	Very low	77 Å²	77	82.5 Å²	82.5	79%	0.794	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.3	-19.2	179.5	0	0	0	0	0	114.4	S27 Q31	S27-G29 PolarHBondContact O-N 3.18Å; G29-Q31 PolarHBondContact O-N 3.34Å
30	D	45.5	Very low	41	Very low	31 Å²	31	82.3 Å²	82.3	17%	0.166	49%	0.487	C	S	.	.			trans	-80.5	103.5	174.8	-74.2	-28.2	0	0	0	110.8	S27 I32 I61 S62	S27-D30 PolarHBondContact O-N 3.2Å; S27-D30 VanDerWaalsContact OG-CG 3.23Å; S27-D30 PolarHBondContact OG-OD2 3.39Å; D30-I32 PolarHBondContact O-N 3.41Å; D30-I32 VanDerWaalsContact O-N 3.1Å; D30-I61 WeakPolarHBondContact OD2-CA 3.01Å; D30-S62 WeakPolarHBondContact OD1-CB 3.23Å; D30-S62 PolarHBondContact OD1-OG 3.44Å; D30-S62 PolarHBondContact OD2-N 2.78Å
31	Q	36.5	Very low	40.6	Very low	191 Å²	191	83 Å²	83	89%	0.893	50%	0.496	S	S	*	.			trans	-77.3	96.5	168.6	-65.9	-169.5	14.2	0	0	109.1	G29 A33	G29-Q31 PolarHBondContact O-N 3.34Å; Q31-A33 PolarHBondContact O-N 3.26Å; Q31-A33 VanDerWaalsContact O-N 3.17Å
32	I	43.8	Very low	39.8	Very low	18 Å²	18	83.6 Å²	83.6	9%	0.092	50%	0.503	C	S	.	.			trans	-74.3	103.2	158.2	-59	163.3	0	0	0	105	A26 D30 G34 M35 L43 Y60	A26-I32 HydrophobicContact CB-CD1 3.79Å; D30-I32 PolarHBondContact O-N 3.41Å; D30-I32 VanDerWaalsContact O-N 3.1Å; I32-G34 PolarHBondContact O-N 2.98Å; I32-M35 HydrophobicContact CB-CB 4.1Å; I32-M35 HydrophobicContact CB-CG 3.78Å; I32-M35 HydrophobicContact CB-SD 4.01Å; I32-M35 HydrophobicContact CD1-CE 3.48Å; I32-M35 VanDerWaalsContact CD1-CE 3.48Å; I32-M35 HydrophobicContact CD1-CG 4.18Å; I32-M35 HydrophobicContact CD1-SD 3.23Å; I32-M35 WeakPolarHBondContact CD1-SD 3.37Å; I32-M35 HydrophobicContact CG1-SD 4.21Å; I32-M35 HydrophobicContact CG2-CB 4.47Å; I32-M35 HydrophobicContact CG2-CE 4.17Å; I32-M35 HydrophobicContact CG2-CG 3.72Å; I32-M35 HydrophobicContact CG2-SD 4.17Å; I32-M35 PolarHBondContact O-N 3.41Å; I32-L43 HydrophobicContact CG2-CD1 3.38Å; I32-Y60 HydrophobicContact CD1-CD1 3.43Å; I32-Y60 VanDerWaalsContact CD1-CD1 3.43Å; I32-Y60 HydrophobicContact CD1-CD2 4.26Å; I32-Y60 HydrophobicContact CD1-CE1 4.05Å; I32-Y60 HydrophobicContact CD1-CG 3.53Å; I32-Y60 HydrophobicContact CG1-CD1 3.56Å; I32-Y60 HydrophobicContact CG1-CE1 3.68Å; I32-Y60 HydrophobicContact CG1-CG 4.13Å
33	A	35.7	Very low	39	Very low	87 Å²	87	85.3 Å²	85.3	72%	0.719	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	108.5	173.2	0	0	0	0	0	108.7	Q31	Q31-A33 PolarHBondContact O-N 3.26Å; Q31-A33 VanDerWaalsContact O-N 3.17Å
34	G	32.8	Very low	38.2	Very low	41 Å²	41	86.2 Å²	86.2	42%	0.423	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	106.9	15.7	-173.1	0	0	0	0	0	117.4	I32 T42	I32-G34 PolarHBondContact O-N 2.98Å; G34-T42 PolarHBondContact O-N 3.09Å
35	M	33.4	Very low	36.8	Very low	55 Å²	55	86.6 Å²	86.6	27%	0.271	54%	0.539	S	S	.	.			trans	-117.9	101.1	168.4	-72	-159.7	-179.1	0	0	112.3	M24 A26 I32 A41	M24-M35 HydrophobicContact CB-CE 3.82Å; M24-M35 HydrophobicContact CE-CE 4.12Å; M24-M35 HydrophobicContact SD-CE 4.41Å; A26-M35 HydrophobicContact CB-SD 4.35Å; I32-M35 HydrophobicContact CB-CB 4.1Å; I32-M35 HydrophobicContact CB-CG 3.78Å; I32-M35 HydrophobicContact CB-SD 4.01Å; I32-M35 HydrophobicContact CD1-CE 3.48Å; I32-M35 VanDerWaalsContact CD1-CE 3.48Å; I32-M35 HydrophobicContact CD1-CG 4.18Å; I32-M35 HydrophobicContact CD1-SD 3.23Å; I32-M35 WeakPolarHBondContact CD1-SD 3.37Å; I32-M35 HydrophobicContact CG1-SD 4.21Å; I32-M35 HydrophobicContact CG2-CB 4.47Å; I32-M35 HydrophobicContact CG2-CE 4.17Å; I32-M35 HydrophobicContact CG2-CG 3.72Å; I32-M35 HydrophobicContact CG2-SD 4.17Å; I32-M35 PolarHBondContact O-N 3.41Å; M35-A41 HydrophobicContact CE-CB 3.68Å; M35-A41 HydrophobicContact CG-CB 4.05Å; M35-A41 HydrophobicContact SD-CB 4.43Å
36	D	28.1	Very low	35.1	Very low	116 Å²	116	82.6 Å²	82.6	62%	0.62	53%	0.528	S	S	*	.			trans	-89.9	140.3	161.5	56.6	-8.3	0	0	0	110.4	S38	D36-S38 PolarHBondContact O-N 3.33Å
37	G	28	Very low	33.9	Very low	92 Å²	92	90.2 Å²	90.2	95%	0.948	55%	0.547	S	S	*	.	S	Bend	trans	-68.3	29.6	-162.8	0	0	0	0	0	117.9
38	S	25.9	Very low	32.8	Very low	87 Å²	87	94.4 Å²	94.4	61%	0.608	57%	0.566	S	S	*	*	S	Bend	trans	-158.9	91.6	175	59.1	0	0	0	0	111.1	D36	D36-S38 PolarHBondContact O-N 3.33Å
39	T	25.2	Very low	31.9	Very low	119 Å²	119	92.8 Å²	92.8	73%	0.73	56%	0.557	S	S	*	*	S	Bend	trans	69.7	115.8	169.6	-16.3	0	0	0	0	114.3
40	K	28.1	Very low	31.3	Very low	168 Å²	168	92.8 Å²	92.8	73%	0.73	54%	0.544	S	S	*	.			trans	98.5	84.5	165	-53.5	157.4	-174.2	173.3	0	116	T42	K40-T42 PolarHBondContact O-N 2.91Å
41	A	32.3	Very low	30.4	Very low	48 Å²	48	98 Å²	98	40%	0.397	57%	0.569	S	S	.	*			trans	-65.9	120	164.7	0	0	0	0	0	110.3	M35	M35-A41 HydrophobicContact CE-CB 3.68Å; M35-A41 HydrophobicContact CG-CB 4.05Å; M35-A41 HydrophobicContact SD-CB 4.43Å
42	T	28.1	Very low	30.1	Very low	55 Å²	55	95.6 Å²	95.6	34%	0.337	56%	0.558	S	S	.	*			trans	-125.8	86.1	175.7	-50	0	0	0	0	107.6	G34 K40 N44 G45	G34-T42 PolarHBondContact O-N 3.09Å; K40-T42 PolarHBondContact O-N 2.91Å; T42-N44 PolarHBondContact O-N 3.33Å; T42-G45 VanDerWaalsContact CG2-N 3.29Å
43	L	32.8	Very low	29.5	Very low	56 Å²	56	99.5 Å²	99.5	29%	0.293	58%	0.583	S	S	.	*	S	Bend	trans	-76.2	102.7	162.6	-119.5	105.9	0	0	0	107.5	I32 G45 L142	I32-L43 HydrophobicContact CG2-CD1 3.38Å; L43-G45 PolarHBondContact O-N 3.11Å; L43-L142 VanDerWaalsContact CD2-O 3.23Å; L43-L142 WeakPolarHBondContact CD2-O 3.37Å
44	N	33.3	Very low	30.1	Very low	102 Å²	102	100 Å²	100	55%	0.545	57%	0.574	S	S	.	*	S	Bend	trans	53.3	45.6	176	-70	-25.5	0	0	0	116.1	T42 R143 L158	T42-N44 PolarHBondContact O-N 3.33Å; N44-R143 PolarHBondContact O-NH2 3.33Å; N44-L158 HydrophobicContact CB-CD1 3.85Å
45	G	27.6	Very low	30.8	Very low	62 Å²	62	101.1 Å²	101.1	64%	0.639	57%	0.572	S	S	*	*	S	Bend	trans	92.7	21.1	160	0	0	0	0	0	117.7	T42 L43	T42-G45 VanDerWaalsContact CG2-N 3.29Å; L43-G45 PolarHBondContact O-N 3.11Å
46	C	28.5	Very low	32.3	Very low	62 Å²	62	99.8 Å²	99.8	42%	0.419	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-103.6	122.4	167.1	-120.8	0	0	0	0	111.1
47	R	25.9	Very low	34.6	Very low	208 Å²	208	99.1 Å²	99.1	79%	0.785	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-84.7	117.6	170.7	-72.3	176.5	171.2	174.7	-2.7	108.8	F49	R47-F49 HydrophobicContact CB-CD2 4.46Å; R47-F49 HydrophobicContact CB-CE2 4.07Å
48	I	30	Very low	37.2	Very low	107 Å²	107	95.2 Å²	95.2	55%	0.549	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-92.7	123.8	167.2	-58.3	174.7	0	0	0	107.9
49	F	27.9	Very low	40.1	Very low	167 Å²	167	93.7 Å²	93.7	73%	0.732	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-94.9	140.7	177.2	-76.1	-94.8	0	0	0	110.3	R47	R47-F49 HydrophobicContact CB-CD2 4.46Å; R47-F49 HydrophobicContact CB-CE2 4.07Å
50	S	27.5	Very low	43.2	Very low	76 Å²	76	89.1 Å²	89.1	53%	0.531	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-90.2	131.4	171.7	180	0	0	0	0	111	E21	E21-S50 WeakPolarHBondContact OE1-CB 3.37Å; E21-S50 PolarHBondContact OE1-OG 2.88Å; E21-S50 WeakPolarHBondContact OE2-CA 3.44Å; E21-S50 WeakPolarHBondContact OE2-CB 3.47Å; E21-S50 PolarHBondContact OE2-OG 3.28Å
51	M	27.4	Very low	46.1	Very low	141 Å²	141	81.2 Å²	81.2	70%	0.695	43%	0.434	S	S	*	.			trans	-167.1	110.6	150.4	-78.1	-148.9	72.5	0	0	110.8
52	H	30.3	Very low	48.8	Very low	140 Å²	140	81.3 Å²	81.3	65%	0.648	43%	0.432	S	S	*	.	S	Bend	trans	62.5	119.9	157.6	-58.5	-39.2	0	0	0	121.9
53	T	31.6	Very low	51.9	Low	100 Å²	100	83.8 Å²	83.8	61%	0.613	44%	0.44	S	S	*	.	S	Bend	trans	68.4	128.9	154.8	52.9	0	0	0	0	120.6
54	N	47.3	Very low	54.9	Low	99 Å²	99	82 Å²	82	53%	0.529	43%	0.432	S	S	.	.			trans	65.8	87.4	-166.2	-75.3	-19.2	0	0	0	115.5	E18 V20 E21	E18-N54 PolarHBondContact OE2-ND2 2.77Å; V20-N54 VanDerWaalsContact CA-O 3.23Å; V20-N54 WeakPolarHBondContact CA-O 3.37Å; V20-N54 VanDerWaalsContact CG1-O 3.22Å; V20-N54 WeakPolarHBondContact CG1-O 3.37Å; V20-N54 HydrophobicContact CG2-CB 4.13Å; E21-N54 PolarHBondContact N-O 3.28Å
55	T	47.9	Very low	57.8	Low	63 Å²	63	78.6 Å²	78.6	39%	0.387	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	128	174.4	45.8	0	0	0	0	111.5	E21 K23 E57	E21-T55 HydrophobicContact CB-CG2 4.08Å; E21-T55 WeakPolarHBondContact O-CA 3.46Å; K23-T55 HydrophobicContact CD-CG2 3.86Å; K23-T55 HydrophobicContact CG-CG2 4.45Å; T55-E57 PolarHBondContact O-N 3.19Å
56	L	65	Low	61	Low	27 Å²	27	78.5 Å²	78.5	14%	0.141	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	92.3	167.5	-164.6	73.4	0	0	0	107.9	Y14 V20 E21 L22 K23 F194 F223	Y14-L56 WeakPolarHBondContact OH-CD1 3.49Å; V20-L56 HydrophobicContact CG1-CB 4.32Å; E21-L56 PolarHBondContact O-N 3.25Å; L22-L56 HydrophobicContact CD2-CB 4.15Å; L22-L56 HydrophobicContact CD2-CD2 3.79Å; K23-L56 PolarHBondContact N-O 3.34Å; K23-L56 VanDerWaalsContact N-O 3.16Å; L56-F194 HydrophobicContact CD1-CZ 4.49Å; L56-F223 HydrophobicContact CD2-CE1 4.13Å
57	E	75.1	Confident	64.2	Low	103 Å²	103	76.1 Å²	76.1	48%	0.481	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.6	176.5	-58.6	-157.1	162.9	0	0	110.3	K23 T55	K23-E57 HydrophobicContact CB-CG 4.01Å; K23-E57 HydrophobicContact CD-CG 3.87Å; K23-E57 WeakPolarHBondContact CD-OE1 3.49Å; K23-E57 IonicContact NZ-OE1 3.16Å; K23-E57 PolarHBondContact NZ-OE1 3.19Å; K23-E57 WeakPolarHBondContact O-CA 3.13Å; T55-E57 PolarHBondContact O-N 3.19Å
58	F	83.4	Confident	67.4	Low	10 Å²	10	68.9 Å²	68.9	4%	0.044	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	158.6	171.1	73.7	-75.5	0	0	0	111.2	K23 M24 K25 Y60 R216 G218 F223	K23-F58 PolarHBondContact O-N 3.49Å; M24-F58 HydrophobicContact CE-CE1 4.48Å; M24-F58 HydrophobicContact CE-CE2 4.16Å; M24-F58 HydrophobicContact CE-CZ 3.61Å; M24-F58 HydrophobicContact CG-CD1 4.29Å; M24-F58 HydrophobicContact CG-CE1 3.41Å; M24-F58 VanDerWaalsContact CG-CE1 3.41Å; M24-F58 HydrophobicContact CG-CE2 4.43Å; M24-F58 HydrophobicContact CG-CZ 3.5Å; M24-F58 VanDerWaalsContact CG-CZ 3.5Å; M24-F58 HydrophobicContact SD-CE1 4.13Å; M24-F58 HydrophobicContact SD-CZ 3.78Å; K25-F58 PolarHBondContact N-O 3.41Å; F58-Y60 HydrophobicContact CE2-CD2 4.41Å; F58-R216 WeakPolarHBondContact CA-O 3.38Å; F58-R216 WeakPolarHBondContact CB-O 3.38Å; F58-G218 WeakPolarHBondContact CE2-O 3.17Å; F58-F223 HydrophobicContact CE1-CE2 4.18Å; F58-F223 AromaticContact CE1-CZ 3.68Å; F58-F223 HydrophobicContact CE1-CZ 3.68Å; F58-F223 AromaticContact CZ-CE2 3.78Å; F58-F223 HydrophobicContact CZ-CE2 3.78Å; F58-F223 AromaticContact CZ-CZ 3.79Å; F58-F223 HydrophobicContact CZ-CZ 3.79Å
59	E	87.9	Confident	70.4	Confident	55 Å²	55	66.9 Å²	66.9	26%	0.257	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125.5	170.5	-170.3	-172.5	158.5	0	0	109.5	K25 S27 R216 R217 G218	K25-E59 CarbonylContact O-C 3.57Å; K25-E59 VanDerWaalsContact O-CA 3.27Å; K25-E59 WeakPolarHBondContact O-CA 3.16Å; S27-E59 WeakPolarHBondContact CB-OE1 3.39Å; E59-R216 PolarHBondContact N-O 3.12Å; E59-R217 HydrophobicContact CB-CB 4.42Å; E59-R217 HydrophobicContact CB-CG 4.17Å; E59-R217 VanDerWaalsContact CD-NE 3.28Å; E59-R217 CarbonylContact O-C 3.56Å; E59-R217 VanDerWaalsContact O-CA 3.23Å; E59-R217 WeakPolarHBondContact O-CA 3.42Å; E59-R217 IonicContact OE1-CZ 3.21Å; E59-R217 IonicContact OE1-NE 3.32Å; E59-R217 PolarHBondContact OE1-NE 2.75Å; E59-R217 IonicContact OE1-NH2 3.94Å; E59-R217 PolarHBondContact OE1-NH2 3.13Å; E59-R217 IonicContact OE2-CZ 2.81Å; E59-R217 IonicContact OE2-NE 3.97Å; E59-R217 PolarHBondContact OE2-NE 2.78Å; E59-R217 IonicContact OE2-NH2 2.66Å; E59-G218 PolarHBondContact O-N 2.79Å
60	Y	89.6	Confident	73.5	Confident	22 Å²	22	60.4 Å²	60.4	9%	0.086	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	125.6	172.2	-174.2	-86.6	0	0	0	110.1	M24 K25 S27 I32 F58 G218 N219 L220	M24-Y60 HydrophobicContact CE-CD2 3.42Å; M24-Y60 VanDerWaalsContact CE-CD2 3.42Å; M24-Y60 HydrophobicContact CE-CE2 4.19Å; M24-Y60 HydrophobicContact CE-CG 4.1Å; K25-Y60 PolarHBondContact O-N 2.8Å; S27-Y60 PolarHBondContact N-O 2.92Å; I32-Y60 HydrophobicContact CD1-CD1 3.43Å; I32-Y60 VanDerWaalsContact CD1-CD1 3.43Å; I32-Y60 HydrophobicContact CD1-CD2 4.26Å; I32-Y60 HydrophobicContact CD1-CE1 4.05Å; I32-Y60 HydrophobicContact CD1-CG 3.53Å; I32-Y60 HydrophobicContact CG1-CD1 3.56Å; I32-Y60 HydrophobicContact CG1-CE1 3.68Å; I32-Y60 HydrophobicContact CG1-CG 4.13Å; F58-Y60 HydrophobicContact CE2-CD2 4.41Å; Y60-G218 VanDerWaalsContact CA-O 3.3Å; Y60-G218 WeakPolarHBondContact CA-O 3.33Å; Y60-N219 HydrophobicContact CE2-CB 3.9Å; Y60-L220 HydrophobicContact CE2-CD2 4.07Å; Y60-L220 HydrophobicContact CE2-CG 3.9Å
61	I	89.9	Confident	76.5	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.01	35%	0.349	C	S	.	.			trans	-119.5	139.2	170.1	64	-177.5	0	0	0	109.8	D30 E63 V65 R217 G218 N219	D30-I61 WeakPolarHBondContact OD2-CA 3.01Å; I61-E63 WeakPolarHBondContact CD1-O 3.36Å; I61-V65 HydrophobicContact CD1-CG1 4.41Å; I61-V65 HydrophobicContact CD1-CG2 4.02Å; I61-R217 HydrophobicContact CD1-CB 3.96Å; I61-R217 HydrophobicContact CG2-CB 4.02Å; I61-G218 PolarHBondContact N-O 3.38Å; I61-N219 WeakPolarHBondContact O-CB 3.1Å
62	S	88.9	Confident	79.4	Confident	50 Å²	50	59.9 Å²	59.9	35%	0.35	34%	0.341	S	S	.	.	S	Bend	trans	-82.3	-22.3	175	71.1	0	0	0	0	112.9	D30	D30-S62 WeakPolarHBondContact OD1-CB 3.23Å; D30-S62 PolarHBondContact OD1-OG 3.44Å; D30-S62 PolarHBondContact OD2-N 2.78Å
63	E	92.5	Very high	82.3	Confident	108 Å²	108	57.6 Å²	57.6	51%	0.505	34%	0.337	S	S	.	.	S	Bend	trans	-134.4	145.1	-179.9	-58.1	-160.2	-159.4	0	0	111.2	I61 R245	I61-E63 WeakPolarHBondContact CD1-O 3.36Å; E63-R245 VanDerWaalsContact CA-NH2 3.27Å; E63-R245 VanDerWaalsContact CG-NH2 3.28Å; E63-R245 IonicContact OE2-CZ 3.52Å; E63-R245 IonicContact OE2-NH1 3.43Å; E63-R245 PolarHBondContact OE2-NH1 2.92Å; E63-R245 IonicContact OE2-NH2 3.37Å
64	S	95.3	Very high	85.1	Confident	18 Å²	18	56.3 Å²	56.3	13%	0.126	33%	0.326	C	S	.	.			trans	-59.6	148.9	175.6	-68	0	0	0	0	111.2	F75 E171 G172	S64-F75 WeakPolarHBondContact O-CE1 3.5Å; S64-E171 WeakPolarHBondContact CA-OE2 3.24Å; S64-E171 VanDerWaalsContact CB-OE2 3.24Å; S64-E171 WeakPolarHBondContact CB-OE2 3.37Å; S64-E171 PolarHBondContact N-OE2 3.33Å; S64-E171 WeakPolarHBondContact OG-CA 3.39Å; S64-E171 PolarHBondContact OG-OE2 3.4Å; S64-G172 WeakPolarHBondContact CA-O 3.41Å; S64-G172 VanDerWaalsContact CB-O 3.3Å; S64-G172 WeakPolarHBondContact CB-O 3.34Å; S64-G172 PolarHBondContact OG-N 3.41Å; S64-G172 PolarHBondContact OG-O 2.79Å
65	V	94.2	Very high	87.2	Confident	31 Å²	31	53.9 Å²	53.9	19%	0.188	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	154	-177.1	-65.2	0	0	0	0	110.3	I61 G67 F75 G172 E173 V174	I61-V65 HydrophobicContact CD1-CG1 4.41Å; I61-V65 HydrophobicContact CD1-CG2 4.02Å; V65-G67 PolarHBondContact O-N 3.25Å; V65-F75 VanDerWaalsContact C-CZ 3.47Å; V65-G172 PolarHBondContact N-O 3Å; V65-E173 HydrophobicContact CG2-CG 4.01Å; V65-E173 CarbonylContact O-C 3.58Å; V65-E173 WeakPolarHBondContact O-CA 3.44Å; V65-V174 PolarHBondContact O-N 3.35Å
66	P	95.4	Very high	89.3	Confident	60 Å²	60	54.8 Å²	54.8	39%	0.39	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	131	171.6	-16.2	25.4	0	0	0	110.8	F75	P66-F75 HydrophobicContact CB-CD2 4.2Å; P66-F75 HydrophobicContact CB-CE2 3.98Å; P66-F75 HydrophobicContact CG-CD1 4.32Å; P66-F75 HydrophobicContact CG-CD2 3.59Å; P66-F75 HydrophobicContact CG-CE1 4.44Å; P66-F75 HydrophobicContact CG-CE2 3.72Å; P66-F75 HydrophobicContact CG-CG 3.88Å; P66-F75 HydrophobicContact CG-CZ 4.14Å
67	G	95.2	Very high	90.6	Very high	11 Å²	11	56.9 Å²	56.9	11%	0.113	33%	0.332	C	S	.	.			trans	-115.5	-177.5	174.5	0	0	0	0	0	112.5	V65 G69 H70 V174	V65-G67 PolarHBondContact O-N 3.25Å; G67-G69 PolarHBondContact O-N 2.78Å; G67-H70 PolarHBondContact O-N 2.96Å; G67-V174 VanDerWaalsContact CA-O 3.29Å; G67-V174 WeakPolarHBondContact CA-O 3.07Å; G67-V174 PolarHBondContact N-O 2.86Å
68	P	94.2	Very high	91.5	Very high	57 Å²	57	55.6 Å²	55.6	37%	0.37	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	133	-176.4	-22.8	32.3	0	0	0	113.2	H70 G176 Q179	P68-H70 VanDerWaalsContact C-N 3.27Å; P68-H70 PolarHBondContact O-N 2.99Å; P68-G176 PolarHBondContact O-N 3.16Å; P68-Q179 HydrophobicContact CB-CG 4.1Å
69	G	93	Very high	91.9	Very high	65 Å²	65	57.3 Å²	57.3	67%	0.67	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	5.7	177.1	0	0	0	0	0	115.3	G67 G176	G67-G69 PolarHBondContact O-N 2.78Å; G69-G176 WeakPolarHBondContact O-CA 3.42Å
70	H	92	Very high	92.2	Very high	31 Å²	31	62.3 Å²	62.3	14%	0.144	37%	0.367	C	S	.	.	S	Bend	trans	-104.4	142	172.2	-169.2	79.7	0	0	0	110.4	G67 P68 P72 D74 F75 V174	G67-H70 PolarHBondContact O-N 2.96Å; P68-H70 VanDerWaalsContact C-N 3.27Å; P68-H70 PolarHBondContact O-N 2.99Å; H70-P72 WeakPolarHBondContact O-CD 3.38Å; H70-D74 IonicContact CE1-OD2 2.86Å; H70-D74 PolarHBondContact CE1-OD2 3.23Å; H70-D74 IonicContact NE2-OD2 3.15Å; H70-F75 AromaticContact CD2-CE2 3.57Å; H70-F75 AromaticContact NE2-CE2 3.66Å; H70-V174 WeakPolarHBondContact CB-O 3.49Å
71	E	90	Very high	92.5	Very high	123 Å²	123	61.6 Å²	61.6	58%	0.575	37%	0.366	S	S	*	.			trans	-76.6	120.6	-175.8	-68.1	-59.7	144.6	0	0	110.6	T73 D74	E71-T73 PolarHBondContact O-N 2.96Å; E71-D74 PolarHBondContact O-N 3.38Å; E71-D74 VanDerWaalsContact O-N 3.12Å
72	P	89.3	Confident	92.7	Very high	83 Å²	83	61.6 Å²	61.6	54%	0.539	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-60.6	-19.6	179.9	-25.1	35.3	0	0	0	114	H70 D74 F75	H70-P72 WeakPolarHBondContact O-CD 3.38Å; P72-D74 PolarHBondContact O-N 3.02Å; P72-F75 PolarHBondContact O-N 2.88Å
73	T	90.7	Very high	93.1	Very high	92 Å²	92	66.5 Å²	66.5	56%	0.564	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-64.6	-24	177.6	50.1	0	0	0	0	113.3	E71 F75 V76	E71-T73 PolarHBondContact O-N 2.96Å; T73-F75 PolarHBondContact O-N 2.73Å; T73-V76 WeakPolarHBondContact O-CB 3.11Å; T73-V76 PolarHBondContact O-N 2.78Å
74	D	89.9	Confident	93.2	Very high	72 Å²	72	62 Å²	62	39%	0.385	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-69.8	-15.8	179.8	-68.7	-9.1	0	0	0	112.4	H70 E71 P72	H70-D74 IonicContact CE1-OD2 2.86Å; H70-D74 PolarHBondContact CE1-OD2 3.23Å; H70-D74 IonicContact NE2-OD2 3.15Å; E71-D74 PolarHBondContact O-N 3.38Å; E71-D74 VanDerWaalsContact O-N 3.12Å; P72-D74 PolarHBondContact O-N 3.02Å
75	F	92	Very high	92.9	Very high	48 Å²	48	67.1 Å²	67.1	21%	0.211	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-91.2	-0.3	174	-73.1	-100.1	0	0	0	113.3	S64 V65 P66 H70 P72 T73 V174 I241 L243	S64-F75 WeakPolarHBondContact O-CE1 3.5Å; V65-F75 VanDerWaalsContact C-CZ 3.47Å; P66-F75 HydrophobicContact CB-CD2 4.2Å; P66-F75 HydrophobicContact CB-CE2 3.98Å; P66-F75 HydrophobicContact CG-CD1 4.32Å; P66-F75 HydrophobicContact CG-CD2 3.59Å; P66-F75 HydrophobicContact CG-CE1 4.44Å; P66-F75 HydrophobicContact CG-CE2 3.72Å; P66-F75 HydrophobicContact CG-CG 3.88Å; P66-F75 HydrophobicContact CG-CZ 4.14Å; H70-F75 AromaticContact CD2-CE2 3.57Å; H70-F75 AromaticContact NE2-CE2 3.66Å; P72-F75 PolarHBondContact O-N 2.88Å; T73-F75 PolarHBondContact O-N 2.73Å; F75-V174 HydrophobicContact CE2-CB 4.18Å; F75-V174 HydrophobicContact CE2-CG2 4.37Å; F75-V174 HydrophobicContact CZ-CB 3.87Å; F75-V174 HydrophobicContact CZ-CG2 3.62Å; F75-I241 HydrophobicContact CD1-CD1 4.47Å; F75-I241 WeakPolarHBondContact O-CG2 3.42Å; F75-L243 HydrophobicContact CD2-CD2 4.42Å; F75-L243 HydrophobicContact CE1-CD2 4.21Å; F75-L243 HydrophobicContact CE2-CD2 3.88Å; F75-L243 HydrophobicContact CZ-CD2 3.78Å
76	V	92.4	Very high	92.6	Very high	82 Å²	82	68.4 Å²	68.4	50%	0.497	41%	0.407	S	S	.	.	S	Bend	trans	-83.3	125.5	178.8	179.2	0	0	0	0	110	T73 S78	T73-V76 WeakPolarHBondContact O-CB 3.11Å; T73-V76 PolarHBondContact O-N 2.78Å; V76-S78 PolarHBondContact O-N 3.26Å; V76-S78 VanDerWaalsContact O-N 3.09Å; V76-S78 PolarHBondContact O-OG 3.21Å
77	P	92.3	Very high	92.3	Very high	71 Å²	71	69.1 Å²	69.1	46%	0.461	41%	0.408	S	S	.	.			trans	-50.1	116.4	174.7	-30.2	36.6	0	0	0	112.6	T240	P77-T240 CarbonylContact C-O 3.57Å; P77-T240 WeakPolarHBondContact CA-O 3.03Å; P77-T240 HydrophobicContact CB-CG2 3.55Å; P77-T240 HydrophobicContact CG-CG2 3.63Å
78	S	93.2	Very high	92.3	Very high	76 Å²	76	68.7 Å²	68.7	53%	0.531	40%	0.403	S	S	.	.			trans	-144.5	-6.1	-176.5	56.4	0	0	0	0	114.2	V76 Q80 T240 P242	V76-S78 PolarHBondContact O-N 3.26Å; V76-S78 VanDerWaalsContact O-N 3.09Å; V76-S78 PolarHBondContact O-OG 3.21Å; S78-Q80 PolarHBondContact O-N 3.22Å; S78-T240 PolarHBondContact N-O 3.43Å; S78-P242 WeakPolarHBondContact OG-CD 3.5Å; S78-P242 WeakPolarHBondContact OG-CG 3.41Å
79	L	92.5	Very high	92.3	Very high	46 Å²	46	67.3 Å²	67.3	24%	0.241	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-69.7	133.5	174	-69.8	-177	0	0	0	111.2	G81 N121 R238 T240 I241 P242	L79-G81 PolarHBondContact O-N 3.26Å; L79-N121 PolarHBondContact O-ND2 3.03Å; L79-R238 HydrophobicContact CD1-CB 4.13Å; L79-T240 PolarHBondContact N-O 2.78Å; L79-T240 VanDerWaalsContact N-O 3.08Å; L79-I241 WeakPolarHBondContact CD1-O 3.48Å; L79-P242 HydrophobicContact CD2-CB 4.27Å; L79-P242 HydrophobicContact CD2-CG 4.06Å; L79-P242 HydrophobicContact CG-CG 4.44Å
80	Q	94.1	Very high	92.2	Very high	161 Å²	161	69.1 Å²	69.1	75%	0.752	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-65.9	127.3	173.4	-172.5	179.3	7	0	0	110	S78 L95	S78-Q80 PolarHBondContact O-N 3.22Å; Q80-L95 HydrophobicContact CB-CD2 4.21Å; Q80-L95 HydrophobicContact CG-CD2 3.75Å
81	G	94.5	Very high	92.2	Very high	7 Å²	7	78.4 Å²	78.4	7%	0.072	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-87.5	157.8	175.7	0	0	0	0	0	113.5	L79 N121 C122	L79-G81 PolarHBondContact O-N 3.26Å; G81-N121 WeakPolarHBondContact CA-O 3.34Å; G81-C122 WeakPolarHBondContact CA-SG 3.3Å
82	C	96	Very high	92	Very high	1 Å²	1	75.9 Å²	75.9	1%	0.007	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-71.6	159	172.6	72.2	0	0	0	0	111.8	L95 C122 A123	C82-L95 HydrophobicContact CB-CB 4.14Å; C82-C122 PolarHBondContact N-SG 3.04Å; C82-C122 WeakPolarHBondContact O-CA 3.19Å; C82-A123 PolarHBondContact O-N 3.28Å
83	Q	95.3	Very high	92.2	Very high	154 Å²	154	79.2 Å²	79.2	72%	0.72	42%	0.423	S	S	*	.			trans	-107.4	26	175.2	-60.5	-59.4	-44.2	0	0	111.7
84	C	95	Very high	92.4	Very high	12 Å²	12	75 Å²	75	8%	0.081	40%	0.398	C	S	.	.			trans	-68.3	132.2	-176.1	-63.2	0	0	0	0	110.5	S86 A123 C124	C84-S86 PolarHBondContact O-N 3.27Å; C84-A123 CarbonylContact O-C 3.55Å; C84-C124 HydrophobicContact CB-CB 4.21Å; C84-C124 VanDerWaalsContact O-CA 3.27Å; C84-C124 WeakPolarHBondContact O-CA 3.45Å; C84-C124 PolarHBondContact O-N 3.23Å
85	P	88.9	Confident	92.7	Very high	126 Å²	126	75.2 Å²	75.2	82%	0.818	40%	0.399	S	S	*	.	S	Bend	trans	-79.9	-6	-178.4	32.8	-36.9	0	0	0	113.7
86	S	88.3	Confident	92.9	Very high	59 Å²	59	73.4 Å²	73.4	41%	0.413	39%	0.392	S	S	.	.	S	Bend	trans	-151.7	-169.9	-175.3	61.4	0	0	0	0	109.5	C84 C88 C124	C84-S86 PolarHBondContact O-N 3.27Å; S86-C88 PolarHBondContact O-N 2.95Å; S86-C124 WeakPolarHBondContact O-CB 3.48Å
87	D	89.6	Confident	93	Very high	74 Å²	74	69.7 Å²	69.7	40%	0.396	37%	0.369	S	S	.	.	S	Bend	trans	-53.6	129.7	179.7	-68	-20.6	0	0	0	111.9	S128 P130	D87-S128 PolarHBondContact OD1-OG 2.85Å; D87-P130 HydrophobicContact CB-CG 4.42Å
88	C	95.5	Very high	93	Very high	2 Å²	2	69.7 Å²	69.7	1%	0.014	37%	0.371	C	S	.	.			trans	-74.1	134.1	-176.2	-66.7	0	0	0	0	111.6	S86 C94 L97 C118 C124 P130	S86-C88 PolarHBondContact O-N 2.95Å; C88-C94 HydrophobicContact CB-CB 3.84Å; C88-C94 PolarHBondContact SG-SG 2.85Å; C88-L97 HydrophobicContact CB-CD1 3.91Å; C88-C118 PolarHBondContact SG-SG 3.1Å; C88-C124 WeakPolarHBondContact SG-CB 2.84Å; C88-C124 VanDerWaalsContact SG-SG 3.62Å; C88-P130 VanDerWaalsContact O-CG 3.25Å; C88-P130 WeakPolarHBondContact O-CG 3.38Å
89	S	93.6	Very high	93	Very high	29 Å²	29	70.4 Å²	70.4	20%	0.203	37%	0.365	C	S	.	.			trans	-137.4	164.9	161.4	66.5	0	0	0	0	110.5	R91 T92 C94 L97 D101	S89-R91 PolarHBondContact O-N 3.17Å; S89-R91 PolarHBondContact OG-N 2.71Å; S89-T92 PolarHBondContact N-OG1 2.99Å; S89-T92 PolarHBondContact O-N 2.53Å; S89-T92 PolarHBondContact O-OG1 3.4Å; S89-T92 WeakPolarHBondContact OG-CG2 3.24Å; S89-T92 PolarHBondContact OG-N 3.13Å; S89-T92 VanDerWaalsContact OG-N 3.09Å; S89-T92 PolarHBondContact OG-OG1 3.48Å; S89-C94 WeakPolarHBondContact O-CB 3.13Å; S89-C94 PolarHBondContact O-N 2.81Å; S89-L97 VanDerWaalsContact C-CD1 3.42Å; S89-L97 VanDerWaalsContact CA-CD1 3.44Å; S89-D101 VanDerWaalsContact CA-OD1 3.27Å; S89-D101 WeakPolarHBondContact CA-OD1 3.49Å
90	F	91.1	Very high	93.1	Very high	102 Å²	102	69 Å²	69	45%	0.447	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-36.8	168.8	-178.8	-121.3	0	0	0	111.2	T92 L93 L97 D101	F90-T92 VanDerWaalsContact C-N 3.26Å; F90-T92 PolarHBondContact O-N 3.08Å; F90-L93 PolarHBondContact O-N 3.23Å; F90-L97 WeakPolarHBondContact CD2-O 3.36Å; F90-D101 PolarHBondContact N-OD1 2.88Å
91	R	91.3	Very high	93.2	Very high	227 Å²	227	64.1 Å²	64.1	86%	0.857	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-31.7	176.9	-66.9	-177	-177.7	-99.5	0.2	112.9	S89 L93	S89-R91 PolarHBondContact O-N 3.17Å; S89-R91 PolarHBondContact OG-N 2.71Å; R91-L93 PolarHBondContact O-N 3.12Å
92	T	87.2	Confident	93.4	Very high	69 Å²	69	63.9 Å²	63.9	42%	0.423	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	11	174.9	57.3	0	0	0	0	112.9	S89 F90 C94	S89-T92 PolarHBondContact N-OG1 2.99Å; S89-T92 PolarHBondContact O-N 2.53Å; S89-T92 PolarHBondContact O-OG1 3.4Å; S89-T92 WeakPolarHBondContact OG-CG2 3.24Å; S89-T92 PolarHBondContact OG-N 3.13Å; S89-T92 VanDerWaalsContact OG-N 3.09Å; S89-T92 PolarHBondContact OG-OG1 3.48Å; F90-T92 VanDerWaalsContact C-N 3.26Å; F90-T92 PolarHBondContact O-N 3.08Å; T92-C94 PolarHBondContact O-N 3.22Å
93	L	92.7	Very high	93.5	Very high	153 Å²	153	64.6 Å²	64.6	80%	0.801	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	38.8	179.3	-55.9	175.7	0	0	0	112.9	F90 R91 L95	F90-L93 PolarHBondContact O-N 3.23Å; R91-L93 PolarHBondContact O-N 3.12Å; L93-L95 PolarHBondContact O-N 2.65Å
94	C	96	Very high	93.5	Very high	4 Å²	4	59.5 Å²	59.5	3%	0.027	32%	0.324	C	S	.	.			trans	-63.2	128.9	176.8	174.4	0	0	0	0	110.7	C88 S89 T92 C96 L97	C88-C94 HydrophobicContact CB-CB 3.84Å; C88-C94 PolarHBondContact SG-SG 2.85Å; S89-C94 WeakPolarHBondContact O-CB 3.13Å; S89-C94 PolarHBondContact O-N 2.81Å; T92-C94 PolarHBondContact O-N 3.22Å; C94-C96 VanDerWaalsContact C-N 3.26Å; C94-C96 PolarHBondContact O-N 3.26Å; C94-C96 PolarHBondContact SG-N 3.34Å; C94-C96 VanDerWaalsContact SG-N 3.4Å; C94-L97 HydrophobicContact CB-CB 4.13Å; C94-L97 HydrophobicContact CB-CD1 4.06Å; C94-L97 HydrophobicContact CB-CG 4.22Å; C94-L97 CarbonylContact O-C 3.37Å; C94-L97 PolarHBondContact O-N 2.71Å
95	L	95	Very high	93.6	Very high	76 Å²	76	67 Å²	67	40%	0.398	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-52.7	-42.9	176.6	-178.7	63.7	0	0	0	112.5	Q80 C82 L93 L97 S98	Q80-L95 HydrophobicContact CB-CD2 4.21Å; Q80-L95 HydrophobicContact CG-CD2 3.75Å; C82-L95 HydrophobicContact CB-CB 4.14Å; L93-L95 PolarHBondContact O-N 2.65Å; L95-L97 PolarHBondContact O-N 2.88Å; L95-S98 PolarHBondContact O-N 3.41Å; L95-S98 PolarHBondContact O-OG 3.06Å
96	C	96.1	Very high	93.9	Very high	11 Å²	11	62.8 Å²	62.8	7%	0.074	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-69.3	-14.2	-179.2	-52.2	0	0	0	0	113.4	C94 V116 C122	C94-C96 VanDerWaalsContact C-N 3.26Å; C94-C96 PolarHBondContact O-N 3.26Å; C94-C96 PolarHBondContact SG-N 3.34Å; C94-C96 VanDerWaalsContact SG-N 3.4Å; C96-V116 HydrophobicContact CB-CG1 4.41Å; C96-C122 VanDerWaalsContact SG-SG 3.62Å
97	L	95.9	Very high	94.4	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.016	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-112	30.5	-177.3	-64.7	174.5	0	0	0	111.5	C88 S89 F90 C94 L95 F99 G100 N102 N131	C88-L97 HydrophobicContact CB-CD1 3.91Å; S89-L97 VanDerWaalsContact C-CD1 3.42Å; S89-L97 VanDerWaalsContact CA-CD1 3.44Å; F90-L97 WeakPolarHBondContact CD2-O 3.36Å; C94-L97 HydrophobicContact CB-CB 4.13Å; C94-L97 HydrophobicContact CB-CD1 4.06Å; C94-L97 HydrophobicContact CB-CG 4.22Å; C94-L97 CarbonylContact O-C 3.37Å; C94-L97 PolarHBondContact O-N 2.71Å; L95-L97 PolarHBondContact O-N 2.88Å; L97-F99 PolarHBondContact O-N 2.9Å; L97-G100 PolarHBondContact O-N 2.85Å; L97-N102 HydrophobicContact CD2-CB 4.37Å; L97-N102 WeakPolarHBondContact CD2-ND2 3.37Å; L97-N131 HydrophobicContact CD1-CB 4.38Å; L97-N131 HydrophobicContact CD2-CB 4.13Å; L97-N131 VanDerWaalsContact CD2-CG 3.43Å; L97-N131 WeakPolarHBondContact CD2-ND2 3.35Å; L97-N131 HydrophobicContact CG-CB 4.48Å
98	S	91.9	Very high	94.9	Very high	71 Å²	71	59.7 Å²	59.7	50%	0.497	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-22.2	-178.5	-65.6	0	0	0	0	114	L95	L95-S98 PolarHBondContact O-N 3.41Å; L95-S98 PolarHBondContact O-OG 3.06Å
99	F	91.8	Very high	94.9	Very high	92 Å²	92	64 Å²	64	40%	0.404	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	28.8	178.1	-55.2	-78.5	0	0	0	112.6	M1 L97 K113 P114	M1-F99 HydrophobicContact CE-CE1 3.97Å; M1-F99 HydrophobicContact CE-CZ 4.4Å; M1-F99 HydrophobicContact CG-CE1 4.08Å; M1-F99 HydrophobicContact CG-CZ 4.24Å; M1-F99 HydrophobicContact SD-CE1 4.12Å; L97-F99 PolarHBondContact O-N 2.9Å; F99-K113 WeakPolarHBondContact O-CD 3.46Å; F99-K113 PolarHBondContact O-NZ 3Å; F99-K113 VanDerWaalsContact O-NZ 3.14Å; F99-P114 HydrophobicContact CD2-CB 4.22Å; F99-P114 HydrophobicContact CD2-CG 4.45Å; F99-P114 HydrophobicContact CE2-CB 4.28Å; F99-P114 HydrophobicContact CE2-CG 4.42Å
100	G	95.4	Very high	95	Very high	16 Å²	16	65.5 Å²	65.5	17%	0.165	35%	0.349	C	S	.	.	S	Bend	trans	85.6	172	-174.7	0	0	0	0	0	113.4	L97 K113	L97-G100 PolarHBondContact O-N 2.85Å; G100-K113 PolarHBondContact O-NZ 3.36Å
101	D	97.2	Very high	95.2	Very high	58 Å²	58	62.3 Å²	62.3	31%	0.31	34%	0.335	S	S	.	.			trans	-59.8	137.3	177.3	-66.7	-44.5	0	0	0	110.5	S89 F90 I109 K113	S89-D101 VanDerWaalsContact CA-OD1 3.27Å; S89-D101 WeakPolarHBondContact CA-OD1 3.49Å; F90-D101 PolarHBondContact N-OD1 2.88Å; D101-I109 HydrophobicContact CB-CD1 4.17Å; D101-I109 VanDerWaalsContact O-CD1 3.24Å; D101-I109 WeakPolarHBondContact O-CD1 3.38Å; D101-K113 VanDerWaalsContact C-NZ 3.33Å; D101-K113 WeakPolarHBondContact O-CE 3.1Å; D101-K113 PolarHBondContact O-NZ 2.97Å
102	N	97.6	Very high	95.2	Very high	3 Å²	3	59 Å²	59	2%	0.016	33%	0.334	C	S	.	.	S	Bend	trans	-84.2	-36.8	177.1	-66	-32.9	0	0	0	111.4	L97 L108 I109 K113 I115 V116 N131	L97-N102 HydrophobicContact CD2-CB 4.37Å; L97-N102 WeakPolarHBondContact CD2-ND2 3.37Å; N102-L108 WeakPolarHBondContact O-CD1 3.19Å; N102-I109 PolarHBondContact O-N 3.3Å; N102-I109 VanDerWaalsContact O-N 3.16Å; N102-K113 PolarHBondContact OD1-NZ 2.74Å; N102-I115 HydrophobicContact CB-CD1 4.23Å; N102-I115 HydrophobicContact CB-CG2 4.17Å; N102-I115 WeakPolarHBondContact OD1-CD1 3.49Å; N102-V116 PolarHBondContact ND2-O 3.49Å; N102-N131 PolarHBondContact ND2-OD1 2.66Å
103	Y	97.9	Very high	95.3	Very high	16 Å²	16	57 Å²	57	6%	0.063	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.1	-172.4	-46.3	-77.3	0	0	0	111.7	L107 L108 I115 E117 P130 V133 F249	Y103-L107 CarbonylContact C-O 3.56Å; Y103-L107 WeakPolarHBondContact CA-O 3.34Å; Y103-L108 HydrophobicContact CD1-CB 4.27Å; Y103-L108 HydrophobicContact CD1-CD1 4.31Å; Y103-L108 HydrophobicContact CE1-CB 4.33Å; Y103-L108 HydrophobicContact CE1-CD1 3.94Å; Y103-I115 WeakPolarHBondContact OH-CG2 3.23Å; Y103-E117 HydrophobicContact CE2-CG 3.89Å; Y103-E117 PolarHBondContact OH-OE1 3.41Å; Y103-P130 WeakPolarHBondContact CD2-O 3.28Å; Y103-V133 HydrophobicContact CD1-CB 4.14Å; Y103-V133 HydrophobicContact CD1-CG1 4.43Å; Y103-V133 HydrophobicContact CD1-CG2 3.77Å; Y103-V133 HydrophobicContact CD2-CB 4.27Å; Y103-V133 HydrophobicContact CD2-CG2 3.6Å; Y103-V133 HydrophobicContact CE1-CB 3.91Å; Y103-V133 HydrophobicContact CE1-CG1 4.24Å; Y103-V133 HydrophobicContact CE1-CG2 4.05Å; Y103-V133 HydrophobicContact CE2-CB 4.05Å; Y103-V133 HydrophobicContact CE2-CG2 3.88Å; Y103-V133 HydrophobicContact CG-CB 4.33Å; Y103-V133 HydrophobicContact CG-CG2 3.56Å; Y103-F249 AromaticContact CE1-CE1 4Å; Y103-F249 HydrophobicContact CE1-CE1 4Å; Y103-F249 HydrophobicContact CE1-CZ 4.03Å
104	A	96.8	Very high	95.2	Very high	47 Å²	47	51.2 Å²	51.2	39%	0.388	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.2	165.1	0	0	0	0	0	108.1	G106 L107 I109	A104-G106 PolarHBondContact O-N 3.04Å; A104-L107 PolarHBondContact N-O 3.43Å; A104-L107 WeakPolarHBondContact O-CB 3.19Å; A104-L107 PolarHBondContact O-N 3.49Å; A104-I109 HydrophobicContact CB-CG2 3.46Å; A104-I109 VanDerWaalsContact CB-CG2 3.46Å
105	N	95.9	Very high	95.2	Very high	170 Å²	170	51 Å²	51	91%	0.909	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	38.2	-175.7	-53.9	-40.9	0	0	0	113.4	L107	N105-L107 VanDerWaalsContact C-N 3.27Å; N105-L107 PolarHBondContact O-N 3.21Å
106	G	96.5	Very high	95.2	Very high	36 Å²	36	49.6 Å²	49.6	37%	0.371	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	2	-179.1	0	0	0	0	0	115.4	A104	A104-G106 PolarHBondContact O-N 3.04Å
107	L	98.4	Very high	95.3	Very high	60 Å²	60	49.1 Å²	49.1	31%	0.314	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.4	177.3	-54.2	177.5	0	0	0	110.4	Y103 A104 N105 I109 A162 G164 Q165	Y103-L107 CarbonylContact C-O 3.56Å; Y103-L107 WeakPolarHBondContact CA-O 3.34Å; A104-L107 PolarHBondContact N-O 3.43Å; A104-L107 WeakPolarHBondContact O-CB 3.19Å; A104-L107 PolarHBondContact O-N 3.49Å; N105-L107 VanDerWaalsContact C-N 3.27Å; N105-L107 PolarHBondContact O-N 3.21Å; L107-I109 PolarHBondContact O-N 2.72Å; L107-A162 HydrophobicContact CD1-CB 4.49Å; L107-A162 HydrophobicContact CD2-CB 4.23Å; L107-G164 CarbonylContact C-O 3.57Å; L107-G164 WeakPolarHBondContact CA-O 3.4Å; L107-Q165 HydrophobicContact CD2-CB 3.76Å; L107-Q165 HydrophobicContact CD2-CG 4.37Å
108	L	98.5	Very high	95.3	Very high	8 Å²	8	49 Å²	49	4%	0.042	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	126.1	172.9	-176.2	71.2	0	0	0	110	N102 Y103 F111 I115 G164 V235 F249	N102-L108 WeakPolarHBondContact O-CD1 3.19Å; Y103-L108 HydrophobicContact CD1-CB 4.27Å; Y103-L108 HydrophobicContact CD1-CD1 4.31Å; Y103-L108 HydrophobicContact CE1-CB 4.33Å; Y103-L108 HydrophobicContact CE1-CD1 3.94Å; L108-F111 HydrophobicContact CD2-CD1 3.76Å; L108-F111 HydrophobicContact CD2-CD2 4.26Å; L108-F111 HydrophobicContact CD2-CE1 3.86Å; L108-F111 HydrophobicContact CD2-CE2 4.31Å; L108-F111 HydrophobicContact CD2-CG 3.99Å; L108-F111 HydrophobicContact CD2-CZ 4.12Å; L108-I115 HydrophobicContact CD1-CD1 3.76Å; L108-I115 HydrophobicContact CD1-CG1 4.17Å; L108-G164 WeakPolarHBondContact CB-O 3.46Å; L108-G164 PolarHBondContact N-O 3.2Å; L108-V235 HydrophobicContact CD2-CG1 4.48Å; L108-V235 HydrophobicContact CD2-CG2 3.89Å; L108-F249 HydrophobicContact CB-CD1 3.75Å; L108-F249 HydrophobicContact CB-CE1 3.88Å; L108-F249 HydrophobicContact CB-CG 4.3Å; L108-F249 HydrophobicContact CD2-CB 4.17Å; L108-F249 HydrophobicContact CD2-CD1 4.05Å; L108-F249 HydrophobicContact CD2-CD2 3.83Å; L108-F249 HydrophobicContact CD2-CE1 4.37Å; L108-F249 HydrophobicContact CD2-CE2 4.16Å; L108-F249 HydrophobicContact CD2-CG 3.76Å; L108-F249 HydrophobicContact CD2-CZ 4.42Å; L108-F249 HydrophobicContact CG-CD1 4.49Å
109	I	97.4	Very high	95.4	Very high	93 Å²	93	45.9 Å²	45.9	48%	0.477	26%	0.259	S	S	.	.			trans	-96.9	-23.3	-174.7	64.9	179.5	0	0	0	113.9	D101 N102 A104 L107	D101-I109 HydrophobicContact CB-CD1 4.17Å; D101-I109 VanDerWaalsContact O-CD1 3.24Å; D101-I109 WeakPolarHBondContact O-CD1 3.38Å; N102-I109 PolarHBondContact O-N 3.3Å; N102-I109 VanDerWaalsContact O-N 3.16Å; A104-I109 HydrophobicContact CB-CG2 3.46Å; A104-I109 VanDerWaalsContact CB-CG2 3.46Å; L107-I109 PolarHBondContact O-N 2.72Å
110	D	95.5	Very high	95.4	Very high	61 Å²	61	49.4 Å²	49.4	33%	0.326	28%	0.275	S	S	.	.			trans	-144.5	120.5	-176.1	-173.2	-13.1	0	0	0	108.9	D112 K113	D110-D112 PolarHBondContact OD1-N 3.46Å; D110-K113 HydrophobicContact CB-CD 3.75Å; D110-K113 HydrophobicContact CB-CG 4.08Å
111	F	94.7	Very high	95.2	Very high	34 Å²	34	51.9 Å²	51.9	15%	0.149	28%	0.284	C	S	.	.	S	Bend	trans	-89.6	-14.3	-176.7	-71.9	-104.4	0	0	0	112.5	L108 T233 V235 F249 A250	L108-F111 HydrophobicContact CD2-CD1 3.76Å; L108-F111 HydrophobicContact CD2-CD2 4.26Å; L108-F111 HydrophobicContact CD2-CE1 3.86Å; L108-F111 HydrophobicContact CD2-CE2 4.31Å; L108-F111 HydrophobicContact CD2-CG 3.99Å; L108-F111 HydrophobicContact CD2-CZ 4.12Å; F111-T233 HydrophobicContact CD1-CG2 3.78Å; F111-T233 HydrophobicContact CE1-CG2 4.43Å; F111-V235 HydrophobicContact CD1-CG2 3.95Å; F111-F249 HydrophobicContact CE1-CB 3.74Å; F111-F249 HydrophobicContact CZ-CB 4.27Å; F111-A250 WeakPolarHBondContact CZ-O 3.49Å
112	D	91.2	Very high	95.1	Very high	158 Å²	158	49.9 Å²	49.9	85%	0.845	27%	0.274	S	S	*	.	S	Bend	trans	-99.5	-4.3	-168.7	-62	-43.7	0	0	0	112.6	D110	D110-D112 PolarHBondContact OD1-N 3.46Å
113	K	90.1	Very high	95	Very high	27 Å²	27	52.5 Å²	52.5	12%	0.117	30%	0.297	C	S	.	.	S	Bend	trans	-103.5	153.3	-178.4	75.4	-174.2	-175.1	102	0	113.1	F99 G100 D101 N102 D110 I115	F99-K113 WeakPolarHBondContact O-CD 3.46Å; F99-K113 PolarHBondContact O-NZ 3Å; F99-K113 VanDerWaalsContact O-NZ 3.14Å; G100-K113 PolarHBondContact O-NZ 3.36Å; D101-K113 VanDerWaalsContact C-NZ 3.33Å; D101-K113 WeakPolarHBondContact O-CE 3.1Å; D101-K113 PolarHBondContact O-NZ 2.97Å; N102-K113 PolarHBondContact OD1-NZ 2.74Å; D110-K113 HydrophobicContact CB-CD 3.75Å; D110-K113 HydrophobicContact CB-CG 4.08Å; K113-I115 HydrophobicContact CG-CD1 3.78Å; K113-I115 PolarHBondContact O-N 3.01Å
114	P	89.6	Confident	94.9	Very high	31 Å²	31	52 Å²	52	20%	0.201	30%	0.295	C	S	.	.			trans	-59.9	129	171.3	-22.1	33.2	0	0	0	111.7	F99	F99-P114 HydrophobicContact CD2-CB 4.22Å; F99-P114 HydrophobicContact CD2-CG 4.45Å; F99-P114 HydrophobicContact CE2-CB 4.28Å; F99-P114 HydrophobicContact CE2-CG 4.42Å
115	I	95.7	Very high	94.4	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117.4	178.8	-52.3	-57.2	0	0	0	110.1	N102 Y103 L108 K113 V235 V237 R238	N102-I115 HydrophobicContact CB-CD1 4.23Å; N102-I115 HydrophobicContact CB-CG2 4.17Å; N102-I115 WeakPolarHBondContact OD1-CD1 3.49Å; Y103-I115 WeakPolarHBondContact OH-CG2 3.23Å; L108-I115 HydrophobicContact CD1-CD1 3.76Å; L108-I115 HydrophobicContact CD1-CG1 4.17Å; K113-I115 HydrophobicContact CG-CD1 3.78Å; K113-I115 PolarHBondContact O-N 3.01Å; I115-V235 HydrophobicContact CG1-CG1 3.67Å; I115-V237 HydrophobicContact CB-CG1 4.48Å; I115-V237 HydrophobicContact CB-CG2 3.97Å; I115-V237 HydrophobicContact CG2-CB 4.35Å; I115-V237 HydrophobicContact CG2-CG1 3.87Å; I115-V237 HydrophobicContact CG2-CG2 3.86Å; I115-R238 PolarHBondContact O-N 3.42Å
116	V	96.1	Very high	93.7	Very high	45 Å²	45	51.1 Å²	51.1	27%	0.273	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	114	170.8	-177.4	0	0	0	0	108.6	C96 N102 N131 R238	C96-V116 HydrophobicContact CB-CG1 4.41Å; N102-V116 PolarHBondContact ND2-O 3.49Å; V116-N131 PolarHBondContact O-ND2 2.79Å; V116-R238 CarbonylContact C-O 3.5Å; V116-R238 WeakPolarHBondContact CA-O 2.85Å
117	E	97.2	Very high	92.8	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.009	30%	0.3	C	S	.	.			trans	-81.4	158.2	173.4	-83	-167.9	179.6	0	0	111.4	Y103 G119 N131 V133 V134 Q135 V237 R238 Y239	Y103-E117 HydrophobicContact CE2-CG 3.89Å; Y103-E117 PolarHBondContact OH-OE1 3.41Å; E117-G119 PolarHBondContact O-N 2.89Å; E117-N131 WeakPolarHBondContact CA-ND2 3.36Å; E117-N131 WeakPolarHBondContact CA-O 3.37Å; E117-N131 WeakPolarHBondContact CB-O 3.4Å; E117-N131 WeakPolarHBondContact CG-O 3.42Å; E117-V133 VanDerWaalsContact CD-N 3.3Å; E117-V133 WeakPolarHBondContact OE1-CA 3.36Å; E117-V133 PolarHBondContact OE1-N 3.47Å; E117-V133 PolarHBondContact OE2-N 2.83Å; E117-V134 PolarHBondContact OE1-N 3.03Å; E117-Q135 WeakPolarHBondContact OE2-CG 3.45Å; E117-Q135 PolarHBondContact OE2-N 2.81Å; E117-Q135 PolarHBondContact OE2-NE2 3.22Å; E117-V237 HydrophobicContact CG-CG1 4.12Å; E117-R238 PolarHBondContact N-O 2.79Å; E117-Y239 HydrophobicContact CB-CD1 4.35Å
118	C	96.5	Very high	92.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	31%	0.306	C	S	.	.			trans	-66.6	123	169.3	-65.4	0	0	0	0	108.6	C88 C122 C129 N131 R132 Q135	C88-C118 PolarHBondContact SG-SG 3.1Å; C118-C122 VanDerWaalsContact CA-SG 3.58Å; C118-C122 HydrophobicContact CB-CB 4.03Å; C118-C129 VanDerWaalsContact SG-SG 3.64Å; C118-N131 PolarHBondContact N-ND2 3.16Å; C118-N131 PolarHBondContact N-O 3.21Å; C118-R132 HydrophobicContact CB-CG 4.14Å; C118-R132 PolarHBondContact O-NH1 3.15Å; C118-Q135 PolarHBondContact O-NE2 2.83Å; C118-Q135 PolarHBondContact O-OE1 3.03Å
119	G	94.6	Very high	92.2	Very high	5 Å²	5	52.4 Å²	52.4	5%	0.052	31%	0.306	C	S	.	.			trans	-94.4	-167.3	179.3	0	0	0	0	0	114.1	E117 N121 C122 R132 T240	E117-G119 PolarHBondContact O-N 2.89Å; G119-N121 PolarHBondContact O-N 2.88Å; G119-C122 PolarHBondContact N-SG 3.14Å; G119-C122 WeakPolarHBondContact O-CB 3.34Å; G119-C122 PolarHBondContact O-N 2.65Å; G119-R132 PolarHBondContact O-NH1 3.5Å; G119-R132 VanDerWaalsContact O-NH1 3.11Å; G119-R132 PolarHBondContact O-NH2 2.8Å; G119-T240 WeakPolarHBondContact CA-OG1 3.47Å
120	F	90.7	Very high	92.2	Very high	167 Å²	167	51.1 Å²	51.1	73%	0.732	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-33.5	175.7	174.1	-99.2	0	0	0	113.1	C122 T240	F120-C122 PolarHBondContact O-N 2.81Å; F120-T240 HydrophobicContact CB-CG2 4.18Å; F120-T240 PolarHBondContact N-OG1 3.48Å; F120-T240 VanDerWaalsContact N-OG1 3.13Å
121	N	92.3	Very high	92.2	Very high	68 Å²	68	48.4 Å²	48.4	36%	0.364	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	0.2	-178.7	-65.7	-25.8	0	0	0	114.4	L79 G81 G119	L79-N121 PolarHBondContact O-ND2 3.03Å; G81-N121 WeakPolarHBondContact CA-O 3.34Å; G119-N121 PolarHBondContact O-N 2.88Å
122	C	95	Very high	92.3	Very high	15 Å²	15	47.7 Å²	47.7	10%	0.101	29%	0.285	C	S	.	.			trans	-88	139.4	-177.7	-63.8	0	0	0	0	111.9	G81 C82 C96 C118 G119 F120	G81-C122 WeakPolarHBondContact CA-SG 3.3Å; C82-C122 PolarHBondContact N-SG 3.04Å; C82-C122 WeakPolarHBondContact O-CA 3.19Å; C96-C122 VanDerWaalsContact SG-SG 3.62Å; C118-C122 VanDerWaalsContact CA-SG 3.58Å; C118-C122 HydrophobicContact CB-CB 4.03Å; G119-C122 PolarHBondContact N-SG 3.14Å; G119-C122 WeakPolarHBondContact O-CB 3.34Å; G119-C122 PolarHBondContact O-N 2.65Å; F120-C122 PolarHBondContact O-N 2.81Å
123	A	94.8	Very high	92.6	Very high	59 Å²	59	41.3 Å²	41.3	49%	0.488	25%	0.252	S	S	.	.			trans	-81.4	-11.6	177.5	0	0	0	0	0	114.3	C82 C84	C82-A123 PolarHBondContact O-N 3.28Å; C84-A123 CarbonylContact O-C 3.55Å
124	C	94.9	Very high	92.9	Very high	4 Å²	4	40.1 Å²	40.1	3%	0.027	25%	0.247	C	C	.	.	S	Bend	trans	-62	155.8	177.5	63	0	0	0	0	111.7	C84 S86 C88 N126 C129	C84-C124 HydrophobicContact CB-CB 4.21Å; C84-C124 VanDerWaalsContact O-CA 3.27Å; C84-C124 WeakPolarHBondContact O-CA 3.45Å; C84-C124 PolarHBondContact O-N 3.23Å; S86-C124 WeakPolarHBondContact O-CB 3.48Å; C88-C124 WeakPolarHBondContact SG-CB 2.84Å; C88-C124 VanDerWaalsContact SG-SG 3.62Å; C124-N126 PolarHBondContact O-N 3.33Å; C124-C129 HydrophobicContact CB-CB 4.5Å; C124-C129 VanDerWaalsContact SG-SG 3.69Å
125	T	86.8	Confident	93.1	Very high	66 Å²	66	41.2 Å²	41.2	41%	0.405	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-52.1	117.5	-176	-46.5	0	0	0	0	111.4	S128 C129	T125-S128 WeakPolarHBondContact CB-OG 3.39Å; T125-S128 WeakPolarHBondContact CG2-OG 3.3Å; T125-C129 WeakPolarHBondContact O-CB 3.45Å; T125-C129 PolarHBondContact O-N 3.27Å
126	N	81	Confident	93	Very high	133 Å²	133	45.4 Å²	45.4	71%	0.711	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	135.6	177.4	-164.6	14.8	0	0	0	109.7	C124 S128	C124-N126 PolarHBondContact O-N 3.33Å; N126-S128 VanDerWaalsContact C-N 3.31Å; N126-S128 PolarHBondContact O-N 3.09Å
127	G	78.7	Confident	92.8	Very high	65 Å²	65	44.8 Å²	44.8	67%	0.67	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	-24.9	179.9	0	0	0	0	0	117
128	S	89.2	Confident	92.6	Very high	63 Å²	63	47.9 Å²	47.9	44%	0.441	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-16.6	177	72.3	0	0	0	0	114.7	D87 T125 N126	D87-S128 PolarHBondContact OD1-OG 2.85Å; T125-S128 WeakPolarHBondContact CB-OG 3.39Å; T125-S128 WeakPolarHBondContact CG2-OG 3.3Å; N126-S128 VanDerWaalsContact C-N 3.31Å; N126-S128 PolarHBondContact O-N 3.09Å
129	C	95.2	Very high	92.4	Very high	4 Å²	4	52.7 Å²	52.7	3%	0.027	33%	0.33	C	S	.	.			trans	-57.4	124.7	-179.4	176.4	0	0	0	0	110.3	C118 C124 T125 N131 R132	C118-C129 VanDerWaalsContact SG-SG 3.64Å; C124-C129 HydrophobicContact CB-CB 4.5Å; C124-C129 VanDerWaalsContact SG-SG 3.69Å; T125-C129 WeakPolarHBondContact O-CB 3.45Å; T125-C129 PolarHBondContact O-N 3.27Å; C129-N131 PolarHBondContact O-N 2.73Å; C129-R132 HydrophobicContact CB-CG 4.01Å; C129-R132 PolarHBondContact O-N 2.73Å
130	P	95.7	Very high	92.3	Very high	66 Å²	66	53.1 Å²	53.1	43%	0.429	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-12.4	-176.4	28.6	-37.3	0	0	0	113	D87 C88 Y103 R132	D87-P130 HydrophobicContact CB-CG 4.42Å; C88-P130 VanDerWaalsContact O-CG 3.25Å; C88-P130 WeakPolarHBondContact O-CG 3.38Å; Y103-P130 WeakPolarHBondContact CD2-O 3.28Å; P130-R132 VanDerWaalsContact C-N 3.29Å; P130-R132 PolarHBondContact O-N 2.85Å
131	N	97.1	Very high	92.4	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.016	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	37.4	174.2	-164.4	36.3	0	0	0	112.6	L97 N102 V116 E117 C118 C129	L97-N131 HydrophobicContact CD1-CB 4.38Å; L97-N131 HydrophobicContact CD2-CB 4.13Å; L97-N131 VanDerWaalsContact CD2-CG 3.43Å; L97-N131 WeakPolarHBondContact CD2-ND2 3.35Å; L97-N131 HydrophobicContact CG-CB 4.48Å; N102-N131 PolarHBondContact ND2-OD1 2.66Å; V116-N131 PolarHBondContact O-ND2 2.79Å; E117-N131 WeakPolarHBondContact CA-ND2 3.36Å; E117-N131 WeakPolarHBondContact CA-O 3.37Å; E117-N131 WeakPolarHBondContact CB-O 3.4Å; E117-N131 WeakPolarHBondContact CG-O 3.42Å; C118-N131 PolarHBondContact N-ND2 3.16Å; C118-N131 PolarHBondContact N-O 3.21Å; C129-N131 PolarHBondContact O-N 2.73Å
132	R	96.3	Very high	92.4	Very high	20 Å²	20	43.4 Å²	43.4	8%	0.075	29%	0.288	C	S	.	.			trans	-139.3	84.7	174.7	-59	-173.1	-178	-94.8	0.9	109.4	C118 G119 C129 P130 Q135 C136	C118-R132 HydrophobicContact CB-CG 4.14Å; C118-R132 PolarHBondContact O-NH1 3.15Å; G119-R132 PolarHBondContact O-NH1 3.5Å; G119-R132 VanDerWaalsContact O-NH1 3.11Å; G119-R132 PolarHBondContact O-NH2 2.8Å; C129-R132 HydrophobicContact CB-CG 4.01Å; C129-R132 PolarHBondContact O-N 2.73Å; P130-R132 VanDerWaalsContact C-N 3.29Å; P130-R132 PolarHBondContact O-N 2.85Å; R132-Q135 HydrophobicContact CB-CG 4Å; R132-C136 PolarHBondContact O-SG 3.26Å
133	V	96.9	Very high	92.1	Very high	24 Å²	24	45 Å²	45	15%	0.145	29%	0.292	C	S	.	.	S	Bend	trans	-114.9	-58.7	-177.1	173.7	0	0	0	0	110.7	Y103 E117 C136 F166	Y103-V133 HydrophobicContact CD1-CB 4.14Å; Y103-V133 HydrophobicContact CD1-CG1 4.43Å; Y103-V133 HydrophobicContact CD1-CG2 3.77Å; Y103-V133 HydrophobicContact CD2-CB 4.27Å; Y103-V133 HydrophobicContact CD2-CG2 3.6Å; Y103-V133 HydrophobicContact CE1-CB 3.91Å; Y103-V133 HydrophobicContact CE1-CG1 4.24Å; Y103-V133 HydrophobicContact CE1-CG2 4.05Å; Y103-V133 HydrophobicContact CE2-CB 4.05Å; Y103-V133 HydrophobicContact CE2-CG2 3.88Å; Y103-V133 HydrophobicContact CG-CB 4.33Å; Y103-V133 HydrophobicContact CG-CG2 3.56Å; E117-V133 VanDerWaalsContact CD-N 3.3Å; E117-V133 WeakPolarHBondContact OE1-CA 3.36Å; E117-V133 PolarHBondContact OE1-N 3.47Å; E117-V133 PolarHBondContact OE2-N 2.83Å; V133-C136 WeakPolarHBondContact O-CB 3.34Å; V133-C136 PolarHBondContact O-N 2.9Å; V133-F166 HydrophobicContact CG1-CB 3.84Å
134	V	96.6	Very high	91.8	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-63.6	-43.7	-179.2	176.4	0	0	0	0	111.1	E117 C136 G137 F166 N169 V237 Y239 S247 F249	E117-V134 PolarHBondContact OE1-N 3.03Å; V134-C136 PolarHBondContact O-N 3.03Å; V134-C136 VanDerWaalsContact O-N 3.12Å; V134-G137 PolarHBondContact O-N 3.33Å; V134-F166 HydrophobicContact CB-CE2 4.34Å; V134-F166 HydrophobicContact CB-CZ 4.41Å; V134-F166 HydrophobicContact CG1-CE2 3.9Å; V134-F166 HydrophobicContact CG1-CZ 3.87Å; V134-F166 HydrophobicContact CG2-CD2 3.88Å; V134-F166 HydrophobicContact CG2-CE2 4.02Å; V134-F166 HydrophobicContact CG2-CG 4.31Å; V134-N169 VanDerWaalsContact CG1-OD1 3.24Å; V134-N169 WeakPolarHBondContact CG1-OD1 3.23Å; V134-V237 HydrophobicContact CB-CG1 4.22Å; V134-V237 HydrophobicContact CG2-CB 4.3Å; V134-V237 HydrophobicContact CG2-CG1 4.03Å; V134-V237 HydrophobicContact CG2-CG2 4.05Å; V134-Y239 HydrophobicContact CB-CE1 4.26Å; V134-Y239 HydrophobicContact CG1-CE1 3.88Å; V134-S247 WeakPolarHBondContact CG1-OG 3.45Å; V134-F249 HydrophobicContact CG2-CE2 4.2Å; V134-F249 HydrophobicContact CG2-CZ 3.58Å
135	Q	94.6	Very high	91.4	Very high	54 Å²	54	46.7 Å²	46.7	25%	0.252	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-65.5	-13.7	179.4	76.8	-168.4	-99.3	0	0	113.6	E117 C118 R132 G137 Y239	E117-Q135 WeakPolarHBondContact OE2-CG 3.45Å; E117-Q135 PolarHBondContact OE2-N 2.81Å; E117-Q135 PolarHBondContact OE2-NE2 3.22Å; C118-Q135 PolarHBondContact O-NE2 2.83Å; C118-Q135 PolarHBondContact O-OE1 3.03Å; R132-Q135 HydrophobicContact CB-CG 4Å; Q135-G137 VanDerWaalsContact C-N 3.25Å; Q135-Y239 HydrophobicContact CB-CD1 4.19Å; Q135-Y239 HydrophobicContact CB-CD2 4Å; Q135-Y239 HydrophobicContact CB-CE1 3.93Å; Q135-Y239 HydrophobicContact CB-CE2 3.74Å; Q135-Y239 HydrophobicContact CB-CG 4.22Å
136	C	93.1	Very high	91.4	Very high	90 Å²	90	50.1 Å²	50.1	61%	0.608	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-81.3	-5.4	175.7	-64.6	0	0	0	0	112.7	R132 V133 V134	R132-C136 PolarHBondContact O-SG 3.26Å; V133-C136 WeakPolarHBondContact O-CB 3.34Å; V133-C136 PolarHBondContact O-N 2.9Å; V134-C136 PolarHBondContact O-N 3.03Å; V134-C136 VanDerWaalsContact O-N 3.12Å
137	G	91.6	Very high	91.6	Very high	32 Å²	32	44.4 Å²	44.4	33%	0.33	27%	0.27	S	S	.	.			trans	78.1	-171.5	175.3	0	0	0	0	0	114.5	V134 Q135 S139	V134-G137 PolarHBondContact O-N 3.33Å; Q135-G137 VanDerWaalsContact C-N 3.25Å; G137-S139 PolarHBondContact O-N 3.32Å
138	I	92.4	Very high	91.5	Very high	66 Å²	66	48.1 Å²	48.1	34%	0.338	28%	0.281	S	S	.	.			trans	-76.8	118.2	-174.8	-58.2	172.7	0	0	0	109.6	L142 C168	I138-L142 HydrophobicContact CD1-CD1 4.36Å; I138-L142 HydrophobicContact CG2-CD1 3.81Å; I138-L142 HydrophobicContact CG2-CG 4.15Å; I138-C168 HydrophobicContact CD1-CB 3.58Å; I138-C168 HydrophobicContact CG1-CB 3.82Å
139	S	92.6	Very high	90.6	Very high	101 Å²	101	46.9 Å²	46.9	71%	0.706	27%	0.272	S	S	*	.			trans	-100.9	-10	173.3	60.4	0	0	0	0	113.8	G137	G137-S139 PolarHBondContact O-N 3.32Å
140	L	93.1	Very high	89.8	Confident	15 Å²	15	51 Å²	51	8%	0.079	29%	0.291	C	S	.	.	S	Bend	trans	-87.5	143.6	-175.9	-70.8	172.4	0	0	0	112.2	L142 I161 V167	L140-L142 HydrophobicContact CB-CD2 3.84Å; L140-L142 HydrophobicContact CB-CG 4.13Å; L140-L142 HydrophobicContact CD1-CD2 4.4Å; L140-L142 PolarHBondContact O-N 2.85Å; L140-I161 HydrophobicContact CD1-CD1 3.86Å; L140-I161 HydrophobicContact CD1-CG1 3.97Å; L140-I161 HydrophobicContact CD1-CG2 4.11Å; L140-I161 HydrophobicContact CD2-CG1 4.32Å; L140-V167 HydrophobicContact CD1-CB 4.38Å; L140-V167 HydrophobicContact CD1-CG1 4.35Å; L140-V167 HydrophobicContact CD1-CG2 4.15Å
141	P	92.9	Very high	89.3	Confident	29 Å²	29	48.8 Å²	48.8	19%	0.188	27%	0.274	C	S	.	.			trans	-77.1	75.2	173.5	33.1	-35	0	0	0	110.6	L158 T159	P141-L158 HydrophobicContact CB-CB 4.21Å; P141-L158 HydrophobicContact CB-CD1 4.28Å; P141-L158 HydrophobicContact CB-CG 4.4Å; P141-L158 HydrophobicContact CG-CB 4.04Å; P141-L158 WeakPolarHBondContact O-CG 3.37Å; P141-L158 PolarHBondContact O-N 3.12Å; P141-T159 WeakPolarHBondContact CD-OG1 3.47Å; P141-T159 HydrophobicContact CG-CG2 3.77Å; P141-T159 WeakPolarHBondContact CG-OG1 3.49Å
142	L	92.5	Very high	88.7	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	147	177.3	-54.4	-178.5	0	0	0	111.1	L43 I138 L140 L155 H156 C157 V167 C168 L220 L260	L43-L142 VanDerWaalsContact CD2-O 3.23Å; L43-L142 WeakPolarHBondContact CD2-O 3.37Å; I138-L142 HydrophobicContact CD1-CD1 4.36Å; I138-L142 HydrophobicContact CG2-CD1 3.81Å; I138-L142 HydrophobicContact CG2-CG 4.15Å; L140-L142 HydrophobicContact CB-CD2 3.84Å; L140-L142 HydrophobicContact CB-CG 4.13Å; L140-L142 HydrophobicContact CD1-CD2 4.4Å; L140-L142 PolarHBondContact O-N 2.85Å; L142-L155 HydrophobicContact CB-CD1 4.29Å; L142-L155 HydrophobicContact CD1-CD2 4.18Å; L142-H156 CarbonylContact C-O 3.55Å; L142-H156 WeakPolarHBondContact CA-O 3.4Å; L142-C157 HydrophobicContact CD2-CB 3.97Å; L142-V167 HydrophobicContact CD1-CG1 4.18Å; L142-V167 HydrophobicContact CD2-CG1 4.09Å; L142-C168 HydrophobicContact CD1-CB 4.21Å; L142-L220 HydrophobicContact CB-CD1 4.08Å; L142-L220 HydrophobicContact CD1-CD1 4.41Å; L142-L260 HydrophobicContact CD2-CD1 3.87Å
143	R	89	Confident	88.3	Confident	47 Å²	47	49.7 Å²	49.7	18%	0.177	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	135.3	177.6	179.7	179.5	-68	166.1	3	110.8	N44 L155 H156 L158	N44-R143 PolarHBondContact O-NH2 3.33Å; R143-L155 WeakPolarHBondContact O-CA 3.3Å; R143-L155 WeakPolarHBondContact O-CD1 3.17Å; R143-H156 PolarHBondContact N-O 2.95Å; R143-H156 PolarHBondContact O-CD2 2.77Å; R143-H156 PolarHBondContact O-N 2.75Å; R143-L158 HydrophobicContact CB-CD2 4.23Å
144	V	88.3	Confident	87.9	Confident	32 Å²	32	48.6 Å²	48.6	19%	0.194	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	135.7	167.9	-177.7	0	0	0	0	108.8	L22 F153 G154 L155 L220 F223	L22-V144 HydrophobicContact CD1-CG1 3.77Å; V144-F153 HydrophobicContact CG1-CB 4.1Å; V144-F153 HydrophobicContact CG1-CD1 4.06Å; V144-F153 HydrophobicContact CG1-CG 4.35Å; V144-G154 WeakPolarHBondContact CA-O 3.18Å; V144-L155 HydrophobicContact CG2-CD1 3.8Å; V144-L220 HydrophobicContact CG2-CD2 3.99Å; V144-F223 HydrophobicContact CG1-CB 4.47Å; V144-F223 HydrophobicContact CG1-CD1 4.05Å; V144-F223 HydrophobicContact CG1-CD2 4.22Å; V144-F223 HydrophobicContact CG1-CE1 4.33Å; V144-F223 HydrophobicContact CG1-CE2 4.49Å; V144-F223 HydrophobicContact CG1-CG 3.99Å; V144-F223 HydrophobicContact CG2-CB 4.41Å; V144-F223 HydrophobicContact CG2-CD2 3.5Å; V144-F223 VanDerWaalsContact CG2-CD2 3.5Å; V144-F223 HydrophobicContact CG2-CE2 3.88Å; V144-F223 HydrophobicContact CG2-CG 3.99Å
145	Y	85.3	Confident	87.8	Confident	67 Å²	67	48.5 Å²	48.5	26%	0.263	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	158.5	178.3	78.4	-67.2	0	0	0	111	T147 F153 G154 H156 E259	Y145-T147 HydrophobicContact CE1-CG2 4.41Å; Y145-T147 HydrophobicContact CE2-CG2 4.13Å; Y145-F153 CarbonylContact O-C 3.25Å; Y145-F153 VanDerWaalsContact O-CA 3.27Å; Y145-F153 WeakPolarHBondContact O-CA 3.35Å; Y145-G154 VanDerWaalsContact CD1-O 3.29Å; Y145-G154 WeakPolarHBondContact CD1-O 3.3Å; Y145-G154 PolarHBondContact N-O 2.81Å; Y145-G154 PolarHBondContact O-N 3.34Å; Y145-H156 HydrophobicContact CD1-CB 4.49Å; Y145-H156 AromaticContact CD1-CD2 3.24Å; Y145-H156 WeakPolarHBondContact CD1-CD2 3.24Å; Y145-H156 AromaticContact CD1-NE2 3.94Å; Y145-H156 HydrophobicContact CE1-CB 4.28Å; Y145-H156 AromaticContact CE1-CD2 3.87Å; Y145-H156 AromaticContact CG-CD2 3.75Å; Y145-H156 AromaticContact CG-NE2 3.97Å; Y145-E259 HydrophobicContact CE1-CG 4.27Å; Y145-E259 WeakPolarHBondContact OH-CB 3.36Å; Y145-E259 VanDerWaalsContact OH-CG 3.24Å; Y145-E259 WeakPolarHBondContact OH-CG 3.42Å; Y145-E259 PolarHBondContact OH-OE2 2.65Å
146	E	86.5	Confident	87.8	Confident	139 Å²	139	46.2 Å²	46.2	65%	0.65	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	121.5	171.1	-169.6	175.6	-174.3	0	0	109	F153	E146-F153 HydrophobicContact CB-CD1 4.39Å; E146-F153 HydrophobicContact CB-CE1 4.24Å
147	T	85.2	Confident	87.8	Confident	12 Å²	12	42 Å²	42	7%	0.074	24%	0.236	C	C	.	.			trans	-71.7	151.8	178.1	73.3	0	0	0	0	110.5	Y145 S149 K151 G152	Y145-T147 HydrophobicContact CE1-CG2 4.41Å; Y145-T147 HydrophobicContact CE2-CG2 4.13Å; T147-S149 WeakPolarHBondContact CB-OG 3.25Å; T147-S149 PolarHBondContact O-N 3.4Å; T147-S149 PolarHBondContact OG1-O 2.88Å; T147-S149 PolarHBondContact OG1-OG 3.37Å; T147-K151 HydrophobicContact CG2-CB 4.4Å; T147-G152 VanDerWaalsContact CB-O 3.3Å; T147-G152 WeakPolarHBondContact CB-O 3.48Å; T147-G152 VanDerWaalsContact CG2-O 3.31Å; T147-G152 WeakPolarHBondContact CG2-O 3.36Å; T147-G152 PolarHBondContact N-O 2.81Å; T147-G152 PolarHBondContact OG1-N 3.18Å; T147-G152 PolarHBondContact OG1-O 3.49Å
148	T	76.4	Confident	88	Confident	144 Å²	144	42.6 Å²	42.6	88%	0.883	23%	0.231	S	C	*	.	S	Bend	trans	-76	-13.1	173.7	54.3	0	0	0	0	113
149	S	70.9	Confident	88.2	Confident	36 Å²	36	42.2 Å²	42.2	25%	0.252	23%	0.232	S	C	.	.	S	Bend	trans	-91.8	176.4	-180	57.5	0	0	0	0	112.9	T147 K151	T147-S149 WeakPolarHBondContact CB-OG 3.25Å; T147-S149 PolarHBondContact O-N 3.4Å; T147-S149 PolarHBondContact OG1-O 2.88Å; T147-S149 PolarHBondContact OG1-OG 3.37Å; S149-K151 PolarHBondContact O-N 2.76Å; S149-K151 WeakPolarHBondContact OG-CB 3.44Å; S149-K151 WeakPolarHBondContact OG-CE 3.23Å; S149-K151 WeakPolarHBondContact OG-CG 3.3Å
150	E	78.8	Confident	88.5	Confident	91 Å²	91	41.5 Å²	41.5	43%	0.425	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	20.3	173.3	-60.5	178	-175.3	0	0	113.4	T13 Y14 H280	T13-E150 CarbonylContact C-O 3.54Å; T13-E150 HydrophobicContact CG2-CB 4.11Å; T13-E150 WeakPolarHBondContact CG2-O 3.27Å; Y14-E150 CarbonylContact C-O 3.58Å; Y14-E150 PolarHBondContact N-O 2.88Å; Y14-E150 CarbonylContact O-C 3.46Å; E150-H280 IonicContact OE2-CE1 3.42Å; E150-H280 PolarHBondContact OE2-CE1 3.04Å; E150-H280 IonicContact OE2-ND1 3.98Å; E150-H280 IonicContact OE2-NE2 3.9Å; E150-H280 PolarHBondContact OE2-NE2 2.85Å
151	K	84.5	Confident	88.8	Confident	19 Å²	19	41 Å²	41	8%	0.083	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.7	-180	-62.2	-174.4	-70.3	168.1	0	113.1	T147 S149 N225 E259 H280	T147-K151 HydrophobicContact CG2-CB 4.4Å; S149-K151 PolarHBondContact O-N 2.76Å; S149-K151 WeakPolarHBondContact OG-CB 3.44Å; S149-K151 WeakPolarHBondContact OG-CE 3.23Å; S149-K151 WeakPolarHBondContact OG-CG 3.3Å; K151-N225 HydrophobicContact CD-CB 4.2Å; K151-E259 IonicContact NZ-OE1 2.68Å; K151-E259 PolarHBondContact NZ-OE1 2.7Å; K151-E259 IonicContact NZ-OE2 3.78Å; K151-E259 PolarHBondContact NZ-OE2 3.42Å; K151-H280 HydrophobicContact CG-CB 4.15Å
152	G	84.5	Confident	89	Confident	14 Å²	14	41.3 Å²	41.3	14%	0.144	23%	0.228	C	C	.	.			trans	74.7	-126.1	-176.2	0	0	0	0	0	111	T147	T147-G152 VanDerWaalsContact CB-O 3.3Å; T147-G152 WeakPolarHBondContact CB-O 3.48Å; T147-G152 VanDerWaalsContact CG2-O 3.31Å; T147-G152 WeakPolarHBondContact CG2-O 3.36Å; T147-G152 PolarHBondContact N-O 2.81Å; T147-G152 PolarHBondContact OG1-N 3.18Å; T147-G152 PolarHBondContact OG1-O 3.49Å
153	F	88.1	Confident	89.3	Confident	29 Å²	29	48.6 Å²	48.6	13%	0.127	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	153.6	176.9	-66.2	-79.2	0	0	0	112	V20 L22 V144 Y145 E146 F223 N225	V20-F153 HydrophobicContact CB-CE2 4.24Å; V20-F153 HydrophobicContact CG1-CE2 4.05Å; L22-F153 HydrophobicContact CD1-CD1 3.49Å; L22-F153 VanDerWaalsContact CD1-CD1 3.49Å; L22-F153 HydrophobicContact CD1-CD2 4.11Å; L22-F153 HydrophobicContact CD1-CE1 3.37Å; L22-F153 HydrophobicContact CD1-CE2 4Å; L22-F153 HydrophobicContact CD1-CG 3.88Å; L22-F153 HydrophobicContact CD1-CZ 3.64Å; L22-F153 HydrophobicContact CD2-CD2 4.03Å; L22-F153 HydrophobicContact CD2-CE2 3.94Å; L22-F153 HydrophobicContact CD2-CG 4.49Å; L22-F153 HydrophobicContact CD2-CZ 4.33Å; L22-F153 HydrophobicContact CG-CD1 4.29Å; L22-F153 HydrophobicContact CG-CD2 4.13Å; L22-F153 HydrophobicContact CG-CE1 3.88Å; L22-F153 HydrophobicContact CG-CE2 3.71Å; L22-F153 HydrophobicContact CG-CG 4.41Å; L22-F153 HydrophobicContact CG-CZ 3.57Å; V144-F153 HydrophobicContact CG1-CB 4.1Å; V144-F153 HydrophobicContact CG1-CD1 4.06Å; V144-F153 HydrophobicContact CG1-CG 4.35Å; Y145-F153 CarbonylContact O-C 3.25Å; Y145-F153 VanDerWaalsContact O-CA 3.27Å; Y145-F153 WeakPolarHBondContact O-CA 3.35Å; E146-F153 HydrophobicContact CB-CD1 4.39Å; E146-F153 HydrophobicContact CB-CE1 4.24Å; F153-F223 HydrophobicContact CB-CD1 3.85Å; F153-F223 HydrophobicContact CB-CE1 4.38Å; F153-N225 PolarHBondContact O-ND2 3.18Å
154	G	89.9	Confident	89.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	173.2	173.6	0	0	0	0	0	111	V144 Y145 F223	V144-G154 WeakPolarHBondContact CA-O 3.18Å; Y145-G154 VanDerWaalsContact CD1-O 3.29Å; Y145-G154 WeakPolarHBondContact CD1-O 3.3Å; Y145-G154 PolarHBondContact N-O 2.81Å; Y145-G154 PolarHBondContact O-N 3.34Å; G154-F223 CarbonylContact C-O 3.51Å; G154-F223 WeakPolarHBondContact CA-O 3.2Å
155	L	92.8	Very high	90.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	138.8	174	-164.6	72.8	0	0	0	109.2	L142 R143 V144 L220 F223 L224 L260	L142-L155 HydrophobicContact CB-CD1 4.29Å; L142-L155 HydrophobicContact CD1-CD2 4.18Å; R143-L155 WeakPolarHBondContact O-CA 3.3Å; R143-L155 WeakPolarHBondContact O-CD1 3.17Å; V144-L155 HydrophobicContact CG2-CD1 3.8Å; L155-L220 HydrophobicContact CD1-CB 4.17Å; L155-L220 HydrophobicContact CD2-CB 4.35Å; L155-F223 HydrophobicContact CB-CB 4.44Å; L155-F223 PolarHBondContact N-O 2.71Å; L155-L224 HydrophobicContact CB-CD2 4Å; L155-L224 HydrophobicContact CB-CG 4.44Å; L155-L224 HydrophobicContact CD2-CD2 3.85Å; L155-L224 HydrophobicContact CD2-CG 4.05Å; L155-L260 HydrophobicContact CD2-CD1 4.37Å; L155-L260 HydrophobicContact CG-CD1 4.41Å; L155-L260 WeakPolarHBondContact O-CB 3.34Å; L155-L260 PolarHBondContact O-N 2.73Å
156	H	94.6	Very high	90.9	Very high	5 Å²	5	44.3 Å²	44.3	2%	0.023	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	164.3	173.5	65.9	119	0	0	0	109.9	L142 R143 Y145 M257 E258	L142-H156 CarbonylContact C-O 3.55Å; L142-H156 WeakPolarHBondContact CA-O 3.4Å; R143-H156 PolarHBondContact N-O 2.95Å; R143-H156 PolarHBondContact O-CD2 2.77Å; R143-H156 PolarHBondContact O-N 2.75Å; Y145-H156 HydrophobicContact CD1-CB 4.49Å; Y145-H156 AromaticContact CD1-CD2 3.24Å; Y145-H156 WeakPolarHBondContact CD1-CD2 3.24Å; Y145-H156 AromaticContact CD1-NE2 3.94Å; Y145-H156 HydrophobicContact CE1-CB 4.28Å; Y145-H156 AromaticContact CE1-CD2 3.87Å; Y145-H156 AromaticContact CG-CD2 3.75Å; Y145-H156 AromaticContact CG-NE2 3.97Å; H156-M257 WeakPolarHBondContact CE1-CE 3.46Å; H156-M257 PolarHBondContact CE1-SD 3.33Å; H156-M257 PolarHBondContact ND1-SD 3.37Å; H156-E258 VanDerWaalsContact CB-O 3.31Å; H156-E258 WeakPolarHBondContact CB-O 3.24Å
157	C	93.9	Very high	91.5	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.014	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	141.2	174.8	-172.4	0	0	0	0	110.6	L142 T159 I161 M257 L260	L142-C157 HydrophobicContact CD2-CB 3.97Å; C157-T159 VanDerWaalsContact C-N 3.26Å; C157-T159 PolarHBondContact O-N 3.03Å; C157-T159 PolarHBondContact SG-O 2.81Å; C157-T159 PolarHBondContact SG-OG1 3.33Å; C157-I161 HydrophobicContact CB-CD1 3.66Å; C157-I161 HydrophobicContact CB-CG1 3.94Å; C157-M257 PolarHBondContact O-N 3.09Å; C157-L260 HydrophobicContact CB-CD1 4.48Å
158	L	95.3	Very high	92	Very high	44 Å²	44	37.1 Å²	37.1	23%	0.23	20%	0.203	C	C	.	.	S	Bend	trans	-77.2	-13.8	179.3	-55.7	-179.4	0	0	0	113.3	N44 P141 R143 M257	N44-L158 HydrophobicContact CB-CD1 3.85Å; P141-L158 HydrophobicContact CB-CB 4.21Å; P141-L158 HydrophobicContact CB-CD1 4.28Å; P141-L158 HydrophobicContact CB-CG 4.4Å; P141-L158 HydrophobicContact CG-CB 4.04Å; P141-L158 WeakPolarHBondContact O-CG 3.37Å; P141-L158 PolarHBondContact O-N 3.12Å; R143-L158 HydrophobicContact CB-CD2 4.23Å; L158-M257 HydrophobicContact CD2-SD 3.61Å
159	T	97.3	Very high	92.9	Very high	58 Å²	58	30.8 Å²	30.8	36%	0.356	16%	0.164	S	C	.	.	S	Bend	trans	-123.7	163.2	-179.7	55.9	0	0	0	0	110.4	P141 C157	P141-T159 WeakPolarHBondContact CD-OG1 3.47Å; P141-T159 HydrophobicContact CG-CG2 3.77Å; P141-T159 WeakPolarHBondContact CG-OG1 3.49Å; C157-T159 VanDerWaalsContact C-N 3.26Å; C157-T159 PolarHBondContact O-N 3.03Å; C157-T159 PolarHBondContact SG-O 2.81Å; C157-T159 PolarHBondContact SG-OG1 3.33Å
160	P	98.5	Very high	94.1	Very high	87 Å²	87	29.1 Å²	29.1	57%	0.565	15%	0.152	S	C	*	.			trans	-59.8	149.9	173.2	-16.8	30.1	0	0	0	110.9	I254 P256	P160-I254 WeakPolarHBondContact CA-O 3.25Å; P160-P256 HydrophobicContact CG-CG 3.77Å
161	I	98.7	Very high	94.9	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.015	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-118.7	128.6	171.6	-49	175.4	0	0	0	107.9	L140 C157 Q165 V167 A250 D253 I254 L260	L140-I161 HydrophobicContact CD1-CD1 3.86Å; L140-I161 HydrophobicContact CD1-CG1 3.97Å; L140-I161 HydrophobicContact CD1-CG2 4.11Å; L140-I161 HydrophobicContact CD2-CG1 4.32Å; C157-I161 HydrophobicContact CB-CD1 3.66Å; C157-I161 HydrophobicContact CB-CG1 3.94Å; I161-Q165 HydrophobicContact CG2-CB 3.75Å; I161-Q165 HydrophobicContact CG2-CG 4.14Å; I161-V167 HydrophobicContact CD1-CG2 4.23Å; I161-V167 HydrophobicContact CG2-CG2 4.27Å; I161-A250 HydrophobicContact CG2-CB 3.67Å; I161-D253 WeakPolarHBondContact O-CA 3.15Å; I161-I254 HydrophobicContact CB-CB 4.06Å; I161-I254 HydrophobicContact CB-CD1 4.45Å; I161-I254 HydrophobicContact CB-CG1 4.48Å; I161-I254 HydrophobicContact CD1-CB 4.48Å; I161-I254 HydrophobicContact CD1-CD1 4.23Å; I161-I254 HydrophobicContact CG1-CB 4.45Å; I161-I254 PolarHBondContact N-O 2.91Å; I161-I254 PolarHBondContact O-N 3.07Å; I161-L260 HydrophobicContact CD1-CD1 4.3Å; I161-L260 HydrophobicContact CD1-CD2 3.7Å
162	A	98.7	Very high	95.4	Very high	36 Å²	36	24 Å²	24	30%	0.298	13%	0.128	S	C	.	.			trans	-80.2	149.6	176.9	0	0	0	0	0	111.4	L107 G164 Q165 A250 D253	L107-A162 HydrophobicContact CD1-CB 4.49Å; L107-A162 HydrophobicContact CD2-CB 4.23Å; A162-G164 PolarHBondContact O-N 3.47Å; A162-Q165 WeakPolarHBondContact O-CB 3.35Å; A162-Q165 PolarHBondContact O-N 3.48Å; A162-A250 WeakPolarHBondContact O-CB 3.19Å; A162-D253 WeakPolarHBondContact CA-OD1 3.32Å
163	R	98.7	Very high	95.9	Very high	156 Å²	156	24.1 Å²	24.1	59%	0.589	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	134.1	169.3	179.2	176.4	175.3	-171.5	-1	110.8	Q165 N251 D253	R163-Q165 VanDerWaalsContact C-N 3.27Å; R163-Q165 PolarHBondContact O-N 2.56Å; R163-N251 WeakPolarHBondContact CD-O 3.43Å; R163-N251 PolarHBondContact NE-O 2.9Å; R163-D253 PolarHBondContact N-OD1 2.96Å
164	G	98.6	Very high	96.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	-4.7	-178.2	0	0	0	0	0	113.8	L107 L108 A162 F249 A250	L107-G164 CarbonylContact C-O 3.57Å; L107-G164 WeakPolarHBondContact CA-O 3.4Å; L108-G164 WeakPolarHBondContact CB-O 3.46Å; L108-G164 PolarHBondContact N-O 3.2Å; A162-G164 PolarHBondContact O-N 3.47Å; G164-F249 WeakPolarHBondContact O-CD1 3.29Å; G164-A250 PolarHBondContact N-O 3.05Å
165	Q	98.6	Very high	96.5	Very high	47 Å²	47	23 Å²	23	22%	0.22	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-72.7	134.1	178.3	-170.2	170.5	5.6	0	0	110.8	L107 I161 A162 R163 F249 A250	L107-Q165 HydrophobicContact CD2-CB 3.76Å; L107-Q165 HydrophobicContact CD2-CG 4.37Å; I161-Q165 HydrophobicContact CG2-CB 3.75Å; I161-Q165 HydrophobicContact CG2-CG 4.14Å; A162-Q165 WeakPolarHBondContact O-CB 3.35Å; A162-Q165 PolarHBondContact O-N 3.48Å; R163-Q165 VanDerWaalsContact C-N 3.27Å; R163-Q165 PolarHBondContact O-N 2.56Å; Q165-F249 WeakPolarHBondContact O-CA 3.44Å; Q165-A250 PolarHBondContact O-N 3.43Å
166	F	98.4	Very high	96.6	Very high	8 Å²	8	23.4 Å²	23.4	4%	0.035	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	133.4	171.9	175.1	-118.7	0	0	0	110.6	V133 V134 C168 N169 F249	V133-F166 HydrophobicContact CG1-CB 3.84Å; V134-F166 HydrophobicContact CB-CE2 4.34Å; V134-F166 HydrophobicContact CB-CZ 4.41Å; V134-F166 HydrophobicContact CG1-CE2 3.9Å; V134-F166 HydrophobicContact CG1-CZ 3.87Å; V134-F166 HydrophobicContact CG2-CD2 3.88Å; V134-F166 HydrophobicContact CG2-CE2 4.02Å; V134-F166 HydrophobicContact CG2-CG 4.31Å; F166-C168 VanDerWaalsContact CE2-C 3.42Å; F166-C168 WeakPolarHBondContact CE2-O 3.29Å; F166-C168 VanDerWaalsContact CZ-C 3.49Å; F166-N169 VanDerWaalsContact CE2-OD1 3.3Å; F166-N169 WeakPolarHBondContact CE2-OD1 3.24Å; F166-N169 WeakPolarHBondContact CZ-OD1 3.31Å; F166-F249 HydrophobicContact CB-CD1 4.01Å; F166-F249 HydrophobicContact CB-CE1 3.62Å; F166-F249 HydrophobicContact CB-CZ 4.29Å; F166-F249 HydrophobicContact CD2-CE1 4.17Å; F166-F249 HydrophobicContact CD2-CE2 4.38Å; F166-F249 HydrophobicContact CD2-CZ 4.06Å; F166-F249 HydrophobicContact CG-CE1 4.35Å
167	V	98.1	Very high	96.3	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-62.8	-178	179.9	0	0	0	0	111.3	L140 L142 I161 L232 L248 L260	L140-V167 HydrophobicContact CD1-CB 4.38Å; L140-V167 HydrophobicContact CD1-CG1 4.35Å; L140-V167 HydrophobicContact CD1-CG2 4.15Å; L142-V167 HydrophobicContact CD1-CG1 4.18Å; L142-V167 HydrophobicContact CD2-CG1 4.09Å; I161-V167 HydrophobicContact CD1-CG2 4.23Å; I161-V167 HydrophobicContact CG2-CG2 4.27Å; V167-L232 HydrophobicContact CB-CD2 4.46Å; V167-L232 HydrophobicContact CG1-CD1 4.45Å; V167-L232 HydrophobicContact CG2-CD2 3.71Å; V167-L248 WeakPolarHBondContact CB-O 3.34Å; V167-L248 PolarHBondContact N-O 3.43Å; V167-L260 HydrophobicContact CG1-CD1 3.95Å
168	C	96.4	Very high	96.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	168	176.5	59.7	0	0	0	0	109.3	I138 L142 F166 L248	I138-C168 HydrophobicContact CD1-CB 3.58Å; I138-C168 HydrophobicContact CG1-CB 3.82Å; L142-C168 HydrophobicContact CD1-CB 4.21Å; F166-C168 VanDerWaalsContact CE2-C 3.42Å; F166-C168 WeakPolarHBondContact CE2-O 3.29Å; F166-C168 VanDerWaalsContact CZ-C 3.49Å; C168-L248 WeakPolarHBondContact O-CB 3.48Å; C168-L248 WeakPolarHBondContact O-CD1 3.47Å; C168-L248 PolarHBondContact O-N 3.48Å
169	N	96.2	Very high	96	Very high	11 Å²	11	33.1 Å²	33.1	6%	0.059	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	157.7	167.3	-67.5	-30.8	0	0	0	110.8	V134 F166 E171 N219 A221 R245 L246 S247	V134-N169 VanDerWaalsContact CG1-OD1 3.24Å; V134-N169 WeakPolarHBondContact CG1-OD1 3.23Å; F166-N169 VanDerWaalsContact CE2-OD1 3.3Å; F166-N169 WeakPolarHBondContact CE2-OD1 3.24Å; F166-N169 WeakPolarHBondContact CZ-OD1 3.31Å; N169-E171 VanDerWaalsContact CB-CD 3.47Å; N169-E171 HydrophobicContact CB-CG 3.68Å; N169-E171 WeakPolarHBondContact CB-OE1 3.49Å; N169-E171 VanDerWaalsContact CG-OE1 3.24Å; N169-E171 PolarHBondContact ND2-OE1 3.21Å; N169-E171 PolarHBondContact O-N 3.38Å; N169-N219 PolarHBondContact O-ND2 2.96Å; N169-N219 PolarHBondContact O-OD1 2.81Å; N169-A221 WeakPolarHBondContact O-CB 3.46Å; N169-R245 PolarHBondContact ND2-NE 3.26Å; N169-L246 CarbonylContact C-O 3.45Å; N169-L246 VanDerWaalsContact CA-O 3.28Å; N169-L246 WeakPolarHBondContact CA-O 3.2Å; N169-S247 WeakPolarHBondContact OD1-CA 3.48Å; N169-S247 PolarHBondContact OD1-OG 2.95Å
170	Y	95.9	Very high	95.6	Very high	1 Å²	1	30.4 Å²	30.4	0%	0.004	16%	0.158	C	C	.	.			trans	-85.8	100.8	163.8	-156.7	-85.3	0	0	0	109.2	F194 F196 I212 P214 A221 L246	Y170-F194 PolarHBondContact OH-O 3.3Å; Y170-F196 HydrophobicContact CD1-CB 3.86Å; Y170-F196 HydrophobicContact CD1-CD2 4.16Å; Y170-F196 HydrophobicContact CD1-CG 4.36Å; Y170-F196 HydrophobicContact CD2-CD2 4.2Å; Y170-F196 HydrophobicContact CE1-CB 3.7Å; Y170-F196 HydrophobicContact CE1-CD2 4.36Å; Y170-F196 HydrophobicContact CE2-CD2 4.42Å; Y170-F196 HydrophobicContact CG-CD2 4.07Å; Y170-I212 HydrophobicContact CD1-CB 4.39Å; Y170-I212 HydrophobicContact CD1-CG2 4.08Å; Y170-I212 WeakPolarHBondContact O-CD1 3.42Å; Y170-P214 HydrophobicContact CE1-CB 4.44Å; Y170-P214 HydrophobicContact CE1-CG 3.62Å; Y170-P214 WeakPolarHBondContact OH-CG 3.17Å; Y170-A221 HydrophobicContact CD2-CB 3.68Å; Y170-A221 HydrophobicContact CE2-CB 4.32Å; Y170-A221 WeakPolarHBondContact CE2-O 3.48Å; Y170-A221 HydrophobicContact CG-CB 4.22Å; Y170-L246 PolarHBondContact N-O 3Å
171	E	95	Very high	95.1	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.009	15%	0.151	C	C	.	.			trans	-111.7	138.2	-171.9	-53.9	-72.5	-177.3	0	0	111.4	S64 N169 P214 G218 N219 R245	S64-E171 WeakPolarHBondContact CA-OE2 3.24Å; S64-E171 VanDerWaalsContact CB-OE2 3.24Å; S64-E171 WeakPolarHBondContact CB-OE2 3.37Å; S64-E171 PolarHBondContact N-OE2 3.33Å; S64-E171 WeakPolarHBondContact OG-CA 3.39Å; S64-E171 PolarHBondContact OG-OE2 3.4Å; N169-E171 VanDerWaalsContact CB-CD 3.47Å; N169-E171 HydrophobicContact CB-CG 3.68Å; N169-E171 WeakPolarHBondContact CB-OE1 3.49Å; N169-E171 VanDerWaalsContact CG-OE1 3.24Å; N169-E171 PolarHBondContact ND2-OE1 3.21Å; N169-E171 PolarHBondContact O-N 3.38Å; E171-P214 WeakPolarHBondContact O-CB 3.31Å; E171-G218 WeakPolarHBondContact O-CA 3.3Å; E171-N219 HydrophobicContact CB-CB 3.94Å; E171-N219 HydrophobicContact CG-CB 4.34Å; E171-N219 VanDerWaalsContact CG-ND2 3.3Å; E171-N219 WeakPolarHBondContact CG-ND2 3.23Å; E171-N219 PolarHBondContact N-OD1 2.88Å; E171-N219 PolarHBondContact O-N 2.62Å; E171-R245 IonicContact OE1-CZ 3.93Å; E171-R245 IonicContact OE1-NE 3.26Å; E171-R245 PolarHBondContact OE1-NE 3.47Å; E171-R245 VanDerWaalsContact OE1-NE 3.15Å; E171-R245 IonicContact OE1-NH2 3.66Å; E171-R245 PolarHBondContact OE1-NH2 3.43Å; E171-R245 IonicContact OE2-CZ 3.72Å; E171-R245 IonicContact OE2-NE 2.69Å; E171-R245 IonicContact OE2-NH2 3.56Å; E171-R245 PolarHBondContact OE2-NH2 3.37Å
172	G	94.9	Very high	94.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	-166.6	-178.9	0	0	0	0	0	113.2	S64 V65 V174 I212 R217	S64-G172 WeakPolarHBondContact CA-O 3.41Å; S64-G172 VanDerWaalsContact CB-O 3.3Å; S64-G172 WeakPolarHBondContact CB-O 3.34Å; S64-G172 PolarHBondContact OG-N 3.41Å; S64-G172 PolarHBondContact OG-O 2.79Å; V65-G172 PolarHBondContact N-O 3Å; G172-V174 PolarHBondContact O-N 3.06Å; G172-I212 VanDerWaalsContact N-CG2 3.33Å; G172-R217 VanDerWaalsContact CA-O 3.24Å; G172-R217 WeakPolarHBondContact CA-O 3.14Å
173	E	95.3	Very high	93.9	Very high	17 Å²	17	36.4 Å²	36.4	8%	0.079	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	123.2	166.6	-65.4	178.1	81	0	0	109	V65 I175 D213 R216 R217	V65-E173 HydrophobicContact CG2-CG 4.01Å; V65-E173 CarbonylContact O-C 3.58Å; V65-E173 WeakPolarHBondContact O-CA 3.44Å; E173-I175 HydrophobicContact CB-CG2 4.13Å; E173-I175 PolarHBondContact O-N 3.18Å; E173-D213 PolarHBondContact N-O 3.43Å; E173-D213 PolarHBondContact O-N 3.01Å; E173-R216 IonicContact OE1-CZ 2.62Å; E173-R216 IonicContact OE1-NH2 2.76Å; E173-R216 PolarHBondContact OE1-NH2 2.79Å; E173-R216 IonicContact OE2-CZ 2.79Å; E173-R216 IonicContact OE2-NE 2.91Å; E173-R216 PolarHBondContact OE2-NE 2.91Å; E173-R216 VanDerWaalsContact OE2-NE 3.16Å; E173-R216 IonicContact OE2-NH2 3.9Å; E173-R216 PolarHBondContact OE2-NH2 2.69Å; E173-R217 HydrophobicContact CG-CB 4.09Å; E173-R217 HydrophobicContact CG-CG 4.25Å
174	V	96.4	Very high	93	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	111.6	172.4	-173	0	0	0	0	107.8	V65 G67 H70 F75 G172 T210 C211 I212 L243	V65-V174 PolarHBondContact O-N 3.35Å; G67-V174 VanDerWaalsContact CA-O 3.29Å; G67-V174 WeakPolarHBondContact CA-O 3.07Å; G67-V174 PolarHBondContact N-O 2.86Å; H70-V174 WeakPolarHBondContact CB-O 3.49Å; F75-V174 HydrophobicContact CE2-CB 4.18Å; F75-V174 HydrophobicContact CE2-CG2 4.37Å; F75-V174 HydrophobicContact CZ-CB 3.87Å; F75-V174 HydrophobicContact CZ-CG2 3.62Å; G172-V174 PolarHBondContact O-N 3.06Å; V174-T210 HydrophobicContact CG1-CG2 4.39Å; V174-C211 CarbonylContact C-O 3.58Å; V174-C211 VanDerWaalsContact CA-O 3.3Å; V174-C211 WeakPolarHBondContact CA-O 3.17Å; V174-I212 HydrophobicContact CG2-CG1 4.37Å; V174-L243 HydrophobicContact CG1-CD2 4.28Å; V174-L243 HydrophobicContact CG2-CD2 4.19Å
175	I	95	Very high	92.2	Very high	4 Å²	4	33 Å²	33	2%	0.021	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	157.4	-172	63.4	173.7	0	0	0	111.8	E173 Q179 A180 L195 C211 D213	E173-I175 HydrophobicContact CB-CG2 4.13Å; E173-I175 PolarHBondContact O-N 3.18Å; I175-Q179 HydrophobicContact CB-CB 4.29Å; I175-Q179 HydrophobicContact CB-CG 4.23Å; I175-Q179 HydrophobicContact CD1-CG 4.26Å; I175-A180 HydrophobicContact CD1-CB 3.81Å; I175-A180 HydrophobicContact CG1-CB 4.18Å; I175-L195 HydrophobicContact CD1-CD1 3.93Å; I175-L195 HydrophobicContact CG1-CD1 4.43Å; I175-C211 HydrophobicContact CG1-CB 3.83Å; I175-C211 PolarHBondContact N-O 2.84Å; I175-C211 WeakPolarHBondContact O-CB 3.44Å; I175-D213 HydrophobicContact CD1-CB 4Å; I175-D213 HydrophobicContact CG1-CB 4.49Å; I175-D213 HydrophobicContact CG2-CB 4.42Å
176	G	93.2	Very high	91.4	Very high	9 Å²	9	34.9 Å²	34.9	9%	0.093	19%	0.19	C	C	.	.			trans	-67.4	149.4	174.1	0	0	0	0	0	111.9	P68 G69 T178 Q179 A180	P68-G176 PolarHBondContact O-N 3.16Å; G69-G176 WeakPolarHBondContact O-CA 3.42Å; G176-T178 VanDerWaalsContact C-N 3.27Å; G176-T178 PolarHBondContact O-N 2.76Å; G176-Q179 WeakPolarHBondContact O-CA 3.06Å; G176-Q179 VanDerWaalsContact O-CB 3.3Å; G176-Q179 WeakPolarHBondContact O-CB 3.33Å; G176-Q179 PolarHBondContact O-N 2.79Å; G176-A180 PolarHBondContact O-N 3.2Å
177	K	89.5	Confident	90.3	Very high	81 Å²	81	36.7 Å²	36.7	35%	0.352	20%	0.2	S	C	.	.	H	α-helix	trans	-53.8	-42	178.3	-174.8	174.6	-174	166.7	0	113.1	Q179 A180 K181 D209 I297	K177-Q179 VanDerWaalsContact C-N 3.3Å; K177-Q179 PolarHBondContact O-N 2.78Å; K177-A180 WeakPolarHBondContact O-CB 3.12Å; K177-A180 PolarHBondContact O-N 3.15Å; K177-K181 WeakPolarHBondContact O-CG 3.32Å; K177-K181 PolarHBondContact O-N 3.18Å; K177-D209 WeakPolarHBondContact CD-OD2 3.48Å; K177-D209 WeakPolarHBondContact CE-OD2 3.35Å; K177-D209 IonicContact NZ-OD2 3.76Å; K177-D209 PolarHBondContact NZ-OD2 2.85Å; K177-I297 WeakPolarHBondContact CE-OXT 3.41Å
178	T	91.1	Very high	89.2	Confident	95 Å²	95	43.9 Å²	43.9	58%	0.583	23%	0.234	S	C	*	.	H	α-helix	trans	-61.8	-39.8	175.6	-56.6	0	0	0	0	111.7	G176 K181 H182	G176-T178 VanDerWaalsContact C-N 3.27Å; G176-T178 PolarHBondContact O-N 2.76Å; T178-K181 WeakPolarHBondContact O-CB 3.29Å; T178-K181 PolarHBondContact O-N 3.05Å; T178-H182 PolarHBondContact O-CD2 2.79Å; T178-H182 PolarHBondContact O-N 2.99Å
179	Q	92	Very high	87.9	Confident	79 Å²	79	48.7 Å²	48.7	37%	0.369	27%	0.273	S	S	.	.	H	α-helix	trans	-66.1	-42.1	176	-174	63.5	32.4	0	0	111.4	P68 I175 G176 K177 K181 H182 Y183	P68-Q179 HydrophobicContact CB-CG 4.1Å; I175-Q179 HydrophobicContact CB-CB 4.29Å; I175-Q179 HydrophobicContact CB-CG 4.23Å; I175-Q179 HydrophobicContact CD1-CG 4.26Å; G176-Q179 WeakPolarHBondContact O-CA 3.06Å; G176-Q179 VanDerWaalsContact O-CB 3.3Å; G176-Q179 WeakPolarHBondContact O-CB 3.33Å; G176-Q179 PolarHBondContact O-N 2.79Å; K177-Q179 VanDerWaalsContact C-N 3.3Å; K177-Q179 PolarHBondContact O-N 2.78Å; Q179-K181 VanDerWaalsContact C-N 3.35Å; Q179-K181 PolarHBondContact O-N 3.47Å; Q179-H182 PolarHBondContact O-N 2.8Å; Q179-Y183 WeakPolarHBondContact O-CB 3.05Å; Q179-Y183 PolarHBondContact O-N 3.29Å
180	A	89.2	Confident	86.5	Confident	2 Å²	2	50.7 Å²	50.7	2%	0.017	30%	0.297	C	S	.	.	H	α-helix	trans	-59.5	-43.8	175.7	0	0	0	0	0	111.8	I175 G176 K177 Y183 F184 L195 C211	I175-A180 HydrophobicContact CD1-CB 3.81Å; I175-A180 HydrophobicContact CG1-CB 4.18Å; G176-A180 PolarHBondContact O-N 3.2Å; K177-A180 WeakPolarHBondContact O-CB 3.12Å; K177-A180 PolarHBondContact O-N 3.15Å; A180-Y183 PolarHBondContact O-N 2.88Å; A180-F184 WeakPolarHBondContact O-CB 3.4Å; A180-F184 PolarHBondContact O-N 3.05Å; A180-L195 HydrophobicContact CB-CD1 4.19Å; A180-L195 HydrophobicContact CB-CD2 3.91Å; A180-C211 HydrophobicContact CB-CB 4.04Å
181	K	87	Confident	85.2	Confident	97 Å²	97	52.4 Å²	52.4	42%	0.422	31%	0.308	S	S	.	.	H	α-helix	trans	-57.2	-49.3	172	-73.1	-178.8	172.1	-165.7	0	113	K177 T178 Q179 F184 A185 I297	K177-K181 WeakPolarHBondContact O-CG 3.32Å; K177-K181 PolarHBondContact O-N 3.18Å; T178-K181 WeakPolarHBondContact O-CB 3.29Å; T178-K181 PolarHBondContact O-N 3.05Å; Q179-K181 VanDerWaalsContact C-N 3.35Å; Q179-K181 PolarHBondContact O-N 3.47Å; K181-F184 PolarHBondContact O-N 3.14Å; K181-A185 WeakPolarHBondContact O-CB 3.49Å; K181-A185 PolarHBondContact O-N 3.15Å; K181-I297 VanDerWaalsContact CA-CG2 3.4Å; K181-I297 HydrophobicContact CB-CG2 4Å; K181-I297 WeakPolarHBondContact CE-O 3.32Å; K181-I297 WeakPolarHBondContact CE-OXT 3.3Å; K181-I297 HydrophobicContact CG-CG2 3.56Å; K181-I297 WeakPolarHBondContact CG-OXT 3.5Å
182	H	87.4	Confident	84.1	Confident	118 Å²	118	54.2 Å²	54.2	55%	0.546	32%	0.321	S	S	.	.	H	α-helix	trans	-64.3	-44.6	179.9	-77.5	-61	0	0	0	112	T178 Q179 F184 A185 S186	T178-H182 PolarHBondContact O-CD2 2.79Å; T178-H182 PolarHBondContact O-N 2.99Å; Q179-H182 PolarHBondContact O-N 2.8Å; H182-F184 VanDerWaalsContact C-N 3.33Å; H182-F184 PolarHBondContact O-N 3.32Å; H182-A185 PolarHBondContact O-N 3.14Å; H182-S186 WeakPolarHBondContact O-CB 3.39Å; H182-S186 PolarHBondContact O-N 2.92Å; H182-S186 VanDerWaalsContact O-N 3.09Å; H182-S186 PolarHBondContact O-OG 2.63Å
183	Y	84.1	Confident	83.4	Confident	36 Å²	36	54.5 Å²	54.5	14%	0.141	32%	0.322	C	S	.	.	H	α-helix	trans	-54.9	-52.7	175.1	174.8	-110.8	0	0	0	110.4	Q179 A180 A185 S186 L187 L195 T215	Q179-Y183 WeakPolarHBondContact O-CB 3.05Å; Q179-Y183 PolarHBondContact O-N 3.29Å; A180-Y183 PolarHBondContact O-N 2.88Å; Y183-A185 PolarHBondContact O-N 2.94Å; Y183-S186 PolarHBondContact O-N 3.06Å; Y183-S186 VanDerWaalsContact O-N 3.09Å; Y183-S186 PolarHBondContact O-OG 3.48Å; Y183-L187 HydrophobicContact CE1-CD1 4.27Å; Y183-L187 HydrophobicContact CE1-CD2 4.19Å; Y183-L187 HydrophobicContact CE1-CG 4.48Å; Y183-L187 HydrophobicContact CE2-CD2 4.11Å; Y183-L187 PolarHBondContact O-N 3.17Å; Y183-L195 HydrophobicContact CD1-CB 4.45Å; Y183-L195 HydrophobicContact CE1-CB 4.35Å; Y183-T215 PolarHBondContact OH-OG1 2.89Å
184	F	79.8	Confident	83	Confident	13 Å²	13	54.2 Å²	54.2	6%	0.057	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-42.2	-178.7	-172.8	-107.6	0	0	0	113.9	A180 K181 H182 S186 L187 R275 F292 I297	A180-F184 WeakPolarHBondContact O-CB 3.4Å; A180-F184 PolarHBondContact O-N 3.05Å; K181-F184 PolarHBondContact O-N 3.14Å; H182-F184 VanDerWaalsContact C-N 3.33Å; H182-F184 PolarHBondContact O-N 3.32Å; F184-S186 PolarHBondContact O-N 3.14Å; F184-L187 HydrophobicContact CD2-CD1 4.07Å; F184-L187 PolarHBondContact O-N 2.99Å; F184-R275 VanDerWaalsContact CE1-NH1 3.33Å; F184-F292 HydrophobicContact CE1-CE1 4.08Å; F184-F292 AromaticContact CE1-CZ 3.76Å; F184-F292 HydrophobicContact CE1-CZ 3.76Å; F184-F292 HydrophobicContact CE2-CD2 4.45Å; F184-F292 HydrophobicContact CE2-CE1 4.23Å; F184-F292 AromaticContact CE2-CE2 3.41Å; F184-F292 HydrophobicContact CE2-CE2 3.41Å; F184-F292 VanDerWaalsContact CE2-CE2 3.41Å; F184-F292 AromaticContact CE2-CZ 3.33Å; F184-F292 HydrophobicContact CE2-CZ 3.33Å; F184-F292 HydrophobicContact CZ-CD1 4.32Å; F184-F292 HydrophobicContact CZ-CD2 4.41Å; F184-F292 AromaticContact CZ-CE1 3.38Å; F184-F292 HydrophobicContact CZ-CE1 3.38Å; F184-F292 AromaticContact CZ-CE2 3.44Å; F184-F292 HydrophobicContact CZ-CE2 3.44Å; F184-F292 VanDerWaalsContact CZ-CE2 3.44Å; F184-F292 AromaticContact CZ-CZ 2.86Å; F184-F292 HydrophobicContact CZ-CZ 2.86Å; F184-I297 HydrophobicContact CB-CD1 3.86Å; F184-I297 HydrophobicContact CB-CG2 3.97Å; F184-I297 HydrophobicContact CD1-CB 4.37Å; F184-I297 HydrophobicContact CD1-CD1 3.75Å; F184-I297 HydrophobicContact CD1-CG2 4.02Å; F184-I297 HydrophobicContact CD2-CD1 3.26Å; F184-I297 HydrophobicContact CE1-CD1 3.85Å; F184-I297 HydrophobicContact CE2-CD1 3.36Å; F184-I297 HydrophobicContact CG-CD1 3.38Å; F184-I297 HydrophobicContact CG-CG2 4.18Å; F184-I297 HydrophobicContact CZ-CD1 3.58Å
185	A	81.6	Confident	82.7	Confident	72 Å²	72	54.2 Å²	54.2	60%	0.595	32%	0.321	S	S	*	.	H	α-helix	trans	-64.5	-25.2	176.5	0	0	0	0	0	112.9	K181 H182 Y183	K181-A185 WeakPolarHBondContact O-CB 3.49Å; K181-A185 PolarHBondContact O-N 3.15Å; H182-A185 PolarHBondContact O-N 3.14Å; Y183-A185 PolarHBondContact O-N 2.94Å
186	S	82.2	Confident	82.5	Confident	86 Å²	86	54 Å²	54	60%	0.601	32%	0.32	S	S	*	.	H	α-helix	trans	-87	-9.2	178.8	73.6	0	0	0	0	114.6	H182 Y183 F184 E188	H182-S186 WeakPolarHBondContact O-CB 3.39Å; H182-S186 PolarHBondContact O-N 2.92Å; H182-S186 VanDerWaalsContact O-N 3.09Å; H182-S186 PolarHBondContact O-OG 2.63Å; Y183-S186 PolarHBondContact O-N 3.06Å; Y183-S186 VanDerWaalsContact O-N 3.09Å; Y183-S186 PolarHBondContact O-OG 3.48Å; F184-S186 PolarHBondContact O-N 3.14Å; S186-E188 PolarHBondContact O-N 3.39Å
187	L	76.5	Confident	82.4	Confident	46 Å²	46	53.8 Å²	53.8	24%	0.241	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-66.6	124.3	-179.3	-70.7	174.7	0	0	0	111.1	Y183 F184 N193	Y183-L187 HydrophobicContact CE1-CD1 4.27Å; Y183-L187 HydrophobicContact CE1-CD2 4.19Å; Y183-L187 HydrophobicContact CE1-CG 4.48Å; Y183-L187 HydrophobicContact CE2-CD2 4.11Å; Y183-L187 PolarHBondContact O-N 3.17Å; F184-L187 HydrophobicContact CD2-CD1 4.07Å; F184-L187 PolarHBondContact O-N 2.99Å; L187-N193 HydrophobicContact CD1-CB 3.76Å
188	E	74.3	Confident	82.3	Confident	152 Å²	152	49.9 Å²	49.9	71%	0.71	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-67	147	170.7	-60.5	-176.7	168.5	0	0	110.4	S186 G190 S191	S186-E188 PolarHBondContact O-N 3.39Å; E188-G190 PolarHBondContact O-N 2.94Å; E188-S191 WeakPolarHBondContact O-CB 3.49Å; E188-S191 PolarHBondContact O-N 3.16Å; E188-S191 PolarHBondContact O-OG 2.78Å
189	A	69.3	Low	82.2	Confident	101 Å²	101	47.6 Å²	47.6	84%	0.835	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	128.8	175.9	0	0	0	0	0	110.3	S191	A189-S191 VanDerWaalsContact C-N 3.33Å
190	G	66.1	Low	81.9	Confident	53 Å²	53	44 Å²	44	55%	0.546	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	-20.9	-176.3	0	0	0	0	0	114.7	E188 K277	E188-G190 PolarHBondContact O-N 2.94Å; G190-K277 PolarHBondContact O-NZ 2.87Å
191	S	69.3	Low	81.7	Confident	36 Å²	36	47.4 Å²	47.4	25%	0.252	28%	0.279	S	S	.	.			trans	-54.6	141.3	178.6	-71.3	0	0	0	0	112	E188 A189 N193 K277	E188-S191 WeakPolarHBondContact O-CB 3.49Å; E188-S191 PolarHBondContact O-N 3.16Å; E188-S191 PolarHBondContact O-OG 2.78Å; A189-S191 VanDerWaalsContact C-N 3.33Å; S191-N193 PolarHBondContact O-N 2.79Å; S191-K277 PolarHBondContact O-NZ 2.91Å
192	P	72.2	Confident	81.4	Confident	41 Å²	41	43.6 Å²	43.6	27%	0.266	26%	0.264	S	S	.	.			trans	-61.7	134.7	171.8	29.2	-35	0	0	0	109.1	A12 F194	A12-P192 VanDerWaalsContact CB-CA 3.45Å; A12-P192 HydrophobicContact CB-CB 3.38Å; P192-F194 HydrophobicContact CB-CE2 3.71Å; P192-F194 HydrophobicContact CB-CZ 3.72Å; P192-F194 HydrophobicContact CG-CE2 4Å; P192-F194 HydrophobicContact CG-CZ 4.29Å
193	N	79.8	Confident	81.1	Confident	6 Å²	6	42.1 Å²	42.1	3%	0.032	27%	0.267	C	S	.	.			trans	-109.9	142.5	167.7	-177.1	10.2	0	0	0	107.1	S10 T11 L187 S191 L195	S10-N193 CarbonylContact O-C 3.56Å; S10-N193 VanDerWaalsContact O-C 3.25Å; S10-N193 WeakPolarHBondContact O-CB 3.32Å; S10-N193 PolarHBondContact OG-ND2 3.38Å; T11-N193 WeakPolarHBondContact CA-O 3.37Å; T11-N193 WeakPolarHBondContact CG2-O 3.31Å; L187-N193 HydrophobicContact CD1-CB 3.76Å; S191-N193 PolarHBondContact O-N 2.79Å; N193-L195 VanDerWaalsContact OD1-CB 3.27Å; N193-L195 WeakPolarHBondContact OD1-CB 3.27Å; N193-L195 PolarHBondContact OD1-N 3.3Å
194	F	87.2	Confident	81.1	Confident	10 Å²	10	45.6 Å²	45.6	4%	0.044	29%	0.287	C	S	.	.			trans	-129.1	2.4	176.1	-53.5	-83.3	0	0	0	111.7	T11 L56 Y170 P192 F196 P214 T215 R222	T11-F194 HydrophobicContact CG2-CD1 3.69Å; T11-F194 HydrophobicContact CG2-CE1 4.22Å; T11-F194 HydrophobicContact CG2-CG 4.47Å; L56-F194 HydrophobicContact CD1-CZ 4.49Å; Y170-F194 PolarHBondContact OH-O 3.3Å; P192-F194 HydrophobicContact CB-CE2 3.71Å; P192-F194 HydrophobicContact CB-CZ 3.72Å; P192-F194 HydrophobicContact CG-CE2 4Å; P192-F194 HydrophobicContact CG-CZ 4.29Å; F194-F196 PolarHBondContact O-N 3.4Å; F194-P214 HydrophobicContact CB-CG 3.53Å; F194-P214 HydrophobicContact CG-CG 4.46Å; F194-P214 WeakPolarHBondContact O-CD 3.35Å; F194-T215 HydrophobicContact CD2-CG2 4.39Å; F194-R222 HydrophobicContact CD1-CB 4.24Å
195	L	89.6	Confident	81.3	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	32%	0.315	C	S	.	.			trans	-63.8	124.7	180	179.6	68.2	0	0	0	109.8	I175 A180 Y183 N193 V197 C211 D213 I297	I175-L195 HydrophobicContact CD1-CD1 3.93Å; I175-L195 HydrophobicContact CG1-CD1 4.43Å; A180-L195 HydrophobicContact CB-CD1 4.19Å; A180-L195 HydrophobicContact CB-CD2 3.91Å; Y183-L195 HydrophobicContact CD1-CB 4.45Å; Y183-L195 HydrophobicContact CE1-CB 4.35Å; N193-L195 VanDerWaalsContact OD1-CB 3.27Å; N193-L195 WeakPolarHBondContact OD1-CB 3.27Å; N193-L195 PolarHBondContact OD1-N 3.3Å; L195-V197 HydrophobicContact CD2-CG2 4.04Å; L195-V197 HydrophobicContact CG-CG2 4.06Å; L195-C211 HydrophobicContact CD1-CB 4.24Å; L195-D213 HydrophobicContact CD1-CB 4.27Å; L195-I297 HydrophobicContact CD2-CD1 3.88Å; L195-I297 HydrophobicContact CD2-CG1 4.34Å
196	F	91.4	Very high	81.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	120.8	168.9	-163.9	-56.9	0	0	0	108.8	A7 A9 Y170 F194 L198 C211 I212 V234 L246 Y262	A7-F196 HydrophobicContact CB-CE1 3.53Å; A7-F196 HydrophobicContact CB-CE2 4.29Å; A7-F196 HydrophobicContact CB-CZ 3.29Å; A9-F196 HydrophobicContact CB-CD2 3.92Å; A9-F196 HydrophobicContact CB-CE2 4.37Å; A9-F196 HydrophobicContact CB-CG 4.34Å; Y170-F196 HydrophobicContact CD1-CB 3.86Å; Y170-F196 HydrophobicContact CD1-CD2 4.16Å; Y170-F196 HydrophobicContact CD1-CG 4.36Å; Y170-F196 HydrophobicContact CD2-CD2 4.2Å; Y170-F196 HydrophobicContact CE1-CB 3.7Å; Y170-F196 HydrophobicContact CE1-CD2 4.36Å; Y170-F196 HydrophobicContact CE2-CD2 4.42Å; Y170-F196 HydrophobicContact CG-CD2 4.07Å; F194-F196 PolarHBondContact O-N 3.4Å; F196-L198 HydrophobicContact CD1-CB 4.45Å; F196-L198 HydrophobicContact CE1-CB 4.17Å; F196-C211 CarbonylContact O-C 3.49Å; F196-C211 WeakPolarHBondContact O-CA 3.09Å; F196-I212 PolarHBondContact N-O 2.82Å; F196-I212 PolarHBondContact O-N 2.91Å; F196-V234 HydrophobicContact CE2-CG1 4.25Å; F196-V234 HydrophobicContact CE2-CG2 3.99Å; F196-V234 HydrophobicContact CZ-CB 4.27Å; F196-V234 HydrophobicContact CZ-CG1 3.81Å; F196-V234 HydrophobicContact CZ-CG2 4.08Å; F196-L246 HydrophobicContact CB-CD1 4.16Å; F196-L246 HydrophobicContact CD1-CD1 3.21Å; F196-L246 HydrophobicContact CD2-CD1 3.98Å; F196-L246 HydrophobicContact CE1-CD1 3.47Å; F196-L246 VanDerWaalsContact CE1-CD1 3.47Å; F196-L246 HydrophobicContact CE2-CD1 4.16Å; F196-L246 HydrophobicContact CG-CD1 3.51Å; F196-L246 HydrophobicContact CZ-CD1 3.92Å; F196-Y262 HydrophobicContact CD2-CE2 4.18Å; F196-Y262 HydrophobicContact CE2-CD2 4.38Å; F196-Y262 AromaticContact CE2-CE2 3.64Å; F196-Y262 HydrophobicContact CE2-CE2 3.64Å
197	V	90.5	Very high	81.5	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.018	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	114.7	169.5	-174.3	0	0	0	0	109	A7 C8 L195 T210 I297	A7-V197 WeakPolarHBondContact CA-O 3.35Å; C8-V197 PolarHBondContact N-O 2.72Å; C8-V197 PolarHBondContact O-N 3.38Å; L195-V197 HydrophobicContact CD2-CG2 4.04Å; L195-V197 HydrophobicContact CG-CG2 4.06Å; V197-T210 WeakPolarHBondContact CA-O 3.13Å; V197-I297 HydrophobicContact CG2-CG1 4.22Å
198	L	88.8	Confident	82	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.8	166.9	168.4	67.4	0	0	0	108.1	I5 F196 E200 D209 T210 P236 A244 L246	I5-L198 HydrophobicContact CB-CD1 4.29Å; I5-L198 HydrophobicContact CG1-CD1 4.21Å; I5-L198 HydrophobicContact CG2-CD1 3.55Å; F196-L198 HydrophobicContact CD1-CB 4.45Å; F196-L198 HydrophobicContact CE1-CB 4.17Å; L198-E200 HydrophobicContact CD1-CG 3.95Å; L198-E200 HydrophobicContact CD2-CG 3.76Å; L198-E200 HydrophobicContact CG-CG 3.77Å; L198-D209 CarbonylContact O-C 3.34Å; L198-D209 WeakPolarHBondContact O-CA 3.31Å; L198-T210 PolarHBondContact N-O 2.89Å; L198-T210 PolarHBondContact O-N 2.81Å; L198-P236 HydrophobicContact CD1-CG 3.94Å; L198-P236 HydrophobicContact CD2-CB 3.95Å; L198-P236 HydrophobicContact CD2-CG 3.81Å; L198-A244 HydrophobicContact CD2-CB 4.02Å; L198-L246 HydrophobicContact CB-CD1 4.41Å; L198-L246 HydrophobicContact CB-CD2 3.72Å; L198-L246 HydrophobicContact CD1-CD2 4.45Å; L198-L246 HydrophobicContact CD2-CD2 3.31Å; L198-L246 HydrophobicContact CG-CD2 3.98Å
199	R	87.5	Confident	82.6	Confident	46 Å²	46	45.1 Å²	45.1	17%	0.174	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	121.1	169.3	-177.3	168.3	-68.7	162.4	4.1	109.7	A4 A6 V207 D209 D295 C296	A4-R199 VanDerWaalsContact O-O 3.08Å; A6-R199 HydrophobicContact CB-CB 4.32Å; A6-R199 PolarHBondContact N-O 3.04Å; A6-R199 PolarHBondContact O-N 3.21Å; R199-V207 HydrophobicContact CG-CG1 3.48Å; R199-V207 VanDerWaalsContact CG-CG1 3.48Å; R199-D209 WeakPolarHBondContact CG-OD1 3.3Å; R199-D209 IonicContact CZ-OD1 2.93Å; R199-D209 IonicContact NE-OD1 3.15Å; R199-D209 PolarHBondContact NE-OD1 2.84Å; R199-D209 IonicContact NH2-OD1 2.87Å; R199-D295 PolarHBondContact NH2-O 3Å; R199-C296 PolarHBondContact NH2-O 3.17Å
200	E	86.1	Confident	83.6	Confident	3 Å²	3	40.5 Å²	40.5	1%	0.014	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.8	176.1	-56.3	173.1	89.3	0	0	110	Y2 L198 V207 I208 R238	Y2-E200 HydrophobicContact CD1-CB 3.45Å; Y2-E200 VanDerWaalsContact CD1-CB 3.45Å; Y2-E200 HydrophobicContact CD1-CG 4.23Å; Y2-E200 HydrophobicContact CE1-CB 4.03Å; Y2-E200 HydrophobicContact CG-CB 4.18Å; L198-E200 HydrophobicContact CD1-CG 3.95Å; L198-E200 HydrophobicContact CD2-CG 3.76Å; L198-E200 HydrophobicContact CG-CG 3.77Å; E200-V207 WeakPolarHBondContact O-CA 3.46Å; E200-I208 PolarHBondContact N-O 2.89Å; E200-I208 PolarHBondContact O-N 2.78Å; E200-R238 IonicContact OE1-CZ 3.54Å; E200-R238 VanDerWaalsContact OE1-CZ 3.26Å; E200-R238 IonicContact OE1-NH1 3.57Å; E200-R238 PolarHBondContact OE1-NH1 2.94Å; E200-R238 IonicContact OE1-NH2 3.48Å; E200-R238 PolarHBondContact OE1-NH2 3.06Å; E200-R238 IonicContact OE2-CZ 2.76Å; E200-R238 IonicContact OE2-NH1 3.14Å; E200-R238 IonicContact OE2-NH2 3.96Å; E200-R238 PolarHBondContact OE2-NH2 3.28Å
201	H	85.1	Confident	84.8	Confident	75 Å²	75	38.1 Å²	38.1	35%	0.347	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	124.3	173.6	-56.1	-104.3	0	0	0	109.6	Y2 D3	Y2-H201 CarbonylContact C-O 3.51Å; Y2-H201 WeakPolarHBondContact CA-O 3.11Å; D3-H201 PolarHBondContact N-O 2.96Å; D3-H201 WeakPolarHBondContact O-CB 3.21Å; D3-H201 PolarHBondContact O-CD2 3.36Å; D3-H201 PolarHBondContact O-N 3.16Å
202	T	81.2	Confident	86.1	Confident	17 Å²	17	36.6 Å²	36.6	10%	0.104	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	157.3	176.6	58.5	0	0	0	0	111.2	M1 Y2 N204 G205 E206 I208	M1-T202 CarbonylContact O-C 3.49Å; M1-T202 VanDerWaalsContact O-CA 3.25Å; M1-T202 WeakPolarHBondContact O-CA 3.31Å; Y2-T202 HydrophobicContact CD1-CG2 3.68Å; Y2-T202 HydrophobicContact CE1-CG2 3.46Å; Y2-T202 VanDerWaalsContact CE1-CG2 3.46Å; T202-N204 PolarHBondContact O-N 3.26Å; T202-N204 PolarHBondContact OG1-OD1 3.47Å; T202-G205 WeakPolarHBondContact O-CA 3.13Å; T202-G205 PolarHBondContact O-N 2.95Å; T202-E206 PolarHBondContact N-O 2.81Å; T202-E206 WeakPolarHBondContact OG1-CA 3.47Å; T202-E206 VanDerWaalsContact OG1-CB 3.32Å; T202-E206 WeakPolarHBondContact OG1-CB 3.4Å; T202-E206 PolarHBondContact OG1-N 3.04Å; T202-E206 VanDerWaalsContact OG1-N 3.13Å; T202-E206 PolarHBondContact OG1-O 3.39Å; T202-I208 HydrophobicContact CG2-CD1 3.84Å
203	S	79.6	Confident	87.1	Confident	87 Å²	87	34.8 Å²	34.8	61%	0.608	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-16.3	179	48.6	0	0	0	0	115.4	M1	M1-S203 PolarHBondContact N-OG 3.27Å; M1-S203 PolarHBondContact O-N 3.07Å
204	N	84.9	Confident	87.6	Confident	108 Å²	108	34.5 Å²	34.5	58%	0.578	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	0.8	173.5	68	3	0	0	0	112.4	T202 E206	T202-N204 PolarHBondContact O-N 3.26Å; T202-N204 PolarHBondContact OG1-OD1 3.47Å; N204-E206 VanDerWaalsContact ND2-CD 3.31Å; N204-E206 PolarHBondContact ND2-OE2 2.91Å; N204-E206 WeakPolarHBondContact OD1-CB 3.49Å; N204-E206 VanDerWaalsContact OD1-CG 3.31Å; N204-E206 WeakPolarHBondContact OD1-CG 3.25Å; N204-E206 PolarHBondContact OD1-N 2.9Å
205	G	83.3	Confident	87.7	Confident	61 Å²	61	35.7 Å²	35.7	63%	0.629	21%	0.206	S	C	*	.	S	Bend	trans	90.6	-0.9	-178	0	0	0	0	0	115	T202	T202-G205 WeakPolarHBondContact O-CA 3.13Å; T202-G205 PolarHBondContact O-N 2.95Å
206	E	85.5	Confident	87.6	Confident	122 Å²	122	41.5 Å²	41.5	57%	0.57	23%	0.228	S	C	*	.			trans	-73.5	143.4	175	-63.1	174.2	145.7	0	0	110.8	T202 N204	T202-E206 PolarHBondContact N-O 2.81Å; T202-E206 WeakPolarHBondContact OG1-CA 3.47Å; T202-E206 VanDerWaalsContact OG1-CB 3.32Å; T202-E206 WeakPolarHBondContact OG1-CB 3.4Å; T202-E206 PolarHBondContact OG1-N 3.04Å; T202-E206 VanDerWaalsContact OG1-N 3.13Å; T202-E206 PolarHBondContact OG1-O 3.39Å; N204-E206 VanDerWaalsContact ND2-CD 3.31Å; N204-E206 PolarHBondContact ND2-OE2 2.91Å; N204-E206 WeakPolarHBondContact OD1-CB 3.49Å; N204-E206 VanDerWaalsContact OD1-CG 3.31Å; N204-E206 WeakPolarHBondContact OD1-CG 3.25Å; N204-E206 PolarHBondContact OD1-N 2.9Å
207	V	84.3	Confident	87.6	Confident	69 Å²	69	45 Å²	45	42%	0.418	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.2	177.1	179.8	0	0	0	0	108.4	R199 E200	R199-V207 HydrophobicContact CG-CG1 3.48Å; R199-V207 VanDerWaalsContact CG-CG1 3.48Å; E200-V207 WeakPolarHBondContact O-CA 3.46Å
208	I	85.3	Confident	87.6	Confident	63 Å²	63	44.9 Å²	44.9	32%	0.323	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	117.9	174	-67.8	165.5	0	0	0	107.7	Y2 E200 T202	Y2-I208 HydrophobicContact CE1-CD1 3.79Å; E200-I208 PolarHBondContact N-O 2.89Å; E200-I208 PolarHBondContact O-N 2.78Å; T202-I208 HydrophobicContact CG2-CD1 3.84Å
209	D	87.4	Confident	87.6	Confident	44 Å²	44	45.1 Å²	45.1	24%	0.235	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.3	173.7	-69.6	-38.9	0	0	0	109.2	K177 L198 R199	K177-D209 WeakPolarHBondContact CD-OD2 3.48Å; K177-D209 WeakPolarHBondContact CE-OD2 3.35Å; K177-D209 IonicContact NZ-OD2 3.76Å; K177-D209 PolarHBondContact NZ-OD2 2.85Å; L198-D209 CarbonylContact O-C 3.34Å; L198-D209 WeakPolarHBondContact O-CA 3.31Å; R199-D209 WeakPolarHBondContact CG-OD1 3.3Å; R199-D209 IonicContact CZ-OD1 2.93Å; R199-D209 IonicContact NE-OD1 3.15Å; R199-D209 PolarHBondContact NE-OD1 2.84Å; R199-D209 IonicContact NH2-OD1 2.87Å
210	T	90.4	Very high	87.8	Confident	4 Å²	4	43.6 Å²	43.6	3%	0.025	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	117.9	171.4	-59.7	0	0	0	0	109	V174 V197 L198 I212 L243	V174-T210 HydrophobicContact CG1-CG2 4.39Å; V197-T210 WeakPolarHBondContact CA-O 3.13Å; L198-T210 PolarHBondContact N-O 2.89Å; L198-T210 PolarHBondContact O-N 2.81Å; T210-I212 HydrophobicContact CG2-CD1 4.42Å; T210-I212 HydrophobicContact CG2-CG1 4.11Å; T210-L243 HydrophobicContact CG2-CD1 3.81Å
211	C	92.5	Very high	88.1	Confident	4 Å²	4	43.5 Å²	43.5	3%	0.027	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	115	-178.5	-59.3	0	0	0	0	109.9	V174 I175 A180 L195 F196	V174-C211 CarbonylContact C-O 3.58Å; V174-C211 VanDerWaalsContact CA-O 3.3Å; V174-C211 WeakPolarHBondContact CA-O 3.17Å; I175-C211 HydrophobicContact CG1-CB 3.83Å; I175-C211 PolarHBondContact N-O 2.84Å; I175-C211 WeakPolarHBondContact O-CB 3.44Å; A180-C211 HydrophobicContact CB-CB 4.04Å; L195-C211 HydrophobicContact CD1-CB 4.24Å; F196-C211 CarbonylContact O-C 3.49Å; F196-C211 WeakPolarHBondContact O-CA 3.09Å
212	I	94.6	Very high	88.5	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121	179.6	-53	-169.9	0	0	0	109.5	Y170 G172 V174 F196 T210 L246	Y170-I212 HydrophobicContact CD1-CB 4.39Å; Y170-I212 HydrophobicContact CD1-CG2 4.08Å; Y170-I212 WeakPolarHBondContact O-CD1 3.42Å; G172-I212 VanDerWaalsContact N-CG2 3.33Å; V174-I212 HydrophobicContact CG2-CG1 4.37Å; F196-I212 PolarHBondContact N-O 2.82Å; F196-I212 PolarHBondContact O-N 2.91Å; T210-I212 HydrophobicContact CG2-CD1 4.42Å; T210-I212 HydrophobicContact CG2-CG1 4.11Å; I212-L246 HydrophobicContact CD1-CD1 3.67Å; I212-L246 HydrophobicContact CD1-CG 3.71Å; I212-L246 HydrophobicContact CG1-CD1 4.22Å
213	D	93.1	Very high	88.9	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	103.4	178.3	-179.9	11.1	0	0	0	111	E173 I175 L195 T215	E173-D213 PolarHBondContact N-O 3.43Å; E173-D213 PolarHBondContact O-N 3.01Å; I175-D213 HydrophobicContact CD1-CB 4Å; I175-D213 HydrophobicContact CG1-CB 4.49Å; I175-D213 HydrophobicContact CG2-CB 4.42Å; L195-D213 HydrophobicContact CD1-CB 4.27Å; D213-T215 VanDerWaalsContact C-N 3.28Å; D213-T215 PolarHBondContact O-N 3.11Å; D213-T215 WeakPolarHBondContact OD1-CB 3.24Å; D213-T215 PolarHBondContact OD1-N 3.37Å; D213-T215 PolarHBondContact OD1-OG1 3.24Å
214	P	91.9	Very high	89.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	17.8	178.6	41.2	-39	0	0	0	112.6	Y170 E171 F194 R217 R222	Y170-P214 HydrophobicContact CE1-CB 4.44Å; Y170-P214 HydrophobicContact CE1-CG 3.62Å; Y170-P214 WeakPolarHBondContact OH-CG 3.17Å; E171-P214 WeakPolarHBondContact O-CB 3.31Å; F194-P214 HydrophobicContact CB-CG 3.53Å; F194-P214 HydrophobicContact CG-CG 4.46Å; F194-P214 WeakPolarHBondContact O-CD 3.35Å; P214-R217 VanDerWaalsContact CA-O 3.32Å; P214-R217 WeakPolarHBondContact CA-O 3.47Å; P214-R222 HydrophobicContact CB-CB 4.06Å; P214-R222 HydrophobicContact CG-CB 3.91Å; P214-R222 PolarHBondContact O-NE 3.42Å
215	T	88	Confident	90.1	Very high	35 Å²	35	31 Å²	31	22%	0.215	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	-48.4	-174.3	-60.1	0	0	0	0	111.4	Y183 F194 D213	Y183-T215 PolarHBondContact OH-OG1 2.89Å; F194-T215 HydrophobicContact CD2-CG2 4.39Å; D213-T215 VanDerWaalsContact C-N 3.28Å; D213-T215 PolarHBondContact O-N 3.11Å; D213-T215 WeakPolarHBondContact OD1-CB 3.24Å; D213-T215 PolarHBondContact OD1-N 3.37Å; D213-T215 PolarHBondContact OD1-OG1 3.24Å
216	R	88.4	Confident	90.5	Very high	123 Å²	123	28.5 Å²	28.5	46%	0.464	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-43	179.3	-63.3	-173.6	-59.4	-81.9	-2.1	113	F58 E59 E173	F58-R216 WeakPolarHBondContact CA-O 3.38Å; F58-R216 WeakPolarHBondContact CB-O 3.38Å; E59-R216 PolarHBondContact N-O 3.12Å; E173-R216 IonicContact OE1-CZ 2.62Å; E173-R216 IonicContact OE1-NH2 2.76Å; E173-R216 PolarHBondContact OE1-NH2 2.79Å; E173-R216 IonicContact OE2-CZ 2.79Å; E173-R216 IonicContact OE2-NE 2.91Å; E173-R216 PolarHBondContact OE2-NE 2.91Å; E173-R216 VanDerWaalsContact OE2-NE 3.16Å; E173-R216 IonicContact OE2-NH2 3.9Å; E173-R216 PolarHBondContact OE2-NH2 2.69Å
217	R	90.9	Very high	91	Very high	75 Å²	75	22.9 Å²	22.9	28%	0.283	11%	0.11	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	116.9	177.6	-46.4	-178.9	78.6	-161.2	-2.7	108	E59 I61 G172 E173 P214	E59-R217 HydrophobicContact CB-CB 4.42Å; E59-R217 HydrophobicContact CB-CG 4.17Å; E59-R217 VanDerWaalsContact CD-NE 3.28Å; E59-R217 CarbonylContact O-C 3.56Å; E59-R217 VanDerWaalsContact O-CA 3.23Å; E59-R217 WeakPolarHBondContact O-CA 3.42Å; E59-R217 IonicContact OE1-CZ 3.21Å; E59-R217 IonicContact OE1-NE 3.32Å; E59-R217 PolarHBondContact OE1-NE 2.75Å; E59-R217 IonicContact OE1-NH2 3.94Å; E59-R217 PolarHBondContact OE1-NH2 3.13Å; E59-R217 IonicContact OE2-CZ 2.81Å; E59-R217 IonicContact OE2-NE 3.97Å; E59-R217 PolarHBondContact OE2-NE 2.78Å; E59-R217 IonicContact OE2-NH2 2.66Å; I61-R217 HydrophobicContact CD1-CB 3.96Å; I61-R217 HydrophobicContact CG2-CB 4.02Å; G172-R217 VanDerWaalsContact CA-O 3.24Å; G172-R217 WeakPolarHBondContact CA-O 3.14Å; E173-R217 HydrophobicContact CG-CB 4.09Å; E173-R217 HydrophobicContact CG-CG 4.25Å; P214-R217 VanDerWaalsContact CA-O 3.32Å; P214-R217 WeakPolarHBondContact CA-O 3.47Å
218	G	90.5	Very high	91.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	172.1	-177.2	0	0	0	0	0	113.6	F58 E59 Y60 I61 E171	F58-G218 WeakPolarHBondContact CE2-O 3.17Å; E59-G218 PolarHBondContact O-N 2.79Å; Y60-G218 VanDerWaalsContact CA-O 3.3Å; Y60-G218 WeakPolarHBondContact CA-O 3.33Å; I61-G218 PolarHBondContact N-O 3.38Å; E171-G218 WeakPolarHBondContact O-CA 3.3Å
219	N	89.4	Confident	91.9	Very high	4 Å²	4	19.9 Å²	19.9	2%	0.021	10%	0.1	C	C	.	.			trans	-104.5	-164.8	-177.2	79.9	-11.3	0	0	0	113.6	Y60 I61 N169 E171 A221 R222	Y60-N219 HydrophobicContact CE2-CB 3.9Å; I61-N219 WeakPolarHBondContact O-CB 3.1Å; N169-N219 PolarHBondContact O-ND2 2.96Å; N169-N219 PolarHBondContact O-OD1 2.81Å; E171-N219 HydrophobicContact CB-CB 3.94Å; E171-N219 HydrophobicContact CG-CB 4.34Å; E171-N219 VanDerWaalsContact CG-ND2 3.3Å; E171-N219 WeakPolarHBondContact CG-ND2 3.23Å; E171-N219 PolarHBondContact N-OD1 2.88Å; E171-N219 PolarHBondContact O-N 2.62Å; N219-A221 PolarHBondContact O-N 2.85Å; N219-A221 WeakPolarHBondContact OD1-CB 3.41Å; N219-A221 PolarHBondContact OD1-N 2.76Å; N219-R222 VanDerWaalsContact O-CD 3.25Å; N219-R222 WeakPolarHBondContact O-CD 3.22Å; N219-R222 WeakPolarHBondContact O-CG 3.17Å; N219-R222 PolarHBondContact O-N 3.06Å
220	L	90.9	Very high	92.4	Very high	15 Å²	15	19.5 Å²	19.5	8%	0.079	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-62.3	-24.7	179.7	-63.3	-178.4	0	0	0	113.9	M24 Y60 L142 V144 L155 R222 F223	M24-L220 HydrophobicContact CE-CD2 4.35Å; Y60-L220 HydrophobicContact CE2-CD2 4.07Å; Y60-L220 HydrophobicContact CE2-CG 3.9Å; L142-L220 HydrophobicContact CB-CD1 4.08Å; L142-L220 HydrophobicContact CD1-CD1 4.41Å; V144-L220 HydrophobicContact CG2-CD2 3.99Å; L155-L220 HydrophobicContact CD1-CB 4.17Å; L155-L220 HydrophobicContact CD2-CB 4.35Å; L220-R222 PolarHBondContact O-N 3.23Å; L220-F223 WeakPolarHBondContact O-CB 3.06Å; L220-F223 WeakPolarHBondContact O-CD2 3.27Å; L220-F223 PolarHBondContact O-N 2.96Å
221	A	94.1	Very high	92.8	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-66	-20.2	-175.3	0	0	0	0	0	113	N169 Y170 N219 F223 L224 L248	N169-A221 WeakPolarHBondContact O-CB 3.46Å; Y170-A221 HydrophobicContact CD2-CB 3.68Å; Y170-A221 HydrophobicContact CE2-CB 4.32Å; Y170-A221 WeakPolarHBondContact CE2-O 3.48Å; Y170-A221 HydrophobicContact CG-CB 4.22Å; N219-A221 PolarHBondContact O-N 2.85Å; N219-A221 WeakPolarHBondContact OD1-CB 3.41Å; N219-A221 PolarHBondContact OD1-N 2.76Å; A221-F223 PolarHBondContact O-N 3.41Å; A221-F223 VanDerWaalsContact O-N 3.11Å; A221-L224 HydrophobicContact CB-CD1 3.91Å; A221-L224 VanDerWaalsContact O-CB 3.31Å; A221-L224 WeakPolarHBondContact O-CB 2.98Å; A221-L224 PolarHBondContact O-N 2.62Å; A221-L248 HydrophobicContact CB-CD1 4.18Å
222	R	92	Very high	93.1	Very high	5 Å²	5	19.2 Å²	19.2	2%	0.019	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-61.2	-16.1	172.2	76	-167	-68	-71	-0.2	113.9	F194 P214 N219 L220	F194-R222 HydrophobicContact CD1-CB 4.24Å; P214-R222 HydrophobicContact CB-CB 4.06Å; P214-R222 HydrophobicContact CG-CB 3.91Å; P214-R222 PolarHBondContact O-NE 3.42Å; N219-R222 VanDerWaalsContact O-CD 3.25Å; N219-R222 WeakPolarHBondContact O-CD 3.22Å; N219-R222 WeakPolarHBondContact O-CG 3.17Å; N219-R222 PolarHBondContact O-N 3.06Å; L220-R222 PolarHBondContact O-N 3.23Å
223	F	91	Very high	93.2	Very high	9 Å²	9	21.3 Å²	21.3	4%	0.039	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-95.1	-0.3	176	-59.1	-69.4	0	0	0	113.7	L22 L56 F58 V144 F153 G154 L155 L220 A221 N225	L22-F223 HydrophobicContact CD1-CE1 4.38Å; L22-F223 HydrophobicContact CD2-CE1 3.52Å; L22-F223 HydrophobicContact CD2-CZ 3.71Å; L56-F223 HydrophobicContact CD2-CE1 4.13Å; F58-F223 HydrophobicContact CE1-CE2 4.18Å; F58-F223 AromaticContact CE1-CZ 3.68Å; F58-F223 HydrophobicContact CE1-CZ 3.68Å; F58-F223 AromaticContact CZ-CE2 3.78Å; F58-F223 HydrophobicContact CZ-CE2 3.78Å; F58-F223 AromaticContact CZ-CZ 3.79Å; F58-F223 HydrophobicContact CZ-CZ 3.79Å; V144-F223 HydrophobicContact CG1-CB 4.47Å; V144-F223 HydrophobicContact CG1-CD1 4.05Å; V144-F223 HydrophobicContact CG1-CD2 4.22Å; V144-F223 HydrophobicContact CG1-CE1 4.33Å; V144-F223 HydrophobicContact CG1-CE2 4.49Å; V144-F223 HydrophobicContact CG1-CG 3.99Å; V144-F223 HydrophobicContact CG2-CB 4.41Å; V144-F223 HydrophobicContact CG2-CD2 3.5Å; V144-F223 VanDerWaalsContact CG2-CD2 3.5Å; V144-F223 HydrophobicContact CG2-CE2 3.88Å; V144-F223 HydrophobicContact CG2-CG 3.99Å; F153-F223 HydrophobicContact CB-CD1 3.85Å; F153-F223 HydrophobicContact CB-CE1 4.38Å; G154-F223 CarbonylContact C-O 3.51Å; G154-F223 WeakPolarHBondContact CA-O 3.2Å; L155-F223 HydrophobicContact CB-CB 4.44Å; L155-F223 PolarHBondContact N-O 2.71Å; L220-F223 WeakPolarHBondContact O-CB 3.06Å; L220-F223 WeakPolarHBondContact O-CD2 3.27Å; L220-F223 PolarHBondContact O-N 2.96Å; A221-F223 PolarHBondContact O-N 3.41Å; A221-F223 VanDerWaalsContact O-N 3.11Å; F223-N225 PolarHBondContact O-N 3.14Å
224	L	94.4	Very high	93.3	Very high	1 Å²	1	22 Å²	22	1%	0.005	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-73.1	124.4	175.2	-72.1	166	0	0	0	109.9	L155 A221 L232 L248 L260 Y262 Y264	L155-L224 HydrophobicContact CB-CD2 4Å; L155-L224 HydrophobicContact CB-CG 4.44Å; L155-L224 HydrophobicContact CD2-CD2 3.85Å; L155-L224 HydrophobicContact CD2-CG 4.05Å; A221-L224 HydrophobicContact CB-CD1 3.91Å; A221-L224 VanDerWaalsContact O-CB 3.31Å; A221-L224 WeakPolarHBondContact O-CB 2.98Å; A221-L224 PolarHBondContact O-N 2.62Å; L224-L232 HydrophobicContact CD1-CD1 4.23Å; L224-L232 HydrophobicContact CD2-CD1 3.78Å; L224-L248 HydrophobicContact CD1-CD1 3.84Å; L224-L248 HydrophobicContact CD1-CD2 3.51Å; L224-L248 HydrophobicContact CD1-CG 4.25Å; L224-L260 HydrophobicContact CD2-CB 3.41Å; L224-L260 VanDerWaalsContact CD2-CB 3.41Å; L224-L260 VanDerWaalsContact CD2-O 3.31Å; L224-L260 WeakPolarHBondContact CD2-O 3.33Å; L224-Y262 HydrophobicContact CB-CD1 3.81Å; L224-Y262 HydrophobicContact CB-CE1 3.73Å; L224-Y262 HydrophobicContact CD1-CD1 4.31Å; L224-Y264 PolarHBondContact O-OH 3.25Å
225	N	93.5	Very high	93.4	Very high	10 Å²	10	22.1 Å²	22.1	5%	0.053	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	168	-179.8	-77.7	-44.5	0	0	0	113	K151 F153 F223 E259 H261 Y262 Y264	K151-N225 HydrophobicContact CD-CB 4.2Å; F153-N225 PolarHBondContact O-ND2 3.18Å; F223-N225 PolarHBondContact O-N 3.14Å; N225-E259 WeakPolarHBondContact CB-OE1 3.09Å; N225-E259 PolarHBondContact ND2-OE1 3.39Å; N225-H261 WeakPolarHBondContact O-CA 3.41Å; N225-H261 WeakPolarHBondContact O-CB 3.36Å; N225-Y262 PolarHBondContact O-N 3.44Å; N225-Y264 VanDerWaalsContact C-CE1 3.49Å; N225-Y264 VanDerWaalsContact C-OH 3.22Å; N225-Y264 WeakPolarHBondContact CA-OH 3.39Å
226	H	93	Very high	93.8	Very high	9 Å²	9	20.9 Å²	20.9	4%	0.042	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	144.8	170.4	-177.6	51.4	0	0	0	111.1	C228 Y262 Y264 C281 L290	H226-C228 PolarHBondContact NE2-SG 3.23Å; H226-C228 VanDerWaalsContact NE2-SG 3.43Å; H226-Y262 WeakPolarHBondContact CA-O 2.87Å; H226-Y262 PolarHBondContact ND1-O 2.98Å; H226-Y264 HydrophobicContact CB-CD1 3.82Å; H226-Y264 HydrophobicContact CB-CD2 3.54Å; H226-Y264 HydrophobicContact CB-CE1 3.82Å; H226-Y264 HydrophobicContact CB-CE2 3.48Å; H226-Y264 VanDerWaalsContact CB-CE2 3.48Å; H226-Y264 HydrophobicContact CB-CG 3.65Å; H226-Y264 AromaticContact CG-CG 3.91Å; H226-Y264 VanDerWaalsContact N-CE1 3.28Å; H226-Y264 PolarHBondContact N-OH 3.05Å; H226-Y264 AromaticContact ND1-CG 3.79Å; H226-Y264 PolarHBondContact ND1-N 3.41Å; H226-Y264 VanDerWaalsContact ND1-N 3.14Å; H226-C281 WeakPolarHBondContact O-CB 3.34Å; H226-L290 HydrophobicContact CB-CD2 3.62Å
227	S	94.5	Very high	94.2	Very high	3 Å²	3	15 Å²	15	2%	0.021	9%	0.087	C	C	.	.			trans	-138.3	143	155.3	-178.3	0	0	0	0	111.8	A229 P230 H261 Y262	S227-A229 PolarHBondContact O-N 3.18Å; S227-A229 VanDerWaalsContact OG-C 3.32Å; S227-A229 PolarHBondContact OG-N 3.04Å; S227-A229 PolarHBondContact OG-O 3.21Å; S227-P230 WeakPolarHBondContact O-CD 3.2Å; S227-H261 VanDerWaalsContact CB-CG 3.43Å; S227-H261 WeakPolarHBondContact CB-ND1 3.06Å; S227-Y262 PolarHBondContact N-O 3.36Å
228	C	94.1	Very high	94.4	Very high	23 Å²	23	12.3 Å²	12.3	16%	0.155	8%	0.076	C	C	.	.	S	Bend	trans	-72.5	-11.4	168.5	-55.4	0	0	0	0	112.1	H226 A283 N285	H226-C228 PolarHBondContact NE2-SG 3.23Å; H226-C228 VanDerWaalsContact NE2-SG 3.43Å; C228-A283 HydrophobicContact CB-CB 4.43Å; C228-N285 PolarHBondContact O-ND2 2.97Å
229	A	96	Very high	94.6	Very high	46 Å²	46	13.5 Å²	13.5	38%	0.38	8%	0.081	S	C	.	.	S	Bend	trans	-126.2	71.4	168.6	0	0	0	0	0	109.4	S227 H261 A283	S227-A229 PolarHBondContact O-N 3.18Å; S227-A229 VanDerWaalsContact OG-C 3.32Å; S227-A229 PolarHBondContact OG-N 3.04Å; S227-A229 PolarHBondContact OG-O 3.21Å; A229-H261 PolarHBondContact O-CE1 3.31Å; A229-H261 VanDerWaalsContact O-CE1 3.23Å; A229-A283 HydrophobicContact CB-CB 3.75Å
230	P	97.2	Very high	94.7	Very high	37 Å²	37	14.7 Å²	14.7	24%	0.24	9%	0.088	C	C	.	.			trans	-68.8	148	-172.1	30.2	-35.8	0	0	0	112.4	S227 N251 H261	S227-P230 WeakPolarHBondContact O-CD 3.2Å; P230-N251 PolarHBondContact O-ND2 3.46Å; P230-N251 PolarHBondContact O-OD1 3.42Å; P230-H261 WeakPolarHBondContact CA-ND1 3.46Å; P230-H261 WeakPolarHBondContact CB-O 3.15Å
231	N	98.5	Very high	94.9	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.09	C	C	.	.	S	Bend	trans	-101.8	-7.6	173	58.2	9.6	0	0	0	112.3	A250 N251 R252 I254 E258 E259 H261	N231-A250 WeakPolarHBondContact O-CA 3.4Å; N231-N251 VanDerWaalsContact C-CG 3.49Å; N231-N251 WeakPolarHBondContact CA-OD1 3.46Å; N231-N251 PolarHBondContact O-N 3.04Å; N231-N251 PolarHBondContact O-OD1 3.22Å; N231-N251 VanDerWaalsContact O-OD1 3.14Å; N231-R252 HydrophobicContact CB-CG 4.41Å; N231-I254 HydrophobicContact CB-CD1 3.86Å; N231-I254 HydrophobicContact CB-CG1 4.09Å; N231-E258 PolarHBondContact ND2-OE1 3.23Å; N231-E259 PolarHBondContact ND2-O 2.96Å; N231-H261 PolarHBondContact N-CE1 2.91Å; N231-H261 VanDerWaalsContact N-CE1 3.32Å; N231-H261 PolarHBondContact N-ND1 2.98Å; N231-H261 VanDerWaalsContact N-ND1 3.15Å; N231-H261 PolarHBondContact N-O 2.55Å; N231-H261 VanDerWaalsContact N-O 3.14Å; N231-H261 PolarHBondContact OD1-CE1 2.68Å; N231-H261 PolarHBondContact OD1-N 2.84Å; N231-H261 PolarHBondContact OD1-ND1 2.89Å; N231-H261 VanDerWaalsContact OD1-ND1 3.17Å; N231-H261 PolarHBondContact OD1-O 3.26Å; N231-H261 VanDerWaalsContact OD1-O 3.05Å
232	L	98.5	Very high	94.7	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.01	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	146.2	171.4	-56.6	-174.5	0	0	0	111.6	V167 L224 L248 F249 A250 I254 L260 H261	V167-L232 HydrophobicContact CB-CD2 4.46Å; V167-L232 HydrophobicContact CG1-CD1 4.45Å; V167-L232 HydrophobicContact CG2-CD2 3.71Å; L224-L232 HydrophobicContact CD1-CD1 4.23Å; L224-L232 HydrophobicContact CD2-CD1 3.78Å; L232-L248 HydrophobicContact CB-CD2 4.12Å; L232-L248 HydrophobicContact CD1-CB 4.15Å; L232-L248 HydrophobicContact CD1-CD2 3.82Å; L232-F249 CarbonylContact C-O 3.57Å; L232-F249 VanDerWaalsContact CA-O 3.3Å; L232-F249 WeakPolarHBondContact CA-O 3.15Å; L232-A250 HydrophobicContact CD2-CB 4.31Å; L232-I254 HydrophobicContact CD2-CD1 3.85Å; L232-L260 HydrophobicContact CD1-CB 4.01Å; L232-L260 HydrophobicContact CD2-CD2 4.29Å; L232-H261 PolarHBondContact N-O 2.93Å
233	T	96.8	Very high	94.7	Very high	48 Å²	48	18.5 Å²	18.5	29%	0.294	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	135.4	168.3	-62.5	0	0	0	0	109.1	F111 V235 L248 F249 N251	F111-T233 HydrophobicContact CD1-CG2 3.78Å; F111-T233 HydrophobicContact CE1-CG2 4.43Å; T233-V235 HydrophobicContact CG2-CG2 4.2Å; T233-L248 WeakPolarHBondContact O-CA 3.45Å; T233-F249 PolarHBondContact N-O 2.91Å; T233-F249 PolarHBondContact O-N 2.98Å; T233-N251 WeakPolarHBondContact OG1-CB 3.03Å
234	V	95.5	Very high	94.8	Very high	17 Å²	17	18.2 Å²	18.2	10%	0.103	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	125.9	173.4	-175.7	0	0	0	0	108.7	F196 L246 L248 Y262	F196-V234 HydrophobicContact CE2-CG1 4.25Å; F196-V234 HydrophobicContact CE2-CG2 3.99Å; F196-V234 HydrophobicContact CZ-CB 4.27Å; F196-V234 HydrophobicContact CZ-CG1 3.81Å; F196-V234 HydrophobicContact CZ-CG2 4.08Å; V234-L246 HydrophobicContact CG1-CB 3.97Å; V234-L248 HydrophobicContact CG2-CD2 4.03Å; V234-L248 HydrophobicContact CG2-CG 4.23Å; V234-Y262 HydrophobicContact CG2-CD2 3.72Å; V234-Y262 HydrophobicContact CG2-CE2 4.35Å; V234-Y262 HydrophobicContact CG2-CG 4.21Å
235	V	95.4	Very high	94.8	Very high	3 Å²	3	19.5 Å²	19.5	2%	0.018	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	120.4	-179.6	-178	0	0	0	0	108.2	L108 F111 I115 T233 V237 S247 F249	L108-V235 HydrophobicContact CD2-CG1 4.48Å; L108-V235 HydrophobicContact CD2-CG2 3.89Å; F111-V235 HydrophobicContact CD1-CG2 3.95Å; I115-V235 HydrophobicContact CG1-CG1 3.67Å; T233-V235 HydrophobicContact CG2-CG2 4.2Å; V235-V237 HydrophobicContact CG1-CG2 4.17Å; V235-V237 PolarHBondContact O-N 3.02Å; V235-S247 PolarHBondContact N-O 3.49Å; V235-S247 WeakPolarHBondContact O-CB 3.42Å; V235-S247 PolarHBondContact O-N 3.18Å; V235-F249 HydrophobicContact CB-CD2 3.85Å; V235-F249 HydrophobicContact CB-CE2 3.99Å; V235-F249 HydrophobicContact CG1-CE2 4.5Å; V235-F249 HydrophobicContact CG2-CD2 3.8Å; V235-F249 HydrophobicContact CG2-CE2 4.39Å
236	P	94.8	Very high	94.9	Very high	8 Å²	8	19.1 Å²	19.1	5%	0.052	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	117.1	170.4	-19.4	31.3	0	0	0	110	I5 L198 A244	I5-P236 HydrophobicContact CD1-CG 3.58Å; I5-P236 HydrophobicContact CG1-CG 3.75Å; L198-P236 HydrophobicContact CD1-CG 3.94Å; L198-P236 HydrophobicContact CD2-CB 3.95Å; L198-P236 HydrophobicContact CD2-CG 3.81Å; P236-A244 HydrophobicContact CB-CB 3.84Å
237	V	96.3	Very high	95.1	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	131.5	178.5	179.2	0	0	0	0	109.4	I115 E117 V134 V235 Y239 R245 S247 F249	I115-V237 HydrophobicContact CB-CG1 4.48Å; I115-V237 HydrophobicContact CB-CG2 3.97Å; I115-V237 HydrophobicContact CG2-CB 4.35Å; I115-V237 HydrophobicContact CG2-CG1 3.87Å; I115-V237 HydrophobicContact CG2-CG2 3.86Å; E117-V237 HydrophobicContact CG-CG1 4.12Å; V134-V237 HydrophobicContact CB-CG1 4.22Å; V134-V237 HydrophobicContact CG2-CB 4.3Å; V134-V237 HydrophobicContact CG2-CG1 4.03Å; V134-V237 HydrophobicContact CG2-CG2 4.05Å; V235-V237 HydrophobicContact CG1-CG2 4.17Å; V235-V237 PolarHBondContact O-N 3.02Å; V237-Y239 HydrophobicContact CG1-CD1 4.25Å; V237-R245 PolarHBondContact N-O 3.41Å; V237-R245 PolarHBondContact O-N 3.14Å; V237-S247 WeakPolarHBondContact CB-OG 2.85Å; V237-S247 WeakPolarHBondContact CG2-OG 2.94Å; V237-F249 HydrophobicContact CG2-CE2 4.08Å; V237-F249 HydrophobicContact CG2-CZ 4.49Å
238	R	96.1	Very high	95.2	Very high	18 Å²	18	18.6 Å²	18.6	7%	0.068	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	136.5	177.9	-69.6	171.8	171.9	82	3.3	110.8	Y2 L79 I115 V116 E117 E200 P242 A244	Y2-R238 PolarHBondContact OH-NH2 2.99Å; Y2-R238 VanDerWaalsContact OH-NH2 3.16Å; L79-R238 HydrophobicContact CD1-CB 4.13Å; I115-R238 PolarHBondContact O-N 3.42Å; V116-R238 CarbonylContact C-O 3.5Å; V116-R238 WeakPolarHBondContact CA-O 2.85Å; E117-R238 PolarHBondContact N-O 2.79Å; E200-R238 IonicContact OE1-CZ 3.54Å; E200-R238 VanDerWaalsContact OE1-CZ 3.26Å; E200-R238 IonicContact OE1-NH1 3.57Å; E200-R238 PolarHBondContact OE1-NH1 2.94Å; E200-R238 IonicContact OE1-NH2 3.48Å; E200-R238 PolarHBondContact OE1-NH2 3.06Å; E200-R238 IonicContact OE2-CZ 2.76Å; E200-R238 IonicContact OE2-NH1 3.14Å; E200-R238 IonicContact OE2-NH2 3.96Å; E200-R238 PolarHBondContact OE2-NH2 3.28Å; R238-P242 WeakPolarHBondContact CD-O 3.48Å; R238-P242 PolarHBondContact NE-O 3.06Å; R238-A244 HydrophobicContact CG-CB 4.3Å
239	Y	94.9	Very high	95.5	Very high	26 Å²	26	17.5 Å²	17.5	10%	0.102	10%	0.104	C	C	.	.	S	Bend	trans	-153.8	144.1	165.7	51.4	-93.8	0	0	0	109.4	E117 V134 Q135 V237 I241 R245	E117-Y239 HydrophobicContact CB-CD1 4.35Å; V134-Y239 HydrophobicContact CB-CE1 4.26Å; V134-Y239 HydrophobicContact CG1-CE1 3.88Å; Q135-Y239 HydrophobicContact CB-CD1 4.19Å; Q135-Y239 HydrophobicContact CB-CD2 4Å; Q135-Y239 HydrophobicContact CB-CE1 3.93Å; Q135-Y239 HydrophobicContact CB-CE2 3.74Å; Q135-Y239 HydrophobicContact CB-CG 4.22Å; V237-Y239 HydrophobicContact CG1-CD1 4.25Å; Y239-I241 PolarHBondContact O-N 3.01Å; Y239-R245 VanDerWaalsContact CE1-CD 3.46Å; Y239-R245 HydrophobicContact CE1-CG 4.4Å; Y239-R245 WeakPolarHBondContact OH-CD 3.42Å; Y239-R245 VanDerWaalsContact OH-CZ 3.28Å; Y239-R245 PolarHBondContact OH-NE 2.98Å; Y239-R245 PolarHBondContact OH-NH1 3.2Å; Y239-R245 VanDerWaalsContact OH-NH1 3.12Å
240	T	91.8	Very high	95.6	Very high	28 Å²	28	15.3 Å²	15.3	17%	0.172	9%	0.086	C	C	.	.	S	Bend	trans	65.7	-46.3	178.4	-55.9	0	0	0	0	114.4	P77 S78 L79 G119 F120	P77-T240 CarbonylContact C-O 3.57Å; P77-T240 WeakPolarHBondContact CA-O 3.03Å; P77-T240 HydrophobicContact CB-CG2 3.55Å; P77-T240 HydrophobicContact CG-CG2 3.63Å; S78-T240 PolarHBondContact N-O 3.43Å; L79-T240 PolarHBondContact N-O 2.78Å; L79-T240 VanDerWaalsContact N-O 3.08Å; G119-T240 WeakPolarHBondContact CA-OG1 3.47Å; F120-T240 HydrophobicContact CB-CG2 4.18Å; F120-T240 PolarHBondContact N-OG1 3.48Å; F120-T240 VanDerWaalsContact N-OG1 3.13Å
241	I	93.7	Very high	95.6	Very high	22 Å²	22	15.6 Å²	15.6	11%	0.113	9%	0.085	C	C	.	.	S	Bend	trans	-119.8	154	178.4	64.7	177.5	0	0	0	111.6	F75 L79 Y239 L243	F75-I241 HydrophobicContact CD1-CD1 4.47Å; F75-I241 WeakPolarHBondContact O-CG2 3.42Å; L79-I241 WeakPolarHBondContact CD1-O 3.48Å; Y239-I241 PolarHBondContact O-N 3.01Å; I241-L243 VanDerWaalsContact C-N 3.3Å; I241-L243 HydrophobicContact CD1-CB 3.93Å; I241-L243 HydrophobicContact CD1-CD2 4.48Å; I241-L243 HydrophobicContact CG1-CB 4.21Å; I241-L243 PolarHBondContact O-N 3.21Å
242	P	90.2	Very high	95.6	Very high	56 Å²	56	20.4 Å²	20.4	36%	0.364	10%	0.103	S	C	.	.	S	Bend	trans	-72.4	-20.4	179.4	-18	32.7	0	0	0	114.2	S78 L79 R238 A244	S78-P242 WeakPolarHBondContact OG-CD 3.5Å; S78-P242 WeakPolarHBondContact OG-CG 3.41Å; L79-P242 HydrophobicContact CD2-CB 4.27Å; L79-P242 HydrophobicContact CD2-CG 4.06Å; L79-P242 HydrophobicContact CG-CG 4.44Å; R238-P242 WeakPolarHBondContact CD-O 3.48Å; R238-P242 PolarHBondContact NE-O 3.06Å; P242-A244 PolarHBondContact O-N 3.33Å
243	L	92.3	Very high	95.7	Very high	23 Å²	23	25.6 Å²	25.6	12%	0.12	13%	0.131	C	C	.	.	S	Bend	trans	-63.1	127	176	-175.6	65.4	0	0	0	110.2	F75 V174 T210 I241	F75-L243 HydrophobicContact CD2-CD2 4.42Å; F75-L243 HydrophobicContact CE1-CD2 4.21Å; F75-L243 HydrophobicContact CE2-CD2 3.88Å; F75-L243 HydrophobicContact CZ-CD2 3.78Å; V174-L243 HydrophobicContact CG1-CD2 4.28Å; V174-L243 HydrophobicContact CG2-CD2 4.19Å; T210-L243 HydrophobicContact CG2-CD1 3.81Å; I241-L243 VanDerWaalsContact C-N 3.3Å; I241-L243 HydrophobicContact CD1-CB 3.93Å; I241-L243 HydrophobicContact CD1-CD2 4.48Å; I241-L243 HydrophobicContact CG1-CB 4.21Å; I241-L243 PolarHBondContact O-N 3.21Å
244	A	92.8	Very high	95.8	Very high	3 Å²	3	23.6 Å²	23.6	3%	0.025	12%	0.118	C	C	.	.	P	Polyproline II helix	trans	-74.5	137.5	-179.8	0	0	0	0	0	111.6	L198 P236 R238 P242	L198-A244 HydrophobicContact CD2-CB 4.02Å; P236-A244 HydrophobicContact CB-CB 3.84Å; R238-A244 HydrophobicContact CG-CB 4.3Å; P242-A244 PolarHBondContact O-N 3.33Å
245	R	94.8	Very high	95.9	Very high	28 Å²	28	25.2 Å²	25.2	11%	0.106	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	127.7	166.2	-58.4	-170	85.2	126.9	0.3	109.8	E63 N169 E171 V237 Y239 S247	E63-R245 VanDerWaalsContact CA-NH2 3.27Å; E63-R245 VanDerWaalsContact CG-NH2 3.28Å; E63-R245 IonicContact OE2-CZ 3.52Å; E63-R245 IonicContact OE2-NH1 3.43Å; E63-R245 PolarHBondContact OE2-NH1 2.92Å; E63-R245 IonicContact OE2-NH2 3.37Å; N169-R245 PolarHBondContact ND2-NE 3.26Å; E171-R245 IonicContact OE1-CZ 3.93Å; E171-R245 IonicContact OE1-NE 3.26Å; E171-R245 PolarHBondContact OE1-NE 3.47Å; E171-R245 VanDerWaalsContact OE1-NE 3.15Å; E171-R245 IonicContact OE1-NH2 3.66Å; E171-R245 PolarHBondContact OE1-NH2 3.43Å; E171-R245 IonicContact OE2-CZ 3.72Å; E171-R245 IonicContact OE2-NE 2.69Å; E171-R245 IonicContact OE2-NH2 3.56Å; E171-R245 PolarHBondContact OE2-NH2 3.37Å; V237-R245 PolarHBondContact N-O 3.41Å; V237-R245 PolarHBondContact O-N 3.14Å; Y239-R245 VanDerWaalsContact CE1-CD 3.46Å; Y239-R245 HydrophobicContact CE1-CG 4.4Å; Y239-R245 WeakPolarHBondContact OH-CD 3.42Å; Y239-R245 VanDerWaalsContact OH-CZ 3.28Å; Y239-R245 PolarHBondContact OH-NE 2.98Å; Y239-R245 PolarHBondContact OH-NH1 3.2Å; Y239-R245 VanDerWaalsContact OH-NH1 3.12Å; R245-S247 PolarHBondContact O-N 3.42Å; R245-S247 PolarHBondContact O-OG 3.39Å
246	L	95.2	Very high	96	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	91.2	-178.3	-54.3	-170.7	0	0	0	109.6	N169 Y170 F196 L198 I212 V234	N169-L246 CarbonylContact C-O 3.45Å; N169-L246 VanDerWaalsContact CA-O 3.28Å; N169-L246 WeakPolarHBondContact CA-O 3.2Å; Y170-L246 PolarHBondContact N-O 3Å; F196-L246 HydrophobicContact CB-CD1 4.16Å; F196-L246 HydrophobicContact CD1-CD1 3.21Å; F196-L246 HydrophobicContact CD2-CD1 3.98Å; F196-L246 HydrophobicContact CE1-CD1 3.47Å; F196-L246 VanDerWaalsContact CE1-CD1 3.47Å; F196-L246 HydrophobicContact CE2-CD1 4.16Å; F196-L246 HydrophobicContact CG-CD1 3.51Å; F196-L246 HydrophobicContact CZ-CD1 3.92Å; L198-L246 HydrophobicContact CB-CD1 4.41Å; L198-L246 HydrophobicContact CB-CD2 3.72Å; L198-L246 HydrophobicContact CD1-CD2 4.45Å; L198-L246 HydrophobicContact CD2-CD2 3.31Å; L198-L246 HydrophobicContact CG-CD2 3.98Å; I212-L246 HydrophobicContact CD1-CD1 3.67Å; I212-L246 HydrophobicContact CD1-CG 3.71Å; I212-L246 HydrophobicContact CG1-CD1 4.22Å; V234-L246 HydrophobicContact CG1-CB 3.97Å
247	S	97.1	Very high	96.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	125.3	-170.8	-53.3	0	0	0	0	110.2	V134 N169 V235 V237 R245	V134-S247 WeakPolarHBondContact CG1-OG 3.45Å; N169-S247 WeakPolarHBondContact OD1-CA 3.48Å; N169-S247 PolarHBondContact OD1-OG 2.95Å; V235-S247 PolarHBondContact N-O 3.49Å; V235-S247 WeakPolarHBondContact O-CB 3.42Å; V235-S247 PolarHBondContact O-N 3.18Å; V237-S247 WeakPolarHBondContact CB-OG 2.85Å; V237-S247 WeakPolarHBondContact CG2-OG 2.94Å; R245-S247 PolarHBondContact O-N 3.42Å; R245-S247 PolarHBondContact O-OG 3.39Å
248	L	98.1	Very high	96.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	124.2	177.8	-64.9	110.4	0	0	0	110.9	V167 C168 A221 L224 L232 T233 V234 Y262	V167-L248 WeakPolarHBondContact CB-O 3.34Å; V167-L248 PolarHBondContact N-O 3.43Å; C168-L248 WeakPolarHBondContact O-CB 3.48Å; C168-L248 WeakPolarHBondContact O-CD1 3.47Å; C168-L248 PolarHBondContact O-N 3.48Å; A221-L248 HydrophobicContact CB-CD1 4.18Å; L224-L248 HydrophobicContact CD1-CD1 3.84Å; L224-L248 HydrophobicContact CD1-CD2 3.51Å; L224-L248 HydrophobicContact CD1-CG 4.25Å; L232-L248 HydrophobicContact CB-CD2 4.12Å; L232-L248 HydrophobicContact CD1-CB 4.15Å; L232-L248 HydrophobicContact CD1-CD2 3.82Å; T233-L248 WeakPolarHBondContact O-CA 3.45Å; V234-L248 HydrophobicContact CG2-CD2 4.03Å; V234-L248 HydrophobicContact CG2-CG 4.23Å; L248-Y262 HydrophobicContact CD2-CD1 4Å; L248-Y262 HydrophobicContact CD2-CG 4.04Å
249	F	98.6	Very high	96.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	143.4	177.4	-70.1	-90.9	0	0	0	110.7	Y103 L108 F111 V134 G164 Q165 F166 L232 T233 V235 V237 N251	Y103-F249 AromaticContact CE1-CE1 4Å; Y103-F249 HydrophobicContact CE1-CE1 4Å; Y103-F249 HydrophobicContact CE1-CZ 4.03Å; L108-F249 HydrophobicContact CB-CD1 3.75Å; L108-F249 HydrophobicContact CB-CE1 3.88Å; L108-F249 HydrophobicContact CB-CG 4.3Å; L108-F249 HydrophobicContact CD2-CB 4.17Å; L108-F249 HydrophobicContact CD2-CD1 4.05Å; L108-F249 HydrophobicContact CD2-CD2 3.83Å; L108-F249 HydrophobicContact CD2-CE1 4.37Å; L108-F249 HydrophobicContact CD2-CE2 4.16Å; L108-F249 HydrophobicContact CD2-CG 3.76Å; L108-F249 HydrophobicContact CD2-CZ 4.42Å; L108-F249 HydrophobicContact CG-CD1 4.49Å; F111-F249 HydrophobicContact CE1-CB 3.74Å; F111-F249 HydrophobicContact CZ-CB 4.27Å; V134-F249 HydrophobicContact CG2-CE2 4.2Å; V134-F249 HydrophobicContact CG2-CZ 3.58Å; G164-F249 WeakPolarHBondContact O-CD1 3.29Å; Q165-F249 WeakPolarHBondContact O-CA 3.44Å; F166-F249 HydrophobicContact CB-CD1 4.01Å; F166-F249 HydrophobicContact CB-CE1 3.62Å; F166-F249 HydrophobicContact CB-CZ 4.29Å; F166-F249 HydrophobicContact CD2-CE1 4.17Å; F166-F249 HydrophobicContact CD2-CE2 4.38Å; F166-F249 HydrophobicContact CD2-CZ 4.06Å; F166-F249 HydrophobicContact CG-CE1 4.35Å; L232-F249 CarbonylContact C-O 3.57Å; L232-F249 VanDerWaalsContact CA-O 3.3Å; L232-F249 WeakPolarHBondContact CA-O 3.15Å; T233-F249 PolarHBondContact N-O 2.91Å; T233-F249 PolarHBondContact O-N 2.98Å; V235-F249 HydrophobicContact CB-CD2 3.85Å; V235-F249 HydrophobicContact CB-CE2 3.99Å; V235-F249 HydrophobicContact CG1-CE2 4.5Å; V235-F249 HydrophobicContact CG2-CD2 3.8Å; V235-F249 HydrophobicContact CG2-CE2 4.39Å; V237-F249 HydrophobicContact CG2-CE2 4.08Å; V237-F249 HydrophobicContact CG2-CZ 4.49Å; F249-N251 PolarHBondContact O-N 3.42Å
250	A	98.8	Very high	96.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	124.2	174.1	0	0	0	0	0	110.9	F111 I161 A162 G164 Q165 N231 L232 I254	F111-A250 WeakPolarHBondContact CZ-O 3.49Å; I161-A250 HydrophobicContact CG2-CB 3.67Å; A162-A250 WeakPolarHBondContact O-CB 3.19Å; G164-A250 PolarHBondContact N-O 3.05Å; Q165-A250 PolarHBondContact O-N 3.43Å; N231-A250 WeakPolarHBondContact O-CA 3.4Å; L232-A250 HydrophobicContact CD2-CB 4.31Å; A250-I254 HydrophobicContact CB-CD1 3.75Å; A250-I254 HydrophobicContact CB-CG1 4.31Å
251	N	98.3	Very high	96.6	Very high	43 Å²	43	34.1 Å²	34.1	23%	0.23	18%	0.181	C	C	.	.	S	Bend	trans	-89.8	-9.1	-178.8	67.9	25	0	0	0	113.4	R163 P230 N231 T233 F249	R163-N251 WeakPolarHBondContact CD-O 3.43Å; R163-N251 PolarHBondContact NE-O 2.9Å; P230-N251 PolarHBondContact O-ND2 3.46Å; P230-N251 PolarHBondContact O-OD1 3.42Å; N231-N251 VanDerWaalsContact C-CG 3.49Å; N231-N251 WeakPolarHBondContact CA-OD1 3.46Å; N231-N251 PolarHBondContact O-N 3.04Å; N231-N251 PolarHBondContact O-OD1 3.22Å; N231-N251 VanDerWaalsContact O-OD1 3.14Å; T233-N251 WeakPolarHBondContact OG1-CB 3.03Å; F249-N251 PolarHBondContact O-N 3.42Å
252	R	98.5	Very high	96.7	Very high	101 Å²	101	33.2 Å²	33.2	38%	0.381	18%	0.176	S	C	.	.	S	Bend	trans	-148.1	174.9	170.4	61.2	170.1	173.6	85.2	-6.4	109.3	N231 E258	N231-R252 HydrophobicContact CB-CG 4.41Å; R252-E258 IonicContact CZ-OE1 3.17Å; R252-E258 IonicContact NH1-OE1 2.87Å; R252-E258 PolarHBondContact NH1-OE1 2.87Å; R252-E258 IonicContact NH1-OE2 2.99Å; R252-E258 PolarHBondContact NH1-OE2 3.48Å; R252-E258 VanDerWaalsContact NH1-OE2 3.14Å; R252-E258 IonicContact NH2-OE1 3.18Å; R252-E258 PolarHBondContact NH2-OE1 3.25Å; R252-E258 IonicContact NH2-OE2 2.63Å
253	D	98.7	Very high	96.8	Very high	112 Å²	112	32.9 Å²	32.9	60%	0.599	18%	0.175	S	C	*	.			trans	-66.6	138.1	168	-61.3	-25.8	0	0	0	109.9	I161 A162 R163	I161-D253 WeakPolarHBondContact O-CA 3.15Å; A162-D253 WeakPolarHBondContact CA-OD1 3.32Å; R163-D253 PolarHBondContact N-OD1 2.96Å
254	I	98.8	Very high	96.7	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.026	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-121.3	128.2	-175.6	-54.2	178.3	0	0	0	108.2	P160 I161 N231 L232 A250 E258 L260	P160-I254 WeakPolarHBondContact CA-O 3.25Å; I161-I254 HydrophobicContact CB-CB 4.06Å; I161-I254 HydrophobicContact CB-CD1 4.45Å; I161-I254 HydrophobicContact CB-CG1 4.48Å; I161-I254 HydrophobicContact CD1-CB 4.48Å; I161-I254 HydrophobicContact CD1-CD1 4.23Å; I161-I254 HydrophobicContact CG1-CB 4.45Å; I161-I254 PolarHBondContact N-O 2.91Å; I161-I254 PolarHBondContact O-N 3.07Å; N231-I254 HydrophobicContact CB-CD1 3.86Å; N231-I254 HydrophobicContact CB-CG1 4.09Å; L232-I254 HydrophobicContact CD2-CD1 3.85Å; A250-I254 HydrophobicContact CB-CD1 3.75Å; A250-I254 HydrophobicContact CB-CG1 4.31Å; I254-E258 HydrophobicContact CG2-CB 3.75Å; I254-E258 HydrophobicContact CG2-CG 4.19Å; I254-L260 HydrophobicContact CD1-CD2 3.7Å; I254-L260 HydrophobicContact CG2-CD2 3.97Å
255	A	98.7	Very high	96.2	Very high	51 Å²	51	32.5 Å²	32.5	42%	0.421	18%	0.177	S	C	.	.			trans	-72.6	154.4	180	0	0	0	0	0	111.4	M257 E258	A255-M257 PolarHBondContact O-N 3.43Å; A255-E258 HydrophobicContact CB-CB 4.41Å; A255-E258 PolarHBondContact N-OE2 2.68Å; A255-E258 VanDerWaalsContact O-CB 3.25Å; A255-E258 WeakPolarHBondContact O-CB 3.44Å; A255-E258 PolarHBondContact O-N 3.31Å
256	P	98	Very high	95	Very high	64 Å²	64	39.2 Å²	39.2	42%	0.416	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	138.8	168.6	-23	31.9	0	0	0	111	P160 E258	P160-P256 HydrophobicContact CG-CG 3.77Å; P256-E258 PolarHBondContact O-N 3.43Å; P256-E258 VanDerWaalsContact O-N 3.15Å
257	M	96.3	Very high	93.7	Very high	108 Å²	108	42 Å²	42	53%	0.532	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	2.4	178.5	-50.3	-72.2	-66.7	0	0	115.8	H156 C157 L158 A255	H156-M257 WeakPolarHBondContact CE1-CE 3.46Å; H156-M257 PolarHBondContact CE1-SD 3.33Å; H156-M257 PolarHBondContact ND1-SD 3.37Å; C157-M257 PolarHBondContact O-N 3.09Å; L158-M257 HydrophobicContact CD2-SD 3.61Å; A255-M257 PolarHBondContact O-N 3.43Å
258	E	97.5	Very high	92.2	Very high	47 Å²	47	42.9 Å²	42.9	22%	0.22	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-66.6	136.6	169.4	-165.3	-170.6	131.8	0	0	109.7	H156 N231 R252 I254 A255 P256 L260	H156-E258 VanDerWaalsContact CB-O 3.31Å; H156-E258 WeakPolarHBondContact CB-O 3.24Å; N231-E258 PolarHBondContact ND2-OE1 3.23Å; R252-E258 IonicContact CZ-OE1 3.17Å; R252-E258 IonicContact NH1-OE1 2.87Å; R252-E258 PolarHBondContact NH1-OE1 2.87Å; R252-E258 IonicContact NH1-OE2 2.99Å; R252-E258 PolarHBondContact NH1-OE2 3.48Å; R252-E258 VanDerWaalsContact NH1-OE2 3.14Å; R252-E258 IonicContact NH2-OE1 3.18Å; R252-E258 PolarHBondContact NH2-OE1 3.25Å; R252-E258 IonicContact NH2-OE2 2.63Å; I254-E258 HydrophobicContact CG2-CB 3.75Å; I254-E258 HydrophobicContact CG2-CG 4.19Å; A255-E258 HydrophobicContact CB-CB 4.41Å; A255-E258 PolarHBondContact N-OE2 2.68Å; A255-E258 VanDerWaalsContact O-CB 3.25Å; A255-E258 WeakPolarHBondContact O-CB 3.44Å; A255-E258 PolarHBondContact O-N 3.31Å; P256-E258 PolarHBondContact O-N 3.43Å; P256-E258 VanDerWaalsContact O-N 3.15Å; E258-L260 PolarHBondContact O-N 3.19Å
259	E	97	Very high	90.4	Very high	30 Å²	30	47.9 Å²	47.9	14%	0.14	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	133.5	177.5	-171.7	175.4	171.6	0	0	110.5	Y145 K151 N225 N231 H261	Y145-E259 HydrophobicContact CE1-CG 4.27Å; Y145-E259 WeakPolarHBondContact OH-CB 3.36Å; Y145-E259 VanDerWaalsContact OH-CG 3.24Å; Y145-E259 WeakPolarHBondContact OH-CG 3.42Å; Y145-E259 PolarHBondContact OH-OE2 2.65Å; K151-E259 IonicContact NZ-OE1 2.68Å; K151-E259 PolarHBondContact NZ-OE1 2.7Å; K151-E259 IonicContact NZ-OE2 3.78Å; K151-E259 PolarHBondContact NZ-OE2 3.42Å; N225-E259 WeakPolarHBondContact CB-OE1 3.09Å; N225-E259 PolarHBondContact ND2-OE1 3.39Å; N231-E259 PolarHBondContact ND2-O 2.96Å; E259-H261 PolarHBondContact O-CD2 3.26Å; E259-H261 VanDerWaalsContact O-CD2 3.29Å
260	L	97.9	Very high	88.6	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	128.7	176.3	-62.1	175.8	0	0	0	109.6	L142 L155 C157 I161 V167 L224 L232 I254 E258	L142-L260 HydrophobicContact CD2-CD1 3.87Å; L155-L260 HydrophobicContact CD2-CD1 4.37Å; L155-L260 HydrophobicContact CG-CD1 4.41Å; L155-L260 WeakPolarHBondContact O-CB 3.34Å; L155-L260 PolarHBondContact O-N 2.73Å; C157-L260 HydrophobicContact CB-CD1 4.48Å; I161-L260 HydrophobicContact CD1-CD1 4.3Å; I161-L260 HydrophobicContact CD1-CD2 3.7Å; V167-L260 HydrophobicContact CG1-CD1 3.95Å; L224-L260 HydrophobicContact CD2-CB 3.41Å; L224-L260 VanDerWaalsContact CD2-CB 3.41Å; L224-L260 VanDerWaalsContact CD2-O 3.31Å; L224-L260 WeakPolarHBondContact CD2-O 3.33Å; L232-L260 HydrophobicContact CD1-CB 4.01Å; L232-L260 HydrophobicContact CD2-CD2 4.29Å; I254-L260 HydrophobicContact CD1-CD2 3.7Å; I254-L260 HydrophobicContact CG2-CD2 3.97Å; E258-L260 PolarHBondContact O-N 3.19Å
261	H	96.7	Very high	87	Confident	22 Å²	22	54.6 Å²	54.6	10%	0.102	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	144.5	-174.6	47.5	54.2	0	0	0	111.8	N225 S227 A229 P230 N231 L232 E259	N225-H261 WeakPolarHBondContact O-CA 3.41Å; N225-H261 WeakPolarHBondContact O-CB 3.36Å; S227-H261 VanDerWaalsContact CB-CG 3.43Å; S227-H261 WeakPolarHBondContact CB-ND1 3.06Å; A229-H261 PolarHBondContact O-CE1 3.31Å; A229-H261 VanDerWaalsContact O-CE1 3.23Å; P230-H261 WeakPolarHBondContact CA-ND1 3.46Å; P230-H261 WeakPolarHBondContact CB-O 3.15Å; N231-H261 PolarHBondContact N-CE1 2.91Å; N231-H261 VanDerWaalsContact N-CE1 3.32Å; N231-H261 PolarHBondContact N-ND1 2.98Å; N231-H261 VanDerWaalsContact N-ND1 3.15Å; N231-H261 PolarHBondContact N-O 2.55Å; N231-H261 VanDerWaalsContact N-O 3.14Å; N231-H261 PolarHBondContact OD1-CE1 2.68Å; N231-H261 PolarHBondContact OD1-N 2.84Å; N231-H261 PolarHBondContact OD1-ND1 2.89Å; N231-H261 VanDerWaalsContact OD1-ND1 3.17Å; N231-H261 PolarHBondContact OD1-O 3.26Å; N231-H261 VanDerWaalsContact OD1-O 3.05Å; L232-H261 PolarHBondContact N-O 2.93Å; E259-H261 PolarHBondContact O-CD2 3.26Å; E259-H261 VanDerWaalsContact O-CD2 3.29Å
262	Y	95.5	Very high	85.5	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.008	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	167.5	176.8	71.2	-75.3	0	0	0	110.4	A9 F196 L224 N225 H226 S227 V234 L248 Y264	A9-Y262 HydrophobicContact CB-CE2 3.86Å; A9-Y262 WeakPolarHBondContact CB-OH 3.41Å; F196-Y262 HydrophobicContact CD2-CE2 4.18Å; F196-Y262 HydrophobicContact CE2-CD2 4.38Å; F196-Y262 AromaticContact CE2-CE2 3.64Å; F196-Y262 HydrophobicContact CE2-CE2 3.64Å; L224-Y262 HydrophobicContact CB-CD1 3.81Å; L224-Y262 HydrophobicContact CB-CE1 3.73Å; L224-Y262 HydrophobicContact CD1-CD1 4.31Å; N225-Y262 PolarHBondContact O-N 3.44Å; H226-Y262 WeakPolarHBondContact CA-O 2.87Å; H226-Y262 PolarHBondContact ND1-O 2.98Å; S227-Y262 PolarHBondContact N-O 3.36Å; V234-Y262 HydrophobicContact CG2-CD2 3.72Å; V234-Y262 HydrophobicContact CG2-CE2 4.35Å; V234-Y262 HydrophobicContact CG2-CG 4.21Å; L248-Y262 HydrophobicContact CD2-CD1 4Å; L248-Y262 HydrophobicContact CD2-CG 4.04Å; Y262-Y264 HydrophobicContact CD1-CE1 4.26Å; Y262-Y264 HydrophobicContact CD2-CD1 4.34Å; Y262-Y264 HydrophobicContact CE1-CD1 4.03Å; Y262-Y264 AromaticContact CE1-CE1 3.63Å; Y262-Y264 HydrophobicContact CE1-CE1 3.63Å; Y262-Y264 AromaticContact CE2-CD1 3.8Å; Y262-Y264 HydrophobicContact CE2-CD1 3.8Å; Y262-Y264 HydrophobicContact CE2-CE1 4.25Å; Y262-Y264 AromaticContact CZ-CD1 3.63Å; Y262-Y264 AromaticContact CZ-CE1 3.62Å
263	S	92.8	Very high	84.1	Confident	49 Å²	49	59.3 Å²	59.3	34%	0.343	34%	0.342	S	S	.	.			trans	-76.9	129.8	172	-175.4	0	0	0	0	109.8	G265	S263-G265 PolarHBondContact O-N 3.15Å; S263-G265 PolarHBondContact OG-N 3.46Å; S263-G265 PolarHBondContact OG-O 3.23Å
264	Y	89.7	Confident	82.5	Confident	2 Å²	2	59 Å²	59	1%	0.008	35%	0.348	C	S	.	.			trans	-75.1	-0.2	177	-85.9	16.9	0	0	0	112.8	C8 A9 T11 L224 N225 H226 Y262 L290 P291	C8-Y264 WeakPolarHBondContact CA-O 3.46Å; A9-Y264 HydrophobicContact CB-CD1 4.29Å; A9-Y264 HydrophobicContact CB-CG 4.43Å; A9-Y264 PolarHBondContact N-O 3.26Å; A9-Y264 WeakPolarHBondContact O-CA 3.27Å; A9-Y264 WeakPolarHBondContact O-CB 3.4Å; A9-Y264 WeakPolarHBondContact O-CD2 3.45Å; T11-Y264 VanDerWaalsContact CA-CE2 3.42Å; T11-Y264 WeakPolarHBondContact CB-OH 3.47Å; T11-Y264 VanDerWaalsContact N-CD2 3.31Å; T11-Y264 WeakPolarHBondContact OG1-CD2 3.37Å; T11-Y264 WeakPolarHBondContact OG1-CE1 3.38Å; T11-Y264 WeakPolarHBondContact OG1-CE2 3.25Å; T11-Y264 PolarHBondContact OG1-OH 3.22Å; L224-Y264 PolarHBondContact O-OH 3.25Å; N225-Y264 VanDerWaalsContact C-CE1 3.49Å; N225-Y264 VanDerWaalsContact C-OH 3.22Å; N225-Y264 WeakPolarHBondContact CA-OH 3.39Å; H226-Y264 HydrophobicContact CB-CD1 3.82Å; H226-Y264 HydrophobicContact CB-CD2 3.54Å; H226-Y264 HydrophobicContact CB-CE1 3.82Å; H226-Y264 HydrophobicContact CB-CE2 3.48Å; H226-Y264 VanDerWaalsContact CB-CE2 3.48Å; H226-Y264 HydrophobicContact CB-CG 3.65Å; H226-Y264 AromaticContact CG-CG 3.91Å; H226-Y264 VanDerWaalsContact N-CE1 3.28Å; H226-Y264 PolarHBondContact N-OH 3.05Å; H226-Y264 AromaticContact ND1-CG 3.79Å; H226-Y264 PolarHBondContact ND1-N 3.41Å; H226-Y264 VanDerWaalsContact ND1-N 3.14Å; Y262-Y264 HydrophobicContact CD1-CE1 4.26Å; Y262-Y264 HydrophobicContact CD2-CD1 4.34Å; Y262-Y264 HydrophobicContact CE1-CD1 4.03Å; Y262-Y264 AromaticContact CE1-CE1 3.63Å; Y262-Y264 HydrophobicContact CE1-CE1 3.63Å; Y262-Y264 AromaticContact CE2-CD1 3.8Å; Y262-Y264 HydrophobicContact CE2-CD1 3.8Å; Y262-Y264 HydrophobicContact CE2-CE1 4.25Å; Y262-Y264 AromaticContact CZ-CD1 3.63Å; Y262-Y264 AromaticContact CZ-CE1 3.62Å; Y264-L290 HydrophobicContact CD2-CD2 4.38Å; Y264-L290 HydrophobicContact CE2-CD2 4.45Å; Y264-P291 VanDerWaalsContact CB-CG 3.47Å
265	G	82.3	Confident	81.1	Confident	17 Å²	17	63.6 Å²	63.6	18%	0.175	37%	0.365	C	S	.	.			trans	119	-156	177.4	0	0	0	0	0	113.1	A7 S263 P291	A7-G265 WeakPolarHBondContact O-CA 3.5Å; S263-G265 PolarHBondContact O-N 3.15Å; S263-G265 PolarHBondContact OG-N 3.46Å; S263-G265 PolarHBondContact OG-O 3.23Å; G265-P291 WeakPolarHBondContact O-CB 3.23Å; G265-P291 WeakPolarHBondContact O-CG 3.2Å
266	Q	71	Confident	80	Confident	168 Å²	168	64.2 Å²	64.2	79%	0.785	36%	0.361	S	S	*	.			trans	-113	150.1	175.1	-60	-173.2	31.9	0	0	108.8
267	S	66.9	Low	79.2	Confident	61 Å²	61	63.4 Å²	63.4	43%	0.427	35%	0.351	S	S	.	.			trans	-81.3	137.9	173.4	-54.8	0	0	0	0	109.9	P291 F292	S267-P291 WeakPolarHBondContact OG-CA 3.19Å; S267-F292 VanDerWaalsContact CA-O 3.24Å; S267-F292 WeakPolarHBondContact CA-O 3.29Å
268	S	65.4	Low	78.8	Confident	18 Å²	18	61.6 Å²	61.6	13%	0.126	35%	0.349	C	S	.	.			trans	-72.9	141.2	165.5	168.8	0	0	0	0	110	N270 T271 F292 D293 D295	S268-N270 PolarHBondContact O-N 3.2Å; S268-N270 VanDerWaalsContact O-N 3.13Å; S268-N270 PolarHBondContact OG-N 2.93Å; S268-N270 VanDerWaalsContact OG-N 3.13Å; S268-T271 PolarHBondContact N-OG1 3.39Å; S268-T271 WeakPolarHBondContact O-CB 3.32Å; S268-T271 PolarHBondContact O-N 2.96Å; S268-T271 VanDerWaalsContact O-N 3.09Å; S268-T271 PolarHBondContact O-OG1 3.34Å; S268-F292 PolarHBondContact N-O 3.09Å; S268-F292 VanDerWaalsContact N-O 3.11Å; S268-D293 WeakPolarHBondContact CB-OD1 3.33Å; S268-D295 WeakPolarHBondContact CB-OD2 3.36Å; S268-D295 PolarHBondContact OG-OD2 3.33Å
269	A	62	Low	78.4	Confident	106 Å²	106	60 Å²	60	88%	0.876	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.2	173.4	0	0	0	0	0	112.9
270	N	60.8	Low	78.2	Confident	121 Å²	121	61.5 Å²	61.5	65%	0.647	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	1.6	-179.5	-64.6	-31.1	0	0	0	113.8	S268 S272	S268-N270 PolarHBondContact O-N 3.2Å; S268-N270 VanDerWaalsContact O-N 3.13Å; S268-N270 PolarHBondContact OG-N 2.93Å; S268-N270 VanDerWaalsContact OG-N 3.13Å; N270-S272 PolarHBondContact O-N 3.18Å
271	T	65.2	Low	77.9	Confident	19 Å²	19	62.4 Å²	62.4	12%	0.117	36%	0.356	C	S	.	.			trans	-59.4	126.7	-174.2	-59.1	0	0	0	0	111.8	S268 K273 L276 F292 D294	S268-T271 PolarHBondContact N-OG1 3.39Å; S268-T271 WeakPolarHBondContact O-CB 3.32Å; S268-T271 PolarHBondContact O-N 2.96Å; S268-T271 VanDerWaalsContact O-N 3.09Å; S268-T271 PolarHBondContact O-OG1 3.34Å; T271-K273 PolarHBondContact O-N 3.25Å; T271-L276 HydrophobicContact CG2-CD2 3.67Å; T271-L276 HydrophobicContact CG2-CG 4.3Å; T271-F292 HydrophobicContact CG2-CB 4.16Å; T271-F292 HydrophobicContact CG2-CD1 3.55Å; T271-F292 HydrophobicContact CG2-CE1 4.34Å; T271-F292 HydrophobicContact CG2-CG 4.27Å; T271-F292 PolarHBondContact OG1-O 3.13Å; T271-D294 WeakPolarHBondContact CA-OD2 3.38Å
272	S	66	Low	77.7	Confident	58 Å²	58	64.8 Å²	64.8	41%	0.406	39%	0.386	S	S	.	.			trans	-62.8	122.3	176.8	-70	0	0	0	0	110.9	N270 S274 R275 D294	N270-S272 PolarHBondContact O-N 3.18Å; S272-S274 PolarHBondContact O-N 3.36Å; S272-R275 PolarHBondContact O-N 3.29Å; S272-D294 PolarHBondContact N-OD2 3.32Å
273	K	68.1	Low	77.6	Confident	186 Å²	186	65.6 Å²	65.6	81%	0.809	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-53	-29.1	-179.9	-69.9	-172	-179.8	-178.7	0	113.9	T271 R275 L276	T271-K273 PolarHBondContact O-N 3.25Å; K273-R275 PolarHBondContact O-N 3.09Å; K273-L276 HydrophobicContact CG-CD1 4.46Å; K273-L276 PolarHBondContact O-N 2.95Å
274	S	66.2	Low	77.8	Confident	104 Å²	104	71.8 Å²	71.8	73%	0.727	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-66.7	-16.5	178.6	54.3	0	0	0	0	114.2	S272	S272-S274 PolarHBondContact O-N 3.36Å
275	R	69	Low	78	Confident	103 Å²	103	76.3 Å²	76.3	39%	0.389	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-101.7	-7.9	179.6	-64.9	-175.1	172.4	-178.8	-8.2	113.6	F184 S272 K273 K277 F292 D294	F184-R275 VanDerWaalsContact CE1-NH1 3.33Å; S272-R275 PolarHBondContact O-N 3.29Å; K273-R275 PolarHBondContact O-N 3.09Å; R275-K277 PolarHBondContact O-N 3.39Å; R275-F292 HydrophobicContact CB-CE1 3.92Å; R275-F292 HydrophobicContact CB-CZ 4.01Å; R275-F292 HydrophobicContact CG-CE1 4.46Å; R275-F292 HydrophobicContact CG-CZ 4.44Å; R275-D294 IonicContact CZ-OD1 2.77Å; R275-D294 IonicContact NH1-OD1 2.75Å; R275-D294 PolarHBondContact NH1-OD1 2.91Å
276	L	76.3	Confident	78.5	Confident	64 Å²	64	77.6 Å²	77.6	34%	0.335	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-69.6	122.4	179.6	-65.1	175.9	0	0	0	110	T271 K273 V289	T271-L276 HydrophobicContact CG2-CD2 3.67Å; T271-L276 HydrophobicContact CG2-CG 4.3Å; K273-L276 HydrophobicContact CG-CD1 4.46Å; K273-L276 PolarHBondContact O-N 2.95Å; L276-V289 HydrophobicContact CB-CG1 4.46Å
277	K	81.3	Confident	79.5	Confident	46 Å²	46	74.3 Å²	74.3	20%	0.2	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-99	144	172.7	-66.4	-173.1	-176.1	-172.3	0	109.9	G190 S191 R275 C279 V289 L290	G190-K277 PolarHBondContact O-NZ 2.87Å; S191-K277 PolarHBondContact O-NZ 2.91Å; R275-K277 PolarHBondContact O-N 3.39Å; K277-C279 PolarHBondContact O-N 3.02Å; K277-V289 CarbonylContact O-C 3.36Å; K277-V289 WeakPolarHBondContact O-CA 3.25Å; K277-L290 HydrophobicContact CB-CB 4.44Å; K277-L290 HydrophobicContact CB-CD1 3.96Å; K277-L290 HydrophobicContact CB-CG 4.41Å; K277-L290 PolarHBondContact O-N 3.25Å
278	S	86.9	Confident	80.5	Confident	71 Å²	71	73.2 Å²	73.2	50%	0.497	44%	0.443	S	S	.	.	B	Isolated β-bridge	trans	-62.8	134.8	175.5	-65.1	0	0	0	0	111.1	T13 H280	T13-S278 PolarHBondContact OG1-O 2.87Å; S278-H280 WeakPolarHBondContact CB-NE2 3.45Å; S278-H280 PolarHBondContact O-CD2 3.33Å
279	C	90.2	Very high	81.6	Confident	12 Å²	12	74.8 Å²	74.8	8%	0.081	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-88	124.3	174.1	179.5	0	0	0	0	110.1	K277 G288 L290	K277-C279 PolarHBondContact O-N 3.02Å; C279-G288 PolarHBondContact N-O 2.77Å; C279-L290 HydrophobicContact CB-CD2 4.1Å; C279-L290 HydrophobicContact CB-CG 4.38Å
280	H	91.6	Very high	82.8	Confident	62 Å²	62	70.5 Å²	70.5	29%	0.287	41%	0.414	S	S	.	.			trans	-115.8	35.2	178.6	-57.2	-91.7	0	0	0	111.6	T13 E150 K151 S278 G282	T13-H280 VanDerWaalsContact CG2-CD2 3.46Å; T13-H280 WeakPolarHBondContact CG2-CD2 3.49Å; E150-H280 IonicContact OE2-CE1 3.42Å; E150-H280 PolarHBondContact OE2-CE1 3.04Å; E150-H280 IonicContact OE2-ND1 3.98Å; E150-H280 IonicContact OE2-NE2 3.9Å; E150-H280 PolarHBondContact OE2-NE2 2.85Å; K151-H280 HydrophobicContact CG-CB 4.15Å; S278-H280 WeakPolarHBondContact CB-NE2 3.45Å; S278-H280 PolarHBondContact O-CD2 3.33Å; H280-G282 VanDerWaalsContact C-N 3.28Å; H280-G282 PolarHBondContact O-N 3.15Å
281	C	92.6	Very high	83.8	Confident	19 Å²	19	65.1 Å²	65.1	13%	0.128	39%	0.386	C	S	.	.			trans	-70.8	-22.4	-177.2	70.7	0	0	0	0	114.1	H226 A283	H226-C281 WeakPolarHBondContact O-CB 3.34Å; C281-A283 VanDerWaalsContact C-N 3.26Å; C281-A283 PolarHBondContact O-N 3.42Å; C281-A283 PolarHBondContact SG-N 2.81Å
282	G	92.1	Very high	84.1	Confident	72 Å²	72	65.3 Å²	65.3	74%	0.742	39%	0.385	S	S	*	.			trans	76.6	3.9	-179.9	0	0	0	0	0	115.2	H280	H280-G282 VanDerWaalsContact C-N 3.28Å; H280-G282 PolarHBondContact O-N 3.15Å
283	A	94.3	Very high	84.3	Confident	19 Å²	19	63.8 Å²	63.8	16%	0.157	37%	0.372	C	S	.	.			trans	-72.3	143.9	176.3	0	0	0	0	0	111.8	C228 A229 C281 N285 C286	C228-A283 HydrophobicContact CB-CB 4.43Å; A229-A283 HydrophobicContact CB-CB 3.75Å; C281-A283 VanDerWaalsContact C-N 3.26Å; C281-A283 PolarHBondContact O-N 3.42Å; C281-A283 PolarHBondContact SG-N 2.81Å; A283-N285 VanDerWaalsContact CB-OD1 3.29Å; A283-N285 WeakPolarHBondContact CB-OD1 2.65Å; A283-N285 PolarHBondContact O-N 3.49Å; A283-C286 WeakPolarHBondContact O-CB 3.21Å; A283-C286 PolarHBondContact O-N 2.89Å
284	D	95	Very high	84.3	Confident	179 Å²	179	56.6 Å²	56.6	96%	0.957	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.1	178.8	-66.3	-29.8	0	0	0	112.8
285	N	94.4	Very high	84.1	Confident	97 Å²	97	55.8 Å²	55.8	52%	0.519	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	20.7	177.4	71.6	-28.3	0	0	0	113.2	C228 A283 T287	C228-N285 PolarHBondContact O-ND2 2.97Å; A283-N285 VanDerWaalsContact CB-OD1 3.29Å; A283-N285 WeakPolarHBondContact CB-OD1 2.65Å; A283-N285 PolarHBondContact O-N 3.49Å; N285-T287 PolarHBondContact O-N 3.49Å
286	C	93.6	Very high	83.5	Confident	45 Å²	45	51 Å²	51	30%	0.304	31%	0.313	S	S	.	.			trans	-58.7	130.9	-178.7	-176.1	0	0	0	0	111.9	A283 G288	A283-C286 WeakPolarHBondContact O-CB 3.21Å; A283-C286 PolarHBondContact O-N 2.89Å; C286-G288 PolarHBondContact O-N 3.11Å; C286-G288 PolarHBondContact SG-N 2.76Å
287	T	90.6	Very high	82.4	Confident	99 Å²	99	49.2 Å²	49.2	61%	0.607	30%	0.303	S	S	*	.			trans	-75.2	-8.4	176.4	56.9	0	0	0	0	113.2	N285 V289	N285-T287 PolarHBondContact O-N 3.49Å; T287-V289 PolarHBondContact O-N 3.13Å; T287-V289 PolarHBondContact OG1-O 2.58Å
288	G	89.4	Confident	82.5	Confident	38 Å²	38	49.4 Å²	49.4	39%	0.392	31%	0.308	S	S	.	.	S	Bend	trans	79.9	-14.6	-177.5	0	0	0	0	0	114.8	C279 C286	C279-G288 PolarHBondContact N-O 2.77Å; C286-G288 PolarHBondContact O-N 3.11Å; C286-G288 PolarHBondContact SG-N 2.76Å
289	V	88.3	Confident	82.2	Confident	50 Å²	50	48.2 Å²	48.2	30%	0.303	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-133	141.8	-179.5	-64.4	0	0	0	0	111	L276 K277 T287	L276-V289 HydrophobicContact CB-CG1 4.46Å; K277-V289 CarbonylContact O-C 3.36Å; K277-V289 WeakPolarHBondContact O-CA 3.25Å; T287-V289 PolarHBondContact O-N 3.13Å; T287-V289 PolarHBondContact OG1-O 2.58Å
290	L	86.5	Confident	81.8	Confident	16 Å²	16	50.2 Å²	50.2	8%	0.084	31%	0.31	C	S	.	.			trans	-66.1	135.3	173.1	-70.5	-179.6	0	0	0	109.4	T11 T13 H226 Y264 K277 C279	T11-L290 WeakPolarHBondContact O-CD1 3.43Å; T13-L290 WeakPolarHBondContact OG1-CD1 3.27Å; H226-L290 HydrophobicContact CB-CD2 3.62Å; Y264-L290 HydrophobicContact CD2-CD2 4.38Å; Y264-L290 HydrophobicContact CE2-CD2 4.45Å; K277-L290 HydrophobicContact CB-CB 4.44Å; K277-L290 HydrophobicContact CB-CD1 3.96Å; K277-L290 HydrophobicContact CB-CG 4.41Å; K277-L290 PolarHBondContact O-N 3.25Å; C279-L290 HydrophobicContact CB-CD2 4.1Å; C279-L290 HydrophobicContact CB-CG 4.38Å
291	P	82.5	Confident	81.2	Confident	9 Å²	9	49.5 Å²	49.5	6%	0.058	31%	0.311	C	S	.	.			trans	-68	139.8	179.5	29.8	-34.1	0	0	0	110.2	Y264 G265 S267	Y264-P291 VanDerWaalsContact CB-CG 3.47Å; G265-P291 WeakPolarHBondContact O-CB 3.23Å; G265-P291 WeakPolarHBondContact O-CG 3.2Å; S267-P291 WeakPolarHBondContact OG-CA 3.19Å
292	F	71.3	Confident	80.5	Confident	23 Å²	23	51.4 Å²	51.4	10%	0.101	32%	0.323	C	S	.	.			trans	-148.6	129.5	-175.2	-169.9	-93.5	0	0	0	108.7	F184 S267 S268 T271 R275 D294	F184-F292 HydrophobicContact CE1-CE1 4.08Å; F184-F292 AromaticContact CE1-CZ 3.76Å; F184-F292 HydrophobicContact CE1-CZ 3.76Å; F184-F292 HydrophobicContact CE2-CD2 4.45Å; F184-F292 HydrophobicContact CE2-CE1 4.23Å; F184-F292 AromaticContact CE2-CE2 3.41Å; F184-F292 HydrophobicContact CE2-CE2 3.41Å; F184-F292 VanDerWaalsContact CE2-CE2 3.41Å; F184-F292 AromaticContact CE2-CZ 3.33Å; F184-F292 HydrophobicContact CE2-CZ 3.33Å; F184-F292 HydrophobicContact CZ-CD1 4.32Å; F184-F292 HydrophobicContact CZ-CD2 4.41Å; F184-F292 AromaticContact CZ-CE1 3.38Å; F184-F292 HydrophobicContact CZ-CE1 3.38Å; F184-F292 AromaticContact CZ-CE2 3.44Å; F184-F292 HydrophobicContact CZ-CE2 3.44Å; F184-F292 VanDerWaalsContact CZ-CE2 3.44Å; F184-F292 AromaticContact CZ-CZ 2.86Å; F184-F292 HydrophobicContact CZ-CZ 2.86Å; S267-F292 VanDerWaalsContact CA-O 3.24Å; S267-F292 WeakPolarHBondContact CA-O 3.29Å; S268-F292 PolarHBondContact N-O 3.09Å; S268-F292 VanDerWaalsContact N-O 3.11Å; T271-F292 HydrophobicContact CG2-CB 4.16Å; T271-F292 HydrophobicContact CG2-CD1 3.55Å; T271-F292 HydrophobicContact CG2-CE1 4.34Å; T271-F292 HydrophobicContact CG2-CG 4.27Å; T271-F292 PolarHBondContact OG1-O 3.13Å; R275-F292 HydrophobicContact CB-CE1 3.92Å; R275-F292 HydrophobicContact CB-CZ 4.01Å; R275-F292 HydrophobicContact CG-CE1 4.46Å; R275-F292 HydrophobicContact CG-CZ 4.44Å; F292-D294 VanDerWaalsContact CE1-OD1 3.23Å; F292-D294 WeakPolarHBondContact CE1-OD1 3.32Å
293	D	70.5	Confident	79.7	Confident	26 Å²	26	50.1 Å²	50.1	14%	0.139	30%	0.295	C	S	.	.			trans	-122	101.2	-178.6	-170.9	-9.1	0	0	0	109.9	C8 S268 D295 C296	C8-D293 HydrophobicContact CB-CB 4.26Å; S268-D293 WeakPolarHBondContact CB-OD1 3.33Å; D293-D295 PolarHBondContact O-N 3.25Å; D293-D295 WeakPolarHBondContact OD1-CA 3.24Å; D293-D295 VanDerWaalsContact OD1-CB 3.29Å; D293-D295 WeakPolarHBondContact OD1-CB 3.36Å; D293-D295 PolarHBondContact OD1-N 2.94Å; D293-C296 HydrophobicContact CB-CB 3.89Å; D293-C296 PolarHBondContact O-N 3.29Å; D293-C296 PolarHBondContact OD1-N 3.26Å; D293-C296 VanDerWaalsContact OD1-N 3.15Å; D293-C296 PolarHBondContact OD2-SG 3.35Å
294	D	66.9	Low	78.7	Confident	35 Å²	35	52.3 Å²	52.3	19%	0.187	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-23.3	172.5	-83.7	-44.2	0	0	0	111.8	T271 S272 R275 F292	T271-D294 WeakPolarHBondContact CA-OD2 3.38Å; S272-D294 PolarHBondContact N-OD2 3.32Å; R275-D294 IonicContact CZ-OD1 2.77Å; R275-D294 IonicContact NH1-OD1 2.75Å; R275-D294 PolarHBondContact NH1-OD1 2.91Å; F292-D294 VanDerWaalsContact CE1-OD1 3.23Å; F292-D294 WeakPolarHBondContact CE1-OD1 3.32Å
295	D	63.6	Low	77.4	Confident	87 Å²	87	42.5 Å²	42.5	47%	0.465	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-16.1	-178.3	-57.8	-48.2	0	0	0	113	R199 S268 D293 I297	R199-D295 PolarHBondContact NH2-O 3Å; S268-D295 WeakPolarHBondContact CB-OD2 3.36Å; S268-D295 PolarHBondContact OG-OD2 3.33Å; D293-D295 PolarHBondContact O-N 3.25Å; D293-D295 WeakPolarHBondContact OD1-CA 3.24Å; D293-D295 VanDerWaalsContact OD1-CB 3.29Å; D293-D295 WeakPolarHBondContact OD1-CB 3.36Å; D293-D295 PolarHBondContact OD1-N 2.94Å; D295-I297 PolarHBondContact O-N 3.24Å
296	C	55.7	Low	76	Confident	3 Å²	3	38 Å²	38	2%	0.02	23%	0.232	C	C	.	.			trans	-71.8	-17.7	173.8	-94.6	0	0	0	0	112.6	C8 R199 D293	C8-C296 HydrophobicContact CB-CB 3.66Å; R199-C296 PolarHBondContact NH2-O 3.17Å; D293-C296 HydrophobicContact CB-CB 3.89Å; D293-C296 PolarHBondContact O-N 3.29Å; D293-C296 PolarHBondContact OD1-N 3.26Å; D293-C296 VanDerWaalsContact OD1-N 3.15Å; D293-C296 PolarHBondContact OD2-SG 3.35Å
297	I	53.5	Low	74.4	Confident	25 Å²	25	37.4 Å²	37.4	13%	0.128	23%	0.226	C	C	.	.			trans	-102.6	0	-176.7	-69.9	172.4	0	0	0	109.6	K177 K181 F184 L195 V197 D295	K177-I297 WeakPolarHBondContact CE-OXT 3.41Å; K181-I297 VanDerWaalsContact CA-CG2 3.4Å; K181-I297 HydrophobicContact CB-CG2 4Å; K181-I297 WeakPolarHBondContact CE-O 3.32Å; K181-I297 WeakPolarHBondContact CE-OXT 3.3Å; K181-I297 HydrophobicContact CG-CG2 3.56Å; K181-I297 WeakPolarHBondContact CG-OXT 3.5Å; F184-I297 HydrophobicContact CB-CD1 3.86Å; F184-I297 HydrophobicContact CB-CG2 3.97Å; F184-I297 HydrophobicContact CD1-CB 4.37Å; F184-I297 HydrophobicContact CD1-CD1 3.75Å; F184-I297 HydrophobicContact CD1-CG2 4.02Å; F184-I297 HydrophobicContact CD2-CD1 3.26Å; F184-I297 HydrophobicContact CE1-CD1 3.85Å; F184-I297 HydrophobicContact CE2-CD1 3.36Å; F184-I297 HydrophobicContact CG-CD1 3.38Å; F184-I297 HydrophobicContact CG-CG2 4.18Å; F184-I297 HydrophobicContact CZ-CD1 3.58Å; L195-I297 HydrophobicContact CD2-CD1 3.88Å; L195-I297 HydrophobicContact CD2-CG1 4.34Å; V197-I297 HydrophobicContact CG2-CG1 4.22Å; D295-I297 PolarHBondContact O-N 3.24Å

Retrieved 297 of 297 residues in 427 ms (Link to these results)

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