A0A077Z7Q6_TRITR Loading...

Notchless 1

AlphaFold DB , UniProt , Accession A0A077Z7Q6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 389 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.1	Low	67	Low	151 Å²	151	79.6 Å²	79.6	74%	0.744	46%	0.46	S	S	*	.				0	126.5	0	-173.6	173.5	-92.2	0	0	106.7	T10	M1-T10 HydrophobicContact CB-CG2 4.41Å; M1-T10 HydrophobicContact CG-CG2 3.37Å; M1-T10 HydrophobicContact SD-CG2 3.37Å; M1-T10 WeakPolarHBondContact SD-CG2 3.23Å
2	E	61.2	Low	67	Low	98 Å²	98	80.1 Å²	80.1	46%	0.458	48%	0.481	S	S	.	.			trans	-83.5	127.5	176.5	-169.2	-174.1	150	0	0	107.8	S4 K351	E2-S4 PolarHBondContact O-N 2.93Å; E2-K351 IonicContact OE1-NZ 3.25Å; E2-K351 PolarHBondContact OE1-NZ 3.18Å; E2-K351 WeakPolarHBondContact OE2-CE 3.4Å; E2-K351 IonicContact OE2-NZ 3.91Å; E2-K351 PolarHBondContact OE2-NZ 3.43Å
3	I	63.6	Low	67.1	Low	67 Å²	67	81.1 Å²	81.1	34%	0.344	49%	0.494	S	S	.	.			trans	-83.3	104.8	176.7	-60.5	155.5	0	0	0	106.6	L7 T10 I24	I3-L7 HydrophobicContact CD1-CD1 3.4Å; I3-L7 VanDerWaalsContact CD1-CD1 3.4Å; I3-L7 HydrophobicContact CG1-CD1 4.02Å; I3-T10 HydrophobicContact CB-CG2 4.31Å; I3-T10 HydrophobicContact CG1-CG2 3.78Å; I3-I24 HydrophobicContact CD1-CD1 4.34Å; I3-I24 HydrophobicContact CD1-CG1 4.23Å; I3-I24 HydrophobicContact CD1-CG2 3.58Å
4	S	64	Low	66.9	Low	85 Å²	85	76 Å²	76	59%	0.594	47%	0.466	S	S	*	.	S	Bend	trans	-94	-33	-177.5	54.2	0	0	0	0	114	E2	E2-S4 PolarHBondContact O-N 2.93Å
5	D	68	Low	66.7	Low	137 Å²	137	85.7 Å²	85.7	73%	0.733	50%	0.499	S	S	*	.	S	Bend	trans	-115.4	-88.5	179.1	-76.6	-50.7	0	0	0	110.5
6	T	73	Confident	66.6	Low	84 Å²	84	83.6 Å²	83.6	52%	0.515	49%	0.488	S	S	.	.			trans	-119.4	150.2	178.9	59.4	0	0	0	0	109.9	G8 S9 T10	T6-G8 PolarHBondContact O-N 3.27Å; T6-S9 PolarHBondContact N-OG 3.11Å; T6-S9 PolarHBondContact O-N 2.95Å; T6-S9 PolarHBondContact O-OG 2.8Å; T6-S9 WeakPolarHBondContact OG1-CB 3.3Å; T6-S9 PolarHBondContact OG1-N 3.22Å; T6-S9 PolarHBondContact OG1-OG 3.34Å; T6-T10 WeakPolarHBondContact O-CB 3.05Å; T6-T10 PolarHBondContact O-N 3.15Å; T6-T10 PolarHBondContact O-OG1 3.11Å
7	L	71.6	Confident	66.7	Low	77 Å²	77	83.4 Å²	83.4	40%	0.403	48%	0.484	S	S	.	.	H	α-helix	trans	-56	-40.3	174.5	-176.9	66.6	0	0	0	110.7	I3 T10 I11 I24	I3-L7 HydrophobicContact CD1-CD1 3.4Å; I3-L7 VanDerWaalsContact CD1-CD1 3.4Å; I3-L7 HydrophobicContact CG1-CD1 4.02Å; L7-T10 PolarHBondContact O-N 2.88Å; L7-I11 HydrophobicContact CD1-CD1 3.73Å; L7-I11 HydrophobicContact CD1-CG1 4.02Å; L7-I11 HydrophobicContact CD2-CD1 4.11Å; L7-I11 HydrophobicContact CG-CD1 3.56Å; L7-I11 HydrophobicContact CG-CG1 4.17Å; L7-I11 WeakPolarHBondContact O-CB 3.04Å; L7-I11 VanDerWaalsContact O-CG1 3.23Å; L7-I11 WeakPolarHBondContact O-CG1 3.16Å; L7-I11 PolarHBondContact O-N 2.83Å; L7-I24 HydrophobicContact CD1-CD1 3.5Å; L7-I24 VanDerWaalsContact CD1-CD1 3.5Å; L7-I24 HydrophobicContact CD1-CG1 4.28Å; L7-I24 HydrophobicContact CD2-CD1 3.95Å; L7-I24 HydrophobicContact CG-CD1 4.4Å
8	G	71.6	Confident	66.8	Low	50 Å²	50	86.8 Å²	86.8	52%	0.515	51%	0.506	S	S	.	.	H	α-helix	trans	-62	-48.4	178.9	0	0	0	0	0	113.9	T6 T10 I11 A12	T6-G8 PolarHBondContact O-N 3.27Å; G8-T10 VanDerWaalsContact C-N 3.3Å; G8-T10 PolarHBondContact O-N 3.13Å; G8-I11 PolarHBondContact O-N 2.77Å; G8-A12 VanDerWaalsContact O-CB 3.23Å; G8-A12 WeakPolarHBondContact O-CB 3.39Å; G8-A12 PolarHBondContact O-N 3.47Å
9	S	73	Confident	67.1	Low	52 Å²	52	91.5 Å²	91.5	36%	0.364	52%	0.523	S	S	.	.	H	α-helix	trans	-63.6	-39.5	177.2	53.6	0	0	0	0	111.8	T6 A12 S13	T6-S9 PolarHBondContact N-OG 3.11Å; T6-S9 PolarHBondContact O-N 2.95Å; T6-S9 PolarHBondContact O-OG 2.8Å; T6-S9 WeakPolarHBondContact OG1-CB 3.3Å; T6-S9 PolarHBondContact OG1-N 3.22Å; T6-S9 PolarHBondContact OG1-OG 3.34Å; S9-A12 PolarHBondContact O-N 3.24Å; S9-S13 WeakPolarHBondContact O-CB 3.34Å; S9-S13 PolarHBondContact O-N 3.07Å; S9-S13 PolarHBondContact O-OG 3.23Å
10	T	67.6	Low	67.3	Low	10 Å²	10	94.6 Å²	94.6	6%	0.061	53%	0.53	C	S	.	.	H	α-helix	trans	-66.3	-50.3	179.6	-54.9	0	0	0	0	110.8	M1 I3 T6 L7 G8 A12 S13 G14	M1-T10 HydrophobicContact CB-CG2 4.41Å; M1-T10 HydrophobicContact CG-CG2 3.37Å; M1-T10 HydrophobicContact SD-CG2 3.37Å; M1-T10 WeakPolarHBondContact SD-CG2 3.23Å; I3-T10 HydrophobicContact CB-CG2 4.31Å; I3-T10 HydrophobicContact CG1-CG2 3.78Å; T6-T10 WeakPolarHBondContact O-CB 3.05Å; T6-T10 PolarHBondContact O-N 3.15Å; T6-T10 PolarHBondContact O-OG1 3.11Å; L7-T10 PolarHBondContact O-N 2.88Å; G8-T10 VanDerWaalsContact C-N 3.3Å; G8-T10 PolarHBondContact O-N 3.13Å; T10-A12 VanDerWaalsContact C-N 3.34Å; T10-A12 PolarHBondContact O-N 3.33Å; T10-S13 PolarHBondContact O-N 3.36Å; T10-S13 PolarHBondContact O-OG 3.35Å; T10-G14 PolarHBondContact O-N 3.05Å
11	I	71.4	Confident	67.7	Low	65 Å²	65	96.5 Å²	96.5	33%	0.333	54%	0.543	S	S	.	.	H	α-helix	trans	-62.5	-39.6	176.8	-68.9	176.1	0	0	0	111.1	L7 G8 G14 V16	L7-I11 HydrophobicContact CD1-CD1 3.73Å; L7-I11 HydrophobicContact CD1-CG1 4.02Å; L7-I11 HydrophobicContact CD2-CD1 4.11Å; L7-I11 HydrophobicContact CG-CD1 3.56Å; L7-I11 HydrophobicContact CG-CG1 4.17Å; L7-I11 WeakPolarHBondContact O-CB 3.04Å; L7-I11 VanDerWaalsContact O-CG1 3.23Å; L7-I11 WeakPolarHBondContact O-CG1 3.16Å; L7-I11 PolarHBondContact O-N 2.83Å; G8-I11 PolarHBondContact O-N 2.77Å; I11-G14 CarbonylContact O-C 3.6Å; I11-G14 PolarHBondContact O-N 3.13Å; I11-V16 HydrophobicContact CG2-CB 4.29Å
12	A	67.4	Low	68.6	Low	85 Å²	85	92.7 Å²	92.7	70%	0.702	53%	0.529	S	S	*	.	H	α-helix	trans	-67.7	-35.2	178.8	0	0	0	0	0	112.8	G8 S9 T10 G14	G8-A12 VanDerWaalsContact O-CB 3.23Å; G8-A12 WeakPolarHBondContact O-CB 3.39Å; G8-A12 PolarHBondContact O-N 3.47Å; S9-A12 PolarHBondContact O-N 3.24Å; T10-A12 VanDerWaalsContact C-N 3.34Å; T10-A12 PolarHBondContact O-N 3.33Å; A12-G14 VanDerWaalsContact C-N 3.32Å
13	S	67.8	Low	69	Low	93 Å²	93	94.9 Å²	94.9	65%	0.65	54%	0.543	S	S	*	.	H	α-helix	trans	-71.9	-28.1	174.2	75.5	0	0	0	0	112.7	S9 T10	S9-S13 WeakPolarHBondContact O-CB 3.34Å; S9-S13 PolarHBondContact O-N 3.07Å; S9-S13 PolarHBondContact O-OG 3.23Å; T10-S13 PolarHBondContact O-N 3.36Å; T10-S13 PolarHBondContact O-OG 3.35Å
14	G	64.2	Low	69.3	Low	10 Å²	10	96.3 Å²	96.3	10%	0.103	55%	0.551	C	S	.	*	T	Hydrogen-bonded Turn	trans	-81.4	135.4	172.3	0	0	0	0	0	110.7	T10 I11 A12 V16	T10-G14 PolarHBondContact O-N 3.05Å; I11-G14 CarbonylContact O-C 3.6Å; I11-G14 PolarHBondContact O-N 3.13Å; A12-G14 VanDerWaalsContact C-N 3.32Å; G14-V16 PolarHBondContact O-N 3.37Å
15	K	63.9	Low	69.6	Low	221 Å²	221	97.6 Å²	97.6	96%	0.961	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	60.8	163.9	-66.3	-178	179.6	-179.4	0	109.8
16	V	65.5	Low	69.5	Low	53 Å²	53	99.9 Å²	99.9	32%	0.321	56%	0.555	S	S	.	*			trans	-84.3	120.3	-178.5	-174.4	0	0	0	0	107.5	I11 G14 V18 V22	I11-V16 HydrophobicContact CG2-CB 4.29Å; G14-V16 PolarHBondContact O-N 3.37Å; V16-V18 PolarHBondContact O-N 3.46Å; V16-V22 HydrophobicContact CG1-CG2 3.36Å
17	N	67.3	Low	69.2	Low	79 Å²	79	103 Å²	103	42%	0.422	56%	0.557	S	S	.	*			trans	-68.2	122.1	176.2	-174.5	-16.6	0	0	0	108.9	E19 K20	N17-E19 PolarHBondContact O-N 3.43Å; N17-E19 VanDerWaalsContact O-N 3.15Å; N17-E19 PolarHBondContact OD1-N 3.41Å; N17-K20 HydrophobicContact CB-CG 4.39Å; N17-K20 PolarHBondContact O-N 2.89Å; N17-K20 VanDerWaalsContact O-N 3.11Å
18	V	69.3	Low	69.1	Low	146 Å²	146	104.2 Å²	104.2	89%	0.885	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-18.7	179.7	-94.1	0	0	0	0	113.9	V16	V16-V18 PolarHBondContact O-N 3.46Å
19	E	73.3	Confident	69.1	Low	175 Å²	175	106.4 Å²	106.4	82%	0.818	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-4.7	178.5	-62.2	-176.6	161.5	0	0	113.9	N17	N17-E19 PolarHBondContact O-N 3.43Å; N17-E19 VanDerWaalsContact O-N 3.15Å; N17-E19 PolarHBondContact OD1-N 3.41Å
20	K	71	Confident	69.3	Low	153 Å²	153	105.3 Å²	105.3	67%	0.665	56%	0.557	S	S	*	*	S	Bend	trans	-105.5	137.1	-178.5	-70.7	-171.2	175.7	-177.1	0	111.6	N17 V22	N17-K20 HydrophobicContact CB-CG 4.39Å; N17-K20 PolarHBondContact O-N 2.89Å; N17-K20 VanDerWaalsContact O-N 3.11Å; K20-V22 PolarHBondContact O-N 3.35Å
21	V	74	Confident	69.9	Low	135 Å²	135	112.2 Å²	112.2	82%	0.818	60%	0.599	S	S	*	*			trans	-61.3	127.3	170.5	-178.4	0	0	0	0	109.1
22	V	71.1	Confident	70.5	Confident	72 Å²	72	113.4 Å²	113.4	44%	0.436	60%	0.6	S	S	.	*			trans	-106	107.2	179	-175.5	0	0	0	0	108.7	V16 K20 I24	V16-V22 HydrophobicContact CG1-CG2 3.36Å; K20-V22 PolarHBondContact O-N 3.35Å; V22-I24 PolarHBondContact O-N 2.83Å; V22-I24 VanDerWaalsContact O-N 3.15Å
23	D	70.1	Confident	71.3	Confident	143 Å²	143	118.4 Å²	118.4	77%	0.765	60%	0.601	S	S	*	*			trans	-73.2	107.9	175.6	-67.5	-25.9	0	0	0	110.4	V25	D23-V25 PolarHBondContact O-N 3.09Å
24	I	71.2	Confident	72.2	Confident	98 Å²	98	114.4 Å²	114.4	50%	0.503	57%	0.572	S	S	.	*			trans	-87.9	102.9	173.7	-58.7	166.1	0	0	0	108.2	I3 L7 V22 Y26	I3-I24 HydrophobicContact CD1-CD1 4.34Å; I3-I24 HydrophobicContact CD1-CG1 4.23Å; I3-I24 HydrophobicContact CD1-CG2 3.58Å; L7-I24 HydrophobicContact CD1-CD1 3.5Å; L7-I24 VanDerWaalsContact CD1-CD1 3.5Å; L7-I24 HydrophobicContact CD1-CG1 4.28Å; L7-I24 HydrophobicContact CD2-CD1 3.95Å; L7-I24 HydrophobicContact CG-CD1 4.4Å; V22-I24 PolarHBondContact O-N 2.83Å; V22-I24 VanDerWaalsContact O-N 3.15Å; I24-Y26 PolarHBondContact O-N 3.44Å
25	V	69.6	Low	73.4	Confident	111 Å²	111	121.9 Å²	121.9	67%	0.673	60%	0.604	S	S	*	*			trans	-82.1	105.4	173.6	-176.3	0	0	0	0	108.7	D23	D23-V25 PolarHBondContact O-N 3.09Å
26	Y	66	Low	74.3	Confident	186 Å²	186	113.2 Å²	113.2	73%	0.729	57%	0.574	S	S	*	*			trans	-64.4	133.6	171.9	-177.9	-105.4	0	0	0	110.5	I24 L28	I24-Y26 PolarHBondContact O-N 3.44Å; Y26-L28 HydrophobicContact CD1-CG 4.47Å; Y26-L28 HydrophobicContact CE1-CD2 3.65Å; Y26-L28 HydrophobicContact CE1-CG 3.69Å
27	R	66.6	Low	75.4	Confident	148 Å²	148	111.7 Å²	111.7	56%	0.558	57%	0.565	S	S	*	*			trans	-122.8	127.5	173.3	-65	-175.7	-174.9	178.5	0.8	108.5	N29	R27-N29 PolarHBondContact O-N 2.65Å
28	L	68.9	Low	76.4	Confident	104 Å²	104	111.9 Å²	111.9	55%	0.545	57%	0.569	S	S	.	*			trans	-72.2	109.7	170.7	-76	160.4	0	0	0	108.1	Y26	Y26-L28 HydrophobicContact CD1-CG 4.47Å; Y26-L28 HydrophobicContact CE1-CD2 3.65Å; Y26-L28 HydrophobicContact CE1-CG 3.69Å
29	N	72.2	Confident	77.3	Confident	96 Å²	96	113.1 Å²	113.1	51%	0.513	56%	0.558	S	S	.	*			trans	-84.1	154	167.2	-73.3	-11.6	0	0	0	109.4	R27 V31	R27-N29 PolarHBondContact O-N 2.65Å; N29-V31 PolarHBondContact O-N 2.83Å
30	A	76.8	Confident	77.9	Confident	29 Å²	29	107.7 Å²	107.7	24%	0.24	54%	0.539	C	S	.	.			trans	-55.3	132.1	169.3	0	0	0	0	0	110.1	Y32 D332 R334	A30-Y32 HydrophobicContact CB-CD1 4.33Å; A30-Y32 HydrophobicContact CB-CE1 4.16Å; A30-Y32 PolarHBondContact O-N 3.24Å; A30-D332 HydrophobicContact CB-CB 3.74Å; A30-R334 PolarHBondContact O-NH2 2.95Å
31	V	81	Confident	78.7	Confident	155 Å²	155	105 Å²	105	94%	0.939	54%	0.535	S	S	*	.	S	Bend	trans	-67.2	-17.8	178.8	-175.8	0	0	0	0	111.6	N29	N29-V31 PolarHBondContact O-N 2.83Å
32	Y	83.2	Confident	79.4	Confident	89 Å²	89	100.4 Å²	100.4	35%	0.349	51%	0.509	S	S	.	.	S	Bend	trans	-111.9	166.9	175	63.9	-84.8	0	0	0	110.7	A30 V34 S331 D332	A30-Y32 HydrophobicContact CB-CD1 4.33Å; A30-Y32 HydrophobicContact CB-CE1 4.16Å; A30-Y32 PolarHBondContact O-N 3.24Å; Y32-V34 HydrophobicContact CD2-CG2 4.3Å; Y32-V34 HydrophobicContact CE2-CG2 3.96Å; Y32-S331 WeakPolarHBondContact CE2-OG 3.5Å; Y32-S331 VanDerWaalsContact OH-C 3.28Å; Y32-S331 VanDerWaalsContact OH-CB 3.29Å; Y32-S331 WeakPolarHBondContact OH-CB 3.36Å; Y32-S331 PolarHBondContact OH-O 2.87Å; Y32-S331 PolarHBondContact OH-OG 3.1Å; Y32-D332 HydrophobicContact CD2-CB 4.37Å; Y32-D332 HydrophobicContact CE2-CB 4.03Å
33	R	84.1	Confident	80.3	Confident	191 Å²	191	99.8 Å²	99.8	72%	0.721	51%	0.508	S	S	*	.			trans	-126.4	131.7	175.9	-171.8	176.4	-173	168.7	0.1	109.5	D332	R33-D332 WeakPolarHBondContact CA-OD2 3.34Å
34	V	87.1	Confident	81.1	Confident	9 Å²	9	95.7 Å²	95.7	6%	0.055	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-83.1	135.1	173.1	177.4	0	0	0	0	108.7	Y32 S331 D332 L335 W371 G375	Y32-V34 HydrophobicContact CD2-CG2 4.3Å; Y32-V34 HydrophobicContact CE2-CG2 3.96Å; V34-S331 VanDerWaalsContact CG2-OG 3.24Å; V34-S331 WeakPolarHBondContact CG2-OG 3.24Å; V34-D332 HydrophobicContact CG2-CB 3.98Å; V34-D332 PolarHBondContact N-OD2 3.36Å; V34-L335 HydrophobicContact CG1-CD1 4.48Å; V34-W371 HydrophobicContact CG1-CH2 4.45Å; V34-W371 HydrophobicContact CG1-CZ2 3.52Å; V34-G375 WeakPolarHBondContact CG1-O 3.36Å
35	Q	88.4	Confident	81.7	Confident	166 Å²	166	95.9 Å²	95.9	78%	0.776	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-82.6	145.9	174.7	-70.4	-172	-21	0	0	110.4	V37	Q35-V37 PolarHBondContact O-N 3.21Å
36	A	84.5	Confident	82	Confident	39 Å²	39	92.4 Å²	92.4	32%	0.322	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-62.3	128.2	173.3	0	0	0	0	0	110.5	T38 L335 L347	A36-T38 PolarHBondContact O-N 3.44Å; A36-L335 HydrophobicContact CB-CD1 4.38Å; A36-L347 HydrophobicContact CB-CD2 3.3Å
37	V	87	Confident	82.4	Confident	21 Å²	21	84 Å²	84	13%	0.127	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-69.8	125.8	168.2	-179.6	0	0	0	0	108.1	Q35 W371 V378	Q35-V37 PolarHBondContact O-N 3.21Å; V37-W371 HydrophobicContact CG2-CZ2 4.23Å; V37-V378 HydrophobicContact CB-CG2 4.42Å; V37-V378 HydrophobicContact CG2-CB 4.3Å; V37-V378 HydrophobicContact CG2-CG2 3.75Å
38	T	87.9	Confident	82.8	Confident	84 Å²	84	79.8 Å²	79.8	52%	0.515	45%	0.45	S	S	.	.			trans	-113.1	-16.5	-170.4	47.1	0	0	0	0	114.5	A36 V357	A36-T38 PolarHBondContact O-N 3.44Å; T38-V357 HydrophobicContact CG2-CG2 4.28Å
39	R	88.7	Confident	83.5	Confident	172 Å²	172	79.7 Å²	79.7	65%	0.649	45%	0.446	S	S	*	.	S	Bend	trans	-155.9	155.4	-176.2	65.2	-177.4	-176.3	-84.4	1.2	110.9
40	C	87.2	Confident	84.1	Confident	61 Å²	61	76.9 Å²	76.9	41%	0.412	44%	0.436	S	S	.	.			trans	-69.9	132.9	165.4	-178.3	0	0	0	0	109.6	S42 L389	C40-S42 PolarHBondContact SG-O 2.9Å; C40-L389 CarbonylContact C-O 3.6Å; C40-L389 WeakPolarHBondContact CA-O 3.23Å
41	T	87.5	Confident	84.6	Confident	96 Å²	96	75.5 Å²	75.5	59%	0.589	43%	0.425	S	S	*	.			trans	-98.4	-34.7	178.1	59.2	0	0	0	0	112.1	L389	T41-L389 PolarHBondContact N-O 2.89Å; T41-L389 VanDerWaalsContact OG1-C 3.31Å; T41-L389 PolarHBondContact OG1-O 3.5Å
42	S	87.4	Confident	84.9	Confident	39 Å²	39	70.9 Å²	70.9	27%	0.273	39%	0.394	S	S	.	.			trans	-152.3	147	179.1	57.2	0	0	0	0	111.8	C40 K388 L389	C40-S42 PolarHBondContact SG-O 2.9Å; S42-K388 WeakPolarHBondContact O-CA 3.01Å; S42-L389 PolarHBondContact N-O 3.48Å; S42-L389 PolarHBondContact O-N 2.86Å
43	S	89.9	Confident	85.1	Confident	59 Å²	59	67.6 Å²	67.6	41%	0.413	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.7	169.6	-68.6	0	0	0	0	107.1	P45 K388	S43-P45 WeakPolarHBondContact O-CD 3.46Å; S43-K388 PolarHBondContact OG-NZ 3.24Å
44	L	87.8	Confident	85.4	Confident	56 Å²	56	58.6 Å²	58.6	29%	0.293	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	93.1	-173.9	-59.6	169.7	0	0	0	108.1	I68 L387 L389	L44-I68 HydrophobicContact CB-CD1 3.96Å; L44-L387 HydrophobicContact CB-CB 4.25Å; L44-L387 HydrophobicContact CD1-CD2 4.3Å; L44-L387 PolarHBondContact N-O 2.95Å; L44-L387 PolarHBondContact O-N 3.46Å; L44-L387 VanDerWaalsContact O-N 3.11Å; L44-L389 HydrophobicContact CD1-CD1 4.03Å
45	P	84.6	Confident	85.6	Confident	103 Å²	103	60.2 Å²	60.2	67%	0.669	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	155.8	170.1	32	-34.9	0	0	0	110	S43	S43-P45 WeakPolarHBondContact O-CD 3.46Å
46	G	74.5	Confident	85.8	Confident	37 Å²	37	52.3 Å²	52.3	38%	0.381	32%	0.322	S	S	.	.			trans	158	-25.7	174.7	0	0	0	0	0	113.7	G48 G67	G46-G48 PolarHBondContact O-N 3.46Å; G46-G67 CarbonylContact C-O 3.49Å; G46-G67 VanDerWaalsContact C-O 3.3Å
47	H	74.9	Confident	86	Confident	11 Å²	11	50.5 Å²	50.5	5%	0.051	31%	0.306	C	S	.	.			trans	-70.1	126.3	177.8	-55.9	-94.4	0	0	0	111.5	E49 V51 F66 G67 I68 K385	H47-E49 VanDerWaalsContact CB-O 3.24Å; H47-E49 WeakPolarHBondContact CB-O 3.39Å; H47-E49 PolarHBondContact O-N 3.25Å; H47-V51 HydrophobicContact CB-CG2 4.2Å; H47-V51 WeakPolarHBondContact CD2-CG2 3.25Å; H47-V51 WeakPolarHBondContact NE2-CG2 3.36Å; H47-F66 PolarHBondContact CE1-O 3.34Å; H47-F66 PolarHBondContact ND1-O 3.08Å; H47-G67 WeakPolarHBondContact CA-O 3.42Å; H47-G67 PolarHBondContact N-O 3.47Å; H47-G67 WeakPolarHBondContact ND1-CA 3.27Å; H47-G67 PolarHBondContact ND1-N 2.77Å; H47-I68 WeakPolarHBondContact CD2-CG1 3.41Å; H47-I68 PolarHBondContact CE1-N 2.95Å; H47-I68 PolarHBondContact ND1-N 3.28Å; H47-I68 VanDerWaalsContact ND1-N 3.1Å; H47-I68 WeakPolarHBondContact NE2-CD1 3.28Å; H47-I68 WeakPolarHBondContact NE2-CG1 3.42Å; H47-K385 HydrophobicContact CB-CB 4.17Å; H47-K385 WeakPolarHBondContact CB-O 3.42Å; H47-K385 WeakPolarHBondContact O-CB 3.28Å
48	G	75.3	Confident	86	Confident	59 Å²	59	49.6 Å²	49.6	61%	0.608	30%	0.301	S	S	*	.	S	Bend	trans	-70.5	-20.9	171.6	0	0	0	0	0	113.1	G46 K385	G46-G48 PolarHBondContact O-N 3.46Å; G48-K385 WeakPolarHBondContact O-CD 3.1Å; G48-K385 WeakPolarHBondContact O-CE 3.37Å; G48-K385 PolarHBondContact O-NZ 3.44Å
49	E	82.8	Confident	85.7	Confident	102 Å²	102	47.2 Å²	47.2	48%	0.477	29%	0.285	S	S	.	.	S	Bend	trans	-136.9	177.5	-176.4	-65.9	-173.7	143.8	0	0	111.3	H47 W79 K385	H47-E49 VanDerWaalsContact CB-O 3.24Å; H47-E49 WeakPolarHBondContact CB-O 3.39Å; H47-E49 PolarHBondContact O-N 3.25Å; E49-W79 PolarHBondContact OE1-NE1 3.03Å; E49-W79 PolarHBondContact OE2-NE1 2.78Å; E49-K385 WeakPolarHBondContact O-CB 3.47Å
50	A	86.3	Confident	85.5	Confident	36 Å²	36	39.5 Å²	39.5	30%	0.298	26%	0.259	S	S	.	.			trans	-61.8	142.7	-178.8	0	0	0	0	0	112.3	I52 Y367 G382	A50-I52 PolarHBondContact O-N 2.8Å; A50-Y367 HydrophobicContact CB-CD2 4.43Å; A50-Y367 HydrophobicContact CB-CE2 4.1Å; A50-G382 WeakPolarHBondContact CA-O 3.4Å
51	V	86.6	Confident	85.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.274	C	S	.	.			trans	-83.9	104.3	174.8	-173.3	0	0	0	0	108.9	H47 A65 G382 L387	H47-V51 HydrophobicContact CB-CG2 4.2Å; H47-V51 WeakPolarHBondContact CD2-CG2 3.25Å; H47-V51 WeakPolarHBondContact NE2-CG2 3.36Å; V51-A65 HydrophobicContact CG1-CB 4.15Å; V51-G382 PolarHBondContact N-O 3.42Å; V51-L387 HydrophobicContact CG1-CD1 4.22Å
52	I	86.6	Confident	85.1	Confident	58 Å²	58	45.4 Å²	45.4	30%	0.297	26%	0.263	S	S	.	.			trans	-86.1	-30.3	-176.8	-59.2	172.6	0	0	0	111.9	A50 W79 L81	A50-I52 PolarHBondContact O-N 2.8Å; I52-W79 HydrophobicContact CD1-CE3 4.11Å; I52-L81 HydrophobicContact CD1-CD2 4.17Å
53	S	87.2	Confident	85.1	Confident	21 Å²	21	45.8 Å²	45.8	15%	0.147	26%	0.263	C	S	.	.			trans	-144.6	133.9	-177.2	-174.9	0	0	0	0	110.3
54	T	90.3	Very high	84.7	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	143.5	171.4	-178.8	0	0	0	0	109.5	S64 A368 V379 L387	T54-S64 VanDerWaalsContact CA-O 3.25Å; T54-S64 WeakPolarHBondContact CA-O 3.24Å; T54-S64 PolarHBondContact OG1-O 2.72Å; T54-A368 HydrophobicContact CG2-CB 3.73Å; T54-V379 HydrophobicContact CG2-CG1 3.78Å; T54-V379 HydrophobicContact CG2-CG2 4.18Å; T54-V379 WeakPolarHBondContact OG1-CG1 3.49Å; T54-V379 WeakPolarHBondContact OG1-CG2 3.3Å; T54-L387 HydrophobicContact CG2-CD1 4.43Å
55	L	92.1	Very high	84.3	Confident	42 Å²	42	41.2 Å²	41.2	22%	0.22	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	141	178.1	-70	176.1	0	0	0	110.9	S64 L83 W85 D370	L55-S64 PolarHBondContact N-O 3.19Å; L55-S64 PolarHBondContact O-N 2.81Å; L55-S64 PolarHBondContact O-OG 2.96Å; L55-L83 HydrophobicContact CD1-CB 4.18Å; L55-L83 VanDerWaalsContact CD1-O 3.23Å; L55-L83 WeakPolarHBondContact CD1-O 3.41Å; L55-W85 PolarHBondContact O-NE1 2.9Å; L55-D370 WeakPolarHBondContact CA-OD2 3.43Å; L55-D370 HydrophobicContact CD2-CB 4.28Å
56	F	91.9	Very high	83.4	Confident	1 Å²	1	38.2 Å²	38.2	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	147.3	163	-75.2	-84.3	0	0	0	111.3	Y62 V63 R223 D370 S372 R377 V379 L389	F56-Y62 WeakPolarHBondContact CA-O 3.04Å; F56-V63 HydrophobicContact CD1-CG2 3.4Å; F56-V63 HydrophobicContact CE1-CG2 3.16Å; F56-V63 HydrophobicContact CG-CG2 4.26Å; F56-V63 HydrophobicContact CZ-CG2 3.86Å; F56-R223 PolarHBondContact O-NH2 3Å; F56-D370 HydrophobicContact CD2-CB 4.33Å; F56-D370 WeakPolarHBondContact CE2-O 3.29Å; F56-D370 PolarHBondContact N-OD2 3.11Å; F56-S372 VanDerWaalsContact CD2-N 3.29Å; F56-R377 HydrophobicContact CE1-CB 4.1Å; F56-R377 HydrophobicContact CZ-CB 3.67Å; F56-V379 HydrophobicContact CD2-CB 4.37Å; F56-V379 HydrophobicContact CD2-CG1 3.73Å; F56-V379 HydrophobicContact CE2-CB 3.59Å; F56-V379 HydrophobicContact CE2-CG1 3.41Å; F56-V379 VanDerWaalsContact CE2-CG1 3.41Å; F56-V379 HydrophobicContact CZ-CB 3.83Å; F56-V379 HydrophobicContact CZ-CG1 4.11Å; F56-L389 HydrophobicContact CE1-CD2 4.33Å; F56-L389 HydrophobicContact CZ-CD2 3.84Å
57	S	90.2	Very high	82.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.215	C	C	.	.			trans	-60.8	154.5	165.2	57.1	0	0	0	0	110.9	D59 G60 R61 Y62	S57-D59 VanDerWaalsContact CB-OD1 3.27Å; S57-D59 WeakPolarHBondContact CB-OD1 3.47Å; S57-D59 PolarHBondContact O-N 3.03Å; S57-D59 VanDerWaalsContact O-N 3.12Å; S57-D59 PolarHBondContact OG-OD1 3.47Å; S57-G60 WeakPolarHBondContact O-CA 2.89Å; S57-G60 PolarHBondContact O-N 2.77Å; S57-R61 PolarHBondContact OG-N 2.76Å; S57-Y62 PolarHBondContact N-O 3.27Å; S57-Y62 PolarHBondContact OG-N 2.89Å; S57-Y62 PolarHBondContact OG-O 2.81Å
58	P	86.6	Confident	80.8	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.013	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-27	179.6	-29.9	37.2	0	0	0	115.3	W85 S86 R223 P373	P58-W85 HydrophobicContact CG-CB 4.16Å; P58-S86 WeakPolarHBondContact CG-O 3.21Å; P58-R223 WeakPolarHBondContact CB-O 3.42Å; P58-R223 WeakPolarHBondContact CG-O 3.24Å; P58-P373 WeakPolarHBondContact O-CB 3.45Å
59	D	82.3	Confident	78.6	Confident	35 Å²	35	40.4 Å²	40.4	19%	0.187	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-6.7	175.9	67.4	-6.3	0	0	0	113.4	S57 R61 H227	S57-D59 VanDerWaalsContact CB-OD1 3.27Å; S57-D59 WeakPolarHBondContact CB-OD1 3.47Å; S57-D59 PolarHBondContact O-N 3.03Å; S57-D59 VanDerWaalsContact O-N 3.12Å; S57-D59 PolarHBondContact OG-OD1 3.47Å; D59-R61 VanDerWaalsContact C-N 3.26Å; D59-R61 HydrophobicContact CB-CG 4.4Å; D59-R61 PolarHBondContact O-N 3.34Å; D59-R61 PolarHBondContact OD1-N 2.92Å; D59-R61 WeakPolarHBondContact OD2-CD 3.48Å; D59-R61 VanDerWaalsContact OD2-CG 3.31Å; D59-R61 WeakPolarHBondContact OD2-CG 3.26Å; D59-R61 IonicContact OD2-CZ 2.78Å; D59-R61 IonicContact OD2-NE 2.76Å; D59-R61 IonicContact OD2-NH1 3.93Å; D59-H227 HydrophobicContact CB-CB 4.37Å
60	G	82.7	Confident	76.4	Confident	9 Å²	9	41.7 Å²	41.7	9%	0.093	23%	0.228	C	C	.	.	S	Bend	trans	73.6	7.7	-178.6	0	0	0	0	0	115.1	S57	S57-G60 WeakPolarHBondContact O-CA 2.89Å; S57-G60 PolarHBondContact O-N 2.77Å
61	R	82.8	Confident	74.3	Confident	196 Å²	196	42.5 Å²	42.5	74%	0.74	23%	0.227	S	C	*	.	S	Bend	trans	-77.9	-39.8	-178	-67.2	-173.5	-174	163.6	-1.4	113.2	S57 D59	S57-R61 PolarHBondContact OG-N 2.76Å; D59-R61 VanDerWaalsContact C-N 3.26Å; D59-R61 HydrophobicContact CB-CG 4.4Å; D59-R61 PolarHBondContact O-N 3.34Å; D59-R61 PolarHBondContact OD1-N 2.92Å; D59-R61 WeakPolarHBondContact OD2-CD 3.48Å; D59-R61 VanDerWaalsContact OD2-CG 3.31Å; D59-R61 WeakPolarHBondContact OD2-CG 3.26Å; D59-R61 IonicContact OD2-CZ 2.78Å; D59-R61 IonicContact OD2-NE 2.76Å; D59-R61 IonicContact OD2-NH1 3.93Å
62	Y	85.4	Confident	71.9	Confident	86 Å²	86	50.9 Å²	50.9	34%	0.337	26%	0.264	S	S	.	.			trans	-111.3	153	-174.9	-59.4	-64.5	0	0	0	111.3	F56 S57 W85 P106 D107	F56-Y62 WeakPolarHBondContact CA-O 3.04Å; S57-Y62 PolarHBondContact N-O 3.27Å; S57-Y62 PolarHBondContact OG-N 2.89Å; S57-Y62 PolarHBondContact OG-O 2.81Å; Y62-W85 HydrophobicContact CD2-CH2 4.19Å; Y62-W85 HydrophobicContact CG-CH2 4.27Å; Y62-P106 HydrophobicContact CD2-CB 4.32Å; Y62-P106 HydrophobicContact CE2-CB 4.43Å; Y62-D107 PolarHBondContact OH-OD1 3.07Å
63	V	85.5	Confident	70.1	Confident	47 Å²	47	49 Å²	49	29%	0.285	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.2	170.8	175.9	0	0	0	0	107.1	F56 V379 L387 L389	F56-V63 HydrophobicContact CD1-CG2 3.4Å; F56-V63 HydrophobicContact CE1-CG2 3.16Å; F56-V63 HydrophobicContact CG-CG2 4.26Å; F56-V63 HydrophobicContact CZ-CG2 3.86Å; V63-V379 HydrophobicContact CG1-CB 4.28Å; V63-V379 HydrophobicContact CG1-CG1 4.43Å; V63-V379 HydrophobicContact CG1-CG2 3.72Å; V63-L387 HydrophobicContact CG1-CD2 3.76Å; V63-L389 HydrophobicContact CG2-CD2 4.05Å
64	S	83.2	Confident	68.6	Low	3 Å²	3	56 Å²	56	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	122	172.4	60.7	0	0	0	0	109.5	T54 L55 W85	T54-S64 VanDerWaalsContact CA-O 3.25Å; T54-S64 WeakPolarHBondContact CA-O 3.24Å; T54-S64 PolarHBondContact OG1-O 2.72Å; L55-S64 PolarHBondContact N-O 3.19Å; L55-S64 PolarHBondContact O-N 2.81Å; L55-S64 PolarHBondContact O-OG 2.96Å; S64-W85 PolarHBondContact OG-NE1 3.5Å
65	A	77.8	Confident	67.7	Low	16 Å²	16	57.7 Å²	57.7	13%	0.132	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	134.5	164.6	0	0	0	0	0	107.5	V51 L387	V51-A65 HydrophobicContact CG1-CB 4.15Å; A65-L387 HydrophobicContact CB-CD1 3.61Å; A65-L387 HydrophobicContact CB-CD2 3.87Å; A65-L387 HydrophobicContact CB-CG 4.35Å
66	F	66.2	Low	66.9	Low	40 Å²	40	57 Å²	57	18%	0.175	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	127	-176.9	-118.4	-94	0	0	0	112.3	H47 C73 H76 V80 L83 W104	H47-F66 PolarHBondContact CE1-O 3.34Å; H47-F66 PolarHBondContact ND1-O 3.08Å; F66-C73 HydrophobicContact CD1-CB 4.42Å; F66-C73 HydrophobicContact CE1-CB 3.28Å; F66-C73 HydrophobicContact CE2-CB 4.25Å; F66-C73 HydrophobicContact CZ-CB 3.19Å; F66-H76 AromaticContact CE1-CD2 3.83Å; F66-H76 AromaticContact CZ-CD2 3.93Å; F66-V80 HydrophobicContact CB-CB 3.83Å; F66-V80 HydrophobicContact CB-CG1 4.03Å; F66-V80 HydrophobicContact CB-CG2 4.13Å; F66-V80 HydrophobicContact CD1-CB 4.17Å; F66-V80 HydrophobicContact CD1-CG2 3.49Å; F66-V80 VanDerWaalsContact CD1-CG2 3.49Å; F66-V80 HydrophobicContact CD2-CG1 4.23Å; F66-V80 HydrophobicContact CD2-CG2 4.44Å; F66-V80 HydrophobicContact CE1-CG2 3.91Å; F66-V80 HydrophobicContact CG-CB 3.96Å; F66-V80 HydrophobicContact CG-CG1 4.03Å; F66-V80 HydrophobicContact CG-CG2 3.75Å; F66-L83 HydrophobicContact CD2-CD2 3.76Å; F66-L83 HydrophobicContact CE2-CD2 4.34Å; F66-W104 AromaticContact CE2-NE1 3.89Å; F66-W104 AromaticContact CZ-CE2 3.84Å; F66-W104 HydrophobicContact CZ-CH2 4.46Å; F66-W104 AromaticContact CZ-CZ2 3.64Å; F66-W104 HydrophobicContact CZ-CZ2 3.64Å; F66-W104 AromaticContact CZ-NE1 3.85Å
67	G	52.7	Low	66.1	Low	40 Å²	40	64.1 Å²	64.1	41%	0.412	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	117.5	-11.5	-176.8	0	0	0	0	0	113.3	G46 H47	G46-G67 CarbonylContact C-O 3.49Å; G46-G67 VanDerWaalsContact C-O 3.3Å; H47-G67 WeakPolarHBondContact CA-O 3.42Å; H47-G67 PolarHBondContact N-O 3.47Å; H47-G67 WeakPolarHBondContact ND1-CA 3.27Å; H47-G67 PolarHBondContact ND1-N 2.77Å
68	I	42.4	Very low	65.7	Low	18 Å²	18	67.6 Å²	67.6	9%	0.092	35%	0.35	C	S	.	.			trans	-84	131.2	168.7	-93.2	161.8	0	0	0	109.2	L44 H47 I70 L387	L44-I68 HydrophobicContact CB-CD1 3.96Å; H47-I68 WeakPolarHBondContact CD2-CG1 3.41Å; H47-I68 PolarHBondContact CE1-N 2.95Å; H47-I68 PolarHBondContact ND1-N 3.28Å; H47-I68 VanDerWaalsContact ND1-N 3.1Å; H47-I68 WeakPolarHBondContact NE2-CD1 3.28Å; H47-I68 WeakPolarHBondContact NE2-CG1 3.42Å; I68-I70 HydrophobicContact CG2-CB 3.66Å; I68-I70 HydrophobicContact CG2-CD1 3.36Å; I68-I70 HydrophobicContact CG2-CG1 3.26Å; I68-I70 PolarHBondContact O-N 2.78Å; I68-L387 HydrophobicContact CD1-CB 3.5Å; I68-L387 HydrophobicContact CD1-CD2 3.86Å; I68-L387 HydrophobicContact CD1-CG 4.31Å
69	S	29.9	Very low	65.4	Low	94 Å²	94	73 Å²	73	66%	0.657	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	6.2	177.2	-31.4	0	0	0	0	115.8	L71	S69-L71 VanDerWaalsContact C-N 3.28Å
70	I	35.8	Very low	65.6	Low	130 Å²	130	72.1 Å²	72.1	67%	0.667	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-26.2	178.8	-61.3	167.4	0	0	0	110.5	I68	I68-I70 HydrophobicContact CG2-CB 3.66Å; I68-I70 HydrophobicContact CG2-CD1 3.36Å; I68-I70 HydrophobicContact CG2-CG1 3.26Å; I68-I70 PolarHBondContact O-N 2.78Å
71	L	41.6	Very low	65.8	Low	52 Å²	52	73.7 Å²	73.7	27%	0.272	37%	0.372	S	S	.	.	S	Bend	trans	-121.3	112.4	164.4	-61.7	164.2	0	0	0	106	S69 C73	S69-L71 VanDerWaalsContact C-N 3.28Å; L71-C73 WeakPolarHBondContact CB-SG 3.25Å; L71-C73 PolarHBondContact O-N 3.16Å
72	K	36.4	Very low	66.1	Low	177 Å²	177	64.9 Å²	64.9	77%	0.77	34%	0.34	S	S	*	.			trans	-67.3	65.5	174.1	-88.9	-174.5	174.9	175.6	0	110.1	H74	K72-H74 PolarHBondContact O-N 2.9Å
73	C	49	Very low	66.5	Low	18 Å²	18	61.3 Å²	61.3	12%	0.122	33%	0.327	C	S	.	.			trans	-84	62.3	-179	-65.8	0	0	0	0	111.1	F66 L71 S75 W104	F66-C73 HydrophobicContact CD1-CB 4.42Å; F66-C73 HydrophobicContact CE1-CB 3.28Å; F66-C73 HydrophobicContact CE2-CB 4.25Å; F66-C73 HydrophobicContact CZ-CB 3.19Å; L71-C73 WeakPolarHBondContact CB-SG 3.25Å; L71-C73 PolarHBondContact O-N 3.16Å; C73-S75 PolarHBondContact O-N 3.02Å; C73-W104 HydrophobicContact CB-CH2 3.4Å; C73-W104 HydrophobicContact CB-CZ2 3.73Å; C73-W104 HydrophobicContact CB-CZ3 3.96Å; C73-W104 WeakPolarHBondContact SG-CH2 2.94Å; C73-W104 WeakPolarHBondContact SG-CZ3 3.41Å
74	H	56.6	Low	66.9	Low	168 Å²	168	60 Å²	60	78%	0.778	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	29.5	177.4	-68	83.2	0	0	0	113.2	K72	K72-H74 PolarHBondContact O-N 2.9Å
75	S	69.9	Low	67.3	Low	38 Å²	38	61 Å²	61	27%	0.266	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-16.4	-172.9	70.2	0	0	0	0	114.7	C73 I102 W104	C73-S75 PolarHBondContact O-N 3.02Å; S75-I102 WeakPolarHBondContact OG-CD1 3.36Å; S75-W104 WeakPolarHBondContact OG-CH2 3.48Å; S75-W104 VanDerWaalsContact OG-CZ2 3.25Å; S75-W104 WeakPolarHBondContact OG-CZ2 3.46Å
76	H	76	Confident	68	Low	26 Å²	26	60.2 Å²	60.2	12%	0.12	32%	0.317	C	S	.	.			trans	-86.6	131.4	175	-77.6	-63.2	0	0	0	109.8	F66 N78 V80 S94 C96 I102	F66-H76 AromaticContact CE1-CD2 3.83Å; F66-H76 AromaticContact CZ-CD2 3.93Å; H76-N78 VanDerWaalsContact C-N 3.27Å; H76-N78 PolarHBondContact O-N 3.01Å; H76-V80 HydrophobicContact CB-CG2 4.16Å; H76-V80 VanDerWaalsContact CD2-CG2 3.41Å; H76-V80 WeakPolarHBondContact CD2-CG2 3.34Å; H76-S94 PolarHBondContact NE2-OG 3.32Å; H76-C96 WeakPolarHBondContact ND1-CB 3.47Å; H76-I102 VanDerWaalsContact CE1-CD1 3.46Å; H76-I102 WeakPolarHBondContact CE1-CD1 3.42Å; H76-I102 VanDerWaalsContact CE1-CG1 3.42Å; H76-I102 WeakPolarHBondContact CE1-CG1 3.43Å
77	N	75.6	Confident	68.9	Low	152 Å²	152	58.7 Å²	58.7	81%	0.813	31%	0.311	S	S	*	.	S	Bend	trans	-86	1.5	-179.6	-61.4	-18.2	0	0	0	112.8
78	N	81.1	Confident	70.5	Confident	73 Å²	73	57.7 Å²	57.7	39%	0.39	30%	0.296	S	S	.	.	S	Bend	trans	-158.2	-179.9	-176.1	-145.7	-52.1	0	0	0	110.7	H76 V80 C96 K97	H76-N78 VanDerWaalsContact C-N 3.27Å; H76-N78 PolarHBondContact O-N 3.01Å; N78-V80 PolarHBondContact O-N 2.97Å; N78-C96 PolarHBondContact O-SG 2.97Å; N78-K97 HydrophobicContact CB-CB 4.19Å
79	W	81.1	Confident	72.6	Confident	114 Å²	114	57.2 Å²	57.2	43%	0.432	30%	0.296	S	S	.	.			trans	-56.6	134.7	-178.5	-62.8	-4.3	0	0	0	112.3	E49 I52 L81 C96 K97	E49-W79 PolarHBondContact OE1-NE1 3.03Å; E49-W79 PolarHBondContact OE2-NE1 2.78Å; I52-W79 HydrophobicContact CD1-CE3 4.11Å; W79-L81 HydrophobicContact CB-CD2 4.2Å; W79-C96 CarbonylContact O-C 3.59Å; W79-C96 WeakPolarHBondContact O-CA 3.4Å; W79-C96 PolarHBondContact O-SG 2.79Å; W79-K97 HydrophobicContact CB-CB 4.31Å; W79-K97 HydrophobicContact CB-CD 4.46Å; W79-K97 WeakPolarHBondContact O-CB 3.22Å; W79-K97 PolarHBondContact O-N 2.81Å
80	V	85.3	Confident	75.4	Confident	18 Å²	18	58.6 Å²	58.6	11%	0.109	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	120.2	170.5	179	0	0	0	0	108.1	F66 H76 N78 L83 G95	F66-V80 HydrophobicContact CB-CB 3.83Å; F66-V80 HydrophobicContact CB-CG1 4.03Å; F66-V80 HydrophobicContact CB-CG2 4.13Å; F66-V80 HydrophobicContact CD1-CB 4.17Å; F66-V80 HydrophobicContact CD1-CG2 3.49Å; F66-V80 VanDerWaalsContact CD1-CG2 3.49Å; F66-V80 HydrophobicContact CD2-CG1 4.23Å; F66-V80 HydrophobicContact CD2-CG2 4.44Å; F66-V80 HydrophobicContact CE1-CG2 3.91Å; F66-V80 HydrophobicContact CG-CB 3.96Å; F66-V80 HydrophobicContact CG-CG1 4.03Å; F66-V80 HydrophobicContact CG-CG2 3.75Å; H76-V80 HydrophobicContact CB-CG2 4.16Å; H76-V80 VanDerWaalsContact CD2-CG2 3.41Å; H76-V80 WeakPolarHBondContact CD2-CG2 3.34Å; N78-V80 PolarHBondContact O-N 2.97Å; V80-L83 HydrophobicContact CG1-CD2 3.89Å; V80-G95 CarbonylContact C-O 3.59Å; V80-G95 WeakPolarHBondContact CA-O 2.98Å
81	L	87.4	Confident	78.1	Confident	41 Å²	41	53.9 Å²	53.9	22%	0.215	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-31.6	-171.8	-58.6	-179.1	0	0	0	112.4	I52 W79 G95 K97 W122	I52-L81 HydrophobicContact CD1-CD2 4.17Å; W79-L81 HydrophobicContact CB-CD2 4.2Å; L81-G95 PolarHBondContact N-O 3.03Å; L81-K97 HydrophobicContact CD1-CB 4.01Å; L81-K97 HydrophobicContact CD1-CG 4.34Å; L81-K97 HydrophobicContact CD2-CB 4.45Å; L81-K97 HydrophobicContact CG-CB 4.2Å; L81-W122 HydrophobicContact CD1-CB 3.72Å; L81-W122 HydrophobicContact CD1-CG 4.1Å
82	C	89.8	Confident	80.5	Confident	12 Å²	12	51.5 Å²	51.5	8%	0.081	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	149.2	-178.3	60.9	0	0	0	0	111.9	S94 G95	C82-S94 WeakPolarHBondContact O-CA 3.49Å; C82-G95 PolarHBondContact O-N 2.99Å
83	L	92.7	Very high	83.3	Confident	11 Å²	11	43 Å²	43	6%	0.058	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	149.8	175.8	-62.7	173.6	0	0	0	108.7	L55 F66 V80 L92 A93	L55-L83 HydrophobicContact CD1-CB 4.18Å; L55-L83 VanDerWaalsContact CD1-O 3.23Å; L55-L83 WeakPolarHBondContact CD1-O 3.41Å; F66-L83 HydrophobicContact CD2-CD2 3.76Å; F66-L83 HydrophobicContact CE2-CD2 4.34Å; V80-L83 HydrophobicContact CG1-CD2 3.89Å; L83-L92 HydrophobicContact CB-CD1 4.36Å; L83-A93 CarbonylContact C-O 3.6Å; L83-A93 WeakPolarHBondContact CA-O 3.35Å
84	S	93.7	Very high	85.4	Confident	18 Å²	18	42.2 Å²	42.2	13%	0.126	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	118	176.5	-163.6	0	0	0	0	110.2	A93 I126 W128	S84-A93 PolarHBondContact N-O 3.14Å; S84-A93 PolarHBondContact O-N 3.32Å; S84-I126 WeakPolarHBondContact CB-O 3.42Å; S84-I126 PolarHBondContact OG-O 3.23Å; S84-W128 PolarHBondContact O-NE1 3.33Å
85	W	93.3	Very high	87.1	Confident	25 Å²	25	34.2 Å²	34.2	10%	0.095	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	140.7	173.7	-73.5	90.7	0	0	0	110.6	L55 P58 Y62 S64 L92 P106 W128	L55-W85 PolarHBondContact O-NE1 2.9Å; P58-W85 HydrophobicContact CG-CB 4.16Å; Y62-W85 HydrophobicContact CD2-CH2 4.19Å; Y62-W85 HydrophobicContact CG-CH2 4.27Å; S64-W85 PolarHBondContact OG-NE1 3.5Å; W85-L92 HydrophobicContact CD2-CB 4.35Å; W85-L92 HydrophobicContact CD2-CD1 3.96Å; W85-L92 HydrophobicContact CE3-CB 4.23Å; W85-L92 HydrophobicContact CG-CD1 4.02Å; W85-L92 HydrophobicContact CZ2-CD1 4.43Å; W85-L92 HydrophobicContact CZ2-CD2 4.32Å; W85-L92 HydrophobicContact CZ3-CB 4.34Å; W85-P106 HydrophobicContact CH2-CB 3.51Å; W85-P106 HydrophobicContact CH2-CG 4.38Å; W85-P106 HydrophobicContact CZ3-CB 3.45Å; W85-P106 VanDerWaalsContact CZ3-CB 3.45Å; W85-P106 HydrophobicContact CZ3-CG 3.82Å; W85-W128 VanDerWaalsContact C-CD1 3.43Å
86	S	92.4	Very high	88.1	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.			trans	-64.8	146.4	163.7	57.6	0	0	0	0	109.5	P58 D88 G89 Q90 K91	P58-S86 WeakPolarHBondContact CG-O 3.21Å; S86-D88 VanDerWaalsContact CB-OD1 3.26Å; S86-D88 WeakPolarHBondContact CB-OD1 3.36Å; S86-D88 PolarHBondContact O-N 2.78Å; S86-D88 PolarHBondContact OG-OD1 3.1Å; S86-G89 WeakPolarHBondContact O-CA 3.4Å; S86-G89 PolarHBondContact O-N 3.35Å; S86-Q90 PolarHBondContact OG-N 3.25Å; S86-K91 PolarHBondContact N-O 3.31Å; S86-K91 WeakPolarHBondContact OG-CA 3.35Å; S86-K91 WeakPolarHBondContact OG-CB 3.33Å; S86-K91 PolarHBondContact OG-N 2.88Å; S86-K91 PolarHBondContact OG-O 3.34Å
87	A	85.3	Confident	88.6	Confident	7 Å²	7	34.7 Å²	34.7	6%	0.058	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.5	-175.2	0	0	0	0	0	113.5	G89 L131 L222	A87-G89 VanDerWaalsContact C-N 3.25Å; A87-G89 PolarHBondContact O-N 3.48Å; A87-L131 HydrophobicContact CB-CB 4.15Å; A87-L222 WeakPolarHBondContact CB-O 3.19Å
88	D	85.8	Confident	89.2	Confident	19 Å²	19	30.1 Å²	30.1	10%	0.102	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-9.2	170.5	61.8	20.4	0	0	0	113.7	S86 Q90 K91 L131 S137 H227	S86-D88 VanDerWaalsContact CB-OD1 3.26Å; S86-D88 WeakPolarHBondContact CB-OD1 3.36Å; S86-D88 PolarHBondContact O-N 2.78Å; S86-D88 PolarHBondContact OG-OD1 3.1Å; D88-Q90 HydrophobicContact CB-CG 4.36Å; D88-Q90 PolarHBondContact O-N 2.91Å; D88-Q90 WeakPolarHBondContact OD1-CB 3.34Å; D88-Q90 PolarHBondContact OD1-N 2.61Å; D88-K91 IonicContact OD2-NZ 3.24Å; D88-L131 HydrophobicContact CB-CD1 4.02Å; D88-S137 WeakPolarHBondContact OD2-CB 3.3Å; D88-S137 PolarHBondContact OD2-OG 2.76Å; D88-H227 PolarHBondContact O-CE1 3.25Å
89	G	87	Confident	89.6	Confident	9 Å²	9	26.7 Å²	26.7	9%	0.093	13%	0.134	C	C	.	.	S	Bend	trans	71.9	2.8	-178.1	0	0	0	0	0	115.3	S86 A87 P106	S86-G89 WeakPolarHBondContact O-CA 3.4Å; S86-G89 PolarHBondContact O-N 3.35Å; A87-G89 VanDerWaalsContact C-N 3.25Å; A87-G89 PolarHBondContact O-N 3.48Å; G89-P106 WeakPolarHBondContact O-CG 3.25Å
90	Q	88.3	Confident	90.2	Very high	123 Å²	123	22 Å²	22	58%	0.575	12%	0.118	S	C	*	.	S	Bend	trans	-88.4	-12.3	-174.9	-62.7	-172.2	-11	0	0	114	S86 D88 P106	S86-Q90 PolarHBondContact OG-N 3.25Å; D88-Q90 HydrophobicContact CB-CG 4.36Å; D88-Q90 PolarHBondContact O-N 2.91Å; D88-Q90 WeakPolarHBondContact OD1-CB 3.34Å; D88-Q90 PolarHBondContact OD1-N 2.61Å; Q90-P106 WeakPolarHBondContact O-CD 3.31Å
91	K	91.8	Very high	90.6	Very high	30 Å²	30	21.1 Å²	21.1	13%	0.13	11%	0.113	C	C	.	.			trans	-137.3	142.9	-177.4	-51.9	-175	-173.1	76.1	0	110.4	S86 D88 V103 W104 I112 W128 H136	S86-K91 PolarHBondContact N-O 3.31Å; S86-K91 WeakPolarHBondContact OG-CA 3.35Å; S86-K91 WeakPolarHBondContact OG-CB 3.33Å; S86-K91 PolarHBondContact OG-N 2.88Å; S86-K91 PolarHBondContact OG-O 3.34Å; D88-K91 IonicContact OD2-NZ 3.24Å; K91-V103 HydrophobicContact CB-CG1 3.9Å; K91-V103 HydrophobicContact CD-CG1 4.25Å; K91-V103 HydrophobicContact CG-CG1 4.43Å; K91-W104 WeakPolarHBondContact CA-O 3.45Å; K91-I112 HydrophobicContact CB-CD1 4.44Å; K91-I112 HydrophobicContact CD-CD1 4.35Å; K91-I112 HydrophobicContact CG-CD1 3.9Å; K91-W128 HydrophobicContact CB-CH2 3.81Å; K91-W128 HydrophobicContact CB-CZ2 3.96Å; K91-W128 HydrophobicContact CD-CH2 3.92Å; K91-W128 HydrophobicContact CD-CZ3 4.24Å; K91-H136 PolarHBondContact NZ-O 3.09Å
92	L	93.1	Very high	90.8	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.01	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.1	170.2	172.2	65.9	0	0	0	108.8	L83 W85 V103 W104	L83-L92 HydrophobicContact CB-CD1 4.36Å; W85-L92 HydrophobicContact CD2-CB 4.35Å; W85-L92 HydrophobicContact CD2-CD1 3.96Å; W85-L92 HydrophobicContact CE3-CB 4.23Å; W85-L92 HydrophobicContact CG-CD1 4.02Å; W85-L92 HydrophobicContact CZ2-CD1 4.43Å; W85-L92 HydrophobicContact CZ2-CD2 4.32Å; W85-L92 HydrophobicContact CZ3-CB 4.34Å; L92-V103 CarbonylContact O-C 3.57Å; L92-V103 VanDerWaalsContact O-CA 3.31Å; L92-V103 WeakPolarHBondContact O-CA 3.18Å; L92-W104 HydrophobicContact CB-CB 4.31Å; L92-W104 PolarHBondContact N-O 2.9Å; L92-W104 VanDerWaalsContact O-CD1 3.25Å; L92-W104 PolarHBondContact O-N 2.86Å
93	A	94	Very high	91	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	143.1	170.4	0	0	0	0	0	110.6	L83 S84 I101 I102 V103 I126 W128 L140	L83-A93 CarbonylContact C-O 3.6Å; L83-A93 WeakPolarHBondContact CA-O 3.35Å; S84-A93 PolarHBondContact N-O 3.14Å; S84-A93 PolarHBondContact O-N 3.32Å; A93-I101 HydrophobicContact CB-CG2 4.45Å; A93-I102 WeakPolarHBondContact CA-O 3.42Å; A93-V103 HydrophobicContact CB-CG2 4.42Å; A93-I126 HydrophobicContact CB-CD1 4.27Å; A93-I126 HydrophobicContact CB-CG2 3.92Å; A93-W128 HydrophobicContact CB-CZ2 3.64Å; A93-L140 HydrophobicContact CB-CD2 4.07Å
94	S	93	Very high	91	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	128	178.5	57.8	0	0	0	0	110.3	H76 C82 I101 I102 W104	H76-S94 PolarHBondContact NE2-OG 3.32Å; C82-S94 WeakPolarHBondContact O-CA 3.49Å; S94-I101 VanDerWaalsContact O-CA 3.29Å; S94-I101 WeakPolarHBondContact O-CA 3.15Å; S94-I102 PolarHBondContact N-O 2.9Å; S94-I102 PolarHBondContact O-N 3.47Å; S94-I102 PolarHBondContact OG-O 3.02Å; S94-W104 PolarHBondContact OG-NE1 2.77Å
95	G	92.4	Very high	90.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	129.5	-179.2	0	0	0	0	0	111.6	V80 L81 C82	V80-G95 CarbonylContact C-O 3.59Å; V80-G95 WeakPolarHBondContact CA-O 2.98Å; L81-G95 PolarHBondContact N-O 3.03Å; C82-G95 PolarHBondContact O-N 2.99Å
96	C	90.4	Very high	90.5	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	155.6	-176.5	-168.1	0	0	0	0	112.5	H76 N78 W79 S98 G99 S100 V123	H76-C96 WeakPolarHBondContact ND1-CB 3.47Å; N78-C96 PolarHBondContact O-SG 2.97Å; W79-C96 CarbonylContact O-C 3.59Å; W79-C96 WeakPolarHBondContact O-CA 3.4Å; W79-C96 PolarHBondContact O-SG 2.79Å; C96-S98 WeakPolarHBondContact CB-OG 3.33Å; C96-S98 PolarHBondContact O-N 2.95Å; C96-S98 PolarHBondContact SG-OG 2.94Å; C96-G99 PolarHBondContact O-N 2.73Å; C96-S100 VanDerWaalsContact CB-O 3.25Å; C96-S100 WeakPolarHBondContact CB-O 3.46Å; C96-S100 WeakPolarHBondContact CB-OG 3.4Å; C96-S100 PolarHBondContact N-O 3.05Å; C96-V123 PolarHBondContact O-N 2.92Å; C96-V123 VanDerWaalsContact O-N 3.11Å
97	K	87.5	Confident	90.2	Very high	75 Å²	75	25.2 Å²	25.2	33%	0.326	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-23.7	170.4	-170.3	175.4	177.7	-177	0	113.2	N78 W79 L81 G99 W122	N78-K97 HydrophobicContact CB-CB 4.19Å; W79-K97 HydrophobicContact CB-CB 4.31Å; W79-K97 HydrophobicContact CB-CD 4.46Å; W79-K97 WeakPolarHBondContact O-CB 3.22Å; W79-K97 PolarHBondContact O-N 2.81Å; L81-K97 HydrophobicContact CD1-CB 4.01Å; L81-K97 HydrophobicContact CD1-CG 4.34Å; L81-K97 HydrophobicContact CD2-CB 4.45Å; L81-K97 HydrophobicContact CG-CB 4.2Å; K97-G99 PolarHBondContact O-N 3.47Å; K97-W122 HydrophobicContact CB-CB 4.33Å; K97-W122 HydrophobicContact CG-CB 4.05Å; K97-W122 HydrophobicContact CG-CE3 3.98Å; K97-W122 VanDerWaalsContact O-CA 3.26Å; K97-W122 WeakPolarHBondContact O-CA 3.33Å; K97-W122 VanDerWaalsContact O-CB 3.24Å; K97-W122 WeakPolarHBondContact O-CB 3.48Å; K97-W122 PolarHBondContact O-N 2.87Å
98	S	87.8	Confident	90.3	Very high	55 Å²	55	27.9 Å²	27.9	39%	0.385	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-11.2	173.6	60.4	0	0	0	0	114	C96 S100	C96-S98 WeakPolarHBondContact CB-OG 3.33Å; C96-S98 PolarHBondContact O-N 2.95Å; C96-S98 PolarHBondContact SG-OG 2.94Å; S98-S100 PolarHBondContact OG-N 2.89Å; S98-S100 PolarHBondContact OG-OG 3.19Å
99	G	90.4	Very high	90.2	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.01	16%	0.155	C	C	.	.	S	Bend	trans	91.6	-3.4	-171.3	0	0	0	0	0	114.4	C96 K97 S121	C96-G99 PolarHBondContact O-N 2.73Å; K97-G99 PolarHBondContact O-N 3.47Å; G99-S121 WeakPolarHBondContact CA-O 3.34Å
100	S	92.6	Very high	90.2	Very high	15 Å²	15	33.9 Å²	33.9	11%	0.105	18%	0.182	C	C	.	.			trans	-79.7	139.7	175.4	56.9	0	0	0	0	112.3	C96 S98	C96-S100 VanDerWaalsContact CB-O 3.25Å; C96-S100 WeakPolarHBondContact CB-O 3.46Å; C96-S100 WeakPolarHBondContact CB-OG 3.4Å; C96-S100 PolarHBondContact N-O 3.05Å; S98-S100 PolarHBondContact OG-N 2.89Å; S98-S100 PolarHBondContact OG-OG 3.19Å
101	I	93.3	Very high	90.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.4	169.5	-54.6	163.9	0	0	0	108.4	A93 S94 L116 V123 I126 S142 W152	A93-I101 HydrophobicContact CB-CG2 4.45Å; S94-I101 VanDerWaalsContact O-CA 3.29Å; S94-I101 WeakPolarHBondContact O-CA 3.15Å; I101-L116 HydrophobicContact CB-CB 4.04Å; I101-L116 HydrophobicContact CB-CD1 4.28Å; I101-L116 HydrophobicContact CG2-CD1 4.18Å; I101-L116 PolarHBondContact N-O 3.49Å; I101-L116 PolarHBondContact O-N 2.84Å; I101-V123 HydrophobicContact CD1-CG1 4.2Å; I101-V123 HydrophobicContact CD1-CG2 4.2Å; I101-V123 HydrophobicContact CG1-CG1 4.2Å; I101-V123 HydrophobicContact CG1-CG2 3.74Å; I101-I126 HydrophobicContact CD1-CD1 4.48Å; I101-I126 HydrophobicContact CG1-CD1 4.26Å; I101-I126 HydrophobicContact CG2-CD1 3.82Å; I101-S142 VanDerWaalsContact CD1-OG 3.24Å; I101-S142 WeakPolarHBondContact CD1-OG 3.46Å; I101-W152 HydrophobicContact CD1-CZ2 4.29Å
102	I	92.9	Very high	90.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.6	177.6	-57.8	-179.9	0	0	0	108.2	S75 H76 A93 S94 W104 R111 V115	S75-I102 WeakPolarHBondContact OG-CD1 3.36Å; H76-I102 VanDerWaalsContact CE1-CD1 3.46Å; H76-I102 WeakPolarHBondContact CE1-CD1 3.42Å; H76-I102 VanDerWaalsContact CE1-CG1 3.42Å; H76-I102 WeakPolarHBondContact CE1-CG1 3.43Å; A93-I102 WeakPolarHBondContact CA-O 3.42Å; S94-I102 PolarHBondContact N-O 2.9Å; S94-I102 PolarHBondContact O-N 3.47Å; S94-I102 PolarHBondContact OG-O 3.02Å; I102-W104 HydrophobicContact CB-CZ2 3.98Å; I102-W104 HydrophobicContact CD1-CZ2 4.31Å; I102-W104 HydrophobicContact CG2-CD2 3.99Å; I102-W104 VanDerWaalsContact CG2-CE2 3.44Å; I102-W104 HydrophobicContact CG2-CE3 4.46Å; I102-W104 HydrophobicContact CG2-CH2 4.07Å; I102-W104 HydrophobicContact CG2-CZ2 3.48Å; I102-W104 VanDerWaalsContact CG2-CZ2 3.48Å; I102-W104 HydrophobicContact CG2-CZ3 4.5Å; I102-W104 PolarHBondContact O-NE1 3.2Å; I102-R111 HydrophobicContact CG2-CB 4.27Å; I102-R111 HydrophobicContact CG2-CG 3.8Å; I102-V115 HydrophobicContact CD1-CG1 4.41Å; I102-V115 HydrophobicContact CD1-CG2 4.14Å; I102-V115 HydrophobicContact CG1-CB 4.47Å; I102-V115 HydrophobicContact CG1-CG1 3.93Å; I102-V115 HydrophobicContact CG1-CG2 4.09Å
103	V	93.6	Very high	90	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.012	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	137.4	174.2	-174.3	0	0	0	0	108.6	K91 L92 A93 R111 I112 L116 W128 L140 V154	K91-V103 HydrophobicContact CB-CG1 3.9Å; K91-V103 HydrophobicContact CD-CG1 4.25Å; K91-V103 HydrophobicContact CG-CG1 4.43Å; L92-V103 CarbonylContact O-C 3.57Å; L92-V103 VanDerWaalsContact O-CA 3.31Å; L92-V103 WeakPolarHBondContact O-CA 3.18Å; A93-V103 HydrophobicContact CB-CG2 4.42Å; V103-R111 CarbonylContact O-C 3.11Å; V103-R111 WeakPolarHBondContact O-CA 3.46Å; V103-I112 HydrophobicContact CB-CB 4.39Å; V103-I112 HydrophobicContact CG1-CB 4.19Å; V103-I112 HydrophobicContact CG1-CD1 4.25Å; V103-I112 PolarHBondContact O-N 2.88Å; V103-L116 HydrophobicContact CG2-CD1 4.44Å; V103-W128 HydrophobicContact CG1-CH2 3.93Å; V103-W128 HydrophobicContact CG1-CZ2 4.28Å; V103-W128 HydrophobicContact CG2-CH2 4.32Å; V103-L140 HydrophobicContact CG2-CD2 4Å; V103-V154 HydrophobicContact CB-CG1 4.13Å; V103-V154 HydrophobicContact CG1-CG1 4Å; V103-V154 HydrophobicContact CG2-CG1 3.89Å; V103-V154 HydrophobicContact CG2-CG2 4.15Å
104	W	91.7	Very high	89.9	Confident	9 Å²	9	44.1 Å²	44.1	3%	0.034	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	144.9	-172.7	-54.3	96.1	0	0	0	110.6	F66 C73 S75 K91 L92 S94 I102 E110 R111	F66-W104 AromaticContact CE2-NE1 3.89Å; F66-W104 AromaticContact CZ-CE2 3.84Å; F66-W104 HydrophobicContact CZ-CH2 4.46Å; F66-W104 AromaticContact CZ-CZ2 3.64Å; F66-W104 HydrophobicContact CZ-CZ2 3.64Å; F66-W104 AromaticContact CZ-NE1 3.85Å; C73-W104 HydrophobicContact CB-CH2 3.4Å; C73-W104 HydrophobicContact CB-CZ2 3.73Å; C73-W104 HydrophobicContact CB-CZ3 3.96Å; C73-W104 WeakPolarHBondContact SG-CH2 2.94Å; C73-W104 WeakPolarHBondContact SG-CZ3 3.41Å; S75-W104 WeakPolarHBondContact OG-CH2 3.48Å; S75-W104 VanDerWaalsContact OG-CZ2 3.25Å; S75-W104 WeakPolarHBondContact OG-CZ2 3.46Å; K91-W104 WeakPolarHBondContact CA-O 3.45Å; L92-W104 HydrophobicContact CB-CB 4.31Å; L92-W104 PolarHBondContact N-O 2.9Å; L92-W104 VanDerWaalsContact O-CD1 3.25Å; L92-W104 PolarHBondContact O-N 2.86Å; S94-W104 PolarHBondContact OG-NE1 2.77Å; I102-W104 HydrophobicContact CB-CZ2 3.98Å; I102-W104 HydrophobicContact CD1-CZ2 4.31Å; I102-W104 HydrophobicContact CG2-CD2 3.99Å; I102-W104 VanDerWaalsContact CG2-CE2 3.44Å; I102-W104 HydrophobicContact CG2-CE3 4.46Å; I102-W104 HydrophobicContact CG2-CH2 4.07Å; I102-W104 HydrophobicContact CG2-CZ2 3.48Å; I102-W104 VanDerWaalsContact CG2-CZ2 3.48Å; I102-W104 HydrophobicContact CG2-CZ3 4.5Å; I102-W104 PolarHBondContact O-NE1 3.2Å; W104-E110 WeakPolarHBondContact CA-O 3.46Å; W104-R111 HydrophobicContact CE3-CB 4.37Å; W104-R111 HydrophobicContact CZ3-CB 4.32Å
105	N	90.3	Very high	89.8	Confident	52 Å²	52	46.3 Å²	46.3	28%	0.278	25%	0.249	S	C	.	.			trans	-83.4	118.6	163.4	-177.1	-34.3	0	0	0	107.4	D107 S108 G109 E110 I112	N105-D107 VanDerWaalsContact C-N 3.31Å; N105-D107 PolarHBondContact O-N 3.3Å; N105-D107 PolarHBondContact OD1-N 2.83Å; N105-S108 WeakPolarHBondContact CB-OG 3.5Å; N105-S108 PolarHBondContact OD1-N 2.91Å; N105-G109 WeakPolarHBondContact O-CA 3.35Å; N105-G109 PolarHBondContact O-N 3.46Å; N105-E110 PolarHBondContact N-O 3.09Å; N105-I112 HydrophobicContact CB-CD1 3.91Å; N105-I112 HydrophobicContact CB-CG1 3.89Å
106	P	86.8	Confident	89.9	Confident	13 Å²	13	46.4 Å²	46.4	8%	0.084	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-28.4	-177.1	29.9	-36.2	0	0	0	113.6	Y62 W85 G89 Q90	Y62-P106 HydrophobicContact CD2-CB 4.32Å; Y62-P106 HydrophobicContact CE2-CB 4.43Å; W85-P106 HydrophobicContact CH2-CB 3.51Å; W85-P106 HydrophobicContact CH2-CG 4.38Å; W85-P106 HydrophobicContact CZ3-CB 3.45Å; W85-P106 VanDerWaalsContact CZ3-CB 3.45Å; W85-P106 HydrophobicContact CZ3-CG 3.82Å; G89-P106 WeakPolarHBondContact O-CG 3.25Å; Q90-P106 WeakPolarHBondContact O-CD 3.31Å
107	D	86.1	Confident	89.9	Confident	116 Å²	116	50.5 Å²	50.5	62%	0.62	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-42.2	-176.9	-62	-42.9	0	0	0	111.7	Y62 N105	Y62-D107 PolarHBondContact OH-OD1 3.07Å; N105-D107 VanDerWaalsContact C-N 3.31Å; N105-D107 PolarHBondContact O-N 3.3Å; N105-D107 PolarHBondContact OD1-N 2.83Å
108	S	86.8	Confident	90	Very high	63 Å²	63	49 Å²	49	44%	0.441	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-22.3	178.6	69.3	0	0	0	0	113.8	N105 E110	N105-S108 WeakPolarHBondContact CB-OG 3.5Å; N105-S108 PolarHBondContact OD1-N 2.91Å; S108-E110 PolarHBondContact O-N 2.91Å; S108-E110 WeakPolarHBondContact OG-CB 3.43Å; S108-E110 PolarHBondContact OG-N 2.59Å
109	G	83.9	Confident	90.3	Very high	15 Å²	15	47 Å²	47	16%	0.155	26%	0.262	C	S	.	.			trans	70.7	9.5	-170.7	0	0	0	0	0	115.4	N105	N105-G109 WeakPolarHBondContact O-CA 3.35Å; N105-G109 PolarHBondContact O-N 3.46Å
110	E	86.9	Confident	90.4	Very high	139 Å²	139	57.5 Å²	57.5	65%	0.65	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-85.7	154.8	178.4	-62.1	-174.3	153.7	0	0	112	W104 N105 S108	W104-E110 WeakPolarHBondContact CA-O 3.46Å; N105-E110 PolarHBondContact N-O 3.09Å; S108-E110 PolarHBondContact O-N 2.91Å; S108-E110 WeakPolarHBondContact OG-CB 3.43Å; S108-E110 PolarHBondContact OG-N 2.59Å
111	R	90	Very high	90.4	Very high	132 Å²	132	58.5 Å²	58.5	50%	0.498	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	131.4	173.1	171.3	177.8	69.8	-157.6	-3.1	110.4	I102 V103 W104 G113	I102-R111 HydrophobicContact CG2-CB 4.27Å; I102-R111 HydrophobicContact CG2-CG 3.8Å; V103-R111 CarbonylContact O-C 3.11Å; V103-R111 WeakPolarHBondContact O-CA 3.46Å; W104-R111 HydrophobicContact CE3-CB 4.37Å; W104-R111 HydrophobicContact CZ3-CB 4.32Å; R111-G113 PolarHBondContact NE-O 3.49Å
112	I	90.8	Very high	90.3	Very high	48 Å²	48	62.1 Å²	62.1	25%	0.246	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	121.1	168	-59.6	174	0	0	0	108.9	K91 V103 N105	K91-I112 HydrophobicContact CB-CD1 4.44Å; K91-I112 HydrophobicContact CD-CD1 4.35Å; K91-I112 HydrophobicContact CG-CD1 3.9Å; V103-I112 HydrophobicContact CB-CB 4.39Å; V103-I112 HydrophobicContact CG1-CB 4.19Å; V103-I112 HydrophobicContact CG1-CD1 4.25Å; V103-I112 PolarHBondContact O-N 2.88Å; N105-I112 HydrophobicContact CB-CD1 3.91Å; N105-I112 HydrophobicContact CB-CG1 3.89Å
113	G	88.8	Confident	90.4	Very high	47 Å²	47	62.1 Å²	62.1	49%	0.485	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	67.8	-156.2	172.1	0	0	0	0	0	114.8	R111	R111-G113 PolarHBondContact NE-O 3.49Å
114	K	91.1	Very high	90.5	Very high	144 Å²	144	64 Å²	64	63%	0.626	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	154.5	-179.4	-65.4	178.8	-178.8	174.5	0	110.9	L116	K114-L116 PolarHBondContact O-N 2.8Å
115	V	92.1	Very high	90.7	Very high	45 Å²	45	64.2 Å²	64.2	27%	0.273	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	128.8	168.5	-178.4	0	0	0	0	108.7	I102 S117	I102-V115 HydrophobicContact CD1-CG1 4.41Å; I102-V115 HydrophobicContact CD1-CG2 4.14Å; I102-V115 HydrophobicContact CG1-CB 4.47Å; I102-V115 HydrophobicContact CG1-CG1 3.93Å; I102-V115 HydrophobicContact CG1-CG2 4.09Å; V115-S117 PolarHBondContact O-N 2.9Å
116	L	93.4	Very high	91	Very high	2 Å²	2	62.2 Å²	62.2	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	102	179.1	-53.3	176.3	0	0	0	108.3	I101 V103 K114 L140 W152	I101-L116 HydrophobicContact CB-CB 4.04Å; I101-L116 HydrophobicContact CB-CD1 4.28Å; I101-L116 HydrophobicContact CG2-CD1 4.18Å; I101-L116 PolarHBondContact N-O 3.49Å; I101-L116 PolarHBondContact O-N 2.84Å; V103-L116 HydrophobicContact CG2-CD1 4.44Å; K114-L116 PolarHBondContact O-N 2.8Å; L116-L140 HydrophobicContact CD1-CD2 4.35Å; L116-W152 HydrophobicContact CB-CD2 4.07Å; L116-W152 HydrophobicContact CB-CE3 3.7Å; L116-W152 HydrophobicContact CB-CH2 4.08Å; L116-W152 HydrophobicContact CB-CZ2 4.49Å; L116-W152 HydrophobicContact CB-CZ3 3.71Å; L116-W152 HydrophobicContact CD1-CB 3.9Å; L116-W152 HydrophobicContact CD1-CD2 4.04Å; L116-W152 HydrophobicContact CD1-CE3 4.21Å; L116-W152 HydrophobicContact CD1-CG 3.93Å; L116-W152 HydrophobicContact CD2-CE3 3.88Å; L116-W152 HydrophobicContact CD2-CZ3 4.42Å; L116-W152 HydrophobicContact CG-CD2 4.44Å; L116-W152 HydrophobicContact CG-CE3 4.14Å
117	S	90.1	Very high	91.4	Very high	87 Å²	87	62.4 Å²	62.4	61%	0.608	33%	0.325	S	S	*	.			trans	-131.1	46.9	-164	65.3	0	0	0	0	114.7	V115	V115-S117 PolarHBondContact O-N 2.9Å
118	S	90.6	Very high	91.9	Very high	44 Å²	44	57.6 Å²	57.6	31%	0.308	30%	0.298	S	S	.	.			trans	-105.5	-7.7	178	77	0	0	0	0	115	R150 W152	S118-R150 WeakPolarHBondContact OG-CD 3.19Å; S118-R150 PolarHBondContact OG-NE 3.49Å; S118-R150 VanDerWaalsContact OG-NE 3.11Å; S118-W152 WeakPolarHBondContact OG-CH2 3.38Å; S118-W152 WeakPolarHBondContact OG-CZ3 3.19Å
119	H	93.6	Very high	92.2	Very high	12 Å²	12	55.6 Å²	55.6	6%	0.056	28%	0.282	C	S	.	.			trans	-69.9	141	167.9	-80.4	-70.6	0	0	0	111.2	S142 S144 D146 R150 W152	H119-S142 PolarHBondContact CD2-OG 3.46Å; H119-S142 PolarHBondContact NE2-OG 3.13Å; H119-S144 WeakPolarHBondContact CE1-CB 3.47Å; H119-S144 WeakPolarHBondContact ND1-CB 3.18Å; H119-S144 PolarHBondContact ND1-OG 2.77Å; H119-D146 VanDerWaalsContact CA-OD2 3.3Å; H119-D146 WeakPolarHBondContact CA-OD2 3.47Å; H119-D146 IonicContact CE1-OD1 3.19Å; H119-D146 IonicContact CG-OD2 3.86Å; H119-D146 IonicContact ND1-OD1 3.48Å; H119-D146 PolarHBondContact ND1-OD1 2.79Å; H119-D146 IonicContact ND1-OD2 3.82Å; H119-D146 PolarHBondContact ND1-OD2 2.91Å; H119-R150 PolarHBondContact CE1-NH1 3.2Å; H119-R150 VanDerWaalsContact CE1-NH1 3.27Å; H119-R150 PolarHBondContact ND1-NH1 3.22Å; H119-W152 AromaticContact CD2-CZ2 3.75Å
120	R	92.5	Very high	92.6	Very high	222 Å²	222	55 Å²	55	84%	0.838	28%	0.276	S	S	*	.	S	Bend	trans	-89.1	-10.9	-179.7	-59	-178.2	-175.4	-135.8	1.8	113.2	D146	R120-D146 HydrophobicContact CB-CB 4.05Å; R120-D146 PolarHBondContact N-OD2 2.9Å
121	S	93.2	Very high	92.7	Very high	35 Å²	35	49.4 Å²	49.4	25%	0.245	25%	0.25	C	S	.	.	S	Bend	trans	-147.9	-179.1	-177.7	-157.9	0	0	0	0	110.6	G99 S144	G99-S121 WeakPolarHBondContact CA-O 3.34Å; S121-S144 PolarHBondContact O-OG 2.84Å
122	W	91.2	Very high	92.4	Very high	77 Å²	77	46.3 Å²	46.3	29%	0.292	24%	0.241	S	C	.	.			trans	-55.9	146.1	-173.3	59.4	58	0	0	0	113.6	L81 K97 N124 S144 K145	L81-W122 HydrophobicContact CD1-CB 3.72Å; L81-W122 HydrophobicContact CD1-CG 4.1Å; K97-W122 HydrophobicContact CB-CB 4.33Å; K97-W122 HydrophobicContact CG-CB 4.05Å; K97-W122 HydrophobicContact CG-CE3 3.98Å; K97-W122 VanDerWaalsContact O-CA 3.26Å; K97-W122 WeakPolarHBondContact O-CA 3.33Å; K97-W122 VanDerWaalsContact O-CB 3.24Å; K97-W122 WeakPolarHBondContact O-CB 3.48Å; K97-W122 PolarHBondContact O-N 2.87Å; W122-N124 PolarHBondContact NE1-OD1 2.82Å; W122-S144 VanDerWaalsContact O-CA 3.25Å; W122-S144 WeakPolarHBondContact O-CA 3.45Å; W122-S144 VanDerWaalsContact O-CB 3.28Å; W122-S144 WeakPolarHBondContact O-CB 3.27Å; W122-S144 PolarHBondContact O-OG 3Å; W122-K145 HydrophobicContact CD2-CB 4.29Å; W122-K145 HydrophobicContact CD2-CD 3.7Å; W122-K145 HydrophobicContact CE3-CD 4.26Å; W122-K145 HydrophobicContact CG-CB 4.02Å; W122-K145 HydrophobicContact CG-CD 4.31Å; W122-K145 HydrophobicContact CH2-CD 3.88Å; W122-K145 HydrophobicContact CZ2-CD 3.22Å; W122-K145 HydrophobicContact CZ3-CD 4.34Å; W122-K145 VanDerWaalsContact NE1-CB 3.28Å; W122-K145 PolarHBondContact O-N 2.77Å; W122-K145 VanDerWaalsContact O-N 3.08Å
123	V	95.1	Very high	92.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	121.2	175.8	-174.3	0	0	0	0	108.9	C96 I101 I126 S143	C96-V123 PolarHBondContact O-N 2.92Å; C96-V123 VanDerWaalsContact O-N 3.11Å; I101-V123 HydrophobicContact CD1-CG1 4.2Å; I101-V123 HydrophobicContact CD1-CG2 4.2Å; I101-V123 HydrophobicContact CG1-CG1 4.2Å; I101-V123 HydrophobicContact CG1-CG2 3.74Å; V123-I126 HydrophobicContact CG1-CD1 4.22Å; V123-I126 HydrophobicContact CG1-CG1 3.87Å; V123-S143 CarbonylContact C-O 3.58Å
124	N	94.5	Very high	92	Very high	41 Å²	41	45.7 Å²	45.7	22%	0.219	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-41.9	-178.5	-68.3	-40.5	0	0	0	111.9	W122 S143 K145 S169 V170 T171	W122-N124 PolarHBondContact NE1-OD1 2.82Å; N124-S143 PolarHBondContact N-O 3.14Å; N124-K145 PolarHBondContact ND2-N 2.78Å; N124-S169 PolarHBondContact ND2-OG 2.91Å; N124-V170 WeakPolarHBondContact CB-O 3.32Å; N124-V170 PolarHBondContact ND2-O 3.21Å; N124-T171 WeakPolarHBondContact CB-O 3.43Å
125	S	95.9	Very high	91.7	Very high	15 Å²	15	42.8 Å²	42.8	11%	0.105	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	150.3	-175.6	-169.3	0	0	0	0	111.9	S142 S143	S125-S142 CarbonylContact O-C 3.53Å; S125-S142 VanDerWaalsContact O-CA 3.32Å; S125-S142 WeakPolarHBondContact O-CA 3.4Å; S125-S143 WeakPolarHBondContact CB-OG 3.21Å; S125-S143 PolarHBondContact N-OG 3.47Å; S125-S143 PolarHBondContact O-N 3.4Å
126	I	96.6	Very high	91.4	Very high	9 Å²	9	47.5 Å²	47.5	5%	0.046	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	134.6	178	-61.7	167.3	0	0	0	108.8	S84 A93 I101 V123 L140 A141	S84-I126 WeakPolarHBondContact CB-O 3.42Å; S84-I126 PolarHBondContact OG-O 3.23Å; A93-I126 HydrophobicContact CB-CD1 4.27Å; A93-I126 HydrophobicContact CB-CG2 3.92Å; I101-I126 HydrophobicContact CD1-CD1 4.48Å; I101-I126 HydrophobicContact CG1-CD1 4.26Å; I101-I126 HydrophobicContact CG2-CD1 3.82Å; V123-I126 HydrophobicContact CG1-CD1 4.22Å; V123-I126 HydrophobicContact CG1-CG1 3.87Å; I126-L140 HydrophobicContact CG2-CD1 4.02Å; I126-A141 WeakPolarHBondContact CA-O 3.32Å
127	T	96.2	Very high	91.2	Very high	18 Å²	18	47.4 Å²	47.4	11%	0.11	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	135.8	176.6	-173.9	0	0	0	0	109.3	L140 A141 V173 W175	T127-L140 CarbonylContact O-C 3.58Å; T127-L140 WeakPolarHBondContact O-CA 3.34Å; T127-A141 HydrophobicContact CG2-CB 3.86Å; T127-A141 PolarHBondContact N-O 2.85Å; T127-A141 PolarHBondContact O-N 2.7Å; T127-V173 HydrophobicContact CG2-CB 4.41Å; T127-V173 HydrophobicContact CG2-CG1 3.87Å; T127-V173 HydrophobicContact CG2-CG2 3.98Å; T127-W175 HydrophobicContact CG2-CB 3.91Å; T127-W175 PolarHBondContact OG1-N 2.7Å
128	W	96.4	Very high	91.4	Very high	15 Å²	15	47.9 Å²	47.9	6%	0.057	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	153.8	176.9	-69.9	89.6	0	0	0	110.8	S84 W85 K91 A93 V103 S137 L140 V154	S84-W128 PolarHBondContact O-NE1 3.33Å; W85-W128 VanDerWaalsContact C-CD1 3.43Å; K91-W128 HydrophobicContact CB-CH2 3.81Å; K91-W128 HydrophobicContact CB-CZ2 3.96Å; K91-W128 HydrophobicContact CD-CH2 3.92Å; K91-W128 HydrophobicContact CD-CZ3 4.24Å; A93-W128 HydrophobicContact CB-CZ2 3.64Å; V103-W128 HydrophobicContact CG1-CH2 3.93Å; V103-W128 HydrophobicContact CG1-CZ2 4.28Å; V103-W128 HydrophobicContact CG2-CH2 4.32Å; W128-S137 WeakPolarHBondContact CZ3-O 3.4Å; W128-L140 HydrophobicContact CD2-CB 3.97Å; W128-L140 HydrophobicContact CE3-CB 3.83Å; W128-L140 HydrophobicContact CE3-CD2 4.37Å; W128-L140 HydrophobicContact CG-CB 4.45Å; W128-L140 HydrophobicContact CH2-CD2 3.78Å; W128-L140 HydrophobicContact CZ2-CD2 3.97Å; W128-L140 HydrophobicContact CZ3-CB 4.21Å; W128-L140 HydrophobicContact CZ3-CD2 3.97Å; W128-V154 HydrophobicContact CH2-CG2 3.95Å; W128-V154 HydrophobicContact CZ3-CG2 3.77Å
129	Q	94.1	Very high	91.6	Very high	20 Å²	20	48 Å²	48	9%	0.093	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-62.8	136.5	168.7	-170.7	164	18.6	0	0	109.4	L131 V133 D134 F139 W175	Q129-L131 PolarHBondContact O-N 2.83Å; Q129-V133 HydrophobicContact CG-CB 4.34Å; Q129-V133 HydrophobicContact CG-CG1 4.46Å; Q129-V133 VanDerWaalsContact NE2-CG1 3.32Å; Q129-D134 HydrophobicContact CB-CB 4.14Å; Q129-D134 HydrophobicContact CG-CB 3.89Å; Q129-F139 HydrophobicContact CB-CB 4.17Å; Q129-F139 PolarHBondContact N-O 3.25Å; Q129-W175 HydrophobicContact CB-CD2 4.09Å; Q129-W175 HydrophobicContact CB-CE3 3.94Å; Q129-W175 HydrophobicContact CB-CH2 3.75Å; Q129-W175 HydrophobicContact CB-CZ2 3.89Å; Q129-W175 HydrophobicContact CB-CZ3 3.78Å; Q129-W175 VanDerWaalsContact CD-CZ2 3.47Å; Q129-W175 HydrophobicContact CG-CD2 4.25Å; Q129-W175 HydrophobicContact CG-CH2 3.97Å; Q129-W175 HydrophobicContact CG-CZ2 3.6Å; Q129-W175 HydrophobicContact CG-CZ3 4.43Å
130	P	91.1	Very high	91.7	Very high	4 Å²	4	47.5 Å²	47.5	3%	0.026	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-54.4	138.2	176.1	-30.6	37.7	0	0	0	112.7	H132 V133 D134 L222	P130-H132 VanDerWaalsContact C-N 3.32Å; P130-H132 WeakPolarHBondContact CB-CE1 3.34Å; P130-H132 WeakPolarHBondContact CB-ND1 3.4Å; P130-H132 PolarHBondContact O-N 3.21Å; P130-V133 HydrophobicContact CB-CG2 4.37Å; P130-V133 PolarHBondContact O-N 2.87Å; P130-D134 PolarHBondContact O-N 3.48Å; P130-L222 HydrophobicContact CB-CD2 3.93Å; P130-L222 HydrophobicContact CG-CD2 4.06Å
131	L	88.9	Confident	92	Very high	21 Å²	21	36.9 Å²	36.9	11%	0.11	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-33.4	-171	-173.6	80.6	0	0	0	112.5	A87 D88 Q129 V133 D134 P135 E225 V226	A87-L131 HydrophobicContact CB-CB 4.15Å; D88-L131 HydrophobicContact CB-CD1 4.02Å; Q129-L131 PolarHBondContact O-N 2.83Å; L131-V133 PolarHBondContact O-N 3.24Å; L131-D134 WeakPolarHBondContact CA-O 3.44Å; L131-D134 CarbonylContact O-C 3.6Å; L131-D134 PolarHBondContact O-N 3.04Å; L131-P135 WeakPolarHBondContact CD1-O 3.39Å; L131-P135 VanDerWaalsContact O-CA 3.3Å; L131-P135 WeakPolarHBondContact O-CA 3.29Å; L131-E225 HydrophobicContact CB-CB 4.27Å; L131-E225 HydrophobicContact CB-CG 4.49Å; L131-E225 VanDerWaalsContact CB-OE2 3.28Å; L131-E225 WeakPolarHBondContact CB-OE2 3.4Å; L131-E225 HydrophobicContact CD2-CB 4.3Å; L131-E225 PolarHBondContact N-OE1 3.45Å; L131-E225 PolarHBondContact N-OE2 2.87Å; L131-V226 HydrophobicContact CD2-CB 4.48Å; L131-V226 HydrophobicContact CD2-CG2 3.02Å
132	H	84.1	Confident	92.2	Very high	67 Å²	67	35.2 Å²	35.2	31%	0.31	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-16.6	173.8	67.5	-85.7	0	0	0	113.9	P130 G177 E225	P130-H132 VanDerWaalsContact C-N 3.32Å; P130-H132 WeakPolarHBondContact CB-CE1 3.34Å; P130-H132 WeakPolarHBondContact CB-ND1 3.4Å; P130-H132 PolarHBondContact O-N 3.21Å; H132-G177 PolarHBondContact NE2-O 3.25Å; H132-E225 IonicContact CE1-OE1 3.88Å; H132-E225 IonicContact CG-OE2 3.57Å; H132-E225 PolarHBondContact N-OE2 2.84Å; H132-E225 IonicContact ND1-OE1 3.31Å; H132-E225 PolarHBondContact ND1-OE1 3.45Å; H132-E225 IonicContact ND1-OE2 2.87Å; H132-E225 PolarHBondContact ND1-OE2 2.84Å
133	V	85.5	Confident	92.5	Very high	67 Å²	67	31.6 Å²	31.6	41%	0.406	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-41.2	171.7	-174.1	0	0	0	0	110.8	Q129 P130 L131	Q129-V133 HydrophobicContact CG-CB 4.34Å; Q129-V133 HydrophobicContact CG-CG1 4.46Å; Q129-V133 VanDerWaalsContact NE2-CG1 3.32Å; P130-V133 HydrophobicContact CB-CG2 4.37Å; P130-V133 PolarHBondContact O-N 2.87Å; L131-V133 PolarHBondContact O-N 3.24Å
134	D	85.3	Confident	92.6	Very high	14 Å²	14	31.6 Å²	31.6	8%	0.075	16%	0.159	C	C	.	.			trans	-127.5	90.2	178.1	177	15.1	0	0	0	111	Q129 P130 L131 H136 S137 R138 F139	Q129-D134 HydrophobicContact CB-CB 4.14Å; Q129-D134 HydrophobicContact CG-CB 3.89Å; P130-D134 PolarHBondContact O-N 3.48Å; L131-D134 WeakPolarHBondContact CA-O 3.44Å; L131-D134 CarbonylContact O-C 3.6Å; L131-D134 PolarHBondContact O-N 3.04Å; D134-H136 PolarHBondContact O-N 2.65Å; D134-H136 PolarHBondContact OD1-N 3.04Å; D134-S137 PolarHBondContact O-N 2.74Å; D134-S137 VanDerWaalsContact O-N 3.15Å; D134-R138 WeakPolarHBondContact OD2-CA 3.23Å; D134-R138 WeakPolarHBondContact OD2-CB 3.39Å; D134-R138 PolarHBondContact OD2-N 2.78Å; D134-F139 PolarHBondContact OD2-N 3.37Å
135	P	84.5	Confident	92.7	Very high	83 Å²	83	33.4 Å²	33.4	54%	0.539	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-11.4	-176.6	-25.3	35.2	0	0	0	114.9	L131	L131-P135 WeakPolarHBondContact CD1-O 3.39Å; L131-P135 VanDerWaalsContact O-CA 3.3Å; L131-P135 WeakPolarHBondContact O-CA 3.29Å
136	H	86.5	Confident	92.6	Very high	144 Å²	144	33.8 Å²	33.8	67%	0.667	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-2.2	-176.9	-62.4	-61.2	0	0	0	113.2	K91 D134 R138	K91-H136 PolarHBondContact NZ-O 3.09Å; D134-H136 PolarHBondContact O-N 2.65Å; D134-H136 PolarHBondContact OD1-N 3.04Å; H136-R138 PolarHBondContact O-N 3Å
137	S	89.6	Confident	92.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.18	C	C	.	.			trans	46.4	51	-172.4	-49.7	0	0	0	0	110.7	D88 W128 D134	D88-S137 WeakPolarHBondContact OD2-CB 3.3Å; D88-S137 PolarHBondContact OD2-OG 2.76Å; W128-S137 WeakPolarHBondContact CZ3-O 3.4Å; D134-S137 PolarHBondContact O-N 2.74Å; D134-S137 VanDerWaalsContact O-N 3.15Å
138	R	93.4	Very high	92.6	Very high	97 Å²	97	37.3 Å²	37.3	37%	0.366	18%	0.182	S	C	.	.			trans	-80.6	-35.6	179.2	175.3	175.6	178	-178	-3.2	111.2	D134 H136 D153 V154 V155	D134-R138 WeakPolarHBondContact OD2-CA 3.23Å; D134-R138 WeakPolarHBondContact OD2-CB 3.39Å; D134-R138 PolarHBondContact OD2-N 2.78Å; H136-R138 PolarHBondContact O-N 3Å; R138-D153 WeakPolarHBondContact CG-OD1 3.47Å; R138-D153 IonicContact CZ-OD2 3.04Å; R138-D153 VanDerWaalsContact NE-CG 3.28Å; R138-D153 IonicContact NE-OD1 2.73Å; R138-D153 PolarHBondContact NE-OD1 3.14Å; R138-D153 IonicContact NE-OD2 3.31Å; R138-D153 PolarHBondContact NE-OD2 3.39Å; R138-D153 IonicContact NH2-OD2 3.98Å; R138-D153 PolarHBondContact NH2-OD2 2.85Å; R138-V154 WeakPolarHBondContact O-CB 3.46Å; R138-V154 WeakPolarHBondContact O-CG2 3.4Å; R138-V154 PolarHBondContact O-N 3.34Å; R138-V155 HydrophobicContact CG-CG2 4.09Å
139	F	95.7	Very high	92.7	Very high	48 Å²	48	36.6 Å²	36.6	21%	0.211	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	140.2	-176.5	-58.4	-79.9	0	0	0	113.3	Q129 D134 I151 W152 D153 V160 W175	Q129-F139 HydrophobicContact CB-CB 4.17Å; Q129-F139 PolarHBondContact N-O 3.25Å; D134-F139 PolarHBondContact OD2-N 3.37Å; F139-I151 HydrophobicContact CB-CG2 4.43Å; F139-I151 HydrophobicContact CD1-CG2 4.34Å; F139-W152 VanDerWaalsContact CA-O 3.27Å; F139-W152 WeakPolarHBondContact CA-O 3.43Å; F139-W152 WeakPolarHBondContact CD1-O 3.43Å; F139-D153 HydrophobicContact CD1-CB 4.22Å; F139-D153 HydrophobicContact CE1-CB 3.89Å; F139-V160 HydrophobicContact CE1-CG2 4.34Å; F139-W175 HydrophobicContact CB-CH2 3.91Å; F139-W175 HydrophobicContact CB-CZ3 4.2Å
140	L	96.3	Very high	92.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	149.1	168.7	68.1	87.7	0	0	0	110.2	A93 V103 L116 I126 T127 W128 I151 W152 V154	A93-L140 HydrophobicContact CB-CD2 4.07Å; V103-L140 HydrophobicContact CG2-CD2 4Å; L116-L140 HydrophobicContact CD1-CD2 4.35Å; I126-L140 HydrophobicContact CG2-CD1 4.02Å; T127-L140 CarbonylContact O-C 3.58Å; T127-L140 WeakPolarHBondContact O-CA 3.34Å; W128-L140 HydrophobicContact CD2-CB 3.97Å; W128-L140 HydrophobicContact CE3-CB 3.83Å; W128-L140 HydrophobicContact CE3-CD2 4.37Å; W128-L140 HydrophobicContact CG-CB 4.45Å; W128-L140 HydrophobicContact CH2-CD2 3.78Å; W128-L140 HydrophobicContact CZ2-CD2 3.97Å; W128-L140 HydrophobicContact CZ3-CB 4.21Å; W128-L140 HydrophobicContact CZ3-CD2 3.97Å; L140-I151 CarbonylContact O-C 3.58Å; L140-I151 WeakPolarHBondContact O-CA 2.99Å; L140-W152 HydrophobicContact CD1-CB 4.11Å; L140-W152 HydrophobicContact CD1-CG 3.97Å; L140-W152 HydrophobicContact CG-CB 4.14Å; L140-W152 PolarHBondContact N-O 3.4Å; L140-W152 PolarHBondContact O-N 2.69Å; L140-V154 HydrophobicContact CD2-CG2 3.52Å; L140-V154 HydrophobicContact CG-CG2 4.07Å
141	A	97.4	Very high	93.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	140.4	171.4	0	0	0	0	0	110.1	I126 T127 I149 R150 I151 V173 W175 I181	I126-A141 WeakPolarHBondContact CA-O 3.32Å; T127-A141 HydrophobicContact CG2-CB 3.86Å; T127-A141 PolarHBondContact N-O 2.85Å; T127-A141 PolarHBondContact O-N 2.7Å; A141-I149 HydrophobicContact CB-CG2 4.43Å; A141-R150 CarbonylContact C-O 3.51Å; A141-R150 VanDerWaalsContact CA-O 3.27Å; A141-R150 WeakPolarHBondContact CA-O 3.37Å; A141-I151 HydrophobicContact CB-CG1 4.29Å; A141-V173 HydrophobicContact CB-CG2 4.45Å; A141-W175 HydrophobicContact CB-CE3 3.79Å; A141-W175 HydrophobicContact CB-CZ3 3.97Å; A141-I181 HydrophobicContact CB-CD1 4.29Å
142	S	97.7	Very high	93.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	141.8	175.8	63.3	0	0	0	0	111.9	I101 H119 S125 I149 R150 W152	I101-S142 VanDerWaalsContact CD1-OG 3.24Å; I101-S142 WeakPolarHBondContact CD1-OG 3.46Å; H119-S142 PolarHBondContact CD2-OG 3.46Å; H119-S142 PolarHBondContact NE2-OG 3.13Å; S125-S142 CarbonylContact O-C 3.53Å; S125-S142 VanDerWaalsContact O-CA 3.32Å; S125-S142 WeakPolarHBondContact O-CA 3.4Å; S142-I149 CarbonylContact O-C 3.56Å; S142-I149 WeakPolarHBondContact O-CA 3.17Å; S142-I149 WeakPolarHBondContact O-CG2 3.35Å; S142-R150 PolarHBondContact N-O 2.66Å; S142-R150 PolarHBondContact O-N 3.44Å; S142-W152 PolarHBondContact OG-NE1 3.1Å
143	S	97.3	Very high	94	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	149	172.6	71.1	0	0	0	0	111.3	V123 N124 S125 V170	V123-S143 CarbonylContact C-O 3.58Å; N124-S143 PolarHBondContact N-O 3.14Å; S125-S143 WeakPolarHBondContact CB-OG 3.21Å; S125-S143 PolarHBondContact N-OG 3.47Å; S125-S143 PolarHBondContact O-N 3.4Å; S143-V170 VanDerWaalsContact CB-CG1 3.47Å; S143-V170 WeakPolarHBondContact CB-O 3.05Å; S143-V170 PolarHBondContact OG-O 3.3Å; S143-V170 VanDerWaalsContact OG-O 3.07Å
144	S	97.3	Very high	94.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	165.2	-178	171.9	0	0	0	0	112.5	H119 S121 W122 D146 H147 D148 V170	H119-S144 WeakPolarHBondContact CE1-CB 3.47Å; H119-S144 WeakPolarHBondContact ND1-CB 3.18Å; H119-S144 PolarHBondContact ND1-OG 2.77Å; S121-S144 PolarHBondContact O-OG 2.84Å; W122-S144 VanDerWaalsContact O-CA 3.25Å; W122-S144 WeakPolarHBondContact O-CA 3.45Å; W122-S144 VanDerWaalsContact O-CB 3.28Å; W122-S144 WeakPolarHBondContact O-CB 3.27Å; W122-S144 PolarHBondContact O-OG 3Å; S144-D146 WeakPolarHBondContact CB-OD1 3.49Å; S144-D146 PolarHBondContact O-N 2.87Å; S144-D146 PolarHBondContact OG-N 3.17Å; S144-D146 PolarHBondContact OG-OD1 2.92Å; S144-H147 PolarHBondContact O-N 2.99Å; S144-D148 PolarHBondContact N-O 3.31Å; S144-V170 PolarHBondContact O-N 3.45Å
145	K	96.2	Very high	94.7	Very high	79 Å²	79	34.4 Å²	34.4	34%	0.343	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.4	170.1	172.9	165.5	178.6	-177.6	0	114	W122 N124 H147 S169	W122-K145 HydrophobicContact CD2-CB 4.29Å; W122-K145 HydrophobicContact CD2-CD 3.7Å; W122-K145 HydrophobicContact CE3-CD 4.26Å; W122-K145 HydrophobicContact CG-CB 4.02Å; W122-K145 HydrophobicContact CG-CD 4.31Å; W122-K145 HydrophobicContact CH2-CD 3.88Å; W122-K145 HydrophobicContact CZ2-CD 3.22Å; W122-K145 HydrophobicContact CZ3-CD 4.34Å; W122-K145 VanDerWaalsContact NE1-CB 3.28Å; W122-K145 PolarHBondContact O-N 2.77Å; W122-K145 VanDerWaalsContact O-N 3.08Å; N124-K145 PolarHBondContact ND2-N 2.78Å; K145-H147 PolarHBondContact O-CE1 2.86Å; K145-H147 PolarHBondContact O-N 3.27Å; K145-H147 VanDerWaalsContact O-N 3.11Å; K145-H147 PolarHBondContact O-ND1 3Å; K145-S169 WeakPolarHBondContact CA-OG 3.45Å
146	D	95.5	Very high	95.1	Very high	23 Å²	23	34.9 Å²	34.9	12%	0.123	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	5.1	173.6	69.7	3.5	0	0	0	114.6	H119 R120 S144 D148 R150	H119-D146 VanDerWaalsContact CA-OD2 3.3Å; H119-D146 WeakPolarHBondContact CA-OD2 3.47Å; H119-D146 IonicContact CE1-OD1 3.19Å; H119-D146 IonicContact CG-OD2 3.86Å; H119-D146 IonicContact ND1-OD1 3.48Å; H119-D146 PolarHBondContact ND1-OD1 2.79Å; H119-D146 IonicContact ND1-OD2 3.82Å; H119-D146 PolarHBondContact ND1-OD2 2.91Å; R120-D146 HydrophobicContact CB-CB 4.05Å; R120-D146 PolarHBondContact N-OD2 2.9Å; S144-D146 WeakPolarHBondContact CB-OD1 3.49Å; S144-D146 PolarHBondContact O-N 2.87Å; S144-D146 PolarHBondContact OG-N 3.17Å; S144-D146 PolarHBondContact OG-OD1 2.92Å; D146-D148 PolarHBondContact O-N 2.98Å; D146-D148 WeakPolarHBondContact OD1-CB 3.45Å; D146-D148 PolarHBondContact OD1-N 2.82Å; D146-R150 IonicContact OD1-NH1 3.8Å; D146-R150 IonicContact OD2-CZ 3.88Å; D146-R150 IonicContact OD2-NH1 2.83Å; D146-R150 PolarHBondContact OD2-NH1 2.89Å
147	H	96.2	Very high	95.4	Very high	75 Å²	75	28.7 Å²	28.7	35%	0.347	14%	0.142	S	C	.	.	S	Bend	trans	78.7	-2.3	176.7	-39	-25.7	0	0	0	114.2	S144 K145 A168 S169 V170	S144-H147 PolarHBondContact O-N 2.99Å; K145-H147 PolarHBondContact O-CE1 2.86Å; K145-H147 PolarHBondContact O-N 3.27Å; K145-H147 VanDerWaalsContact O-N 3.11Å; K145-H147 PolarHBondContact O-ND1 3Å; H147-A168 VanDerWaalsContact ND1-CA 3.34Å; H147-A168 WeakPolarHBondContact ND1-CA 3.45Å; H147-A168 PolarHBondContact ND1-O 2.67Å; H147-S169 PolarHBondContact ND1-N 3.33Å; H147-S169 VanDerWaalsContact ND1-N 3.13Å; H147-V170 WeakPolarHBondContact O-CG2 3.13Å
148	D	96.2	Very high	95.6	Very high	27 Å²	27	34.3 Å²	34.3	14%	0.144	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	151.6	-178.1	-66.3	-28.8	0	0	0	111.6	S144 D146 R150 L162	S144-D148 PolarHBondContact N-O 3.31Å; D146-D148 PolarHBondContact O-N 2.98Å; D146-D148 WeakPolarHBondContact OD1-CB 3.45Å; D146-D148 PolarHBondContact OD1-N 2.82Å; D148-R150 IonicContact OD2-CZ 3.48Å; D148-R150 IonicContact OD2-NH1 3.47Å; D148-R150 PolarHBondContact OD2-NH1 2.84Å; D148-R150 IonicContact OD2-NH2 2.95Å; D148-R150 PolarHBondContact OD2-NH2 3.44Å; D148-L162 HydrophobicContact CB-CD1 3.65Å
149	I	97.5	Very high	95.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.8	159.5	-56.1	129.2	0	0	0	107.5	A141 S142 L163 V170 V173 S183 W193	A141-I149 HydrophobicContact CB-CG2 4.43Å; S142-I149 CarbonylContact O-C 3.56Å; S142-I149 WeakPolarHBondContact O-CA 3.17Å; S142-I149 WeakPolarHBondContact O-CG2 3.35Å; I149-L163 HydrophobicContact CB-CB 4.1Å; I149-L163 HydrophobicContact CB-CD1 4.29Å; I149-L163 HydrophobicContact CB-CG 4.45Å; I149-L163 HydrophobicContact CD1-CB 4.45Å; I149-L163 HydrophobicContact CG2-CD1 4Å; I149-L163 PolarHBondContact N-O 2.99Å; I149-L163 VanDerWaalsContact N-O 3.16Å; I149-L163 PolarHBondContact O-N 2.88Å; I149-V170 HydrophobicContact CD1-CG1 4.11Å; I149-V170 HydrophobicContact CD1-CG2 4.45Å; I149-V170 HydrophobicContact CG1-CB 4.46Å; I149-V170 HydrophobicContact CG1-CG1 3.88Å; I149-V170 HydrophobicContact CG1-CG2 4.35Å; I149-V173 HydrophobicContact CG2-CG2 4.1Å; I149-S183 WeakPolarHBondContact CD1-OG 3.16Å; I149-W193 HydrophobicContact CD1-CZ2 4.24Å
150	R	97.2	Very high	95.5	Very high	20 Å²	20	33.7 Å²	33.7	8%	0.075	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	135	178.4	-70.2	-177.8	171.4	78	11.7	110.1	S118 H119 A141 S142 D146 D148 W152 R161 L162	S118-R150 WeakPolarHBondContact OG-CD 3.19Å; S118-R150 PolarHBondContact OG-NE 3.49Å; S118-R150 VanDerWaalsContact OG-NE 3.11Å; H119-R150 PolarHBondContact CE1-NH1 3.2Å; H119-R150 VanDerWaalsContact CE1-NH1 3.27Å; H119-R150 PolarHBondContact ND1-NH1 3.22Å; A141-R150 CarbonylContact C-O 3.51Å; A141-R150 VanDerWaalsContact CA-O 3.27Å; A141-R150 WeakPolarHBondContact CA-O 3.37Å; S142-R150 PolarHBondContact N-O 2.66Å; S142-R150 PolarHBondContact O-N 3.44Å; D146-R150 IonicContact OD1-NH1 3.8Å; D146-R150 IonicContact OD2-CZ 3.88Å; D146-R150 IonicContact OD2-NH1 2.83Å; D146-R150 PolarHBondContact OD2-NH1 2.89Å; D148-R150 IonicContact OD2-CZ 3.48Å; D148-R150 IonicContact OD2-NH1 3.47Å; D148-R150 PolarHBondContact OD2-NH1 2.84Å; D148-R150 IonicContact OD2-NH2 2.95Å; D148-R150 PolarHBondContact OD2-NH2 3.44Å; R150-W152 HydrophobicContact CB-CD2 4.47Å; R150-W152 HydrophobicContact CB-CZ2 3.77Å; R150-W152 HydrophobicContact CG-CZ2 4.33Å; R150-W152 VanDerWaalsContact O-CD1 3.29Å; R150-W152 PolarHBondContact O-NE1 2.89Å; R150-R161 WeakPolarHBondContact CA-O 3.46Å; R150-L162 HydrophobicContact CG-CD1 3.74Å
151	I	97.2	Very high	95.5	Very high	6 Å²	6	38.3 Å²	38.3	3%	0.031	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.6	168.2	-57.4	176.4	0	0	0	107.4	F139 L140 A141 S159 V160 R161 L163 W175 I181	F139-I151 HydrophobicContact CB-CG2 4.43Å; F139-I151 HydrophobicContact CD1-CG2 4.34Å; L140-I151 CarbonylContact O-C 3.58Å; L140-I151 WeakPolarHBondContact O-CA 2.99Å; A141-I151 HydrophobicContact CB-CG1 4.29Å; I151-S159 CarbonylContact O-C 3.58Å; I151-S159 WeakPolarHBondContact O-CA 3.33Å; I151-V160 PolarHBondContact O-N 3.3Å; I151-R161 HydrophobicContact CB-CB 4.09Å; I151-R161 HydrophobicContact CD1-CB 4.2Å; I151-R161 HydrophobicContact CG1-CB 4.36Å; I151-R161 PolarHBondContact N-O 3.05Å; I151-R161 PolarHBondContact O-N 2.71Å; I151-L163 HydrophobicContact CD1-CD1 4.37Å; I151-W175 HydrophobicContact CD1-CH2 4.38Å; I151-W175 HydrophobicContact CG2-CH2 3.83Å; I151-W175 HydrophobicContact CG2-CZ3 4.16Å; I151-I181 HydrophobicContact CD1-CD1 3.56Å; I151-I181 HydrophobicContact CG1-CD1 4.06Å
152	W	96.7	Very high	95.4	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.015	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.4	-174.2	-54.6	86.2	0	0	0	110.3	I101 L116 S118 H119 F139 L140 S142 R150 Q158	I101-W152 HydrophobicContact CD1-CZ2 4.29Å; L116-W152 HydrophobicContact CB-CD2 4.07Å; L116-W152 HydrophobicContact CB-CE3 3.7Å; L116-W152 HydrophobicContact CB-CH2 4.08Å; L116-W152 HydrophobicContact CB-CZ2 4.49Å; L116-W152 HydrophobicContact CB-CZ3 3.71Å; L116-W152 HydrophobicContact CD1-CB 3.9Å; L116-W152 HydrophobicContact CD1-CD2 4.04Å; L116-W152 HydrophobicContact CD1-CE3 4.21Å; L116-W152 HydrophobicContact CD1-CG 3.93Å; L116-W152 HydrophobicContact CD2-CE3 3.88Å; L116-W152 HydrophobicContact CD2-CZ3 4.42Å; L116-W152 HydrophobicContact CG-CD2 4.44Å; L116-W152 HydrophobicContact CG-CE3 4.14Å; S118-W152 WeakPolarHBondContact OG-CH2 3.38Å; S118-W152 WeakPolarHBondContact OG-CZ3 3.19Å; H119-W152 AromaticContact CD2-CZ2 3.75Å; F139-W152 VanDerWaalsContact CA-O 3.27Å; F139-W152 WeakPolarHBondContact CA-O 3.43Å; F139-W152 WeakPolarHBondContact CD1-O 3.43Å; L140-W152 HydrophobicContact CD1-CB 4.11Å; L140-W152 HydrophobicContact CD1-CG 3.97Å; L140-W152 HydrophobicContact CG-CB 4.14Å; L140-W152 PolarHBondContact N-O 3.4Å; L140-W152 PolarHBondContact O-N 2.69Å; S142-W152 PolarHBondContact OG-NE1 3.1Å; R150-W152 HydrophobicContact CB-CD2 4.47Å; R150-W152 HydrophobicContact CB-CZ2 3.77Å; R150-W152 HydrophobicContact CG-CZ2 4.33Å; R150-W152 VanDerWaalsContact O-CD1 3.29Å; R150-W152 PolarHBondContact O-NE1 2.89Å; W152-Q158 WeakPolarHBondContact CA-O 3.36Å
153	D	95.3	Very high	95.3	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.011	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	111.5	161.4	-174.8	-28.9	0	0	0	108.1	R138 F139 V155 L156 G157 Q158 V160	R138-D153 WeakPolarHBondContact CG-OD1 3.47Å; R138-D153 IonicContact CZ-OD2 3.04Å; R138-D153 VanDerWaalsContact NE-CG 3.28Å; R138-D153 IonicContact NE-OD1 2.73Å; R138-D153 PolarHBondContact NE-OD1 3.14Å; R138-D153 IonicContact NE-OD2 3.31Å; R138-D153 PolarHBondContact NE-OD2 3.39Å; R138-D153 IonicContact NH2-OD2 3.98Å; R138-D153 PolarHBondContact NH2-OD2 2.85Å; F139-D153 HydrophobicContact CD1-CB 4.22Å; F139-D153 HydrophobicContact CE1-CB 3.89Å; D153-V155 VanDerWaalsContact C-N 3.27Å; D153-V155 PolarHBondContact O-N 2.87Å; D153-V155 WeakPolarHBondContact OD1-CB 3.24Å; D153-V155 PolarHBondContact OD1-N 3.35Å; D153-L156 HydrophobicContact CB-CB 4.11Å; D153-L156 HydrophobicContact CB-CD1 4.45Å; D153-L156 HydrophobicContact CB-CG 4.42Å; D153-L156 PolarHBondContact OD1-N 3.26Å; D153-L156 VanDerWaalsContact OD1-N 3.09Å; D153-L156 VanDerWaalsContact OD2-CD1 3.28Å; D153-L156 WeakPolarHBondContact OD2-CD1 3.45Å; D153-L156 WeakPolarHBondContact OD2-CG 3.49Å; D153-G157 WeakPolarHBondContact O-CA 3.41Å; D153-G157 PolarHBondContact O-N 3.33Å; D153-Q158 PolarHBondContact N-O 3.38Å; D153-Q158 PolarHBondContact O-N 3.31Å; D153-V160 HydrophobicContact CB-CG2 3.53Å
154	V	93.6	Very high	95.2	Very high	6 Å²	6	46.2 Å²	46.2	4%	0.036	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-31	-177.2	175.6	0	0	0	0	111.7	V103 W128 R138 L140	V103-V154 HydrophobicContact CB-CG1 4.13Å; V103-V154 HydrophobicContact CG1-CG1 4Å; V103-V154 HydrophobicContact CG2-CG1 3.89Å; V103-V154 HydrophobicContact CG2-CG2 4.15Å; W128-V154 HydrophobicContact CH2-CG2 3.95Å; W128-V154 HydrophobicContact CZ3-CG2 3.77Å; R138-V154 WeakPolarHBondContact O-CB 3.46Å; R138-V154 WeakPolarHBondContact O-CG2 3.4Å; R138-V154 PolarHBondContact O-N 3.34Å; L140-V154 HydrophobicContact CD2-CG2 3.52Å; L140-V154 HydrophobicContact CG-CG2 4.07Å
155	V	92	Very high	95	Very high	108 Å²	108	48 Å²	48	66%	0.655	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-45.2	-179.6	178.3	0	0	0	0	110.2	R138 D153	R138-V155 HydrophobicContact CG-CG2 4.09Å; D153-V155 VanDerWaalsContact C-N 3.27Å; D153-V155 PolarHBondContact O-N 2.87Å; D153-V155 WeakPolarHBondContact OD1-CB 3.24Å; D153-V155 PolarHBondContact OD1-N 3.35Å
156	L	92.6	Very high	95.1	Very high	94 Å²	94	44.8 Å²	44.8	49%	0.492	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-22.8	178	-62.7	-179.3	0	0	0	112.9	D153	D153-L156 HydrophobicContact CB-CB 4.11Å; D153-L156 HydrophobicContact CB-CD1 4.45Å; D153-L156 HydrophobicContact CB-CG 4.42Å; D153-L156 PolarHBondContact OD1-N 3.26Å; D153-L156 VanDerWaalsContact OD1-N 3.09Å; D153-L156 VanDerWaalsContact OD2-CD1 3.28Å; D153-L156 WeakPolarHBondContact OD2-CD1 3.45Å; D153-L156 WeakPolarHBondContact OD2-CG 3.49Å
157	G	92.3	Very high	95.1	Very high	13 Å²	13	49.2 Å²	49.2	13%	0.134	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	32.5	-178.1	0	0	0	0	0	113.2	D153	D153-G157 WeakPolarHBondContact O-CA 3.41Å; D153-G157 PolarHBondContact O-N 3.33Å
158	Q	93.2	Very high	95.2	Very high	119 Å²	119	46.7 Å²	46.7	56%	0.556	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.9	153.7	-173.3	-65.2	-179.2	-2.3	0	0	111.6	W152 D153 V160	W152-Q158 WeakPolarHBondContact CA-O 3.36Å; D153-Q158 PolarHBondContact N-O 3.38Å; D153-Q158 PolarHBondContact O-N 3.31Å; Q158-V160 PolarHBondContact O-N 3.25Å
159	S	94	Very high	95.2	Very high	54 Å²	54	45.6 Å²	45.6	38%	0.378	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	116.3	170.2	55.9	0	0	0	0	109.4	I151	I151-S159 CarbonylContact O-C 3.58Å; I151-S159 WeakPolarHBondContact O-CA 3.33Å
160	V	94.6	Very high	95.2	Very high	77 Å²	77	45.6 Å²	45.6	47%	0.467	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-31.5	179	-178.2	0	0	0	0	111.2	F139 I151 D153 Q158	F139-V160 HydrophobicContact CE1-CG2 4.34Å; I151-V160 PolarHBondContact O-N 3.3Å; D153-V160 HydrophobicContact CB-CG2 3.53Å; Q158-V160 PolarHBondContact O-N 3.25Å
161	R	94.5	Very high	95.2	Very high	97 Å²	97	45.7 Å²	45.7	37%	0.366	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	146.9	178	-55.6	-174.2	179.3	-82	-9.8	111.9	R150 I151 D196 D197	R150-R161 WeakPolarHBondContact CA-O 3.46Å; I151-R161 HydrophobicContact CB-CB 4.09Å; I151-R161 HydrophobicContact CD1-CB 4.2Å; I151-R161 HydrophobicContact CG1-CB 4.36Å; I151-R161 PolarHBondContact N-O 3.05Å; I151-R161 PolarHBondContact O-N 2.71Å; R161-D196 PolarHBondContact NE-O 2.86Å; R161-D196 PolarHBondContact NH2-O 3.36Å; R161-D197 PolarHBondContact NH1-O 2.76Å
162	L	96	Very high	95.2	Very high	92 Å²	92	45.8 Å²	45.8	48%	0.482	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.1	171.2	179.9	66.5	0	0	0	108.2	D148 R150	D148-L162 HydrophobicContact CB-CD1 3.65Å; R150-L162 HydrophobicContact CG-CD1 3.74Å
163	L	95.9	Very high	95.2	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	89	173.4	-39	175.3	0	0	0	107.7	I149 I151 I181 W193	I149-L163 HydrophobicContact CB-CB 4.1Å; I149-L163 HydrophobicContact CB-CD1 4.29Å; I149-L163 HydrophobicContact CB-CG 4.45Å; I149-L163 HydrophobicContact CD1-CB 4.45Å; I149-L163 HydrophobicContact CG2-CD1 4Å; I149-L163 PolarHBondContact N-O 2.99Å; I149-L163 VanDerWaalsContact N-O 3.16Å; I149-L163 PolarHBondContact O-N 2.88Å; I151-L163 HydrophobicContact CD1-CD1 4.37Å; L163-I181 HydrophobicContact CD1-CD1 4.12Å; L163-I181 HydrophobicContact CD1-CG2 4.37Å; L163-W193 HydrophobicContact CB-CD2 3.93Å; L163-W193 HydrophobicContact CB-CE3 3.85Å; L163-W193 HydrophobicContact CB-CG 4.46Å; L163-W193 HydrophobicContact CB-CH2 4.35Å; L163-W193 HydrophobicContact CB-CZ2 4.42Å; L163-W193 HydrophobicContact CB-CZ3 4.06Å; L163-W193 HydrophobicContact CD1-CB 3.94Å; L163-W193 HydrophobicContact CD1-CD2 4.22Å; L163-W193 HydrophobicContact CD1-CG 3.86Å; L163-W193 HydrophobicContact CD2-CE3 4.49Å
164	S	94.3	Very high	95.3	Very high	72 Å²	72	47.8 Å²	47.8	50%	0.503	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	136.5	177.8	57.7	0	0	0	0	110.2
165	G	93.9	Very high	95.4	Very high	37 Å²	37	48 Å²	48	38%	0.381	28%	0.277	S	S	.	.			trans	162.5	-7.9	174	0	0	0	0	0	115.3	K191	G165-K191 WeakPolarHBondContact O-CE 3.4Å; G165-K191 PolarHBondContact O-NZ 3.2Å; G165-K191 VanDerWaalsContact O-NZ 3.13Å
166	H	97.3	Very high	95.5	Very high	12 Å²	12	42.8 Å²	42.8	6%	0.056	25%	0.246	C	C	.	.			trans	-75.6	149.7	162.7	-78.9	-66.8	0	0	0	110.4	V170 S183 S185 D187 T189 K191	H166-V170 HydrophobicContact CB-CG2 3.9Å; H166-S183 PolarHBondContact CD2-OG 2.96Å; H166-S183 PolarHBondContact NE2-O 3.46Å; H166-S183 PolarHBondContact NE2-OG 3.22Å; H166-S185 VanDerWaalsContact CE1-CB 3.42Å; H166-S185 WeakPolarHBondContact CE1-CB 3.39Å; H166-S185 WeakPolarHBondContact ND1-CB 3.41Å; H166-D187 WeakPolarHBondContact CA-OD2 3.32Å; H166-D187 WeakPolarHBondContact CB-OD2 3.45Å; H166-D187 IonicContact CE1-OD1 3.86Å; H166-D187 IonicContact CE1-OD2 3.12Å; H166-D187 IonicContact CG-OD2 3.76Å; H166-D187 VanDerWaalsContact ND1-CG 3.34Å; H166-D187 IonicContact ND1-OD1 3.17Å; H166-D187 PolarHBondContact ND1-OD1 3.05Å; H166-D187 IonicContact ND1-OD2 3.55Å; H166-D187 PolarHBondContact ND1-OD2 2.99Å; H166-T189 PolarHBondContact CE1-OG1 2.59Å; H166-T189 PolarHBondContact ND1-OG1 3.17Å; H166-K191 WeakPolarHBondContact ND1-CE 3.23Å
167	T	96.7	Very high	95.3	Very high	117 Å²	117	39.2 Å²	39.2	72%	0.718	23%	0.231	S	C	*	.	S	Bend	trans	-102.4	0.5	179.4	59.5	0	0	0	0	113.3	D187	T167-D187 PolarHBondContact N-OD2 2.96Å; T167-D187 VanDerWaalsContact OG1-CB 3.23Å; T167-D187 WeakPolarHBondContact OG1-CB 3.36Å
168	A	97.4	Very high	95.1	Very high	22 Å²	22	42.6 Å²	42.6	18%	0.182	24%	0.243	C	C	.	.	S	Bend	trans	-149.3	177.2	177.3	0	0	0	0	0	111	H147 V170 S185 Q186 D187	H147-A168 VanDerWaalsContact ND1-CA 3.34Å; H147-A168 WeakPolarHBondContact ND1-CA 3.45Å; H147-A168 PolarHBondContact ND1-O 2.67Å; A168-V170 PolarHBondContact O-N 2.88Å; A168-S185 PolarHBondContact O-OG 3.19Å; A168-Q186 HydrophobicContact CB-CB 3.89Å; A168-D187 HydrophobicContact CB-CB 4.02Å
169	S	97.3	Very high	95	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.021	22%	0.224	C	C	.	.			trans	-50	127.9	-175.3	175.9	0	0	0	0	112.4	N124 K145 H147 T171 S185 Q186	N124-S169 PolarHBondContact ND2-OG 2.91Å; K145-S169 WeakPolarHBondContact CA-OG 3.45Å; H147-S169 PolarHBondContact ND1-N 3.33Å; H147-S169 VanDerWaalsContact ND1-N 3.13Å; S169-T171 PolarHBondContact O-N 2.83Å; S169-S185 VanDerWaalsContact O-CA 3.3Å; S169-S185 WeakPolarHBondContact O-CA 3.13Å; S169-S185 PolarHBondContact O-OG 3.36Å; S169-Q186 PolarHBondContact O-N 2.9Å
170	V	97.9	Very high	95.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	100.8	177.4	-173.9	0	0	0	0	108.9	N124 S143 S144 H147 I149 H166 A168 A184	N124-V170 WeakPolarHBondContact CB-O 3.32Å; N124-V170 PolarHBondContact ND2-O 3.21Å; S143-V170 VanDerWaalsContact CB-CG1 3.47Å; S143-V170 WeakPolarHBondContact CB-O 3.05Å; S143-V170 PolarHBondContact OG-O 3.3Å; S143-V170 VanDerWaalsContact OG-O 3.07Å; S144-V170 PolarHBondContact O-N 3.45Å; H147-V170 WeakPolarHBondContact O-CG2 3.13Å; I149-V170 HydrophobicContact CD1-CG1 4.11Å; I149-V170 HydrophobicContact CD1-CG2 4.45Å; I149-V170 HydrophobicContact CG1-CB 4.46Å; I149-V170 HydrophobicContact CG1-CG1 3.88Å; I149-V170 HydrophobicContact CG1-CG2 4.35Å; H166-V170 HydrophobicContact CB-CG2 3.9Å; A168-V170 PolarHBondContact O-N 2.88Å; V170-A184 CarbonylContact C-O 3.54Å; V170-A184 WeakPolarHBondContact CA-O 3.21Å; V170-A184 VanDerWaalsContact CG1-O 3.23Å; V170-A184 WeakPolarHBondContact CG1-O 3.4Å
171	T	97	Very high	95.2	Very high	23 Å²	23	32.1 Å²	32.1	14%	0.141	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	-37.1	-171.5	51.6	0	0	0	0	112.9	N124 S169 A184 Q186 V211	N124-T171 WeakPolarHBondContact CB-O 3.43Å; S169-T171 PolarHBondContact O-N 2.83Å; T171-A184 PolarHBondContact N-O 3.03Å; T171-A184 PolarHBondContact OG1-O 2.91Å; T171-A184 VanDerWaalsContact OG1-O 3.09Å; T171-Q186 HydrophobicContact CG2-CG 3.76Å; T171-V211 WeakPolarHBondContact CB-O 3.45Å; T171-V211 WeakPolarHBondContact CG2-O 3.35Å; T171-V211 PolarHBondContact OG1-O 2.86Å
172	C	96.6	Very high	95.4	Very high	8 Å²	8	27.5 Å²	27.5	5%	0.054	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	144.7	-174.4	-171.8	0	0	0	0	111.4	R174 S183 A184 I214	C172-R174 PolarHBondContact SG-NH1 2.52Å; C172-S183 WeakPolarHBondContact O-CA 3.45Å; C172-A184 HydrophobicContact CB-CB 4.37Å; C172-A184 PolarHBondContact N-O 3.3Å; C172-A184 PolarHBondContact O-N 3.15Å; C172-I214 HydrophobicContact CB-CG1 3.99Å
173	V	97.6	Very high	95.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	142.8	173.4	62.5	0	0	0	0	110.5	T127 A141 I149 I181 Y182	T127-V173 HydrophobicContact CG2-CB 4.41Å; T127-V173 HydrophobicContact CG2-CG1 3.87Å; T127-V173 HydrophobicContact CG2-CG2 3.98Å; A141-V173 HydrophobicContact CB-CG2 4.45Å; I149-V173 HydrophobicContact CG2-CG2 4.1Å; V173-I181 HydrophobicContact CG2-CG2 3.54Å; V173-Y182 CarbonylContact C-O 3.51Å; V173-Y182 WeakPolarHBondContact CA-O 3.4Å
174	R	97	Very high	95.5	Very high	48 Å²	48	23 Å²	23	18%	0.181	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	135.3	175.3	-68.9	-66.7	-177.2	-89.9	-3.5	110.3	C172 I181 Y182 I214 L216 D219	C172-R174 PolarHBondContact SG-NH1 2.52Å; R174-I181 CarbonylContact O-C 3.56Å; R174-I181 WeakPolarHBondContact O-CA 3.37Å; R174-Y182 HydrophobicContact CB-CD2 4.4Å; R174-Y182 PolarHBondContact N-O 3.47Å; R174-Y182 PolarHBondContact O-N 3.35Å; R174-I214 HydrophobicContact CB-CD1 4.37Å; R174-I214 HydrophobicContact CG-CD1 4.13Å; R174-I214 HydrophobicContact CG-CG1 4.12Å; R174-L216 HydrophobicContact CB-CD1 4.01Å; R174-L216 HydrophobicContact CB-CG 4.16Å; R174-D219 IonicContact NE-OD2 3.68Å; R174-D219 PolarHBondContact NE-OD2 3.28Å; R174-D219 VanDerWaalsContact NE-OD2 3.17Å
175	W	95.8	Very high	95.7	Very high	9 Å²	9	19.6 Å²	19.6	3%	0.034	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	107.6	173.2	-152.8	-34.1	0	0	0	109	T127 Q129 F139 A141 I151 I181 A195	T127-W175 HydrophobicContact CG2-CB 3.91Å; T127-W175 PolarHBondContact OG1-N 2.7Å; Q129-W175 HydrophobicContact CB-CD2 4.09Å; Q129-W175 HydrophobicContact CB-CE3 3.94Å; Q129-W175 HydrophobicContact CB-CH2 3.75Å; Q129-W175 HydrophobicContact CB-CZ2 3.89Å; Q129-W175 HydrophobicContact CB-CZ3 3.78Å; Q129-W175 VanDerWaalsContact CD-CZ2 3.47Å; Q129-W175 HydrophobicContact CG-CD2 4.25Å; Q129-W175 HydrophobicContact CG-CH2 3.97Å; Q129-W175 HydrophobicContact CG-CZ2 3.6Å; Q129-W175 HydrophobicContact CG-CZ3 4.43Å; F139-W175 HydrophobicContact CB-CH2 3.91Å; F139-W175 HydrophobicContact CB-CZ3 4.2Å; A141-W175 HydrophobicContact CB-CE3 3.79Å; A141-W175 HydrophobicContact CB-CZ3 3.97Å; I151-W175 HydrophobicContact CD1-CH2 4.38Å; I151-W175 HydrophobicContact CG2-CH2 3.83Å; I151-W175 HydrophobicContact CG2-CZ3 4.16Å; W175-I181 HydrophobicContact CB-CG1 4.44Å; W175-I181 HydrophobicContact CD2-CD1 3.97Å; W175-I181 HydrophobicContact CD2-CG1 3.87Å; W175-I181 HydrophobicContact CE3-CD1 4.27Å; W175-I181 HydrophobicContact CG-CD1 4.44Å; W175-I181 HydrophobicContact CG-CG1 3.81Å; W175-I181 HydrophobicContact CH2-CD1 4.49Å; W175-I181 HydrophobicContact CZ2-CD1 4.2Å; W175-A195 HydrophobicContact CZ2-CB 3.71Å
176	G	92.8	Very high	95.9	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.118	C	C	.	.			trans	-76.7	161.6	179.2	0	0	0	0	0	112.9	E178 L180 E249	G176-E178 PolarHBondContact O-N 3.25Å; G176-L180 PolarHBondContact N-O 2.98Å; G176-E249 WeakPolarHBondContact CA-OE2 3.24Å
177	G	88.3	Confident	95.9	Very high	18 Å²	18	21 Å²	21	19%	0.186	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-14.4	177.5	0	0	0	0	0	113.9	H132 G179 E249	H132-G177 PolarHBondContact NE2-O 3.25Å; G177-G179 VanDerWaalsContact C-N 3.26Å; G177-G179 PolarHBondContact O-N 3.17Å; G177-E249 PolarHBondContact N-OE1 3.18Å
178	E	88.9	Confident	95.9	Very high	84 Å²	84	22 Å²	22	39%	0.393	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	13.7	179.7	-62.3	-179	-178.3	0	0	113.7	G176 L180 P248 E249 A266	G176-E178 PolarHBondContact O-N 3.25Å; E178-L180 VanDerWaalsContact C-N 3.27Å; E178-L180 PolarHBondContact O-N 3Å; E178-P248 WeakPolarHBondContact OE1-CA 3.44Å; E178-E249 HydrophobicContact CG-CG 3.97Å; E178-E249 PolarHBondContact OE1-N 3.3Å; E178-A266 WeakPolarHBondContact OE2-CB 3.01Å
179	G	91.4	Very high	95.9	Very high	15 Å²	15	22.1 Å²	22.1	16%	0.155	11%	0.109	C	C	.	.	S	Bend	trans	72.8	20.5	-175.9	0	0	0	0	0	113.5	G177 A195	G177-G179 VanDerWaalsContact C-N 3.26Å; G177-G179 PolarHBondContact O-N 3.17Å; G179-A195 VanDerWaalsContact O-CB 3.29Å; G179-A195 WeakPolarHBondContact O-CB 3.45Å; G179-A195 PolarHBondContact O-N 3.06Å
180	L	95.4	Very high	95.9	Very high	16 Å²	16	22 Å²	22	8%	0.084	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	143.1	178.3	-63.5	-180	0	0	0	110.9	G176 E178 Y182 V192 W193 R194 A266	G176-L180 PolarHBondContact N-O 2.98Å; E178-L180 VanDerWaalsContact C-N 3.27Å; E178-L180 PolarHBondContact O-N 3Å; L180-Y182 HydrophobicContact CB-CE1 4.06Å; L180-Y182 HydrophobicContact CB-CE2 4.3Å; L180-Y182 HydrophobicContact CD1-CE1 4.3Å; L180-V192 HydrophobicContact CB-CG1 4.22Å; L180-V192 HydrophobicContact CD1-CG1 4.23Å; L180-W193 CarbonylContact C-O 3.59Å; L180-W193 WeakPolarHBondContact CA-O 3.35Å; L180-R194 HydrophobicContact CD2-CB 4.47Å; L180-A266 HydrophobicContact CD1-CB 4.12Å
181	I	97.3	Very high	95.9	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	131.8	170	-65.9	168.6	0	0	0	108.1	A141 I151 L163 V173 R174 W175 V192 W193 A195	A141-I181 HydrophobicContact CB-CD1 4.29Å; I151-I181 HydrophobicContact CD1-CD1 3.56Å; I151-I181 HydrophobicContact CG1-CD1 4.06Å; L163-I181 HydrophobicContact CD1-CD1 4.12Å; L163-I181 HydrophobicContact CD1-CG2 4.37Å; V173-I181 HydrophobicContact CG2-CG2 3.54Å; R174-I181 CarbonylContact O-C 3.56Å; R174-I181 WeakPolarHBondContact O-CA 3.37Å; W175-I181 HydrophobicContact CB-CG1 4.44Å; W175-I181 HydrophobicContact CD2-CD1 3.97Å; W175-I181 HydrophobicContact CD2-CG1 3.87Å; W175-I181 HydrophobicContact CE3-CD1 4.27Å; W175-I181 HydrophobicContact CG-CD1 4.44Å; W175-I181 HydrophobicContact CG-CG1 3.81Å; W175-I181 HydrophobicContact CH2-CD1 4.49Å; W175-I181 HydrophobicContact CZ2-CD1 4.2Å; I181-V192 CarbonylContact O-C 3.55Å; I181-V192 WeakPolarHBondContact O-CA 3.04Å; I181-W193 HydrophobicContact CB-CB 4.3Å; I181-W193 PolarHBondContact N-O 3.35Å; I181-W193 PolarHBondContact O-N 2.83Å; I181-A195 HydrophobicContact CD1-CB 3.99Å; I181-A195 HydrophobicContact CG1-CB 4.12Å
182	Y	97.6	Very high	95.9	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	131.1	177.6	-46.2	-82.3	0	0	0	108.7	V173 R174 L180 K191 V192 I214 L216 E249 M251 P265	V173-Y182 CarbonylContact C-O 3.51Å; V173-Y182 WeakPolarHBondContact CA-O 3.4Å; R174-Y182 HydrophobicContact CB-CD2 4.4Å; R174-Y182 PolarHBondContact N-O 3.47Å; R174-Y182 PolarHBondContact O-N 3.35Å; L180-Y182 HydrophobicContact CB-CE1 4.06Å; L180-Y182 HydrophobicContact CB-CE2 4.3Å; L180-Y182 HydrophobicContact CD1-CE1 4.3Å; Y182-K191 WeakPolarHBondContact CA-O 3.09Å; Y182-V192 HydrophobicContact CD1-CB 4.25Å; Y182-V192 HydrophobicContact CD1-CG1 3.39Å; Y182-V192 HydrophobicContact CD1-CG2 4Å; Y182-V192 HydrophobicContact CE1-CG1 3.39Å; Y182-V192 HydrophobicContact CE1-CG2 4.46Å; Y182-V192 HydrophobicContact CG-CG1 4.44Å; Y182-I214 WeakPolarHBondContact O-CD1 3.27Å; Y182-L216 HydrophobicContact CD2-CD1 3.68Å; Y182-L216 HydrophobicContact CD2-CD2 3.57Å; Y182-L216 HydrophobicContact CD2-CG 4.15Å; Y182-L216 HydrophobicContact CE2-CD1 3.54Å; Y182-L216 HydrophobicContact CE2-CD2 3.6Å; Y182-L216 HydrophobicContact CE2-CG 4.21Å; Y182-L216 HydrophobicContact CG-CD2 4.2Å; Y182-E249 PolarHBondContact OH-OE2 3.46Å; Y182-M251 HydrophobicContact CD1-SD 4.22Å; Y182-M251 HydrophobicContact CG-SD 4.11Å; Y182-P265 HydrophobicContact CD1-CB 3.77Å; Y182-P265 HydrophobicContact CD1-CG 3.81Å; Y182-P265 HydrophobicContact CE1-CB 3.5Å; Y182-P265 VanDerWaalsContact CE1-CB 3.5Å; Y182-P265 HydrophobicContact CE1-CG 3.29Å
183	S	98.1	Very high	96	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133.9	179.6	62.9	0	0	0	0	111.8	I149 H166 C172 I190 K191 W193	I149-S183 WeakPolarHBondContact CD1-OG 3.16Å; H166-S183 PolarHBondContact CD2-OG 2.96Å; H166-S183 PolarHBondContact NE2-O 3.46Å; H166-S183 PolarHBondContact NE2-OG 3.22Å; C172-S183 WeakPolarHBondContact O-CA 3.45Å; S183-I190 CarbonylContact O-C 3.45Å; S183-I190 WeakPolarHBondContact O-CA 3.5Å; S183-I190 WeakPolarHBondContact O-CG2 3.3Å; S183-K191 PolarHBondContact N-O 2.92Å; S183-K191 PolarHBondContact O-N 3.4Å; S183-W193 PolarHBondContact OG-NE1 3.23Å
184	A	97.8	Very high	95.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	144.5	175.7	0	0	0	0	0	110.5	V170 T171 C172 I190 V211 I214	V170-A184 CarbonylContact C-O 3.54Å; V170-A184 WeakPolarHBondContact CA-O 3.21Å; V170-A184 VanDerWaalsContact CG1-O 3.23Å; V170-A184 WeakPolarHBondContact CG1-O 3.4Å; T171-A184 PolarHBondContact N-O 3.03Å; T171-A184 PolarHBondContact OG1-O 2.91Å; T171-A184 VanDerWaalsContact OG1-O 3.09Å; C172-A184 HydrophobicContact CB-CB 4.37Å; C172-A184 PolarHBondContact N-O 3.3Å; C172-A184 PolarHBondContact O-N 3.15Å; A184-I190 HydrophobicContact CB-CG1 4.4Å; A184-V211 HydrophobicContact CB-CB 3.98Å; A184-V211 HydrophobicContact CB-CG1 3.64Å; A184-I214 HydrophobicContact CB-CD1 4.29Å; A184-I214 HydrophobicContact CB-CG1 4.21Å; A184-I214 HydrophobicContact CB-CG2 3.75Å
185	S	98.1	Very high	95.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	159.9	-177.2	174.8	0	0	0	0	113.1	H166 A168 S169 D187 R188 T189 V211	H166-S185 VanDerWaalsContact CE1-CB 3.42Å; H166-S185 WeakPolarHBondContact CE1-CB 3.39Å; H166-S185 WeakPolarHBondContact ND1-CB 3.41Å; A168-S185 PolarHBondContact O-OG 3.19Å; S169-S185 VanDerWaalsContact O-CA 3.3Å; S169-S185 WeakPolarHBondContact O-CA 3.13Å; S169-S185 PolarHBondContact O-OG 3.36Å; S185-D187 WeakPolarHBondContact CB-OD1 3.42Å; S185-D187 PolarHBondContact O-N 3.12Å; S185-D187 PolarHBondContact OG-N 2.93Å; S185-D187 VanDerWaalsContact OG-N 3.1Å; S185-D187 PolarHBondContact OG-OD1 3.47Å; S185-R188 PolarHBondContact O-N 2.92Å; S185-T189 PolarHBondContact N-O 3.02Å; S185-V211 PolarHBondContact O-N 3.23Å
186	Q	97.5	Very high	95.6	Very high	57 Å²	57	29.8 Å²	29.8	27%	0.266	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-11.3	167.6	-65.5	-177.9	-16.8	0	0	112.9	A168 S169 T171 R188 W210	A168-Q186 HydrophobicContact CB-CB 3.89Å; S169-Q186 PolarHBondContact O-N 2.9Å; T171-Q186 HydrophobicContact CG2-CG 3.76Å; Q186-R188 PolarHBondContact O-N 3.44Å; Q186-R188 VanDerWaalsContact O-N 3.14Å; Q186-W210 HydrophobicContact CB-CB 4.3Å; Q186-W210 HydrophobicContact CB-CD2 4.13Å; Q186-W210 HydrophobicContact CB-CG 3.82Å; Q186-W210 HydrophobicContact CG-CB 4.09Å; Q186-W210 HydrophobicContact CG-CD2 3.85Å; Q186-W210 HydrophobicContact CG-CE3 4.21Å; Q186-W210 HydrophobicContact CG-CG 3.82Å
187	D	97	Very high	95.6	Very high	20 Å²	20	32.8 Å²	32.8	11%	0.107	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	3.6	171.9	71.8	10.1	0	0	0	113.5	H166 T167 A168 S185 T189	H166-D187 WeakPolarHBondContact CA-OD2 3.32Å; H166-D187 WeakPolarHBondContact CB-OD2 3.45Å; H166-D187 IonicContact CE1-OD1 3.86Å; H166-D187 IonicContact CE1-OD2 3.12Å; H166-D187 IonicContact CG-OD2 3.76Å; H166-D187 VanDerWaalsContact ND1-CG 3.34Å; H166-D187 IonicContact ND1-OD1 3.17Å; H166-D187 PolarHBondContact ND1-OD1 3.05Å; H166-D187 IonicContact ND1-OD2 3.55Å; H166-D187 PolarHBondContact ND1-OD2 2.99Å; T167-D187 PolarHBondContact N-OD2 2.96Å; T167-D187 VanDerWaalsContact OG1-CB 3.23Å; T167-D187 WeakPolarHBondContact OG1-CB 3.36Å; A168-D187 HydrophobicContact CB-CB 4.02Å; S185-D187 WeakPolarHBondContact CB-OD1 3.42Å; S185-D187 PolarHBondContact O-N 3.12Å; S185-D187 PolarHBondContact OG-N 2.93Å; S185-D187 VanDerWaalsContact OG-N 3.1Å; S185-D187 PolarHBondContact OG-OD1 3.47Å; D187-T189 VanDerWaalsContact CG-OG1 3.29Å; D187-T189 PolarHBondContact O-N 2.98Å; D187-T189 WeakPolarHBondContact OD1-CA 3.37Å; D187-T189 WeakPolarHBondContact OD1-CB 3.48Å; D187-T189 PolarHBondContact OD1-N 3.34Å; D187-T189 PolarHBondContact OD1-OG1 3.43Å; D187-T189 PolarHBondContact OD2-OG1 3.35Å
188	R	97.4	Very high	95.8	Very high	139 Å²	139	32.7 Å²	32.7	53%	0.525	16%	0.159	S	C	.	.	S	Bend	trans	74.1	12.3	178.1	-44.2	170.4	-77.2	-173.9	-4	113.5	S185 Q186 A208 H209	S185-R188 PolarHBondContact O-N 2.92Å; Q186-R188 PolarHBondContact O-N 3.44Å; Q186-R188 VanDerWaalsContact O-N 3.14Å; R188-A208 WeakPolarHBondContact CD-O 3.03Å; R188-H209 WeakPolarHBondContact CG-O 3.36Å
189	T	97.6	Very high	96.1	Very high	24 Å²	24	32.1 Å²	32.1	15%	0.147	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	156.2	179.6	75.7	0	0	0	0	111.9	H166 S185 D187 T203	H166-T189 PolarHBondContact CE1-OG1 2.59Å; H166-T189 PolarHBondContact ND1-OG1 3.17Å; S185-T189 PolarHBondContact N-O 3.02Å; D187-T189 VanDerWaalsContact CG-OG1 3.29Å; D187-T189 PolarHBondContact O-N 2.98Å; D187-T189 WeakPolarHBondContact OD1-CA 3.37Å; D187-T189 WeakPolarHBondContact OD1-CB 3.48Å; D187-T189 PolarHBondContact OD1-N 3.34Å; D187-T189 PolarHBondContact OD1-OG1 3.43Å; D187-T189 PolarHBondContact OD2-OG1 3.35Å; T189-T203 HydrophobicContact CG2-CG2 4.04Å
190	I	97.8	Very high	96.4	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.3	165.5	-56.2	155.7	0	0	0	106.9	S183 A184 L204 V211 I214 M251 S253	S183-I190 CarbonylContact O-C 3.45Å; S183-I190 WeakPolarHBondContact O-CA 3.5Å; S183-I190 WeakPolarHBondContact O-CG2 3.3Å; A184-I190 HydrophobicContact CB-CG1 4.4Å; I190-L204 HydrophobicContact CB-CB 4.18Å; I190-L204 HydrophobicContact CB-CD1 4.33Å; I190-L204 HydrophobicContact CG2-CD1 4.26Å; I190-L204 PolarHBondContact N-O 2.96Å; I190-L204 WeakPolarHBondContact O-CB 3.03Å; I190-L204 PolarHBondContact O-N 3.49Å; I190-V211 HydrophobicContact CD1-CG1 4.28Å; I190-V211 HydrophobicContact CG1-CG1 4.09Å; I190-V211 HydrophobicContact CG1-CG2 4.35Å; I190-I214 HydrophobicContact CD1-CG2 4.23Å; I190-I214 HydrophobicContact CG1-CG2 4.38Å; I190-M251 HydrophobicContact CD1-CE 4.23Å; I190-M251 HydrophobicContact CG2-CE 3.68Å; I190-M251 HydrophobicContact CG2-SD 4.15Å; I190-S253 WeakPolarHBondContact CD1-OG 3.38Å
191	K	97.6	Very high	96.3	Very high	22 Å²	22	35.7 Å²	35.7	10%	0.096	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	145.7	179.7	-71.7	177.2	-168.5	-86.5	0	110.2	G165 H166 Y182 S183 W193 L200 T203	G165-K191 WeakPolarHBondContact O-CE 3.4Å; G165-K191 PolarHBondContact O-NZ 3.2Å; G165-K191 VanDerWaalsContact O-NZ 3.13Å; H166-K191 WeakPolarHBondContact ND1-CE 3.23Å; Y182-K191 WeakPolarHBondContact CA-O 3.09Å; S183-K191 PolarHBondContact N-O 2.92Å; S183-K191 PolarHBondContact O-N 3.4Å; K191-W193 HydrophobicContact CB-CZ2 3.69Å; K191-W193 HydrophobicContact CD-CH2 4.03Å; K191-W193 HydrophobicContact CD-CZ2 3.53Å; K191-W193 HydrophobicContact CG-CZ2 4.23Å; K191-L200 HydrophobicContact CB-CD1 3.65Å; K191-L200 HydrophobicContact CD-CD1 4.05Å; K191-L200 HydrophobicContact CD-CD2 4.41Å; K191-L200 HydrophobicContact CG-CD1 3.87Å; K191-T203 HydrophobicContact CG-CG2 4.26Å; K191-T203 PolarHBondContact NZ-OG1 3.17Å
192	V	97.4	Very high	96.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	116.5	179.2	-159.7	0	0	0	0	109.7	L180 I181 Y182 C201 R202 L204 P265	L180-V192 HydrophobicContact CB-CG1 4.22Å; L180-V192 HydrophobicContact CD1-CG1 4.23Å; I181-V192 CarbonylContact O-C 3.55Å; I181-V192 WeakPolarHBondContact O-CA 3.04Å; Y182-V192 HydrophobicContact CD1-CB 4.25Å; Y182-V192 HydrophobicContact CD1-CG1 3.39Å; Y182-V192 HydrophobicContact CD1-CG2 4Å; Y182-V192 HydrophobicContact CE1-CG1 3.39Å; Y182-V192 HydrophobicContact CE1-CG2 4.46Å; Y182-V192 HydrophobicContact CG-CG1 4.44Å; V192-C201 PolarHBondContact O-N 2.88Å; V192-R202 HydrophobicContact CB-CB 4.37Å; V192-R202 VanDerWaalsContact CB-NH2 3.32Å; V192-R202 HydrophobicContact CG2-CB 4.25Å; V192-R202 PolarHBondContact N-O 3.06Å; V192-R202 PolarHBondContact O-N 3.33Å; V192-L204 HydrophobicContact CG2-CD1 4.04Å; V192-L204 HydrophobicContact CG2-CG 4.2Å; V192-P265 HydrophobicContact CG2-CB 3.97Å
193	W	97.6	Very high	96.2	Very high	6 Å²	6	39.7 Å²	39.7	2%	0.023	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	144.1	-173.6	-44.1	86.2	0	0	0	109.3	I149 L163 L180 I181 S183 K191 V199 L200	I149-W193 HydrophobicContact CD1-CZ2 4.24Å; L163-W193 HydrophobicContact CB-CD2 3.93Å; L163-W193 HydrophobicContact CB-CE3 3.85Å; L163-W193 HydrophobicContact CB-CG 4.46Å; L163-W193 HydrophobicContact CB-CH2 4.35Å; L163-W193 HydrophobicContact CB-CZ2 4.42Å; L163-W193 HydrophobicContact CB-CZ3 4.06Å; L163-W193 HydrophobicContact CD1-CB 3.94Å; L163-W193 HydrophobicContact CD1-CD2 4.22Å; L163-W193 HydrophobicContact CD1-CG 3.86Å; L163-W193 HydrophobicContact CD2-CE3 4.49Å; L180-W193 CarbonylContact C-O 3.59Å; L180-W193 WeakPolarHBondContact CA-O 3.35Å; I181-W193 HydrophobicContact CB-CB 4.3Å; I181-W193 PolarHBondContact N-O 3.35Å; I181-W193 PolarHBondContact O-N 2.83Å; S183-W193 PolarHBondContact OG-NE1 3.23Å; K191-W193 HydrophobicContact CB-CZ2 3.69Å; K191-W193 HydrophobicContact CD-CH2 4.03Å; K191-W193 HydrophobicContact CD-CZ2 3.53Å; K191-W193 HydrophobicContact CG-CZ2 4.23Å; W193-V199 CarbonylContact C-O 3.59Å; W193-V199 VanDerWaalsContact CA-O 3.32Å; W193-V199 WeakPolarHBondContact CA-O 3.13Å; W193-L200 HydrophobicContact CD2-CD1 4.01Å; W193-L200 HydrophobicContact CE3-CB 3.77Å; W193-L200 HydrophobicContact CE3-CD1 3.96Å; W193-L200 HydrophobicContact CE3-CG 4.45Å; W193-L200 HydrophobicContact CH2-CB 4.4Å; W193-L200 HydrophobicContact CH2-CD1 4.06Å; W193-L200 HydrophobicContact CZ2-CD1 4.1Å; W193-L200 HydrophobicContact CZ3-CB 3.66Å; W193-L200 HydrophobicContact CZ3-CD1 3.99Å; W193-L200 HydrophobicContact CZ3-CG 4.26Å
194	R	95.7	Very high	96.1	Very high	110 Å²	110	39.8 Å²	39.8	42%	0.415	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	127.1	165.5	-175.9	-175.9	-52.2	152.8	-3.1	108.1	L180 D196 D197 G198 V199	L180-R194 HydrophobicContact CD2-CB 4.47Å; R194-D196 VanDerWaalsContact C-N 3.32Å; R194-D196 PolarHBondContact O-N 3Å; R194-D197 WeakPolarHBondContact CB-OD1 3.47Å; R194-D197 WeakPolarHBondContact CD-OD1 3.26Å; R194-D197 WeakPolarHBondContact CD-OD2 3.35Å; R194-D197 IonicContact CZ-OD2 2.99Å; R194-D197 IonicContact NE-OD2 3.61Å; R194-D197 IonicContact NH1-OD2 2.88Å; R194-D197 PolarHBondContact NH1-OD2 3.4Å; R194-G198 WeakPolarHBondContact O-CA 3.44Å; R194-G198 PolarHBondContact O-N 2.93Å; R194-V199 PolarHBondContact N-O 2.71Å
195	A	94	Very high	95.9	Very high	6 Å²	6	43.7 Å²	43.7	5%	0.05	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-35.4	-173.7	0	0	0	0	0	112.4	W175 G179 I181	W175-A195 HydrophobicContact CZ2-CB 3.71Å; G179-A195 VanDerWaalsContact O-CB 3.29Å; G179-A195 WeakPolarHBondContact O-CB 3.45Å; G179-A195 PolarHBondContact O-N 3.06Å; I181-A195 HydrophobicContact CD1-CB 3.99Å; I181-A195 HydrophobicContact CG1-CB 4.12Å
196	D	91.9	Very high	95.6	Very high	108 Å²	108	45.8 Å²	45.8	58%	0.578	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-39.9	-172.3	-62.2	-26.1	0	0	0	113.8	R161 R194	R161-D196 PolarHBondContact NE-O 2.86Å; R161-D196 PolarHBondContact NH2-O 3.36Å; R194-D196 VanDerWaalsContact C-N 3.32Å; R194-D196 PolarHBondContact O-N 3Å
197	D	93	Very high	95.5	Very high	62 Å²	62	43.7 Å²	43.7	33%	0.332	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-18.4	-177.6	57.8	15.9	0	0	0	113	R161 R194 V199	R161-D197 PolarHBondContact NH1-O 2.76Å; R194-D197 WeakPolarHBondContact CB-OD1 3.47Å; R194-D197 WeakPolarHBondContact CD-OD1 3.26Å; R194-D197 WeakPolarHBondContact CD-OD2 3.35Å; R194-D197 IonicContact CZ-OD2 2.99Å; R194-D197 IonicContact NE-OD2 3.61Å; R194-D197 IonicContact NH1-OD2 2.88Å; R194-D197 PolarHBondContact NH1-OD2 3.4Å; D197-V199 HydrophobicContact CB-CG2 4.18Å; D197-V199 VanDerWaalsContact CG-CG2 3.4Å; D197-V199 WeakPolarHBondContact OD1-CB 3.3Å; D197-V199 WeakPolarHBondContact OD1-CG2 3.32Å; D197-V199 PolarHBondContact OD1-N 2.86Å; D197-V199 WeakPolarHBondContact OD2-CG2 3.25Å
198	G	93.4	Very high	95.5	Very high	16 Å²	16	46 Å²	46	17%	0.165	26%	0.262	C	S	.	.			trans	82.1	11	-175.6	0	0	0	0	0	114.1	R194 L200	R194-G198 WeakPolarHBondContact O-CA 3.44Å; R194-G198 PolarHBondContact O-N 2.93Å; G198-L200 PolarHBondContact O-N 2.96Å
199	V	95.7	Very high	95.5	Very high	72 Å²	72	43.2 Å²	43.2	44%	0.436	25%	0.254	S	S	.	.			trans	-69.2	132.6	-178.6	172.5	0	0	0	0	110.5	W193 R194 D197 C201	W193-V199 CarbonylContact C-O 3.59Å; W193-V199 VanDerWaalsContact CA-O 3.32Å; W193-V199 WeakPolarHBondContact CA-O 3.13Å; R194-V199 PolarHBondContact N-O 2.71Å; D197-V199 HydrophobicContact CB-CG2 4.18Å; D197-V199 VanDerWaalsContact CG-CG2 3.4Å; D197-V199 WeakPolarHBondContact OD1-CB 3.3Å; D197-V199 WeakPolarHBondContact OD1-CG2 3.32Å; D197-V199 PolarHBondContact OD1-N 2.86Å; D197-V199 WeakPolarHBondContact OD2-CG2 3.25Å; V199-C201 PolarHBondContact O-N 3.33Å; V199-C201 VanDerWaalsContact O-N 3.14Å
200	L	96.4	Very high	95.5	Very high	64 Å²	64	47.5 Å²	47.5	34%	0.335	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	101.7	169.6	179.2	61.3	0	0	0	109.9	K191 W193 G198 R202	K191-L200 HydrophobicContact CB-CD1 3.65Å; K191-L200 HydrophobicContact CD-CD1 4.05Å; K191-L200 HydrophobicContact CD-CD2 4.41Å; K191-L200 HydrophobicContact CG-CD1 3.87Å; W193-L200 HydrophobicContact CD2-CD1 4.01Å; W193-L200 HydrophobicContact CE3-CB 3.77Å; W193-L200 HydrophobicContact CE3-CD1 3.96Å; W193-L200 HydrophobicContact CE3-CG 4.45Å; W193-L200 HydrophobicContact CH2-CB 4.4Å; W193-L200 HydrophobicContact CH2-CD1 4.06Å; W193-L200 HydrophobicContact CZ2-CD1 4.1Å; W193-L200 HydrophobicContact CZ3-CB 3.66Å; W193-L200 HydrophobicContact CZ3-CD1 3.99Å; W193-L200 HydrophobicContact CZ3-CG 4.26Å; G198-L200 PolarHBondContact O-N 2.96Å; L200-R202 WeakPolarHBondContact CD1-O 3.32Å
201	C	94.6	Very high	95.4	Very high	43 Å²	43	47.4 Å²	47.4	29%	0.291	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-42.1	-179.2	-50.4	0	0	0	0	112.1	V192 V199	V192-C201 PolarHBondContact O-N 2.88Å; V199-C201 PolarHBondContact O-N 3.33Å; V199-C201 VanDerWaalsContact O-N 3.14Å
202	R	94.6	Very high	95.3	Very high	31 Å²	31	48 Å²	48	12%	0.117	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	147.4	-178.2	-60.5	120.5	-48.6	-165.4	1.4	111.9	V192 L200 L204 P265 A266 K269	V192-R202 HydrophobicContact CB-CB 4.37Å; V192-R202 VanDerWaalsContact CB-NH2 3.32Å; V192-R202 HydrophobicContact CG2-CB 4.25Å; V192-R202 PolarHBondContact N-O 3.06Å; V192-R202 PolarHBondContact O-N 3.33Å; L200-R202 WeakPolarHBondContact CD1-O 3.32Å; R202-L204 HydrophobicContact CB-CD2 4.36Å; R202-P265 VanDerWaalsContact CD-O 3.24Å; R202-P265 WeakPolarHBondContact CD-O 3.38Å; R202-P265 PolarHBondContact NE-O 3.28Å; R202-P265 PolarHBondContact NH1-O 2.86Å; R202-P265 VanDerWaalsContact NH1-O 3.14Å; R202-A266 PolarHBondContact NH1-O 3.47Å; R202-K269 HydrophobicContact CB-CG 4.49Å; R202-K269 HydrophobicContact CG-CG 4.16Å
203	T	96.6	Very high	95.3	Very high	52 Å²	52	48.5 Å²	48.5	32%	0.319	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	120.9	161.4	-61.5	0	0	0	0	107.3	T189 K191	T189-T203 HydrophobicContact CG2-CG2 4.04Å; K191-T203 HydrophobicContact CG-CG2 4.26Å; K191-T203 PolarHBondContact NZ-OG1 3.17Å
204	L	96.3	Very high	95.3	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	120.5	177.3	-48.8	176.5	0	0	0	107.8	I190 V192 R202 M251 W263 P265	I190-L204 HydrophobicContact CB-CB 4.18Å; I190-L204 HydrophobicContact CB-CD1 4.33Å; I190-L204 HydrophobicContact CG2-CD1 4.26Å; I190-L204 PolarHBondContact N-O 2.96Å; I190-L204 WeakPolarHBondContact O-CB 3.03Å; I190-L204 PolarHBondContact O-N 3.49Å; V192-L204 HydrophobicContact CG2-CD1 4.04Å; V192-L204 HydrophobicContact CG2-CG 4.2Å; R202-L204 HydrophobicContact CB-CD2 4.36Å; L204-M251 HydrophobicContact CD1-CE 3.63Å; L204-W263 HydrophobicContact CB-CE3 4.13Å; L204-W263 HydrophobicContact CB-CH2 4.14Å; L204-W263 HydrophobicContact CB-CZ3 3.9Å; L204-W263 HydrophobicContact CD1-CB 4.45Å; L204-W263 HydrophobicContact CD1-CD2 4.01Å; L204-W263 HydrophobicContact CD1-CE3 3.96Å; L204-W263 HydrophobicContact CD1-CG 4.22Å; L204-W263 HydrophobicContact CD2-CE3 4.25Å; L204-W263 HydrophobicContact CD2-CZ3 4.42Å; L204-W263 HydrophobicContact CG-CE3 4.34Å; L204-P265 HydrophobicContact CD1-CB 4Å
205	S	94	Very high	95.3	Very high	83 Å²	83	43 Å²	43	58%	0.58	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	139.3	-179.9	55.8	0	0	0	0	109.3
206	G	91.7	Very high	95.4	Very high	43 Å²	43	42.8 Å²	42.8	44%	0.443	25%	0.252	S	S	.	.			trans	172.7	-30	178.4	0	0	0	0	0	113.4	F261	G206-F261 WeakPolarHBondContact O-CE2 3.32Å; G206-F261 WeakPolarHBondContact O-CZ 3.34Å
207	H	96.2	Very high	95.6	Very high	14 Å²	14	37.9 Å²	37.9	7%	0.065	23%	0.226	C	C	.	.			trans	-70.8	141.2	172.8	-75	-65.5	0	0	0	111.6	V211 S253 S255 D257 T259 F261	H207-V211 HydrophobicContact CB-CG2 4.02Å; H207-S253 WeakPolarHBondContact NE2-CB 3.46Å; H207-S253 PolarHBondContact NE2-OG 3.18Å; H207-S255 VanDerWaalsContact CE1-CB 3.4Å; H207-S255 WeakPolarHBondContact CE1-CB 3.42Å; H207-S255 WeakPolarHBondContact ND1-CB 3.38Å; H207-D257 WeakPolarHBondContact CA-OD2 3.44Å; H207-D257 IonicContact ND1-OD1 3.62Å; H207-D257 IonicContact ND1-OD2 2.83Å; H207-T259 PolarHBondContact CE1-O 2.92Å; H207-T259 PolarHBondContact ND1-OG1 3.02Å; H207-F261 AromaticContact CD2-CD2 3.87Å; H207-F261 AromaticContact CE1-CD2 3.42Å; H207-F261 VanDerWaalsContact CE1-CD2 3.42Å; H207-F261 WeakPolarHBondContact CE1-CD2 3.5Å; H207-F261 AromaticContact CE1-CE2 3.98Å; H207-F261 AromaticContact CG-CD2 3.9Å; H207-F261 AromaticContact CG-CE2 3.99Å; H207-F261 AromaticContact ND1-CD2 3.6Å; H207-F261 AromaticContact ND1-CE2 3.69Å; H207-F261 AromaticContact NE2-CD2 3.58Å
208	A	95.4	Very high	95.6	Very high	68 Å²	68	35.2 Å²	35.2	56%	0.562	21%	0.212	S	C	*	.	S	Bend	trans	-90.1	-17.9	177.6	0	0	0	0	0	112.7	R188 D257	R188-A208 WeakPolarHBondContact CD-O 3.03Å; A208-D257 HydrophobicContact CB-CB 4.05Å; A208-D257 PolarHBondContact N-OD2 3.03Å
209	H	97.1	Very high	95.6	Very high	80 Å²	80	36 Å²	36	37%	0.37	21%	0.212	S	C	.	.	S	Bend	trans	-133.6	-175.8	179.4	-149.2	-85.1	0	0	0	111.5	R188 V211 S255 D256 D257	R188-H209 WeakPolarHBondContact CG-O 3.36Å; H209-V211 PolarHBondContact O-N 3.37Å; H209-S255 VanDerWaalsContact C-OG 3.31Å; H209-S255 PolarHBondContact O-OG 3.13Å; H209-S255 VanDerWaalsContact O-OG 3.09Å; H209-D256 HydrophobicContact CB-CB 3.71Å; H209-D256 IonicContact CE1-OD2 3.42Å; H209-D256 PolarHBondContact CE1-OD2 3.48Å; H209-D256 WeakPolarHBondContact ND1-CB 3.47Å; H209-D256 IonicContact ND1-OD2 2.67Å; H209-D256 PolarHBondContact ND1-OD2 3.12Å; H209-D257 HydrophobicContact CB-CB 3.92Å
210	W	97.4	Very high	95.4	Very high	114 Å²	114	34.4 Å²	34.4	43%	0.432	20%	0.199	S	C	.	.			trans	-52.9	135.9	-178.3	-58.7	-10.2	0	0	0	111.7	Q186 S255 D256	Q186-W210 HydrophobicContact CB-CB 4.3Å; Q186-W210 HydrophobicContact CB-CD2 4.13Å; Q186-W210 HydrophobicContact CB-CG 3.82Å; Q186-W210 HydrophobicContact CG-CB 4.09Å; Q186-W210 HydrophobicContact CG-CD2 3.85Å; Q186-W210 HydrophobicContact CG-CE3 4.21Å; Q186-W210 HydrophobicContact CG-CG 3.82Å; W210-S255 WeakPolarHBondContact O-CA 3.3Å; W210-S255 WeakPolarHBondContact O-CB 3.21Å; W210-S255 PolarHBondContact O-OG 2.96Å; W210-D256 WeakPolarHBondContact CB-OD2 3.28Å; W210-D256 PolarHBondContact O-N 3.11Å
211	V	97.5	Very high	95	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	116.7	174	-170.6	0	0	0	0	107.6	T171 A184 S185 I190 H207 H209 I214	T171-V211 WeakPolarHBondContact CB-O 3.45Å; T171-V211 WeakPolarHBondContact CG2-O 3.35Å; T171-V211 PolarHBondContact OG1-O 2.86Å; A184-V211 HydrophobicContact CB-CB 3.98Å; A184-V211 HydrophobicContact CB-CG1 3.64Å; S185-V211 PolarHBondContact O-N 3.23Å; I190-V211 HydrophobicContact CD1-CG1 4.28Å; I190-V211 HydrophobicContact CG1-CG1 4.09Å; I190-V211 HydrophobicContact CG1-CG2 4.35Å; H207-V211 HydrophobicContact CB-CG2 4.02Å; H209-V211 PolarHBondContact O-N 3.37Å; V211-I214 HydrophobicContact CG1-CG2 4.34Å
212	N	95.6	Very high	94.8	Very high	34 Å²	34	30.1 Å²	30.1	18%	0.182	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-40.9	-172.1	-65.2	-27.4	0	0	0	112.5	G254 D256 I282	N212-G254 PolarHBondContact N-O 3.23Å; N212-D256 PolarHBondContact ND2-OD1 2.8Å; N212-I282 PolarHBondContact ND2-O 2.87Å
213	S	95.7	Very high	94.5	Very high	10 Å²	10	31.5 Å²	31.5	7%	0.07	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.1	-172.9	-176.6	0	0	0	0	110.5	S253 G254 V285	S213-S253 CarbonylContact O-C 3.59Å; S213-S253 WeakPolarHBondContact O-CA 3.5Å; S213-G254 PolarHBondContact N-O 2.59Å; S213-G254 PolarHBondContact O-N 3.03Å; S213-V285 PolarHBondContact OG-N 2.9Å
214	I	97.5	Very high	93.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	147.2	165.8	52.3	169.6	0	0	0	108.8	C172 R174 Y182 A184 I190 V211 M251 V252	C172-I214 HydrophobicContact CB-CG1 3.99Å; R174-I214 HydrophobicContact CB-CD1 4.37Å; R174-I214 HydrophobicContact CG-CD1 4.13Å; R174-I214 HydrophobicContact CG-CG1 4.12Å; Y182-I214 WeakPolarHBondContact O-CD1 3.27Å; A184-I214 HydrophobicContact CB-CD1 4.29Å; A184-I214 HydrophobicContact CB-CG1 4.21Å; A184-I214 HydrophobicContact CB-CG2 3.75Å; I190-I214 HydrophobicContact CD1-CG2 4.23Å; I190-I214 HydrophobicContact CG1-CG2 4.38Å; V211-I214 HydrophobicContact CG1-CG2 4.34Å; I214-M251 HydrophobicContact CB-CG 4.38Å; I214-M251 HydrophobicContact CB-SD 4.21Å; I214-M251 HydrophobicContact CD1-SD 4.35Å; I214-M251 HydrophobicContact CG2-SD 4.18Å; I214-V252 CarbonylContact C-O 3.55Å; I214-V252 VanDerWaalsContact CA-O 3.26Å; I214-V252 WeakPolarHBondContact CA-O 3.49Å
215	A	97.4	Very high	92.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	141.5	172.6	0	0	0	0	0	110.1	D219 M251 V252 V285 L286 F287	A215-D219 WeakPolarHBondContact CA-OD2 3.26Å; A215-M251 CarbonylContact O-C 3.59Å; A215-M251 VanDerWaalsContact O-CA 3.29Å; A215-M251 WeakPolarHBondContact O-CA 3.27Å; A215-V252 PolarHBondContact N-O 3.06Å; A215-V252 PolarHBondContact O-N 2.95Å; A215-V285 HydrophobicContact CB-CG1 4.36Å; A215-V285 VanDerWaalsContact CB-O 3.27Å; A215-V285 WeakPolarHBondContact CB-O 3.27Å; A215-L286 HydrophobicContact CB-CD2 4.47Å; A215-F287 HydrophobicContact CB-CD2 4.19Å; A215-F287 WeakPolarHBondContact O-CE2 3.36Å
216	L	96.3	Very high	91.1	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	149	170.9	-51.2	175.3	0	0	0	109.8	R174 Y182 T218 D219 R250 M251 F287	R174-L216 HydrophobicContact CB-CD1 4.01Å; R174-L216 HydrophobicContact CB-CG 4.16Å; Y182-L216 HydrophobicContact CD2-CD1 3.68Å; Y182-L216 HydrophobicContact CD2-CD2 3.57Å; Y182-L216 HydrophobicContact CD2-CG 4.15Å; Y182-L216 HydrophobicContact CE2-CD1 3.54Å; Y182-L216 HydrophobicContact CE2-CD2 3.6Å; Y182-L216 HydrophobicContact CE2-CG 4.21Å; Y182-L216 HydrophobicContact CG-CD2 4.2Å; L216-T218 PolarHBondContact O-N 2.76Å; L216-D219 VanDerWaalsContact CB-OD1 3.28Å; L216-D219 WeakPolarHBondContact CB-OD1 3.22Å; L216-D219 WeakPolarHBondContact CG-OD1 3.27Å; L216-D219 PolarHBondContact N-OD2 2.79Å; L216-D219 WeakPolarHBondContact O-CB 3.27Å; L216-D219 PolarHBondContact O-N 3.12Å; L216-R250 WeakPolarHBondContact CA-O 3.46Å; L216-M251 HydrophobicContact CD2-CB 3.71Å; L216-M251 HydrophobicContact CD2-CG 3.87Å; L216-M251 HydrophobicContact CD2-SD 4.28Å; L216-F287 VanDerWaalsContact C-CD2 3.44Å
217	H	94.6	Very high	89.5	Confident	5 Å²	5	29.9 Å²	29.9	2%	0.023	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-15.6	173.3	88.5	-64.8	0	0	0	113.3	R250 F287	H217-R250 HydrophobicContact CB-CB 4.3Å; H217-R250 PolarHBondContact CD2-NH2 3.09Å; H217-R250 VanDerWaalsContact CD2-NH2 3.28Å; H217-R250 PolarHBondContact N-O 3.4Å; H217-R250 PolarHBondContact ND1-N 2.78Å; H217-R250 VanDerWaalsContact ND1-N 3.17Å; H217-F287 VanDerWaalsContact CA-CG 3.47Å; H217-F287 HydrophobicContact CB-CB 4.39Å; H217-F287 HydrophobicContact CB-CD1 3.56Å; H217-F287 HydrophobicContact CB-CD2 4.13Å; H217-F287 HydrophobicContact CB-CE1 3.67Å; H217-F287 HydrophobicContact CB-CE2 4.22Å; H217-F287 HydrophobicContact CB-CG 3.78Å; H217-F287 HydrophobicContact CB-CZ 4Å
218	T	92.9	Very high	87.1	Confident	7 Å²	7	31.3 Å²	31.3	4%	0.043	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-11.6	177.1	42.9	0	0	0	0	113.3	L216 Y220 A221 L222 L241 L244 E249	L216-T218 PolarHBondContact O-N 2.76Å; T218-Y220 VanDerWaalsContact C-N 3.26Å; T218-Y220 PolarHBondContact O-N 2.62Å; T218-Y220 VanDerWaalsContact O-N 3.09Å; T218-A221 WeakPolarHBondContact O-CA 3.28Å; T218-A221 WeakPolarHBondContact O-CB 3.39Å; T218-A221 PolarHBondContact O-N 2.88Å; T218-L222 WeakPolarHBondContact O-CG 3.43Å; T218-L222 PolarHBondContact O-N 2.77Å; T218-L241 HydrophobicContact CG2-CD2 3.56Å; T218-L244 HydrophobicContact CG2-CD1 3.84Å; T218-E249 HydrophobicContact CG2-CG 4.05Å; T218-E249 PolarHBondContact OG1-OE1 2.99Å
219	D	93.1	Very high	84.8	Confident	32 Å²	32	36 Å²	36	17%	0.171	17%	0.165	C	C	.	.	H	α-helix	trans	-51.6	-43	-171.2	-82	-10.8	0	0	0	112.5	R174 A215 L216 L222 R223	R174-D219 IonicContact NE-OD2 3.68Å; R174-D219 PolarHBondContact NE-OD2 3.28Å; R174-D219 VanDerWaalsContact NE-OD2 3.17Å; A215-D219 WeakPolarHBondContact CA-OD2 3.26Å; L216-D219 VanDerWaalsContact CB-OD1 3.28Å; L216-D219 WeakPolarHBondContact CB-OD1 3.22Å; L216-D219 WeakPolarHBondContact CG-OD1 3.27Å; L216-D219 PolarHBondContact N-OD2 2.79Å; L216-D219 WeakPolarHBondContact O-CB 3.27Å; L216-D219 PolarHBondContact O-N 3.12Å; D219-L222 PolarHBondContact O-N 2.91Å; D219-R223 WeakPolarHBondContact O-CB 3.38Å; D219-R223 PolarHBondContact O-N 3.33Å
220	Y	91.5	Very high	82.1	Confident	38 Å²	38	40.2 Å²	40.2	15%	0.149	18%	0.183	C	C	.	.	H	α-helix	trans	-67.1	-40.3	179.4	-173.1	-88.3	0	0	0	112.9	T218 R223 C224 P289 S331 P373	T218-Y220 VanDerWaalsContact C-N 3.26Å; T218-Y220 PolarHBondContact O-N 2.62Å; T218-Y220 VanDerWaalsContact O-N 3.09Å; Y220-R223 PolarHBondContact O-N 2.91Å; Y220-C224 PolarHBondContact O-N 3.2Å; Y220-P289 HydrophobicContact CD1-CB 3.48Å; Y220-P289 VanDerWaalsContact CD1-CB 3.48Å; Y220-P289 HydrophobicContact CD1-CG 3.94Å; Y220-P289 HydrophobicContact CD2-CB 4.22Å; Y220-P289 HydrophobicContact CD2-CG 3.75Å; Y220-P289 HydrophobicContact CE1-CB 3.84Å; Y220-P289 HydrophobicContact CE1-CG 4.13Å; Y220-P289 HydrophobicContact CE2-CG 3.95Å; Y220-P289 HydrophobicContact CG-CB 3.7Å; Y220-P289 HydrophobicContact CG-CG 3.76Å; Y220-S331 WeakPolarHBondContact OH-CA 3.28Å; Y220-S331 WeakPolarHBondContact OH-CB 3.29Å; Y220-P373 PolarHBondContact OH-O 3.11Å
221	A	89	Confident	79.1	Confident	2 Å²	2	38 Å²	38	2%	0.017	19%	0.188	C	C	.	.	H	α-helix	trans	-66.9	-43.1	177.9	0	0	0	0	0	111	T218 R223 C224 E225 K240 L241 L244	T218-A221 WeakPolarHBondContact O-CA 3.28Å; T218-A221 WeakPolarHBondContact O-CB 3.39Å; T218-A221 PolarHBondContact O-N 2.88Å; A221-R223 VanDerWaalsContact C-N 3.32Å; A221-R223 PolarHBondContact O-N 2.51Å; A221-C224 CarbonylContact O-C 3.38Å; A221-C224 PolarHBondContact O-N 3.49Å; A221-E225 WeakPolarHBondContact O-CG 3.37Å; A221-E225 PolarHBondContact O-N 3.39Å; A221-K240 HydrophobicContact CB-CB 3.87Å; A221-L241 HydrophobicContact CB-CD2 3.74Å; A221-L241 HydrophobicContact CB-CG 4.12Å; A221-L244 HydrophobicContact CB-CD1 3.97Å
222	L	89.8	Confident	76.1	Confident	15 Å²	15	42.6 Å²	42.6	8%	0.079	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-33.9	176.4	-60.6	174.1	0	0	0	112.1	A87 P130 T218 D219 C224 E225 L241	A87-L222 WeakPolarHBondContact CB-O 3.19Å; P130-L222 HydrophobicContact CB-CD2 3.93Å; P130-L222 HydrophobicContact CG-CD2 4.06Å; T218-L222 WeakPolarHBondContact O-CG 3.43Å; T218-L222 PolarHBondContact O-N 2.77Å; D219-L222 PolarHBondContact O-N 2.91Å; L222-C224 VanDerWaalsContact C-N 3.3Å; L222-C224 PolarHBondContact O-N 2.88Å; L222-E225 WeakPolarHBondContact CD2-OE1 3.35Å; L222-L241 HydrophobicContact CD2-CD1 3.87Å; L222-L241 HydrophobicContact CD2-CD2 3.95Å; L222-L241 HydrophobicContact CD2-CG 4.43Å; L222-L241 HydrophobicContact CG-CD2 4.3Å
223	R	88.3	Confident	73.3	Confident	61 Å²	61	48.1 Å²	48.1	23%	0.23	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-32.8	173.5	-178.4	-178.4	174.5	-174.2	-0.9	112.5	F56 P58 D219 Y220 A221 D370	F56-R223 PolarHBondContact O-NH2 3Å; P58-R223 WeakPolarHBondContact CB-O 3.42Å; P58-R223 WeakPolarHBondContact CG-O 3.24Å; D219-R223 WeakPolarHBondContact O-CB 3.38Å; D219-R223 PolarHBondContact O-N 3.33Å; Y220-R223 PolarHBondContact O-N 2.91Å; A221-R223 VanDerWaalsContact C-N 3.32Å; A221-R223 PolarHBondContact O-N 2.51Å; R223-D370 IonicContact CZ-OD1 3.34Å; R223-D370 IonicContact CZ-OD2 3.58Å; R223-D370 IonicContact NH1-OD1 3.88Å; R223-D370 PolarHBondContact NH1-OD1 2.93Å; R223-D370 IonicContact NH1-OD2 3.8Å; R223-D370 PolarHBondContact NH1-OD2 2.79Å; R223-D370 IonicContact NH2-OD1 2.88Å; R223-D370 IonicContact NH2-OD2 3.28Å; R223-D370 PolarHBondContact NH2-OD2 3.43Å
224	C	81.2	Confident	70.5	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.007	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	37.1	-167.4	-53.3	0	0	0	0	113.5	Y220 A221 L222 K240	Y220-C224 PolarHBondContact O-N 3.2Å; A221-C224 CarbonylContact O-C 3.38Å; A221-C224 PolarHBondContact O-N 3.49Å; L222-C224 VanDerWaalsContact C-N 3.3Å; L222-C224 PolarHBondContact O-N 2.88Å; C224-K240 PolarHBondContact O-NZ 3.26Å
225	E	70.7	Confident	67.8	Low	19 Å²	19	59.4 Å²	59.4	9%	0.089	32%	0.316	C	S	.	.	S	Bend	trans	-60.2	-48.4	-170.3	-68	-163.8	-170.2	0	0	113.5	L131 H132 A221 L222 P238	L131-E225 HydrophobicContact CB-CB 4.27Å; L131-E225 HydrophobicContact CB-CG 4.49Å; L131-E225 VanDerWaalsContact CB-OE2 3.28Å; L131-E225 WeakPolarHBondContact CB-OE2 3.4Å; L131-E225 HydrophobicContact CD2-CB 4.3Å; L131-E225 PolarHBondContact N-OE1 3.45Å; L131-E225 PolarHBondContact N-OE2 2.87Å; H132-E225 IonicContact CE1-OE1 3.88Å; H132-E225 IonicContact CG-OE2 3.57Å; H132-E225 PolarHBondContact N-OE2 2.84Å; H132-E225 IonicContact ND1-OE1 3.31Å; H132-E225 PolarHBondContact ND1-OE1 3.45Å; H132-E225 IonicContact ND1-OE2 2.87Å; H132-E225 PolarHBondContact ND1-OE2 2.84Å; A221-E225 WeakPolarHBondContact O-CG 3.37Å; A221-E225 PolarHBondContact O-N 3.39Å; L222-E225 WeakPolarHBondContact CD2-OE1 3.35Å; E225-P238 HydrophobicContact CB-CB 4.42Å; E225-P238 HydrophobicContact CB-CG 4.21Å; E225-P238 HydrophobicContact CG-CG 3.87Å
226	V	65.2	Low	65.2	Low	57 Å²	57	62.3 Å²	62.3	35%	0.345	34%	0.335	S	S	.	.	S	Bend	trans	-78.3	-37.2	-177.3	-171.4	0	0	0	0	112.2	L131 S228 A231	L131-V226 HydrophobicContact CD2-CB 4.48Å; L131-V226 HydrophobicContact CD2-CG2 3.02Å; V226-S228 VanDerWaalsContact C-N 3.34Å; V226-S228 PolarHBondContact O-N 2.82Å; V226-A231 WeakPolarHBondContact O-CB 3.26Å
227	H	56.6	Low	63	Low	68 Å²	68	64.7 Å²	64.7	32%	0.315	35%	0.35	S	S	.	.			trans	-98	42	-158.9	-60.2	103.4	0	0	0	113.2	D59 D88	D59-H227 HydrophobicContact CB-CB 4.37Å; D88-H227 PolarHBondContact O-CE1 3.25Å
228	S	46.3	Very low	61.3	Low	44 Å²	44	65.2 Å²	65.2	31%	0.308	35%	0.354	S	S	.	.	S	Bend	trans	-69.4	139.8	160.5	-162.2	0	0	0	0	108.6	V226 K230 A231	V226-S228 VanDerWaalsContact C-N 3.34Å; V226-S228 PolarHBondContact O-N 2.82Å; S228-K230 CarbonylContact O-C 3.51Å; S228-K230 PolarHBondContact O-N 2.79Å; S228-A231 PolarHBondContact O-N 3.12Å; S228-A231 VanDerWaalsContact O-N 3.14Å
229	R	47.2	Very low	59.9	Low	167 Å²	167	70.7 Å²	70.7	63%	0.63	38%	0.379	S	S	*	.	S	Bend	trans	-56.5	-0.8	178	-82.8	-179.8	169.2	159.6	-3.2	114.3	N374 E376	R229-N374 PolarHBondContact NH2-O 3.26Å; R229-E376 IonicContact NH2-OE1 2.99Å; R229-E376 PolarHBondContact NH2-OE1 3.15Å; R229-E376 VanDerWaalsContact NH2-OE1 3.13Å
230	K	41.2	Very low	58.5	Low	169 Å²	169	71.6 Å²	71.6	74%	0.735	38%	0.382	S	S	*	.	S	Bend	trans	-131.9	77.5	165.8	-65.7	-178.4	178.3	-177.9	0	109.2	S228 T232	S228-K230 CarbonylContact O-C 3.51Å; S228-K230 PolarHBondContact O-N 2.79Å; K230-T232 VanDerWaalsContact C-N 3.33Å; K230-T232 PolarHBondContact O-N 2.86Å; K230-T232 VanDerWaalsContact O-N 3.11Å
231	A	33.9	Very low	57.4	Low	66 Å²	66	70.8 Å²	70.8	55%	0.545	38%	0.38	S	S	.	.			trans	-80.4	84.7	172.1	0	0	0	0	0	108.8	V226 S228	V226-A231 WeakPolarHBondContact O-CB 3.26Å; S228-A231 PolarHBondContact O-N 3.12Å; S228-A231 VanDerWaalsContact O-N 3.14Å
232	T	34.1	Very low	56.2	Low	98 Å²	98	77.7 Å²	77.7	60%	0.601	41%	0.406	S	S	*	.			trans	-70.1	129.6	159.3	30.3	0	0	0	0	107.9	K230 S234	K230-T232 VanDerWaalsContact C-N 3.33Å; K230-T232 PolarHBondContact O-N 2.86Å; K230-T232 VanDerWaalsContact O-N 3.11Å; T232-S234 PolarHBondContact O-N 3.14Å
233	T	36.1	Very low	54.8	Low	149 Å²	149	80 Å²	80	91%	0.914	43%	0.427	S	S	*	.			trans	-68.5	41.3	-173.5	47.8	0	0	0	0	114.5
234	S	36.9	Very low	54.1	Low	69 Å²	69	78.2 Å²	78.2	48%	0.483	42%	0.422	S	S	.	.			trans	-98.7	115.5	-179.8	178.9	0	0	0	0	110.1	T232 T236	T232-S234 PolarHBondContact O-N 3.14Å; S234-T236 PolarHBondContact O-N 3.05Å; S234-T236 WeakPolarHBondContact OG-CG2 3.37Å; S234-T236 PolarHBondContact OG-OG1 2.73Å
235	N	40.9	Very low	53.3	Low	178 Å²	178	80.1 Å²	80.1	95%	0.952	44%	0.441	S	S	*	.			trans	-64.5	28.8	173.1	-75.6	-17.6	0	0	0	114.1
236	T	44.3	Very low	53.1	Low	62 Å²	62	85.7 Å²	85.7	38%	0.38	48%	0.483	S	S	.	.	S	Bend	trans	-98.3	144.9	177.9	51.9	0	0	0	0	109.6	S234	S234-T236 PolarHBondContact O-N 3.05Å; S234-T236 WeakPolarHBondContact OG-CG2 3.37Å; S234-T236 PolarHBondContact OG-OG1 2.73Å
237	C	50.4	Low	53.7	Low	51 Å²	51	84.8 Å²	84.8	35%	0.345	49%	0.485	S	S	.	.	S	Bend	trans	-28.9	119.9	172	173.2	0	0	0	0	111.2	E239 R242	C237-E239 PolarHBondContact O-N 2.85Å; C237-R242 PolarHBondContact O-NE 3.01Å
238	P	58.9	Low	55.1	Low	16 Å²	16	84.2 Å²	84.2	10%	0.104	49%	0.487	C	S	.	.			trans	-53.5	136.7	-165	14.1	-28.4	0	0	0	110.5	E225 K240 L241 R242	E225-P238 HydrophobicContact CB-CB 4.42Å; E225-P238 HydrophobicContact CB-CG 4.21Å; E225-P238 HydrophobicContact CG-CG 3.87Å; P238-K240 PolarHBondContact O-N 3.01Å; P238-L241 HydrophobicContact CG-CB 4.33Å; P238-L241 HydrophobicContact CG-CD1 3.57Å; P238-L241 HydrophobicContact CG-CG 3.87Å; P238-L241 WeakPolarHBondContact O-CB 3.26Å; P238-L241 PolarHBondContact O-N 2.67Å; P238-R242 PolarHBondContact O-N 3.44Å
239	E	61.4	Low	57.3	Low	122 Å²	122	82.4 Å²	82.4	57%	0.57	47%	0.474	S	S	*	.	H	α-helix	trans	-49.9	-30.9	-177	-66.8	-176	163.8	0	0	112.4	C237 R242 A243	C237-E239 PolarHBondContact O-N 2.85Å; E239-R242 PolarHBondContact O-N 3.43Å; E239-A243 WeakPolarHBondContact O-CB 3.07Å; E239-A243 PolarHBondContact O-N 2.91Å
240	K	64.6	Low	59.6	Low	51 Å²	51	76.1 Å²	76.1	22%	0.222	45%	0.45	C	S	.	.	H	α-helix	trans	-63.4	-43.9	174.7	-66.4	178.6	-176.9	166.3	0	113.3	A221 C224 P238 R242 A243 L244	A221-K240 HydrophobicContact CB-CB 3.87Å; C224-K240 PolarHBondContact O-NZ 3.26Å; P238-K240 PolarHBondContact O-N 3.01Å; K240-R242 VanDerWaalsContact C-N 3.32Å; K240-A243 PolarHBondContact O-N 3.45Å; K240-L244 WeakPolarHBondContact O-CG 3.21Å; K240-L244 PolarHBondContact O-N 3.46Å
241	L	67.9	Low	62.2	Low	21 Å²	21	68.1 Å²	68.1	11%	0.11	42%	0.415	C	S	.	.	H	α-helix	trans	-64.7	-40.5	174.8	-73.3	176.5	0	0	0	110.6	T218 A221 L222 P238 A243 L244	T218-L241 HydrophobicContact CG2-CD2 3.56Å; A221-L241 HydrophobicContact CB-CD2 3.74Å; A221-L241 HydrophobicContact CB-CG 4.12Å; L222-L241 HydrophobicContact CD2-CD1 3.87Å; L222-L241 HydrophobicContact CD2-CD2 3.95Å; L222-L241 HydrophobicContact CD2-CG 4.43Å; L222-L241 HydrophobicContact CG-CD2 4.3Å; P238-L241 HydrophobicContact CG-CB 4.33Å; P238-L241 HydrophobicContact CG-CD1 3.57Å; P238-L241 HydrophobicContact CG-CG 3.87Å; P238-L241 WeakPolarHBondContact O-CB 3.26Å; P238-L241 PolarHBondContact O-N 2.67Å; L241-A243 VanDerWaalsContact C-N 3.3Å; L241-A243 PolarHBondContact O-N 3.49Å; L241-L244 HydrophobicContact CD2-CD1 4.38Å; L241-L244 PolarHBondContact O-N 3.17Å
242	R	63.7	Low	65.3	Low	148 Å²	148	65 Å²	65	56%	0.558	39%	0.389	S	S	*	.	H	α-helix	trans	-62.6	-37.9	174.6	-67.1	-179.2	172.4	179.1	-2.9	112.2	C237 P238 E239 K240 L244 G245	C237-R242 PolarHBondContact O-NE 3.01Å; P238-R242 PolarHBondContact O-N 3.44Å; E239-R242 PolarHBondContact O-N 3.43Å; K240-R242 VanDerWaalsContact C-N 3.32Å; R242-L244 VanDerWaalsContact C-N 3.29Å; R242-L244 PolarHBondContact O-N 3.28Å; R242-G245 PolarHBondContact O-N 2.8Å; R242-G245 VanDerWaalsContact O-N 3.11Å
243	A	62.2	Low	68.3	Low	64 Å²	64	60.3 Å²	60.3	53%	0.529	36%	0.361	S	S	.	.	H	α-helix	trans	-67.6	-25.9	178.7	0	0	0	0	0	113.5	E239 K240 L241 G245	E239-A243 WeakPolarHBondContact O-CB 3.07Å; E239-A243 PolarHBondContact O-N 2.91Å; K240-A243 PolarHBondContact O-N 3.45Å; L241-A243 VanDerWaalsContact C-N 3.3Å; L241-A243 PolarHBondContact O-N 3.49Å; A243-G245 PolarHBondContact O-N 2.88Å
244	L	72.3	Confident	71.2	Confident	23 Å²	23	53.2 Å²	53.2	12%	0.12	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-10.7	173.1	-67.4	170.7	0	0	0	113.1	T218 A221 K240 L241 R242 D290	T218-L244 HydrophobicContact CG2-CD1 3.84Å; A221-L244 HydrophobicContact CB-CD1 3.97Å; K240-L244 WeakPolarHBondContact O-CG 3.21Å; K240-L244 PolarHBondContact O-N 3.46Å; L241-L244 HydrophobicContact CD2-CD1 4.38Å; L241-L244 PolarHBondContact O-N 3.17Å; R242-L244 VanDerWaalsContact C-N 3.29Å; R242-L244 PolarHBondContact O-N 3.28Å; L244-D290 WeakPolarHBondContact CD2-O 3.47Å
245	G	64.6	Low	74.1	Confident	40 Å²	40	49.9 Å²	49.9	41%	0.412	29%	0.294	S	S	.	.			trans	95.4	157.2	178.9	0	0	0	0	0	113	R242 A243 G247	R242-G245 PolarHBondContact O-N 2.8Å; R242-G245 VanDerWaalsContact O-N 3.11Å; A243-G245 PolarHBondContact O-N 2.88Å; G245-G247 PolarHBondContact O-N 3.26Å; G245-G247 VanDerWaalsContact O-N 3.08Å
246	S	66.2	Low	76.7	Confident	137 Å²	137	42.7 Å²	42.7	96%	0.958	26%	0.256	S	S	*	.	S	Bend	trans	-76.9	16.1	-177.9	56.8	0	0	0	0	114.8
247	G	77.2	Confident	79.2	Confident	38 Å²	38	41.3 Å²	41.3	39%	0.392	25%	0.246	S	C	.	.	S	Bend	trans	-81.9	163.6	-178.9	0	0	0	0	0	112.6	G245	G245-G247 PolarHBondContact O-N 3.26Å; G245-G247 VanDerWaalsContact O-N 3.08Å
248	P	87.3	Confident	81.4	Confident	56 Å²	56	43.1 Å²	43.1	36%	0.364	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-60.2	147.2	173.9	25.1	-34	0	0	0	111.7	E178 R250 L264 A266	E178-P248 WeakPolarHBondContact OE1-CA 3.44Å; P248-R250 PolarHBondContact O-N 2.87Å; P248-L264 HydrophobicContact CB-CD2 4.43Å; P248-L264 HydrophobicContact CG-CD2 3.97Å; P248-A266 HydrophobicContact CB-CB 4.48Å
249	E	91.9	Very high	83.2	Confident	6 Å²	6	42.6 Å²	42.6	3%	0.028	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-54.5	129.1	175.3	-76.6	-173.9	142.2	0	0	111.9	G176 G177 E178 Y182 T218 P265	G176-E249 WeakPolarHBondContact CA-OE2 3.24Å; G177-E249 PolarHBondContact N-OE1 3.18Å; E178-E249 HydrophobicContact CG-CG 3.97Å; E178-E249 PolarHBondContact OE1-N 3.3Å; Y182-E249 PolarHBondContact OH-OE2 3.46Å; T218-E249 HydrophobicContact CG2-CG 4.05Å; T218-E249 PolarHBondContact OG1-OE1 2.99Å; E249-P265 WeakPolarHBondContact O-CD 3.24Å
250	R	94.9	Very high	85	Confident	35 Å²	35	36.8 Å²	36.8	13%	0.132	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-94.9	141.9	170.2	-70.9	-179.4	-57.3	-72.5	2.8	110.2	L216 H217 P248 L262 W263 L264 F287 G291 G308	L216-R250 WeakPolarHBondContact CA-O 3.46Å; H217-R250 HydrophobicContact CB-CB 4.3Å; H217-R250 PolarHBondContact CD2-NH2 3.09Å; H217-R250 VanDerWaalsContact CD2-NH2 3.28Å; H217-R250 PolarHBondContact N-O 3.4Å; H217-R250 PolarHBondContact ND1-N 2.78Å; H217-R250 VanDerWaalsContact ND1-N 3.17Å; P248-R250 PolarHBondContact O-N 2.87Å; R250-L262 HydrophobicContact CB-CD1 4.38Å; R250-W263 WeakPolarHBondContact CA-O 3.17Å; R250-L264 HydrophobicContact CG-CD2 3.52Å; R250-F287 HydrophobicContact CB-CZ 4.14Å; R250-G291 PolarHBondContact NH2-O 3.4Å; R250-G308 VanDerWaalsContact CD-O 3.32Å; R250-G308 WeakPolarHBondContact CD-O 3.36Å; R250-G308 PolarHBondContact NE-O 3.23Å; R250-G308 VanDerWaalsContact NE-O 3.14Å
251	M	97.1	Very high	86.5	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	142.8	176.1	179.3	-179.6	65.9	0	0	110	Y182 I190 L204 I214 A215 L216 W263 P265	Y182-M251 HydrophobicContact CD1-SD 4.22Å; Y182-M251 HydrophobicContact CG-SD 4.11Å; I190-M251 HydrophobicContact CD1-CE 4.23Å; I190-M251 HydrophobicContact CG2-CE 3.68Å; I190-M251 HydrophobicContact CG2-SD 4.15Å; L204-M251 HydrophobicContact CD1-CE 3.63Å; I214-M251 HydrophobicContact CB-CG 4.38Å; I214-M251 HydrophobicContact CB-SD 4.21Å; I214-M251 HydrophobicContact CD1-SD 4.35Å; I214-M251 HydrophobicContact CG2-SD 4.18Å; A215-M251 CarbonylContact O-C 3.59Å; A215-M251 VanDerWaalsContact O-CA 3.29Å; A215-M251 WeakPolarHBondContact O-CA 3.27Å; L216-M251 HydrophobicContact CD2-CB 3.71Å; L216-M251 HydrophobicContact CD2-CG 3.87Å; L216-M251 HydrophobicContact CD2-SD 4.28Å; M251-W263 HydrophobicContact CB-CB 4.35Å; M251-W263 HydrophobicContact CE-CB 3.95Å; M251-W263 HydrophobicContact CE-CG 3.89Å; M251-W263 PolarHBondContact N-O 3.49Å; M251-W263 PolarHBondContact O-N 3.14Å; M251-P265 HydrophobicContact CB-CG 3.93Å; M251-P265 HydrophobicContact CE-CB 4.01Å; M251-P265 HydrophobicContact CE-CG 4.24Å
252	V	97.7	Very high	87.9	Confident	0 Å²	0	34 Å²	34	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.6	166.7	177.1	0	0	0	0	109	I214 A215 L260 F261 L262 M275 V285 F287 V294	I214-V252 CarbonylContact C-O 3.55Å; I214-V252 VanDerWaalsContact CA-O 3.26Å; I214-V252 WeakPolarHBondContact CA-O 3.49Å; A215-V252 PolarHBondContact N-O 3.06Å; A215-V252 PolarHBondContact O-N 2.95Å; V252-L260 HydrophobicContact CG1-CB 4.04Å; V252-L260 HydrophobicContact CG1-CD2 3.72Å; V252-F261 VanDerWaalsContact CA-O 3.28Å; V252-F261 WeakPolarHBondContact CA-O 3.48Å; V252-L262 HydrophobicContact CG2-CB 4.42Å; V252-L262 HydrophobicContact CG2-CD1 3.5Å; V252-L262 VanDerWaalsContact CG2-CD1 3.5Å; V252-M275 HydrophobicContact CG1-SD 4.45Å; V252-V285 HydrophobicContact CB-CG2 4.12Å; V252-V285 HydrophobicContact CG1-CG1 4.37Å; V252-V285 HydrophobicContact CG1-CG2 3.63Å; V252-F287 HydrophobicContact CB-CE2 3.98Å; V252-F287 HydrophobicContact CB-CZ 4.38Å; V252-F287 HydrophobicContact CG2-CE1 4.49Å; V252-F287 HydrophobicContact CG2-CE2 3.63Å; V252-F287 HydrophobicContact CG2-CZ 3.53Å; V252-V294 HydrophobicContact CB-CG1 4.42Å; V252-V294 HydrophobicContact CG1-CG1 4.24Å; V252-V294 HydrophobicContact CG2-CG1 4.21Å; V252-V294 HydrophobicContact CG2-CG2 3.93Å
253	S	97.8	Very high	89.5	Confident	0 Å²	0	27 Å²	27	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	141.7	173	58.4	0	0	0	0	111	I190 H207 S213 L260 F261 W263	I190-S253 WeakPolarHBondContact CD1-OG 3.38Å; H207-S253 WeakPolarHBondContact NE2-CB 3.46Å; H207-S253 PolarHBondContact NE2-OG 3.18Å; S213-S253 CarbonylContact O-C 3.59Å; S213-S253 WeakPolarHBondContact O-CA 3.5Å; S253-L260 CarbonylContact O-C 3.56Å; S253-L260 WeakPolarHBondContact O-CA 3.44Å; S253-L260 WeakPolarHBondContact O-CB 3.31Å; S253-F261 PolarHBondContact N-O 3.09Å; S253-F261 PolarHBondContact O-N 3.07Å; S253-F261 VanDerWaalsContact O-N 3.09Å; S253-W263 PolarHBondContact OG-NE1 2.92Å
254	G	97.4	Very high	91.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	140.8	173.1	0	0	0	0	0	111.1	N212 S213	N212-G254 PolarHBondContact N-O 3.23Å; S213-G254 PolarHBondContact N-O 2.59Å; S213-G254 PolarHBondContact O-N 3.03Å
255	S	97.5	Very high	92	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	164.6	-173.8	175.8	0	0	0	0	112.6	H207 H209 W210 D257 F258 T259 I282	H207-S255 VanDerWaalsContact CE1-CB 3.4Å; H207-S255 WeakPolarHBondContact CE1-CB 3.42Å; H207-S255 WeakPolarHBondContact ND1-CB 3.38Å; H209-S255 VanDerWaalsContact C-OG 3.31Å; H209-S255 PolarHBondContact O-OG 3.13Å; H209-S255 VanDerWaalsContact O-OG 3.09Å; W210-S255 WeakPolarHBondContact O-CA 3.3Å; W210-S255 WeakPolarHBondContact O-CB 3.21Å; W210-S255 PolarHBondContact O-OG 2.96Å; S255-D257 VanDerWaalsContact CB-OD1 3.3Å; S255-D257 WeakPolarHBondContact CB-OD1 3.44Å; S255-D257 PolarHBondContact O-N 3.28Å; S255-D257 PolarHBondContact OG-N 3.35Å; S255-D257 PolarHBondContact OG-OD1 2.9Å; S255-F258 PolarHBondContact O-N 3.2Å; S255-T259 PolarHBondContact N-O 3.34Å; S255-I282 PolarHBondContact O-N 3.3Å
256	D	96.5	Very high	93.2	Very high	27 Å²	27	23.8 Å²	23.8	14%	0.144	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.5	169.3	-78	-12.3	0	0	0	114.4	H209 W210 N212 F258 L281	H209-D256 HydrophobicContact CB-CB 3.71Å; H209-D256 IonicContact CE1-OD2 3.42Å; H209-D256 PolarHBondContact CE1-OD2 3.48Å; H209-D256 WeakPolarHBondContact ND1-CB 3.47Å; H209-D256 IonicContact ND1-OD2 2.67Å; H209-D256 PolarHBondContact ND1-OD2 3.12Å; W210-D256 WeakPolarHBondContact CB-OD2 3.28Å; W210-D256 PolarHBondContact O-N 3.11Å; N212-D256 PolarHBondContact ND2-OD1 2.8Å; D256-F258 WeakPolarHBondContact O-CD1 3.34Å; D256-F258 WeakPolarHBondContact O-CE1 3.34Å; D256-F258 PolarHBondContact O-N 3.11Å; D256-L281 HydrophobicContact CB-CB 4.41Å; D256-L281 WeakPolarHBondContact OD1-CB 3.47Å
257	D	95.7	Very high	94.3	Very high	32 Å²	32	21 Å²	21	17%	0.171	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	9.5	173.5	69.6	3.5	0	0	0	113.5	H207 A208 H209 S255 T259	H207-D257 WeakPolarHBondContact CA-OD2 3.44Å; H207-D257 IonicContact ND1-OD1 3.62Å; H207-D257 IonicContact ND1-OD2 2.83Å; A208-D257 HydrophobicContact CB-CB 4.05Å; A208-D257 PolarHBondContact N-OD2 3.03Å; H209-D257 HydrophobicContact CB-CB 3.92Å; S255-D257 VanDerWaalsContact CB-OD1 3.3Å; S255-D257 WeakPolarHBondContact CB-OD1 3.44Å; S255-D257 PolarHBondContact O-N 3.28Å; S255-D257 PolarHBondContact OG-N 3.35Å; S255-D257 PolarHBondContact OG-OD1 2.9Å; D257-T259 PolarHBondContact O-N 2.97Å; D257-T259 VanDerWaalsContact OD1-CB 3.32Å; D257-T259 WeakPolarHBondContact OD1-CB 3.32Å; D257-T259 PolarHBondContact OD1-N 3.19Å; D257-T259 PolarHBondContact OD1-OG1 2.97Å; D257-T259 PolarHBondContact OD2-OG1 3.17Å
258	F	97	Very high	95	Very high	89 Å²	89	23.3 Å²	23.3	39%	0.39	13%	0.127	S	C	.	.	S	Bend	trans	68.1	11.5	178.7	-37.8	-25.4	0	0	0	113.3	S255 D256 H278 Q279 Q280 L281 I282	S255-F258 PolarHBondContact O-N 3.2Å; D256-F258 WeakPolarHBondContact O-CD1 3.34Å; D256-F258 WeakPolarHBondContact O-CE1 3.34Å; D256-F258 PolarHBondContact O-N 3.11Å; F258-H278 HydrophobicContact CB-CB 4.43Å; F258-Q279 WeakPolarHBondContact CE2-O 3.46Å; F258-Q280 VanDerWaalsContact CD1-CA 3.45Å; F258-Q280 VanDerWaalsContact CD1-O 3.26Å; F258-Q280 WeakPolarHBondContact CD1-O 3.5Å; F258-Q280 VanDerWaalsContact CE1-C 3.42Å; F258-L281 HydrophobicContact CD1-CB 4.4Å; F258-L281 HydrophobicContact CE1-CB 4.38Å; F258-L281 VanDerWaalsContact CE1-N 3.29Å; F258-I282 VanDerWaalsContact C-CD1 3.44Å
259	T	97.3	Very high	95.2	Very high	6 Å²	6	27.4 Å²	27.4	4%	0.037	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	150.7	178.6	75.1	0	0	0	0	111.9	H207 S255 D257 T276 I282	H207-T259 PolarHBondContact CE1-O 2.92Å; H207-T259 PolarHBondContact ND1-OG1 3.02Å; S255-T259 PolarHBondContact N-O 3.34Å; D257-T259 PolarHBondContact O-N 2.97Å; D257-T259 VanDerWaalsContact OD1-CB 3.32Å; D257-T259 WeakPolarHBondContact OD1-CB 3.32Å; D257-T259 PolarHBondContact OD1-N 3.19Å; D257-T259 PolarHBondContact OD1-OG1 2.97Å; D257-T259 PolarHBondContact OD2-OG1 3.17Å; T259-T276 HydrophobicContact CG2-CG2 4.24Å; T259-I282 VanDerWaalsContact O-CD1 3.26Å; T259-I282 WeakPolarHBondContact O-CD1 3.25Å
260	L	97.7	Very high	95.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	154.2	160.9	-54.9	93.5	0	0	0	110.2	V252 S253 M275 I282 V285 W306	V252-L260 HydrophobicContact CG1-CB 4.04Å; V252-L260 HydrophobicContact CG1-CD2 3.72Å; S253-L260 CarbonylContact O-C 3.56Å; S253-L260 WeakPolarHBondContact O-CA 3.44Å; S253-L260 WeakPolarHBondContact O-CB 3.31Å; L260-M275 HydrophobicContact CB-CB 3.91Å; L260-M275 HydrophobicContact CB-CE 4.48Å; L260-M275 HydrophobicContact CB-SD 4.28Å; L260-M275 PolarHBondContact N-O 2.85Å; L260-M275 PolarHBondContact O-N 3.15Å; L260-I282 HydrophobicContact CD1-CD1 3.44Å; L260-I282 VanDerWaalsContact CD1-CD1 3.44Å; L260-I282 HydrophobicContact CD1-CG1 3.99Å; L260-I282 HydrophobicContact CD2-CG2 4.31Å; L260-I282 HydrophobicContact CG-CD1 3.71Å; L260-I282 HydrophobicContact CG-CG1 4.37Å; L260-V285 HydrophobicContact CD2-CB 3.97Å; L260-V285 HydrophobicContact CD2-CG2 3.63Å; L260-W306 HydrophobicContact CD1-CZ2 4.24Å
261	F	97.6	Very high	95.3	Very high	13 Å²	13	35.7 Å²	35.7	6%	0.057	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.9	168.4	-75.1	-75.6	0	0	0	110	G206 H207 V252 S253 W263 P271 R274	G206-F261 WeakPolarHBondContact O-CE2 3.32Å; G206-F261 WeakPolarHBondContact O-CZ 3.34Å; H207-F261 AromaticContact CD2-CD2 3.87Å; H207-F261 AromaticContact CE1-CD2 3.42Å; H207-F261 VanDerWaalsContact CE1-CD2 3.42Å; H207-F261 WeakPolarHBondContact CE1-CD2 3.5Å; H207-F261 AromaticContact CE1-CE2 3.98Å; H207-F261 AromaticContact CG-CD2 3.9Å; H207-F261 AromaticContact CG-CE2 3.99Å; H207-F261 AromaticContact ND1-CD2 3.6Å; H207-F261 AromaticContact ND1-CE2 3.69Å; H207-F261 AromaticContact NE2-CD2 3.58Å; V252-F261 VanDerWaalsContact CA-O 3.28Å; V252-F261 WeakPolarHBondContact CA-O 3.48Å; S253-F261 PolarHBondContact N-O 3.09Å; S253-F261 PolarHBondContact O-N 3.07Å; S253-F261 VanDerWaalsContact O-N 3.09Å; F261-W263 HydrophobicContact CB-CD2 4.32Å; F261-W263 HydrophobicContact CB-CH2 4.42Å; F261-W263 HydrophobicContact CB-CZ2 3.4Å; F261-W263 VanDerWaalsContact CB-CZ2 3.4Å; F261-W263 HydrophobicContact CD1-CZ2 4.37Å; F261-W263 AromaticContact CD2-CZ2 3.91Å; F261-W263 HydrophobicContact CD2-CZ2 3.91Å; F261-W263 HydrophobicContact CG-CH2 4.42Å; F261-W263 AromaticContact CG-CZ2 3.67Å; F261-W263 HydrophobicContact CG-CZ2 3.67Å; F261-W263 VanDerWaalsContact O-CD1 3.31Å; F261-W263 PolarHBondContact O-NE1 3.36Å; F261-P271 HydrophobicContact CB-CB 4.11Å; F261-P271 HydrophobicContact CD1-CB 3.45Å; F261-P271 VanDerWaalsContact CD1-CB 3.45Å; F261-P271 HydrophobicContact CD1-CG 3.62Å; F261-P271 HydrophobicContact CE1-CB 4.17Å; F261-P271 HydrophobicContact CE1-CG 3.8Å; F261-P271 HydrophobicContact CG-CB 4.09Å; F261-R274 HydrophobicContact CD1-CB 3.89Å; F261-R274 HydrophobicContact CD1-CG 3.99Å; F261-R274 HydrophobicContact CE1-CB 3.55Å; F261-R274 HydrophobicContact CE1-CG 3.42Å; F261-R274 VanDerWaalsContact CE1-CG 3.42Å; F261-R274 HydrophobicContact CZ-CB 4.41Å; F261-R274 HydrophobicContact CZ-CG 3.81Å
262	L	97.1	Very high	95.2	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	131.9	168.3	-179.9	66.3	0	0	0	108.8	R250 V252 P271 V272 T273 M275 F287	R250-L262 HydrophobicContact CB-CD1 4.38Å; V252-L262 HydrophobicContact CG2-CB 4.42Å; V252-L262 HydrophobicContact CG2-CD1 3.5Å; V252-L262 VanDerWaalsContact CG2-CD1 3.5Å; L262-P271 CarbonylContact O-C 3.6Å; L262-P271 WeakPolarHBondContact O-CA 3.33Å; L262-V272 HydrophobicContact CB-CB 4.44Å; L262-V272 HydrophobicContact CD2-CB 4.28Å; L262-V272 HydrophobicContact CD2-CG1 4.21Å; L262-V272 HydrophobicContact CG-CB 4.23Å; L262-V272 PolarHBondContact O-N 3.04Å; L262-T273 HydrophobicContact CB-CG2 3.75Å; L262-T273 HydrophobicContact CD2-CG2 4.18Å; L262-T273 PolarHBondContact N-O 3.47Å; L262-M275 HydrophobicContact CB-SD 4.14Å; L262-F287 HydrophobicContact CD1-CZ 4.07Å
263	W	96.8	Very high	95.1	Very high	1 Å²	1	40.6 Å²	40.6	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	151.5	-174.5	-53.5	93.1	0	0	0	111.6	L204 R250 M251 S253 F261 P265 P271	L204-W263 HydrophobicContact CB-CE3 4.13Å; L204-W263 HydrophobicContact CB-CH2 4.14Å; L204-W263 HydrophobicContact CB-CZ3 3.9Å; L204-W263 HydrophobicContact CD1-CB 4.45Å; L204-W263 HydrophobicContact CD1-CD2 4.01Å; L204-W263 HydrophobicContact CD1-CE3 3.96Å; L204-W263 HydrophobicContact CD1-CG 4.22Å; L204-W263 HydrophobicContact CD2-CE3 4.25Å; L204-W263 HydrophobicContact CD2-CZ3 4.42Å; L204-W263 HydrophobicContact CG-CE3 4.34Å; R250-W263 WeakPolarHBondContact CA-O 3.17Å; M251-W263 HydrophobicContact CB-CB 4.35Å; M251-W263 HydrophobicContact CE-CB 3.95Å; M251-W263 HydrophobicContact CE-CG 3.89Å; M251-W263 PolarHBondContact N-O 3.49Å; M251-W263 PolarHBondContact O-N 3.14Å; S253-W263 PolarHBondContact OG-NE1 2.92Å; F261-W263 HydrophobicContact CB-CD2 4.32Å; F261-W263 HydrophobicContact CB-CH2 4.42Å; F261-W263 HydrophobicContact CB-CZ2 3.4Å; F261-W263 VanDerWaalsContact CB-CZ2 3.4Å; F261-W263 HydrophobicContact CD1-CZ2 4.37Å; F261-W263 AromaticContact CD2-CZ2 3.91Å; F261-W263 HydrophobicContact CD2-CZ2 3.91Å; F261-W263 HydrophobicContact CG-CH2 4.42Å; F261-W263 AromaticContact CG-CZ2 3.67Å; F261-W263 HydrophobicContact CG-CZ2 3.67Å; F261-W263 VanDerWaalsContact O-CD1 3.31Å; F261-W263 PolarHBondContact O-NE1 3.36Å; W263-P265 VanDerWaalsContact C-CD 3.41Å; W263-P265 WeakPolarHBondContact O-CD 3.38Å; W263-P271 HydrophobicContact CD2-CB 4.16Å; W263-P271 VanDerWaalsContact CE3-CA 3.48Å; W263-P271 HydrophobicContact CE3-CB 3.82Å; W263-P271 HydrophobicContact CH2-CB 3.76Å; W263-P271 HydrophobicContact CH2-CG 3.96Å; W263-P271 HydrophobicContact CZ2-CB 4.09Å; W263-P271 HydrophobicContact CZ3-CB 3.63Å; W263-P271 VanDerWaalsContact CZ3-CD 3.42Å; W263-P271 HydrophobicContact CZ3-CG 3.98Å
264	L	94.8	Very high	95	Very high	32 Å²	32	47.6 Å²	47.6	17%	0.168	24%	0.237	C	C	.	.			trans	-111.7	74	159.7	-71.5	172.4	0	0	0	107.6	P248 R250 A266 S267 Q268 V272	P248-L264 HydrophobicContact CB-CD2 4.43Å; P248-L264 HydrophobicContact CG-CD2 3.97Å; R250-L264 HydrophobicContact CG-CD2 3.52Å; L264-A266 PolarHBondContact O-N 3.02Å; L264-A266 VanDerWaalsContact O-N 3.13Å; L264-S267 PolarHBondContact O-N 3.34Å; L264-S267 VanDerWaalsContact O-N 3.12Å; L264-Q268 HydrophobicContact CB-CB 4.43Å; L264-Q268 HydrophobicContact CB-CG 4.45Å; L264-Q268 PolarHBondContact O-N 3.48Å; L264-V272 HydrophobicContact CB-CG2 4.36Å; L264-V272 HydrophobicContact CD1-CG2 3.88Å; L264-V272 HydrophobicContact CG-CG2 3.73Å
265	P	91.5	Very high	95	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.6	-166	29	-39.5	0	0	0	113.5	Y182 V192 R202 L204 E249 M251 W263	Y182-P265 HydrophobicContact CD1-CB 3.77Å; Y182-P265 HydrophobicContact CD1-CG 3.81Å; Y182-P265 HydrophobicContact CE1-CB 3.5Å; Y182-P265 VanDerWaalsContact CE1-CB 3.5Å; Y182-P265 HydrophobicContact CE1-CG 3.29Å; V192-P265 HydrophobicContact CG2-CB 3.97Å; R202-P265 VanDerWaalsContact CD-O 3.24Å; R202-P265 WeakPolarHBondContact CD-O 3.38Å; R202-P265 PolarHBondContact NE-O 3.28Å; R202-P265 PolarHBondContact NH1-O 2.86Å; R202-P265 VanDerWaalsContact NH1-O 3.14Å; L204-P265 HydrophobicContact CD1-CB 4Å; E249-P265 WeakPolarHBondContact O-CD 3.24Å; M251-P265 HydrophobicContact CB-CG 3.93Å; M251-P265 HydrophobicContact CE-CB 4.01Å; M251-P265 HydrophobicContact CE-CG 4.24Å; W263-P265 VanDerWaalsContact C-CD 3.41Å; W263-P265 WeakPolarHBondContact O-CD 3.38Å
266	A	90.5	Very high	94.9	Very high	27 Å²	27	51.5 Å²	51.5	22%	0.223	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-44.9	174.8	0	0	0	0	0	112	E178 L180 R202 P248 L264	E178-A266 WeakPolarHBondContact OE2-CB 3.01Å; L180-A266 HydrophobicContact CD1-CB 4.12Å; R202-A266 PolarHBondContact NH1-O 3.47Å; P248-A266 HydrophobicContact CB-CB 4.48Å; L264-A266 PolarHBondContact O-N 3.02Å; L264-A266 VanDerWaalsContact O-N 3.13Å
267	S	89.9	Confident	94.8	Very high	78 Å²	78	51.7 Å²	51.7	55%	0.545	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-29.3	-166.7	56.1	0	0	0	0	114.7	L264	L264-S267 PolarHBondContact O-N 3.34Å; L264-S267 VanDerWaalsContact O-N 3.12Å
268	Q	91.1	Very high	94.9	Very high	87 Å²	87	50.7 Å²	50.7	41%	0.407	26%	0.264	S	S	.	.			trans	-123.8	138.4	-169.5	-61.7	-178.2	8	0	0	112.3	L264	L264-Q268 HydrophobicContact CB-CB 4.43Å; L264-Q268 HydrophobicContact CB-CG 4.45Å; L264-Q268 PolarHBondContact O-N 3.48Å
269	K	91.6	Very high	94.8	Very high	141 Å²	141	53.7 Å²	53.7	61%	0.613	28%	0.279	S	S	*	.	S	Bend	trans	-85.8	-23.4	171	-69.4	-175.1	-179.6	-179.9	0	113.3	R202	R202-K269 HydrophobicContact CB-CG 4.49Å; R202-K269 HydrophobicContact CG-CG 4.16Å
270	K	93.7	Very high	94.8	Very high	171 Å²	171	57.5 Å²	57.5	74%	0.743	30%	0.296	S	S	*	.	S	Bend	trans	-89.6	146.9	178.7	-67.5	-174.9	179.1	-178.7	0	109.6
271	P	94.9	Very high	94.8	Very high	44 Å²	44	59.6 Å²	59.6	29%	0.286	31%	0.307	S	S	.	.			trans	-67.3	143.9	173.3	27.7	-31.4	0	0	0	109.9	F261 L262 W263 T273	F261-P271 HydrophobicContact CB-CB 4.11Å; F261-P271 HydrophobicContact CD1-CB 3.45Å; F261-P271 VanDerWaalsContact CD1-CB 3.45Å; F261-P271 HydrophobicContact CD1-CG 3.62Å; F261-P271 HydrophobicContact CE1-CB 4.17Å; F261-P271 HydrophobicContact CE1-CG 3.8Å; F261-P271 HydrophobicContact CG-CB 4.09Å; L262-P271 CarbonylContact O-C 3.6Å; L262-P271 WeakPolarHBondContact O-CA 3.33Å; W263-P271 HydrophobicContact CD2-CB 4.16Å; W263-P271 VanDerWaalsContact CE3-CA 3.48Å; W263-P271 HydrophobicContact CE3-CB 3.82Å; W263-P271 HydrophobicContact CH2-CB 3.76Å; W263-P271 HydrophobicContact CH2-CG 3.96Å; W263-P271 HydrophobicContact CZ2-CB 4.09Å; W263-P271 HydrophobicContact CZ3-CB 3.63Å; W263-P271 VanDerWaalsContact CZ3-CD 3.42Å; W263-P271 HydrophobicContact CZ3-CG 3.98Å; P271-T273 VanDerWaalsContact C-N 3.33Å
272	V	94.4	Very high	94.7	Very high	61 Å²	61	59 Å²	59	37%	0.37	30%	0.304	S	S	.	.	S	Bend	trans	-64.3	-44.1	171.9	178.2	0	0	0	0	109.8	L262 L264	L262-V272 HydrophobicContact CB-CB 4.44Å; L262-V272 HydrophobicContact CD2-CB 4.28Å; L262-V272 HydrophobicContact CD2-CG1 4.21Å; L262-V272 HydrophobicContact CG-CB 4.23Å; L262-V272 PolarHBondContact O-N 3.04Å; L264-V272 HydrophobicContact CB-CG2 4.36Å; L264-V272 HydrophobicContact CD1-CG2 3.88Å; L264-V272 HydrophobicContact CG-CG2 3.73Å
273	T	95.7	Very high	94.7	Very high	43 Å²	43	61.5 Å²	61.5	26%	0.264	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	154.8	175.7	-168.8	0	0	0	0	111.6	L262 P271 M275 T310	L262-T273 HydrophobicContact CB-CG2 3.75Å; L262-T273 HydrophobicContact CD2-CG2 4.18Å; L262-T273 PolarHBondContact N-O 3.47Å; P271-T273 VanDerWaalsContact C-N 3.33Å; T273-M275 HydrophobicContact CG2-CG 3.88Å; T273-M275 HydrophobicContact CG2-SD 4.47Å; T273-T310 WeakPolarHBondContact CG2-O 3.09Å
274	R	96.8	Very high	94.7	Very high	147 Å²	147	63 Å²	63	56%	0.555	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	119.9	169.6	-171.1	-179.7	-179.1	-170.1	-0.5	108.5	F261 T276	F261-R274 HydrophobicContact CD1-CB 3.89Å; F261-R274 HydrophobicContact CD1-CG 3.99Å; F261-R274 HydrophobicContact CE1-CB 3.55Å; F261-R274 HydrophobicContact CE1-CG 3.42Å; F261-R274 VanDerWaalsContact CE1-CG 3.42Å; F261-R274 HydrophobicContact CZ-CB 4.41Å; F261-R274 HydrophobicContact CZ-CG 3.81Å; R274-T276 HydrophobicContact CG-CG2 3.86Å
275	M	96.9	Very high	94.8	Very high	3 Å²	3	61.5 Å²	61.5	2%	0.015	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	108.3	-175.6	-61.1	165.9	59.4	0	0	108.1	V252 L260 L262 T273 V294 W306 G311	V252-M275 HydrophobicContact CG1-SD 4.45Å; L260-M275 HydrophobicContact CB-CB 3.91Å; L260-M275 HydrophobicContact CB-CE 4.48Å; L260-M275 HydrophobicContact CB-SD 4.28Å; L260-M275 PolarHBondContact N-O 2.85Å; L260-M275 PolarHBondContact O-N 3.15Å; L262-M275 HydrophobicContact CB-SD 4.14Å; T273-M275 HydrophobicContact CG2-CG 3.88Å; T273-M275 HydrophobicContact CG2-SD 4.47Å; M275-V294 HydrophobicContact CE-CG1 4.46Å; M275-W306 HydrophobicContact CB-CD2 4.44Å; M275-W306 HydrophobicContact CB-CE3 4Å; M275-W306 HydrophobicContact CB-CH2 4.2Å; M275-W306 HydrophobicContact CB-CZ3 3.88Å; M275-W306 HydrophobicContact CE-CB 3.31Å; M275-W306 HydrophobicContact CE-CD2 3.24Å; M275-W306 HydrophobicContact CE-CE3 3.66Å; M275-W306 HydrophobicContact CE-CG 3.06Å; M275-W306 HydrophobicContact CG-CE3 4.29Å; M275-G311 WeakPolarHBondContact CG-O 3.43Å
276	T	95.9	Very high	95.1	Very high	78 Å²	78	63 Å²	63	48%	0.479	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	151.5	-173	57.2	0	0	0	0	112.1	T259 R274 W306	T259-T276 HydrophobicContact CG2-CG2 4.24Å; R274-T276 HydrophobicContact CG-CG2 3.86Å; T276-W306 WeakPolarHBondContact O-CH2 3.14Å
277	G	94.5	Very high	95.4	Very high	32 Å²	32	62.3 Å²	62.3	33%	0.33	32%	0.317	S	S	.	.			trans	141.1	-9.1	160.2	0	0	0	0	0	114.2	R304	G277-R304 VanDerWaalsContact C-NH2 3.33Å; G277-R304 PolarHBondContact O-NH1 3.01Å; G277-R304 PolarHBondContact O-NH2 2.89Å
278	H	96.7	Very high	95.6	Very high	10 Å²	10	58.7 Å²	58.7	5%	0.046	29%	0.292	C	S	.	.			trans	-56.8	148.3	162.6	-82	-66.1	0	0	0	110.3	F258 I282 S296 S298 D300	F258-H278 HydrophobicContact CB-CB 4.43Å; H278-I282 HydrophobicContact CB-CG1 4.45Å; H278-S296 PolarHBondContact NE2-O 2.84Å; H278-S296 PolarHBondContact NE2-OG 2.95Å; H278-S298 WeakPolarHBondContact CE1-CB 3.48Å; H278-S298 WeakPolarHBondContact ND1-CB 3.29Å; H278-D300 VanDerWaalsContact CA-OD2 3.25Å; H278-D300 WeakPolarHBondContact CA-OD2 3.32Å; H278-D300 IonicContact CE1-OD1 2.8Å; H278-D300 IonicContact CG-OD2 3.97Å; H278-D300 IonicContact ND1-OD1 3.44Å; H278-D300 PolarHBondContact ND1-OD1 2.97Å; H278-D300 IonicContact ND1-OD2 3.56Å; H278-D300 PolarHBondContact ND1-OD2 3.38Å
279	Q	96.3	Very high	95.6	Very high	153 Å²	153	55.2 Å²	55.2	72%	0.715	28%	0.277	S	S	*	.	S	Bend	trans	-103.5	-6.9	-177.6	-65.4	-176.5	-29.3	0	0	113	F258 D300	F258-Q279 WeakPolarHBondContact CE2-O 3.46Å; Q279-D300 HydrophobicContact CB-CB 4.03Å; Q279-D300 PolarHBondContact N-OD2 3.24Å
280	Q	97.2	Very high	95.5	Very high	85 Å²	85	50.6 Å²	50.6	40%	0.397	26%	0.259	S	S	.	.	S	Bend	trans	-143.6	178.8	174.8	-59.6	-170.1	15.1	0	0	110.2	F258 S298 F299 D300	F258-Q280 VanDerWaalsContact CD1-CA 3.45Å; F258-Q280 VanDerWaalsContact CD1-O 3.26Å; F258-Q280 WeakPolarHBondContact CD1-O 3.5Å; F258-Q280 VanDerWaalsContact CE1-C 3.42Å; Q280-S298 PolarHBondContact O-OG 3.18Å; Q280-F299 HydrophobicContact CB-CB 3.96Å; Q280-F299 PolarHBondContact OE1-O 2.87Å; Q280-D300 HydrophobicContact CB-CB 4.06Å; Q280-D300 HydrophobicContact CG-CB 4.05Å
281	L	96	Very high	95.4	Very high	44 Å²	44	42.4 Å²	42.4	23%	0.23	22%	0.223	C	C	.	.			trans	-57.3	149.5	-175.7	66.8	86.8	0	0	0	112.2	D256 F258 N283 S298 F299	D256-L281 HydrophobicContact CB-CB 4.41Å; D256-L281 WeakPolarHBondContact OD1-CB 3.47Å; F258-L281 HydrophobicContact CD1-CB 4.4Å; F258-L281 HydrophobicContact CE1-CB 4.38Å; F258-L281 VanDerWaalsContact CE1-N 3.29Å; L281-N283 HydrophobicContact CD1-CB 4.39Å; L281-S298 VanDerWaalsContact O-CA 3.27Å; L281-S298 WeakPolarHBondContact O-CA 3.25Å; L281-S298 WeakPolarHBondContact O-CB 3.35Å; L281-S298 PolarHBondContact O-OG 2.78Å; L281-F299 HydrophobicContact CD1-CB 4.42Å; L281-F299 HydrophobicContact CD1-CD1 3.67Å; L281-F299 HydrophobicContact CD1-CD2 3.78Å; L281-F299 HydrophobicContact CD1-CE1 3.79Å; L281-F299 HydrophobicContact CD1-CE2 3.89Å; L281-F299 HydrophobicContact CD1-CG 3.67Å; L281-F299 HydrophobicContact CD1-CZ 3.89Å; L281-F299 HydrophobicContact CD2-CD2 3.93Å; L281-F299 HydrophobicContact CD2-CE2 4.12Å; L281-F299 HydrophobicContact CD2-CG 4.49Å; L281-F299 HydrophobicContact CG-CB 4.23Å; L281-F299 HydrophobicContact CG-CD1 4.38Å; L281-F299 HydrophobicContact CG-CD2 3.82Å; L281-F299 HydrophobicContact CG-CE2 4.28Å; L281-F299 HydrophobicContact CG-CG 3.88Å; L281-F299 PolarHBondContact O-N 2.79Å
282	I	96.9	Very high	95.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	119.7	174.6	-64.1	130.1	0	0	0	107.7	N212 S255 F258 T259 L260 H278	N212-I282 PolarHBondContact ND2-O 2.87Å; S255-I282 PolarHBondContact O-N 3.3Å; F258-I282 VanDerWaalsContact C-CD1 3.44Å; T259-I282 VanDerWaalsContact O-CD1 3.26Å; T259-I282 WeakPolarHBondContact O-CD1 3.25Å; L260-I282 HydrophobicContact CD1-CD1 3.44Å; L260-I282 VanDerWaalsContact CD1-CD1 3.44Å; L260-I282 HydrophobicContact CD1-CG1 3.99Å; L260-I282 HydrophobicContact CD2-CG2 4.31Å; L260-I282 HydrophobicContact CG-CD1 3.71Å; L260-I282 HydrophobicContact CG-CG1 4.37Å; H278-I282 HydrophobicContact CB-CG1 4.45Å
283	N	96.1	Very high	95.2	Very high	55 Å²	55	42.4 Å²	42.4	29%	0.294	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-43.1	-178.8	-165.2	56.9	0	0	0	111.6	L281 A297 F299 Y325	L281-N283 HydrophobicContact CD1-CB 4.39Å; N283-A297 PolarHBondContact N-O 2.91Å; N283-F299 HydrophobicContact CB-CD1 4.11Å; N283-F299 HydrophobicContact CB-CE1 3.63Å; N283-Y325 PolarHBondContact ND2-O 2.92Å
284	Q	96.8	Very high	95.3	Very high	32 Å²	32	40.4 Å²	40.4	15%	0.15	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	143.4	-179.7	-162.3	-177.6	31.3	0	0	111.2	L286 A297 I327	Q284-L286 HydrophobicContact CG-CG 4.32Å; Q284-A297 HydrophobicContact CB-CB 4.44Å; Q284-A297 PolarHBondContact N-O 2.72Å; Q284-A297 PolarHBondContact O-N 3.05Å; Q284-I327 PolarHBondContact OE1-O 3.36Å
285	V	97.4	Very high	95.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	139.2	168.9	62.6	0	0	0	0	109.1	S213 A215 V252 L260 V294 A295	S213-V285 PolarHBondContact OG-N 2.9Å; A215-V285 HydrophobicContact CB-CG1 4.36Å; A215-V285 VanDerWaalsContact CB-O 3.27Å; A215-V285 WeakPolarHBondContact CB-O 3.27Å; V252-V285 HydrophobicContact CB-CG2 4.12Å; V252-V285 HydrophobicContact CG1-CG1 4.37Å; V252-V285 HydrophobicContact CG1-CG2 3.63Å; L260-V285 HydrophobicContact CD2-CB 3.97Å; L260-V285 HydrophobicContact CD2-CG2 3.63Å; V285-V294 HydrophobicContact CG2-CG1 3.49Å; V285-V294 VanDerWaalsContact CG2-CG1 3.49Å; V285-A295 WeakPolarHBondContact CA-O 3.37Å; V285-A295 WeakPolarHBondContact CG2-O 3.43Å
286	L	97.5	Very high	95.3	Very high	31 Å²	31	33.2 Å²	33.2	16%	0.162	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	141.7	177.5	-67.8	178	0	0	0	111	A215 Q284 V294 A295 I327 W329	A215-L286 HydrophobicContact CB-CD2 4.47Å; Q284-L286 HydrophobicContact CG-CG 4.32Å; L286-V294 WeakPolarHBondContact O-CA 3.35Å; L286-A295 PolarHBondContact N-O 3.33Å; L286-A295 PolarHBondContact O-N 3.13Å; L286-I327 HydrophobicContact CB-CD1 4.28Å; L286-I327 HydrophobicContact CD1-CG1 4.14Å; L286-I327 WeakPolarHBondContact CD1-O 2.94Å; L286-I327 HydrophobicContact CG-CD1 4.47Å; L286-I327 HydrophobicContact CG-CG1 4.47Å; L286-W329 PolarHBondContact O-NE1 2.88Å
287	F	96.8	Very high	95.4	Very high	14 Å²	14	29.5 Å²	29.5	6%	0.061	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	150.3	163.3	-81	-93.4	0	0	0	110.7	A215 L216 H217 R250 V252 L262 L293 V294 W329	A215-F287 HydrophobicContact CB-CD2 4.19Å; A215-F287 WeakPolarHBondContact O-CE2 3.36Å; L216-F287 VanDerWaalsContact C-CD2 3.44Å; H217-F287 VanDerWaalsContact CA-CG 3.47Å; H217-F287 HydrophobicContact CB-CB 4.39Å; H217-F287 HydrophobicContact CB-CD1 3.56Å; H217-F287 HydrophobicContact CB-CD2 4.13Å; H217-F287 HydrophobicContact CB-CE1 3.67Å; H217-F287 HydrophobicContact CB-CE2 4.22Å; H217-F287 HydrophobicContact CB-CG 3.78Å; H217-F287 HydrophobicContact CB-CZ 4Å; R250-F287 HydrophobicContact CB-CZ 4.14Å; V252-F287 HydrophobicContact CB-CE2 3.98Å; V252-F287 HydrophobicContact CB-CZ 4.38Å; V252-F287 HydrophobicContact CG2-CE1 4.49Å; V252-F287 HydrophobicContact CG2-CE2 3.63Å; V252-F287 HydrophobicContact CG2-CZ 3.53Å; L262-F287 HydrophobicContact CD1-CZ 4.07Å; F287-L293 WeakPolarHBondContact CA-O 3.17Å; F287-V294 HydrophobicContact CD1-CG2 3.47Å; F287-V294 VanDerWaalsContact CD1-CG2 3.47Å; F287-V294 HydrophobicContact CD2-CG2 4.3Å; F287-V294 HydrophobicContact CE1-CG2 3.34Å; F287-V294 HydrophobicContact CE2-CG2 4.19Å; F287-V294 HydrophobicContact CG-CG2 3.98Å; F287-V294 HydrophobicContact CZ-CG2 3.75Å; F287-W329 PolarHBondContact O-NE1 2.76Å
288	S	94.7	Very high	95.6	Very high	1 Å²	1	28 Å²	28	1%	0.007	14%	0.137	C	C	.	.			trans	-64.8	154.5	163.9	51.1	0	0	0	0	110.8	D290 G291 F292 L293	S288-D290 VanDerWaalsContact CB-OD1 3.3Å; S288-D290 WeakPolarHBondContact CB-OD1 3.32Å; S288-D290 PolarHBondContact O-N 2.6Å; S288-D290 VanDerWaalsContact O-N 3.08Å; S288-D290 PolarHBondContact OG-OD1 2.92Å; S288-G291 WeakPolarHBondContact O-CA 3.23Å; S288-G291 PolarHBondContact O-N 3.02Å; S288-F292 PolarHBondContact OG-N 2.87Å; S288-L293 PolarHBondContact N-O 3.36Å; S288-L293 WeakPolarHBondContact OG-CA 3.35Å; S288-L293 WeakPolarHBondContact OG-CB 3.33Å; S288-L293 PolarHBondContact OG-N 3.31Å; S288-L293 PolarHBondContact OG-O 2.76Å
289	P	91.8	Very high	95.6	Very high	15 Å²	15	30 Å²	30	10%	0.097	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-28	177.1	-33.2	36.7	0	0	0	116.1	Y220 W329 S330 S333	Y220-P289 HydrophobicContact CD1-CB 3.48Å; Y220-P289 VanDerWaalsContact CD1-CB 3.48Å; Y220-P289 HydrophobicContact CD1-CG 3.94Å; Y220-P289 HydrophobicContact CD2-CB 4.22Å; Y220-P289 HydrophobicContact CD2-CG 3.75Å; Y220-P289 HydrophobicContact CE1-CB 3.84Å; Y220-P289 HydrophobicContact CE1-CG 4.13Å; Y220-P289 HydrophobicContact CE2-CG 3.95Å; Y220-P289 HydrophobicContact CG-CB 3.7Å; Y220-P289 HydrophobicContact CG-CG 3.76Å; P289-W329 HydrophobicContact CG-CB 4.28Å; P289-S330 WeakPolarHBondContact CG-O 3.37Å; P289-S333 WeakPolarHBondContact CB-OG 3.42Å; P289-S333 VanDerWaalsContact CD-OG 3.24Å; P289-S333 WeakPolarHBondContact CD-OG 3.36Å
290	D	88.7	Confident	95.6	Very high	43 Å²	43	23.8 Å²	23.8	23%	0.23	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-4.3	175.8	67.9	4.8	0	0	0	114	L244 S288 F292 S333	L244-D290 WeakPolarHBondContact CD2-O 3.47Å; S288-D290 VanDerWaalsContact CB-OD1 3.3Å; S288-D290 WeakPolarHBondContact CB-OD1 3.32Å; S288-D290 PolarHBondContact O-N 2.6Å; S288-D290 VanDerWaalsContact O-N 3.08Å; S288-D290 PolarHBondContact OG-OD1 2.92Å; D290-F292 HydrophobicContact CB-CD2 3.77Å; D290-F292 HydrophobicContact CB-CE2 4.31Å; D290-F292 VanDerWaalsContact CG-CD2 3.5Å; D290-F292 WeakPolarHBondContact O-CD2 3.37Å; D290-F292 PolarHBondContact O-N 2.9Å; D290-F292 PolarHBondContact OD1-N 3.38Å; D290-S333 PolarHBondContact N-OG 3.33Å; D290-S333 VanDerWaalsContact N-OG 3.11Å
291	G	90.9	Very high	95.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.115	C	C	.	.	S	Bend	trans	69.1	9.8	179.2	0	0	0	0	0	115.6	R250 S288	R250-G291 PolarHBondContact NH2-O 3.4Å; S288-G291 WeakPolarHBondContact O-CA 3.23Å; S288-G291 PolarHBondContact O-N 3.02Å
292	F	90.5	Very high	95.6	Very high	72 Å²	72	21.7 Å²	21.7	32%	0.316	11%	0.107	S	C	.	.	S	Bend	trans	-94.3	-25	-176.5	-71.9	-64.7	0	0	0	114.4	S288 D290 G308	S288-F292 PolarHBondContact OG-N 2.87Å; D290-F292 HydrophobicContact CB-CD2 3.77Å; D290-F292 HydrophobicContact CB-CE2 4.31Å; D290-F292 VanDerWaalsContact CG-CD2 3.5Å; D290-F292 WeakPolarHBondContact O-CD2 3.37Å; D290-F292 PolarHBondContact O-N 2.9Å; D290-F292 PolarHBondContact OD1-N 3.38Å; F292-G308 PolarHBondContact O-N 2.66Å
293	L	94.9	Very high	95.7	Very high	32 Å²	32	21.7 Å²	21.7	17%	0.168	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	151.8	177.5	-59.9	177.5	0	0	0	110.1	F287 S288 I305 W306 L314 W329 A350	F287-L293 WeakPolarHBondContact CA-O 3.17Å; S288-L293 PolarHBondContact N-O 3.36Å; S288-L293 WeakPolarHBondContact OG-CA 3.35Å; S288-L293 WeakPolarHBondContact OG-CB 3.33Å; S288-L293 PolarHBondContact OG-N 3.31Å; S288-L293 PolarHBondContact OG-O 2.76Å; L293-I305 HydrophobicContact CB-CG2 4.43Å; L293-I305 HydrophobicContact CD1-CG2 4.48Å; L293-I305 HydrophobicContact CD2-CG2 4.07Å; L293-W306 WeakPolarHBondContact CA-O 3.46Å; L293-L314 HydrophobicContact CD2-CD1 3.56Å; L293-W329 HydrophobicContact CB-CH2 3.74Å; L293-W329 HydrophobicContact CB-CZ2 3.97Å; L293-W329 HydrophobicContact CD1-CH2 3.8Å; L293-W329 HydrophobicContact CD1-CZ3 4.2Å; L293-W329 HydrophobicContact CG-CH2 4.43Å; L293-A350 HydrophobicContact CD1-CB 4.17Å
294	V	97.2	Very high	95.8	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.006	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	130.5	170.4	172.9	0	0	0	0	106.8	V252 M275 V285 L286 F287 I305 W306	V252-V294 HydrophobicContact CB-CG1 4.42Å; V252-V294 HydrophobicContact CG1-CG1 4.24Å; V252-V294 HydrophobicContact CG2-CG1 4.21Å; V252-V294 HydrophobicContact CG2-CG2 3.93Å; M275-V294 HydrophobicContact CE-CG1 4.46Å; V285-V294 HydrophobicContact CG2-CG1 3.49Å; V285-V294 VanDerWaalsContact CG2-CG1 3.49Å; L286-V294 WeakPolarHBondContact O-CA 3.35Å; F287-V294 HydrophobicContact CD1-CG2 3.47Å; F287-V294 VanDerWaalsContact CD1-CG2 3.47Å; F287-V294 HydrophobicContact CD2-CG2 4.3Å; F287-V294 HydrophobicContact CE1-CG2 3.34Å; F287-V294 HydrophobicContact CE2-CG2 4.19Å; F287-V294 HydrophobicContact CG-CG2 3.98Å; F287-V294 HydrophobicContact CZ-CG2 3.75Å; V294-I305 CarbonylContact O-C 3.45Å; V294-I305 VanDerWaalsContact O-CA 3.31Å; V294-I305 WeakPolarHBondContact O-CA 3.26Å; V294-W306 HydrophobicContact CB-CB 4.26Å; V294-W306 PolarHBondContact N-O 3.32Å; V294-W306 PolarHBondContact O-N 3.03Å
295	A	97.8	Very high	95.8	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	135.2	171.2	0	0	0	0	0	109.3	V285 L286 I303 R304 I305 I327 W329 L336	V285-A295 WeakPolarHBondContact CA-O 3.37Å; V285-A295 WeakPolarHBondContact CG2-O 3.43Å; L286-A295 PolarHBondContact N-O 3.33Å; L286-A295 PolarHBondContact O-N 3.13Å; A295-I303 HydrophobicContact CB-CG2 4.28Å; A295-R304 WeakPolarHBondContact CA-O 3.48Å; A295-I305 HydrophobicContact CB-CD1 3.62Å; A295-I327 HydrophobicContact CB-CD1 3.45Å; A295-I327 VanDerWaalsContact CB-CD1 3.45Å; A295-I327 WeakPolarHBondContact O-CD1 3.5Å; A295-W329 HydrophobicContact CB-CZ2 3.56Å; A295-L336 HydrophobicContact CB-CD1 3.99Å; A295-L336 HydrophobicContact CB-CD2 4.04Å
296	S	97.8	Very high	95.8	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	121.2	176.4	55.9	0	0	0	0	110.7	H278 I303 R304 W306	H278-S296 PolarHBondContact NE2-O 2.84Å; H278-S296 PolarHBondContact NE2-OG 2.95Å; S296-I303 VanDerWaalsContact O-CA 3.26Å; S296-I303 WeakPolarHBondContact O-CA 3.43Å; S296-R304 PolarHBondContact N-O 3.4Å; S296-R304 PolarHBondContact O-N 3.07Å; S296-R304 PolarHBondContact OG-O 3.26Å; S296-W306 PolarHBondContact OG-NE1 3.26Å
297	A	97.5	Very high	95.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129.8	176.2	0	0	0	0	0	110	N283 Q284 V324 I327	N283-A297 PolarHBondContact N-O 2.91Å; Q284-A297 HydrophobicContact CB-CB 4.44Å; Q284-A297 PolarHBondContact N-O 2.72Å; Q284-A297 PolarHBondContact O-N 3.05Å; A297-V324 HydrophobicContact CB-CB 4.19Å; A297-V324 HydrophobicContact CB-CG1 3.8Å; A297-I327 HydrophobicContact CB-CD1 4.47Å; A297-I327 HydrophobicContact CB-CG1 4.17Å; A297-I327 HydrophobicContact CB-CG2 3.91Å
298	S	97.7	Very high	95.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	159.1	-175.5	176.4	0	0	0	0	111.8	H278 Q280 L281 D300 H301 S302 V324	H278-S298 WeakPolarHBondContact CE1-CB 3.48Å; H278-S298 WeakPolarHBondContact ND1-CB 3.29Å; Q280-S298 PolarHBondContact O-OG 3.18Å; L281-S298 VanDerWaalsContact O-CA 3.27Å; L281-S298 WeakPolarHBondContact O-CA 3.25Å; L281-S298 WeakPolarHBondContact O-CB 3.35Å; L281-S298 PolarHBondContact O-OG 2.78Å; S298-D300 VanDerWaalsContact CB-OD1 3.29Å; S298-D300 WeakPolarHBondContact CB-OD1 3.29Å; S298-D300 PolarHBondContact O-N 3.44Å; S298-D300 PolarHBondContact OG-N 3.09Å; S298-D300 PolarHBondContact OG-OD1 2.75Å; S298-H301 PolarHBondContact O-N 2.86Å; S298-S302 PolarHBondContact N-O 3.47Å; S298-V324 PolarHBondContact O-N 3.23Å; S298-V324 VanDerWaalsContact O-N 3.14Å
299	F	97.2	Very high	95.3	Very high	51 Å²	51	27.4 Å²	27.4	22%	0.224	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-4.9	173	-73.8	19.5	0	0	0	112.4	Q280 L281 N283 H301 A323 Y325	Q280-F299 HydrophobicContact CB-CB 3.96Å; Q280-F299 PolarHBondContact OE1-O 2.87Å; L281-F299 HydrophobicContact CD1-CB 4.42Å; L281-F299 HydrophobicContact CD1-CD1 3.67Å; L281-F299 HydrophobicContact CD1-CD2 3.78Å; L281-F299 HydrophobicContact CD1-CE1 3.79Å; L281-F299 HydrophobicContact CD1-CE2 3.89Å; L281-F299 HydrophobicContact CD1-CG 3.67Å; L281-F299 HydrophobicContact CD1-CZ 3.89Å; L281-F299 HydrophobicContact CD2-CD2 3.93Å; L281-F299 HydrophobicContact CD2-CE2 4.12Å; L281-F299 HydrophobicContact CD2-CG 4.49Å; L281-F299 HydrophobicContact CG-CB 4.23Å; L281-F299 HydrophobicContact CG-CD1 4.38Å; L281-F299 HydrophobicContact CG-CD2 3.82Å; L281-F299 HydrophobicContact CG-CE2 4.28Å; L281-F299 HydrophobicContact CG-CG 3.88Å; L281-F299 PolarHBondContact O-N 2.79Å; N283-F299 HydrophobicContact CB-CD1 4.11Å; N283-F299 HydrophobicContact CB-CE1 3.63Å; F299-H301 PolarHBondContact O-CD2 2.92Å; F299-H301 PolarHBondContact O-N 2.91Å; F299-H301 VanDerWaalsContact O-N 3.11Å; F299-A323 HydrophobicContact CB-CB 4Å; F299-A323 HydrophobicContact CD1-CB 3.8Å; F299-A323 HydrophobicContact CD2-CB 4.34Å; F299-A323 HydrophobicContact CE1-CB 4.35Å; F299-A323 HydrophobicContact CG-CB 3.8Å; F299-Y325 AromaticContact CE1-CD1 3.69Å; F299-Y325 HydrophobicContact CE1-CD1 3.69Å; F299-Y325 AromaticContact CE1-CE1 3.78Å; F299-Y325 HydrophobicContact CE1-CE1 3.78Å; F299-Y325 AromaticContact CZ-CD1 3.98Å; F299-Y325 HydrophobicContact CZ-CD1 3.98Å; F299-Y325 AromaticContact CZ-CE1 3.67Å; F299-Y325 HydrophobicContact CZ-CE1 3.67Å
300	D	96.7	Very high	95.3	Very high	23 Å²	23	29.6 Å²	29.6	12%	0.123	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	15.4	171.1	72.6	5.5	0	0	0	114.1	H278 Q279 Q280 S298 S302	H278-D300 VanDerWaalsContact CA-OD2 3.25Å; H278-D300 WeakPolarHBondContact CA-OD2 3.32Å; H278-D300 IonicContact CE1-OD1 2.8Å; H278-D300 IonicContact CG-OD2 3.97Å; H278-D300 IonicContact ND1-OD1 3.44Å; H278-D300 PolarHBondContact ND1-OD1 2.97Å; H278-D300 IonicContact ND1-OD2 3.56Å; H278-D300 PolarHBondContact ND1-OD2 3.38Å; Q279-D300 HydrophobicContact CB-CB 4.03Å; Q279-D300 PolarHBondContact N-OD2 3.24Å; Q280-D300 HydrophobicContact CB-CB 4.06Å; Q280-D300 HydrophobicContact CG-CB 4.05Å; S298-D300 VanDerWaalsContact CB-OD1 3.29Å; S298-D300 WeakPolarHBondContact CB-OD1 3.29Å; S298-D300 PolarHBondContact O-N 3.44Å; S298-D300 PolarHBondContact OG-N 3.09Å; S298-D300 PolarHBondContact OG-OD1 2.75Å; D300-S302 VanDerWaalsContact CG-OG 3.27Å; D300-S302 PolarHBondContact O-N 3.45Å; D300-S302 VanDerWaalsContact O-N 3.13Å; D300-S302 WeakPolarHBondContact OD1-CA 3.37Å; D300-S302 VanDerWaalsContact OD1-CB 3.29Å; D300-S302 WeakPolarHBondContact OD1-CB 3.16Å; D300-S302 PolarHBondContact OD1-N 2.82Å; D300-S302 PolarHBondContact OD1-OG 3.02Å; D300-S302 PolarHBondContact OD2-OG 3.44Å
301	H	97.2	Very high	95.5	Very high	76 Å²	76	27.7 Å²	27.7	35%	0.352	13%	0.129	S	C	.	.	S	Bend	trans	65.2	9.8	179.7	-39.1	163.5	0	0	0	113.8	S298 F299 V321 Q322 A323	S298-H301 PolarHBondContact O-N 2.86Å; F299-H301 PolarHBondContact O-CD2 2.92Å; F299-H301 PolarHBondContact O-N 2.91Å; F299-H301 VanDerWaalsContact O-N 3.11Å; H301-V321 PolarHBondContact CE1-O 3.28Å; H301-V321 PolarHBondContact ND1-O 2.9Å; H301-Q322 WeakPolarHBondContact CA-O 3.46Å; H301-Q322 WeakPolarHBondContact CB-O 3.46Å; H301-Q322 VanDerWaalsContact CD2-CA 3.46Å; H301-Q322 WeakPolarHBondContact CD2-CA 3.19Å; H301-Q322 PolarHBondContact CD2-O 3.08Å; H301-A323 PolarHBondContact CD2-N 3.26Å; H301-A323 VanDerWaalsContact CD2-N 3.33Å
302	S	96.7	Very high	95.8	Very high	9 Å²	9	34.8 Å²	34.8	6%	0.063	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	152.8	-176.7	84.9	0	0	0	0	112.1	S298 D300	S298-S302 PolarHBondContact N-O 3.47Å; D300-S302 VanDerWaalsContact CG-OG 3.27Å; D300-S302 PolarHBondContact O-N 3.45Å; D300-S302 VanDerWaalsContact O-N 3.13Å; D300-S302 WeakPolarHBondContact OD1-CA 3.37Å; D300-S302 VanDerWaalsContact OD1-CB 3.29Å; D300-S302 WeakPolarHBondContact OD1-CB 3.16Å; D300-S302 PolarHBondContact OD1-N 2.82Å; D300-S302 PolarHBondContact OD1-OG 3.02Å; D300-S302 PolarHBondContact OD2-OG 3.44Å
303	I	97.8	Very high	96	Very high	1 Å²	1	36 Å²	36	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.9	167.7	-56.6	152.6	0	0	0	107	A295 S296 I305 T316 L317 V324 I327 L336 S338	A295-I303 HydrophobicContact CB-CG2 4.28Å; S296-I303 VanDerWaalsContact O-CA 3.26Å; S296-I303 WeakPolarHBondContact O-CA 3.43Å; I303-I305 HydrophobicContact CG2-CD1 4.47Å; I303-T316 CarbonylContact O-C 3.3Å; I303-T316 WeakPolarHBondContact O-CA 3.48Å; I303-L317 HydrophobicContact CB-CB 4.11Å; I303-L317 HydrophobicContact CB-CD1 4.06Å; I303-L317 HydrophobicContact CB-CG 4.34Å; I303-L317 HydrophobicContact CG2-CD1 3.97Å; I303-L317 PolarHBondContact N-O 3.01Å; I303-L317 PolarHBondContact O-N 3.13Å; I303-V324 HydrophobicContact CD1-CG1 4.04Å; I303-V324 HydrophobicContact CG1-CB 4.38Å; I303-V324 HydrophobicContact CG1-CG1 3.91Å; I303-V324 HydrophobicContact CG1-CG2 4.2Å; I303-I327 HydrophobicContact CD1-CG2 3.89Å; I303-I327 HydrophobicContact CG1-CG2 4.1Å; I303-I327 HydrophobicContact CG2-CG2 4.32Å; I303-L336 HydrophobicContact CD1-CD2 4.39Å; I303-L336 HydrophobicContact CG2-CD2 3.8Å; I303-S338 WeakPolarHBondContact CD1-OG 3.35Å
304	R	97.4	Very high	96	Very high	36 Å²	36	38.1 Å²	38.1	14%	0.136	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	138.7	177.2	-67.8	-178.5	175.1	-135.5	-4.8	110.7	G277 A295 S296 W306 F313 T316	G277-R304 VanDerWaalsContact C-NH2 3.33Å; G277-R304 PolarHBondContact O-NH1 3.01Å; G277-R304 PolarHBondContact O-NH2 2.89Å; A295-R304 WeakPolarHBondContact CA-O 3.48Å; S296-R304 PolarHBondContact N-O 3.4Å; S296-R304 PolarHBondContact O-N 3.07Å; S296-R304 PolarHBondContact OG-O 3.26Å; R304-W306 HydrophobicContact CB-CZ2 3.71Å; R304-W306 HydrophobicContact CG-CZ2 4.3Å; R304-W306 PolarHBondContact O-NE1 3.34Å; R304-F313 HydrophobicContact CB-CE2 4.28Å; R304-F313 HydrophobicContact CG-CE2 4.12Å; R304-T316 HydrophobicContact CG-CG2 4.23Å
305	I	97.6	Very high	95.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	133.7	175.7	-54.2	-59.9	0	0	0	109	L293 V294 A295 I303 L314 R315 L317 W329 L336	L293-I305 HydrophobicContact CB-CG2 4.43Å; L293-I305 HydrophobicContact CD1-CG2 4.48Å; L293-I305 HydrophobicContact CD2-CG2 4.07Å; V294-I305 CarbonylContact O-C 3.45Å; V294-I305 VanDerWaalsContact O-CA 3.31Å; V294-I305 WeakPolarHBondContact O-CA 3.26Å; A295-I305 HydrophobicContact CB-CD1 3.62Å; I303-I305 HydrophobicContact CG2-CD1 4.47Å; I305-L314 HydrophobicContact CG2-CD1 4.26Å; I305-L314 WeakPolarHBondContact O-CB 3.38Å; I305-L314 PolarHBondContact O-N 2.87Å; I305-R315 HydrophobicContact CB-CG 3.97Å; I305-R315 HydrophobicContact CG1-CG 4.2Å; I305-R315 PolarHBondContact N-O 2.82Å; I305-R315 PolarHBondContact O-N 3.21Å; I305-L317 HydrophobicContact CD1-CD1 4.05Å; I305-L317 HydrophobicContact CG1-CD1 4.12Å; I305-L317 HydrophobicContact CG1-CD2 4.35Å; I305-L317 HydrophobicContact CG1-CG 4.15Å; I305-W329 HydrophobicContact CD1-CH2 4.25Å; I305-W329 HydrophobicContact CD1-CZ2 4.33Å; I305-L336 HydrophobicContact CD1-CD2 4.41Å
306	W	97.1	Very high	95.9	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.015	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	158.3	-175.9	-42	81.8	0	0	0	110.7	L260 M275 T276 L293 V294 S296 R304 G308 K312 F313	L260-W306 HydrophobicContact CD1-CZ2 4.24Å; M275-W306 HydrophobicContact CB-CD2 4.44Å; M275-W306 HydrophobicContact CB-CE3 4Å; M275-W306 HydrophobicContact CB-CH2 4.2Å; M275-W306 HydrophobicContact CB-CZ3 3.88Å; M275-W306 HydrophobicContact CE-CB 3.31Å; M275-W306 HydrophobicContact CE-CD2 3.24Å; M275-W306 HydrophobicContact CE-CE3 3.66Å; M275-W306 HydrophobicContact CE-CG 3.06Å; M275-W306 HydrophobicContact CG-CE3 4.29Å; T276-W306 WeakPolarHBondContact O-CH2 3.14Å; L293-W306 WeakPolarHBondContact CA-O 3.46Å; V294-W306 HydrophobicContact CB-CB 4.26Å; V294-W306 PolarHBondContact N-O 3.32Å; V294-W306 PolarHBondContact O-N 3.03Å; S296-W306 PolarHBondContact OG-NE1 3.26Å; R304-W306 HydrophobicContact CB-CZ2 3.71Å; R304-W306 HydrophobicContact CG-CZ2 4.3Å; R304-W306 PolarHBondContact O-NE1 3.34Å; W306-G308 PolarHBondContact O-N 2.93Å; W306-K312 CarbonylContact C-O 3.39Å; W306-K312 WeakPolarHBondContact CA-O 3.44Å; W306-F313 HydrophobicContact CD2-CD2 4.38Å; W306-F313 VanDerWaalsContact CE3-CA 3.47Å; W306-F313 HydrophobicContact CE3-CB 3.72Å; W306-F313 HydrophobicContact CE3-CD2 4.08Å; W306-F313 HydrophobicContact CE3-CG 4.42Å; W306-F313 HydrophobicContact CH2-CD2 4.09Å; W306-F313 HydrophobicContact CZ2-CD2 4.41Å; W306-F313 HydrophobicContact CZ3-CB 3.64Å; W306-F313 AromaticContact CZ3-CD2 3.93Å; W306-F313 HydrophobicContact CZ3-CD2 3.93Å; W306-F313 HydrophobicContact CZ3-CG 4.25Å
307	C	94.7	Very high	95.8	Very high	32 Å²	32	43.5 Å²	43.5	22%	0.216	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	115.9	172.3	178.2	0	0	0	0	110.3	R309 T310 G311 K312 L314	C307-R309 PolarHBondContact O-N 2.92Å; C307-R309 VanDerWaalsContact O-N 3.1Å; C307-T310 WeakPolarHBondContact CB-OG1 3.13Å; C307-T310 PolarHBondContact O-N 2.72Å; C307-T310 PolarHBondContact SG-OG1 3.3Å; C307-G311 WeakPolarHBondContact O-CA 3.31Å; C307-G311 PolarHBondContact O-N 2.88Å; C307-K312 HydrophobicContact CB-CB 4.37Å; C307-K312 PolarHBondContact N-O 2.8Å; C307-L314 HydrophobicContact CB-CD1 4.34Å; C307-L314 HydrophobicContact CB-CD2 4.49Å; C307-L314 HydrophobicContact CB-CG 4.48Å
308	G	92.9	Very high	95.7	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-13.5	-178.4	0	0	0	0	0	115.8	R250 F292 W306	R250-G308 VanDerWaalsContact CD-O 3.32Å; R250-G308 WeakPolarHBondContact CD-O 3.36Å; R250-G308 PolarHBondContact NE-O 3.23Å; R250-G308 VanDerWaalsContact NE-O 3.14Å; F292-G308 PolarHBondContact O-N 2.66Å; W306-G308 PolarHBondContact O-N 2.93Å
309	R	91	Very high	95.6	Very high	181 Å²	181	54.6 Å²	54.6	68%	0.683	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-35.7	175.7	-173.7	173.2	179.5	171.7	-0.4	113.6	C307	C307-R309 PolarHBondContact O-N 2.92Å; C307-R309 VanDerWaalsContact O-N 3.1Å
310	T	92.4	Very high	95.5	Very high	60 Å²	60	52.8 Å²	52.8	37%	0.368	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-13.9	-171.6	62	0	0	0	0	113.4	T273 C307 K312	T273-T310 WeakPolarHBondContact CG2-O 3.09Å; C307-T310 WeakPolarHBondContact CB-OG1 3.13Å; C307-T310 PolarHBondContact O-N 2.72Å; C307-T310 PolarHBondContact SG-OG1 3.3Å; T310-K312 PolarHBondContact O-N 3.4Å; T310-K312 WeakPolarHBondContact OG1-CG 3.01Å; T310-K312 PolarHBondContact OG1-N 3.39Å
311	G	93.7	Very high	95.5	Very high	4 Å²	4	56.9 Å²	56.9	4%	0.041	27%	0.271	C	S	.	.			trans	60.8	16.2	-169.3	0	0	0	0	0	114.4	M275 C307 F313	M275-G311 WeakPolarHBondContact CG-O 3.43Å; C307-G311 WeakPolarHBondContact O-CA 3.31Å; C307-G311 PolarHBondContact O-N 2.88Å; G311-F313 PolarHBondContact O-N 3.08Å
312	K	95.3	Very high	95.5	Very high	149 Å²	149	57.6 Å²	57.6	65%	0.648	28%	0.275	S	S	*	.			trans	-62.1	134.4	172.3	-73.1	-175.7	178.8	-174.3	0	110.4	W306 C307 T310	W306-K312 CarbonylContact C-O 3.39Å; W306-K312 WeakPolarHBondContact CA-O 3.44Å; C307-K312 HydrophobicContact CB-CB 4.37Å; C307-K312 PolarHBondContact N-O 2.8Å; T310-K312 PolarHBondContact O-N 3.4Å; T310-K312 WeakPolarHBondContact OG1-CG 3.01Å; T310-K312 PolarHBondContact OG1-N 3.39Å
313	F	96.4	Very high	95.5	Very high	97 Å²	97	57.8 Å²	57.8	43%	0.425	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	135	171.2	175.6	-105.2	0	0	0	110.2	R304 W306 G311 R315 T316	R304-F313 HydrophobicContact CB-CE2 4.28Å; R304-F313 HydrophobicContact CG-CE2 4.12Å; W306-F313 HydrophobicContact CD2-CD2 4.38Å; W306-F313 VanDerWaalsContact CE3-CA 3.47Å; W306-F313 HydrophobicContact CE3-CB 3.72Å; W306-F313 HydrophobicContact CE3-CD2 4.08Å; W306-F313 HydrophobicContact CE3-CG 4.42Å; W306-F313 HydrophobicContact CH2-CD2 4.09Å; W306-F313 HydrophobicContact CZ2-CD2 4.41Å; W306-F313 HydrophobicContact CZ3-CB 3.64Å; W306-F313 AromaticContact CZ3-CD2 3.93Å; W306-F313 HydrophobicContact CZ3-CD2 3.93Å; W306-F313 HydrophobicContact CZ3-CG 4.25Å; G311-F313 PolarHBondContact O-N 3.08Å; F313-R315 VanDerWaalsContact CE2-C 3.45Å; F313-R315 VanDerWaalsContact CE2-O 3.3Å; F313-R315 WeakPolarHBondContact CE2-O 3.4Å; F313-T316 VanDerWaalsContact CZ-OG1 3.29Å; F313-T316 WeakPolarHBondContact CZ-OG1 3.32Å
314	L	94.8	Very high	95.5	Very high	77 Å²	77	57.7 Å²	57.7	40%	0.403	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	-53.2	177.4	-61.6	176.5	0	0	0	111.1	L293 I305 C307	L293-L314 HydrophobicContact CD2-CD1 3.56Å; I305-L314 HydrophobicContact CG2-CD1 4.26Å; I305-L314 WeakPolarHBondContact O-CB 3.38Å; I305-L314 PolarHBondContact O-N 2.87Å; C307-L314 HydrophobicContact CB-CD1 4.34Å; C307-L314 HydrophobicContact CB-CD2 4.49Å; C307-L314 HydrophobicContact CB-CG 4.48Å
315	R	95.4	Very high	95.5	Very high	85 Å²	85	58 Å²	58	32%	0.321	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	167	-177.2	64.2	-163.7	76.7	-150.4	12.3	112.5	I305 F313 K351 D352	I305-R315 HydrophobicContact CB-CG 3.97Å; I305-R315 HydrophobicContact CG1-CG 4.2Å; I305-R315 PolarHBondContact N-O 2.82Å; I305-R315 PolarHBondContact O-N 3.21Å; F313-R315 VanDerWaalsContact CE2-C 3.45Å; F313-R315 VanDerWaalsContact CE2-O 3.3Å; F313-R315 WeakPolarHBondContact CE2-O 3.4Å; R315-K351 PolarHBondContact NH1-O 3.11Å; R315-K351 PolarHBondContact NH2-O 2.91Å; R315-D352 PolarHBondContact NH1-O 2.99Å
316	T	96.5	Very high	95.4	Very high	28 Å²	28	60.1 Å²	60.1	17%	0.172	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.2	172.6	-55.8	0	0	0	0	109.4	I303 R304 F313 R318	I303-T316 CarbonylContact O-C 3.3Å; I303-T316 WeakPolarHBondContact O-CA 3.48Å; R304-T316 HydrophobicContact CG-CG2 4.23Å; F313-T316 VanDerWaalsContact CZ-OG1 3.29Å; F313-T316 WeakPolarHBondContact CZ-OG1 3.32Å; T316-R318 HydrophobicContact CG2-CG 3.82Å
317	L	96.7	Very high	95.4	Very high	1 Å²	1	60 Å²	60	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	118.8	169.5	-46.5	178.2	0	0	0	107.6	I303 I305 L336 W348	I303-L317 HydrophobicContact CB-CB 4.11Å; I303-L317 HydrophobicContact CB-CD1 4.06Å; I303-L317 HydrophobicContact CB-CG 4.34Å; I303-L317 HydrophobicContact CG2-CD1 3.97Å; I303-L317 PolarHBondContact N-O 3.01Å; I303-L317 PolarHBondContact O-N 3.13Å; I305-L317 HydrophobicContact CD1-CD1 4.05Å; I305-L317 HydrophobicContact CG1-CD1 4.12Å; I305-L317 HydrophobicContact CG1-CD2 4.35Å; I305-L317 HydrophobicContact CG1-CG 4.15Å; L317-L336 HydrophobicContact CD1-CD2 3.8Å; L317-W348 HydrophobicContact CB-CD2 3.89Å; L317-W348 HydrophobicContact CB-CE3 3.77Å; L317-W348 HydrophobicContact CB-CG 4.46Å; L317-W348 HydrophobicContact CB-CH2 4.38Å; L317-W348 HydrophobicContact CB-CZ2 4.47Å; L317-W348 HydrophobicContact CB-CZ3 4.03Å; L317-W348 HydrophobicContact CD1-CB 3.81Å; L317-W348 HydrophobicContact CD1-CD2 4.03Å; L317-W348 HydrophobicContact CD1-CG 3.7Å; L317-W348 HydrophobicContact CD2-CB 4.46Å; L317-W348 HydrophobicContact CD2-CE3 4.26Å; L317-W348 HydrophobicContact CG-CD2 4.38Å; L317-W348 HydrophobicContact CG-CE3 4.4Å; L317-W348 HydrophobicContact CG-CG 4.49Å
318	R	95.2	Very high	95.5	Very high	194 Å²	194	58.9 Å²	58.9	73%	0.732	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122	135.4	-178.8	-65.8	-172.4	178.3	123.5	-4	109.8	T316 W348	T316-R318 HydrophobicContact CG2-CG 3.82Å; R318-W348 VanDerWaalsContact C-CH2 3.44Å; R318-W348 VanDerWaalsContact O-CH2 3.25Å; R318-W348 WeakPolarHBondContact O-CH2 3.36Å; R318-W348 WeakPolarHBondContact O-CZ3 3.47Å
319	G	94.2	Very high	95.7	Very high	38 Å²	38	59.4 Å²	59.4	39%	0.392	28%	0.282	S	S	.	.			trans	163.1	-21.3	175.1	0	0	0	0	0	113.8	K346	G319-K346 WeakPolarHBondContact O-CE 3.5Å
320	H	96.7	Very high	95.8	Very high	14 Å²	14	50.8 Å²	50.8	7%	0.065	25%	0.249	C	C	.	.			trans	-68.8	146.2	168.2	-78.9	-61.4	0	0	0	111.3	V324 S338 S340 D342 K346	H320-V324 HydrophobicContact CB-CG2 3.99Å; H320-S338 PolarHBondContact NE2-OG 2.54Å; H320-S340 WeakPolarHBondContact CE1-CB 3.46Å; H320-S340 WeakPolarHBondContact ND1-CB 3.47Å; H320-S340 PolarHBondContact ND1-OG 3.11Å; H320-D342 VanDerWaalsContact CA-OD2 3.26Å; H320-D342 WeakPolarHBondContact CA-OD2 3.21Å; H320-D342 WeakPolarHBondContact CB-OD2 3.36Å; H320-D342 IonicContact CE1-OD1 3.97Å; H320-D342 IonicContact CE1-OD2 2.83Å; H320-D342 IonicContact CG-OD2 3.13Å; H320-D342 IonicContact ND1-OD1 3.99Å; H320-D342 PolarHBondContact ND1-OD1 2.98Å; H320-D342 IonicContact ND1-OD2 2.74Å; H320-D342 PolarHBondContact ND1-OD2 2.54Å; H320-K346 WeakPolarHBondContact ND1-CE 3.3Å
321	V	96.6	Very high	95.8	Very high	108 Å²	108	48.2 Å²	48.2	66%	0.655	23%	0.234	S	C	*	.	S	Bend	trans	-99.9	-18.7	-177.8	-176.7	0	0	0	0	111.4	H301 D342	H301-V321 PolarHBondContact CE1-O 3.28Å; H301-V321 PolarHBondContact ND1-O 2.9Å; V321-D342 HydrophobicContact CB-CB 4.3Å; V321-D342 PolarHBondContact N-OD2 3.42Å
322	Q	97.3	Very high	95.6	Very high	92 Å²	92	48.3 Å²	48.3	43%	0.43	23%	0.233	S	C	.	.	S	Bend	trans	-132.9	-175.9	177.6	-57.8	-173.1	3.8	0	0	111.5	H301 V324 S340 A341 D342	H301-Q322 WeakPolarHBondContact CA-O 3.46Å; H301-Q322 WeakPolarHBondContact CB-O 3.46Å; H301-Q322 VanDerWaalsContact CD2-CA 3.46Å; H301-Q322 WeakPolarHBondContact CD2-CA 3.19Å; H301-Q322 PolarHBondContact CD2-O 3.08Å; Q322-V324 PolarHBondContact O-N 3.11Å; Q322-S340 PolarHBondContact O-OG 2.73Å; Q322-A341 HydrophobicContact CB-CB 3.73Å; Q322-A341 PolarHBondContact OE1-O 3.29Å; Q322-A341 VanDerWaalsContact OE1-O 3.06Å; Q322-D342 HydrophobicContact CB-CB 4.02Å; Q322-D342 HydrophobicContact CG-CB 4.01Å
323	A	97	Very high	95.4	Very high	12 Å²	12	41.7 Å²	41.7	10%	0.099	21%	0.206	C	C	.	.			trans	-56.7	132.5	-175.1	0	0	0	0	0	112.7	F299 H301 Y325 S340 A341	F299-A323 HydrophobicContact CB-CB 4Å; F299-A323 HydrophobicContact CD1-CB 3.8Å; F299-A323 HydrophobicContact CD2-CB 4.34Å; F299-A323 HydrophobicContact CE1-CB 4.35Å; F299-A323 HydrophobicContact CG-CB 3.8Å; H301-A323 PolarHBondContact CD2-N 3.26Å; H301-A323 VanDerWaalsContact CD2-N 3.33Å; A323-Y325 HydrophobicContact CB-CE1 4.4Å; A323-S340 CarbonylContact O-C 3.58Å; A323-S340 VanDerWaalsContact O-CA 3.32Å; A323-S340 WeakPolarHBondContact O-CA 3.26Å; A323-S340 PolarHBondContact O-OG 3.02Å; A323-S340 VanDerWaalsContact O-OG 3.11Å; A323-A341 HydrophobicContact CB-CB 4.43Å; A323-A341 PolarHBondContact O-N 3.42Å
324	V	97.7	Very high	95.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	115	174.6	-172	0	0	0	0	108.6	A297 S298 I303 H320 Q322 I327	A297-V324 HydrophobicContact CB-CB 4.19Å; A297-V324 HydrophobicContact CB-CG1 3.8Å; S298-V324 PolarHBondContact O-N 3.23Å; S298-V324 VanDerWaalsContact O-N 3.14Å; I303-V324 HydrophobicContact CD1-CG1 4.04Å; I303-V324 HydrophobicContact CG1-CB 4.38Å; I303-V324 HydrophobicContact CG1-CG1 3.91Å; I303-V324 HydrophobicContact CG1-CG2 4.2Å; H320-V324 HydrophobicContact CB-CG2 3.99Å; Q322-V324 PolarHBondContact O-N 3.11Å; V324-I327 HydrophobicContact CG1-CG2 4.33Å
325	Y	96.6	Very high	95.2	Very high	42 Å²	42	37.9 Å²	37.9	17%	0.165	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-53.7	-178.1	-67.6	-54.5	0	0	0	111.7	N283 F299 A323 G339 A341 E365 V366 Y367	N283-Y325 PolarHBondContact ND2-O 2.92Å; F299-Y325 AromaticContact CE1-CD1 3.69Å; F299-Y325 HydrophobicContact CE1-CD1 3.69Å; F299-Y325 AromaticContact CE1-CE1 3.78Å; F299-Y325 HydrophobicContact CE1-CE1 3.78Å; F299-Y325 AromaticContact CZ-CD1 3.98Å; F299-Y325 HydrophobicContact CZ-CD1 3.98Å; F299-Y325 AromaticContact CZ-CE1 3.67Å; F299-Y325 HydrophobicContact CZ-CE1 3.67Å; A323-Y325 HydrophobicContact CB-CE1 4.4Å; Y325-G339 PolarHBondContact N-O 2.85Å; Y325-A341 HydrophobicContact CD2-CB 4.4Å; Y325-A341 HydrophobicContact CE2-CB 3.51Å; Y325-E365 HydrophobicContact CE2-CB 4.24Å; Y325-E365 PolarHBondContact OH-OE2 3.21Å; Y325-V366 WeakPolarHBondContact CD2-O 3.42Å; Y325-Y367 AromaticContact CD2-CD1 3.79Å; Y325-Y367 HydrophobicContact CD2-CD1 3.79Å; Y325-Y367 HydrophobicContact CD2-CE1 4.25Å; Y325-Y367 AromaticContact CE2-CD1 3.79Å; Y325-Y367 HydrophobicContact CE2-CD1 3.79Å; Y325-Y367 AromaticContact CE2-CE1 3.75Å; Y325-Y367 HydrophobicContact CE2-CE1 3.75Å; Y325-Y367 HydrophobicContact CG-CD1 4.39Å
326	Q	95.9	Very high	95.3	Very high	45 Å²	45	33.8 Å²	33.8	21%	0.21	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	155.7	-175.5	-74.2	-167.8	8.4	0	0	113	S338 G339 Y367 A368	Q326-S338 CarbonylContact O-C 3.57Å; Q326-S338 WeakPolarHBondContact O-CA 3.36Å; Q326-G339 PolarHBondContact N-O 3.14Å; Q326-G339 PolarHBondContact O-N 3.1Å; Q326-Y367 VanDerWaalsContact CG-O 3.27Å; Q326-Y367 WeakPolarHBondContact CG-O 3.46Å; Q326-Y367 PolarHBondContact NE2-O 3.46Å; Q326-A368 VanDerWaalsContact OE1-CA 3.27Å
327	I	97.1	Very high	95.3	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	151.4	176.6	47.9	163.3	0	0	0	109.1	Q284 L286 A295 A297 I303 V324 L336 V337	Q284-I327 PolarHBondContact OE1-O 3.36Å; L286-I327 HydrophobicContact CB-CD1 4.28Å; L286-I327 HydrophobicContact CD1-CG1 4.14Å; L286-I327 WeakPolarHBondContact CD1-O 2.94Å; L286-I327 HydrophobicContact CG-CD1 4.47Å; L286-I327 HydrophobicContact CG-CG1 4.47Å; A295-I327 HydrophobicContact CB-CD1 3.45Å; A295-I327 VanDerWaalsContact CB-CD1 3.45Å; A295-I327 WeakPolarHBondContact O-CD1 3.5Å; A297-I327 HydrophobicContact CB-CD1 4.47Å; A297-I327 HydrophobicContact CB-CG1 4.17Å; A297-I327 HydrophobicContact CB-CG2 3.91Å; I303-I327 HydrophobicContact CD1-CG2 3.89Å; I303-I327 HydrophobicContact CG1-CG2 4.1Å; I303-I327 HydrophobicContact CG2-CG2 4.32Å; V324-I327 HydrophobicContact CG1-CG2 4.33Å; I327-L336 HydrophobicContact CB-CD1 4.24Å; I327-L336 HydrophobicContact CB-CD2 4.4Å; I327-L336 HydrophobicContact CB-CG 4.44Å; I327-L336 HydrophobicContact CG2-CD2 4.08Å; I327-V337 CarbonylContact C-O 3.57Å; I327-V337 VanDerWaalsContact CA-O 3.23Å; I327-V337 WeakPolarHBondContact CA-O 3.4Å
328	S	96.8	Very high	95.3	Very high	9 Å²	9	32.4 Å²	32.4	6%	0.063	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	140.9	170.6	-166.4	0	0	0	0	110.6	L336 V337 D370 W371	S328-L336 WeakPolarHBondContact O-CA 3.5Å; S328-V337 PolarHBondContact N-O 3.14Å; S328-V337 PolarHBondContact O-N 3.01Å; S328-D370 PolarHBondContact OG-OD1 3.21Å; S328-W371 PolarHBondContact OG-N 3.39Å; S328-W371 VanDerWaalsContact OG-N 3.09Å
329	W	96.2	Very high	95.4	Very high	10 Å²	10	23.2 Å²	23.2	4%	0.038	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	142.5	-179.4	-76.7	100.4	0	0	0	110.8	L286 F287 P289 L293 A295 I305 L336 A350	L286-W329 PolarHBondContact O-NE1 2.88Å; F287-W329 PolarHBondContact O-NE1 2.76Å; P289-W329 HydrophobicContact CG-CB 4.28Å; L293-W329 HydrophobicContact CB-CH2 3.74Å; L293-W329 HydrophobicContact CB-CZ2 3.97Å; L293-W329 HydrophobicContact CD1-CH2 3.8Å; L293-W329 HydrophobicContact CD1-CZ3 4.2Å; L293-W329 HydrophobicContact CG-CH2 4.43Å; A295-W329 HydrophobicContact CB-CZ2 3.56Å; I305-W329 HydrophobicContact CD1-CH2 4.25Å; I305-W329 HydrophobicContact CD1-CZ2 4.33Å; W329-L336 HydrophobicContact CD2-CD1 3.52Å; W329-L336 HydrophobicContact CE3-CD1 3.99Å; W329-L336 HydrophobicContact CG-CD1 3.8Å; W329-L336 HydrophobicContact CH2-CD1 4.5Å; W329-L336 HydrophobicContact CZ2-CD1 4.1Å; W329-L336 HydrophobicContact CZ3-CD1 4.46Å; W329-A350 HydrophobicContact CH2-CB 3.89Å; W329-A350 HydrophobicContact CZ3-CB 3.5Å; W329-A350 VanDerWaalsContact CZ3-CB 3.5Å
330	S	94.1	Very high	95.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.107	C	C	.	.			trans	-66.7	150	163.3	63.9	0	0	0	0	110.4	P289 D332 S333 R334 L335	P289-S330 WeakPolarHBondContact CG-O 3.37Å; S330-D332 WeakPolarHBondContact CB-OD1 3.17Å; S330-D332 PolarHBondContact O-N 2.83Å; S330-D332 VanDerWaalsContact O-N 3.1Å; S330-D332 PolarHBondContact OG-OD1 2.92Å; S330-S333 PolarHBondContact O-N 3.26Å; S330-R334 PolarHBondContact OG-N 3.39Å; S330-L335 PolarHBondContact N-O 3.31Å; S330-L335 WeakPolarHBondContact OG-CA 3.42Å; S330-L335 WeakPolarHBondContact OG-CB 3.48Å; S330-L335 PolarHBondContact OG-N 2.71Å; S330-L335 PolarHBondContact OG-O 3.29Å
331	S	91.1	Very high	95.5	Very high	6 Å²	6	21.1 Å²	21.1	4%	0.042	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.1	-176.8	56.4	0	0	0	0	114.6	Y32 V34 Y220 P373	Y32-S331 WeakPolarHBondContact CE2-OG 3.5Å; Y32-S331 VanDerWaalsContact OH-C 3.28Å; Y32-S331 VanDerWaalsContact OH-CB 3.29Å; Y32-S331 WeakPolarHBondContact OH-CB 3.36Å; Y32-S331 PolarHBondContact OH-O 2.87Å; Y32-S331 PolarHBondContact OH-OG 3.1Å; V34-S331 VanDerWaalsContact CG2-OG 3.24Å; V34-S331 WeakPolarHBondContact CG2-OG 3.24Å; Y220-S331 WeakPolarHBondContact OH-CA 3.28Å; Y220-S331 WeakPolarHBondContact OH-CB 3.29Å; S331-P373 VanDerWaalsContact CB-O 3.23Å; S331-P373 WeakPolarHBondContact CB-O 3.36Å; S331-P373 PolarHBondContact OG-O 2.82Å
332	D	89.2	Confident	95.5	Very high	6 Å²	6	17 Å²	17	3%	0.032	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	4.2	175	70.6	-13	0	0	0	114.6	A30 Y32 R33 V34 S330 R334	A30-D332 HydrophobicContact CB-CB 3.74Å; Y32-D332 HydrophobicContact CD2-CB 4.37Å; Y32-D332 HydrophobicContact CE2-CB 4.03Å; R33-D332 WeakPolarHBondContact CA-OD2 3.34Å; V34-D332 HydrophobicContact CG2-CB 3.98Å; V34-D332 PolarHBondContact N-OD2 3.36Å; S330-D332 WeakPolarHBondContact CB-OD1 3.17Å; S330-D332 PolarHBondContact O-N 2.83Å; S330-D332 VanDerWaalsContact O-N 3.1Å; S330-D332 PolarHBondContact OG-OD1 2.92Å; D332-R334 HydrophobicContact CB-CG 4.38Å; D332-R334 PolarHBondContact O-N 3.44Å; D332-R334 PolarHBondContact OD1-N 3.34Å; D332-R334 VanDerWaalsContact OD2-CD 3.26Å; D332-R334 WeakPolarHBondContact OD2-CD 3.44Å; D332-R334 IonicContact OD2-NE 2.81Å
333	S	92.3	Very high	95.4	Very high	11 Å²	11	14.4 Å²	14.4	8%	0.077	7%	0.074	C	C	.	.	S	Bend	trans	63	12.1	-178.4	-52	0	0	0	0	115.7	P289 D290 S330	P289-S333 WeakPolarHBondContact CB-OG 3.42Å; P289-S333 VanDerWaalsContact CD-OG 3.24Å; P289-S333 WeakPolarHBondContact CD-OG 3.36Å; D290-S333 PolarHBondContact N-OG 3.33Å; D290-S333 VanDerWaalsContact N-OG 3.11Å; S330-S333 PolarHBondContact O-N 3.26Å
334	R	92	Very high	95.4	Very high	79 Å²	79	14.9 Å²	14.9	30%	0.298	8%	0.075	S	C	.	.	S	Bend	trans	-94.8	-31.4	-176	-59.2	-175.9	-165.7	-170.9	4.5	113.6	A30 S330 D332 A350	A30-R334 PolarHBondContact O-NH2 2.95Å; S330-R334 PolarHBondContact OG-N 3.39Å; D332-R334 HydrophobicContact CB-CG 4.38Å; D332-R334 PolarHBondContact O-N 3.44Å; D332-R334 PolarHBondContact OD1-N 3.34Å; D332-R334 VanDerWaalsContact OD2-CD 3.26Å; D332-R334 WeakPolarHBondContact OD2-CD 3.44Å; D332-R334 IonicContact OD2-NE 2.81Å; R334-A350 VanDerWaalsContact O-CB 3.32Å; R334-A350 WeakPolarHBondContact O-CB 3.49Å; R334-A350 PolarHBondContact O-N 3.43Å
335	L	95.1	Very high	95.3	Very high	14 Å²	14	15.2 Å²	15.2	7%	0.073	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	149.8	-173.9	-51.9	175	0	0	0	110.1	V34 A36 S330 L347 W348 L356 W371	V34-L335 HydrophobicContact CG1-CD1 4.48Å; A36-L335 HydrophobicContact CB-CD1 4.38Å; S330-L335 PolarHBondContact N-O 3.31Å; S330-L335 WeakPolarHBondContact OG-CA 3.42Å; S330-L335 WeakPolarHBondContact OG-CB 3.48Å; S330-L335 PolarHBondContact OG-N 2.71Å; S330-L335 PolarHBondContact OG-O 3.29Å; L335-L347 HydrophobicContact CB-CD1 4.27Å; L335-W348 WeakPolarHBondContact CA-O 3.29Å; L335-L356 HydrophobicContact CD2-CD1 3.45Å; L335-L356 VanDerWaalsContact CD2-CD1 3.45Å; L335-W371 HydrophobicContact CB-CH2 3.66Å; L335-W371 HydrophobicContact CB-CZ3 3.82Å; L335-W371 HydrophobicContact CD1-CH2 3.73Å; L335-W371 HydrophobicContact CD1-CZ2 4.25Å; L335-W371 HydrophobicContact CG-CH2 4.35Å
336	L	96.6	Very high	95.3	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.9	172.6	-171.1	83.9	0	0	0	108.1	A295 I303 I305 L317 I327 S328 W329 L347 W348	A295-L336 HydrophobicContact CB-CD1 3.99Å; A295-L336 HydrophobicContact CB-CD2 4.04Å; I303-L336 HydrophobicContact CD1-CD2 4.39Å; I303-L336 HydrophobicContact CG2-CD2 3.8Å; I305-L336 HydrophobicContact CD1-CD2 4.41Å; L317-L336 HydrophobicContact CD1-CD2 3.8Å; I327-L336 HydrophobicContact CB-CD1 4.24Å; I327-L336 HydrophobicContact CB-CD2 4.4Å; I327-L336 HydrophobicContact CB-CG 4.44Å; I327-L336 HydrophobicContact CG2-CD2 4.08Å; S328-L336 WeakPolarHBondContact O-CA 3.5Å; W329-L336 HydrophobicContact CD2-CD1 3.52Å; W329-L336 HydrophobicContact CE3-CD1 3.99Å; W329-L336 HydrophobicContact CG-CD1 3.8Å; W329-L336 HydrophobicContact CH2-CD1 4.5Å; W329-L336 HydrophobicContact CZ2-CD1 4.1Å; W329-L336 HydrophobicContact CZ3-CD1 4.46Å; L336-L347 WeakPolarHBondContact O-CA 3.14Å; L336-W348 HydrophobicContact CB-CB 4.37Å; L336-W348 PolarHBondContact N-O 3.38Å; L336-W348 PolarHBondContact O-N 2.74Å
337	V	96.8	Very high	95.3	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	144.2	167.9	67	0	0	0	0	109.6	I327 S328 L345 K346 L347 V369 W371 V378	I327-V337 CarbonylContact C-O 3.57Å; I327-V337 VanDerWaalsContact CA-O 3.23Å; I327-V337 WeakPolarHBondContact CA-O 3.4Å; S328-V337 PolarHBondContact N-O 3.14Å; S328-V337 PolarHBondContact O-N 3.01Å; V337-L345 HydrophobicContact CG2-CB 4.45Å; V337-L345 HydrophobicContact CG2-CD2 4Å; V337-K346 CarbonylContact C-O 3.55Å; V337-K346 WeakPolarHBondContact CA-O 3.22Å; V337-L347 HydrophobicContact CB-CD1 4.17Å; V337-V369 HydrophobicContact CB-CG1 4.45Å; V337-V369 HydrophobicContact CG1-CG1 3.53Å; V337-V369 HydrophobicContact CG2-CG1 4.14Å; V337-W371 HydrophobicContact CB-CE3 4.13Å; V337-W371 HydrophobicContact CB-CZ3 4.09Å; V337-W371 HydrophobicContact CG1-CE3 3.8Å; V337-W371 HydrophobicContact CG1-CZ3 4.28Å; V337-V378 HydrophobicContact CG1-CG1 4.12Å; V337-V378 HydrophobicContact CG1-CG2 4.29Å; V337-V378 HydrophobicContact CG2-CG1 4.16Å
338	S	97.2	Very high	95.3	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	143.3	177.3	54.9	0	0	0	0	112	I303 H320 Q326 L345 K346 W348	I303-S338 WeakPolarHBondContact CD1-OG 3.35Å; H320-S338 PolarHBondContact NE2-OG 2.54Å; Q326-S338 CarbonylContact O-C 3.57Å; Q326-S338 WeakPolarHBondContact O-CA 3.36Å; S338-L345 CarbonylContact O-C 3.59Å; S338-L345 WeakPolarHBondContact O-CA 3.39Å; S338-K346 PolarHBondContact N-O 3.22Å; S338-K346 PolarHBondContact O-N 2.85Å; S338-K346 PolarHBondContact OG-O 3.01Å; S338-W348 PolarHBondContact OG-NE1 3.3Å
339	G	96.4	Very high	95.2	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	138	171.9	0	0	0	0	0	110.9	Y325 Q326	Y325-G339 PolarHBondContact N-O 2.85Å; Q326-G339 PolarHBondContact N-O 3.14Å; Q326-G339 PolarHBondContact O-N 3.1Å
340	S	97.5	Very high	95	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	162.7	-169.3	172.1	0	0	0	0	112	H320 Q322 A323 D342 S343 T344 V366	H320-S340 WeakPolarHBondContact CE1-CB 3.46Å; H320-S340 WeakPolarHBondContact ND1-CB 3.47Å; H320-S340 PolarHBondContact ND1-OG 3.11Å; Q322-S340 PolarHBondContact O-OG 2.73Å; A323-S340 CarbonylContact O-C 3.58Å; A323-S340 VanDerWaalsContact O-CA 3.32Å; A323-S340 WeakPolarHBondContact O-CA 3.26Å; A323-S340 PolarHBondContact O-OG 3.02Å; A323-S340 VanDerWaalsContact O-OG 3.11Å; S340-D342 VanDerWaalsContact CB-OD1 3.25Å; S340-D342 WeakPolarHBondContact CB-OD1 3.36Å; S340-D342 PolarHBondContact O-N 3.29Å; S340-D342 PolarHBondContact OG-N 3.37Å; S340-D342 PolarHBondContact OG-OD1 2.8Å; S340-D342 PolarHBondContact OG-OD2 2.83Å; S340-D342 VanDerWaalsContact OG-OD2 3.12Å; S340-S343 PolarHBondContact O-N 3.18Å; S340-T344 PolarHBondContact N-O 3.1Å; S340-V366 PolarHBondContact O-N 3.29Å
341	A	96.8	Very high	94.7	Very high	9 Å²	9	17.4 Å²	17.4	7%	0.074	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20	169.8	0	0	0	0	0	112.7	Q322 A323 Y325 S343 E365	Q322-A341 HydrophobicContact CB-CB 3.73Å; Q322-A341 PolarHBondContact OE1-O 3.29Å; Q322-A341 VanDerWaalsContact OE1-O 3.06Å; A323-A341 HydrophobicContact CB-CB 4.43Å; A323-A341 PolarHBondContact O-N 3.42Å; Y325-A341 HydrophobicContact CD2-CB 4.4Å; Y325-A341 HydrophobicContact CE2-CB 3.51Å; A341-S343 PolarHBondContact O-N 2.92Å; A341-E365 HydrophobicContact CB-CG 4.08Å
342	D	95.9	Very high	94.6	Very high	21 Å²	21	20.8 Å²	20.8	11%	0.112	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	14.4	177.3	65.1	23.2	0	0	0	114.5	H320 V321 Q322 S340 T344	H320-D342 VanDerWaalsContact CA-OD2 3.26Å; H320-D342 WeakPolarHBondContact CA-OD2 3.21Å; H320-D342 WeakPolarHBondContact CB-OD2 3.36Å; H320-D342 IonicContact CE1-OD1 3.97Å; H320-D342 IonicContact CE1-OD2 2.83Å; H320-D342 IonicContact CG-OD2 3.13Å; H320-D342 IonicContact ND1-OD1 3.99Å; H320-D342 PolarHBondContact ND1-OD1 2.98Å; H320-D342 IonicContact ND1-OD2 2.74Å; H320-D342 PolarHBondContact ND1-OD2 2.54Å; V321-D342 HydrophobicContact CB-CB 4.3Å; V321-D342 PolarHBondContact N-OD2 3.42Å; Q322-D342 HydrophobicContact CB-CB 4.02Å; Q322-D342 HydrophobicContact CG-CB 4.01Å; S340-D342 VanDerWaalsContact CB-OD1 3.25Å; S340-D342 WeakPolarHBondContact CB-OD1 3.36Å; S340-D342 PolarHBondContact O-N 3.29Å; S340-D342 PolarHBondContact OG-N 3.37Å; S340-D342 PolarHBondContact OG-OD1 2.8Å; S340-D342 PolarHBondContact OG-OD2 2.83Å; S340-D342 VanDerWaalsContact OG-OD2 3.12Å; D342-T344 PolarHBondContact O-N 2.93Å; D342-T344 VanDerWaalsContact O-N 3.13Å; D342-T344 WeakPolarHBondContact OD1-CB 3.31Å; D342-T344 PolarHBondContact OD1-N 2.95Å; D342-T344 PolarHBondContact OD1-OG1 2.91Å
343	S	95.6	Very high	94.7	Very high	38 Å²	38	21.3 Å²	21.3	27%	0.266	11%	0.113	S	C	.	.	S	Bend	trans	60.7	9.5	-177.4	70.5	0	0	0	0	116	S340 A341 D364	S340-S343 PolarHBondContact O-N 3.18Å; A341-S343 PolarHBondContact O-N 2.92Å; S343-D364 WeakPolarHBondContact CA-O 3.12Å; S343-D364 VanDerWaalsContact CB-O 3.24Å; S343-D364 WeakPolarHBondContact CB-O 3.41Å
344	T	96	Very high	94.7	Very high	21 Å²	21	26.8 Å²	26.8	13%	0.129	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	152.3	179.4	70.9	0	0	0	0	112.4	S340 D342 K346	S340-T344 PolarHBondContact N-O 3.1Å; D342-T344 PolarHBondContact O-N 2.93Å; D342-T344 VanDerWaalsContact O-N 3.13Å; D342-T344 WeakPolarHBondContact OD1-CB 3.31Å; D342-T344 PolarHBondContact OD1-N 2.95Å; D342-T344 PolarHBondContact OD1-OG1 2.91Å; T344-K346 WeakPolarHBondContact OG1-CE 3.43Å
345	L	96.7	Very high	94.9	Very high	8 Å²	8	26.5 Å²	26.5	4%	0.042	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	143.6	159.1	-74.5	90.7	0	0	0	109.6	V337 S338 L359 V366 V369 V378	V337-L345 HydrophobicContact CG2-CB 4.45Å; V337-L345 HydrophobicContact CG2-CD2 4Å; S338-L345 CarbonylContact O-C 3.59Å; S338-L345 WeakPolarHBondContact O-CA 3.39Å; L345-L359 HydrophobicContact CB-CB 3.87Å; L345-L359 HydrophobicContact CB-CD1 4.39Å; L345-L359 PolarHBondContact N-O 2.82Å; L345-L359 WeakPolarHBondContact O-CA 3.44Å; L345-L359 WeakPolarHBondContact O-CB 3.23Å; L345-L359 PolarHBondContact O-N 3.39Å; L345-V366 HydrophobicContact CD1-CG1 4.09Å; L345-V366 HydrophobicContact CD1-CG2 4.02Å; L345-V366 HydrophobicContact CG-CG1 4.45Å; L345-V369 HydrophobicContact CD2-CG1 3.88Å; L345-V369 HydrophobicContact CD2-CG2 3.82Å; L345-V369 HydrophobicContact CG-CG2 4.43Å; L345-V378 HydrophobicContact CD2-CG1 4.3Å
346	K	96.5	Very high	94.8	Very high	11 Å²	11	29.8 Å²	29.8	5%	0.048	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135	176.1	-70.4	-176.8	-166.1	-62.6	0	110.5	G319 H320 V337 S338 T344 W348 L355 D358	G319-K346 WeakPolarHBondContact O-CE 3.5Å; H320-K346 WeakPolarHBondContact ND1-CE 3.3Å; V337-K346 CarbonylContact C-O 3.55Å; V337-K346 WeakPolarHBondContact CA-O 3.22Å; S338-K346 PolarHBondContact N-O 3.22Å; S338-K346 PolarHBondContact O-N 2.85Å; S338-K346 PolarHBondContact OG-O 3.01Å; T344-K346 WeakPolarHBondContact OG1-CE 3.43Å; K346-W348 HydrophobicContact CB-CZ2 3.62Å; K346-W348 HydrophobicContact CD-CH2 4.15Å; K346-W348 HydrophobicContact CD-CZ2 3.7Å; K346-W348 HydrophobicContact CG-CZ2 4.27Å; K346-W348 PolarHBondContact O-NE1 3.4Å; K346-L355 HydrophobicContact CB-CD1 3.62Å; K346-L355 HydrophobicContact CD-CD1 4.01Å; K346-L355 HydrophobicContact CG-CD1 3.89Å; K346-D358 IonicContact NZ-OD1 3.08Å; K346-D358 PolarHBondContact NZ-OD1 3.13Å; K346-D358 IonicContact NZ-OD2 3.6Å; K346-D358 PolarHBondContact NZ-OD2 3.42Å
347	L	96.5	Very high	94.7	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	127.5	176.7	-173.2	75.2	0	0	0	110.3	A36 L335 L336 V337 L356 V357 W371	A36-L347 HydrophobicContact CB-CD2 3.3Å; L335-L347 HydrophobicContact CB-CD1 4.27Å; L336-L347 WeakPolarHBondContact O-CA 3.14Å; V337-L347 HydrophobicContact CB-CD1 4.17Å; L347-L356 HydrophobicContact CD2-CB 4.41Å; L347-L356 HydrophobicContact CD2-CD1 4.44Å; L347-L356 PolarHBondContact O-N 3.42Å; L347-V357 HydrophobicContact CB-CB 4.15Å; L347-V357 HydrophobicContact CD2-CB 4.45Å; L347-V357 HydrophobicContact CD2-CG2 4.24Å; L347-V357 PolarHBondContact N-O 3.28Å; L347-V357 PolarHBondContact O-N 2.83Å; L347-W371 HydrophobicContact CD1-CH2 3.41Å; L347-W371 VanDerWaalsContact CD1-CH2 3.41Å; L347-W371 HydrophobicContact CD1-CZ3 3.42Å; L347-W371 VanDerWaalsContact CD1-CZ3 3.42Å
348	W	96.7	Very high	94.6	Very high	3 Å²	3	34.8 Å²	34.8	1%	0.011	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	142.9	-173.2	-51	91.6	0	0	0	111.4	L317 R318 L335 L336 S338 K346 K354 L355	L317-W348 HydrophobicContact CB-CD2 3.89Å; L317-W348 HydrophobicContact CB-CE3 3.77Å; L317-W348 HydrophobicContact CB-CG 4.46Å; L317-W348 HydrophobicContact CB-CH2 4.38Å; L317-W348 HydrophobicContact CB-CZ2 4.47Å; L317-W348 HydrophobicContact CB-CZ3 4.03Å; L317-W348 HydrophobicContact CD1-CB 3.81Å; L317-W348 HydrophobicContact CD1-CD2 4.03Å; L317-W348 HydrophobicContact CD1-CG 3.7Å; L317-W348 HydrophobicContact CD2-CB 4.46Å; L317-W348 HydrophobicContact CD2-CE3 4.26Å; L317-W348 HydrophobicContact CG-CD2 4.38Å; L317-W348 HydrophobicContact CG-CE3 4.4Å; L317-W348 HydrophobicContact CG-CG 4.49Å; R318-W348 VanDerWaalsContact C-CH2 3.44Å; R318-W348 VanDerWaalsContact O-CH2 3.25Å; R318-W348 WeakPolarHBondContact O-CH2 3.36Å; R318-W348 WeakPolarHBondContact O-CZ3 3.47Å; L335-W348 WeakPolarHBondContact CA-O 3.29Å; L336-W348 HydrophobicContact CB-CB 4.37Å; L336-W348 PolarHBondContact N-O 3.38Å; L336-W348 PolarHBondContact O-N 2.74Å; S338-W348 PolarHBondContact OG-NE1 3.3Å; K346-W348 HydrophobicContact CB-CZ2 3.62Å; K346-W348 HydrophobicContact CD-CH2 4.15Å; K346-W348 HydrophobicContact CD-CZ2 3.7Å; K346-W348 HydrophobicContact CG-CZ2 4.27Å; K346-W348 PolarHBondContact O-NE1 3.4Å; W348-K354 WeakPolarHBondContact CA-O 3.34Å; W348-L355 HydrophobicContact CD2-CD1 4.2Å; W348-L355 HydrophobicContact CE3-CB 3.97Å; W348-L355 HydrophobicContact CE3-CD1 4.1Å; W348-L355 HydrophobicContact CH2-CB 4.28Å; W348-L355 HydrophobicContact CH2-CD1 3.91Å; W348-L355 HydrophobicContact CZ2-CD1 4.04Å; W348-L355 HydrophobicContact CZ3-CB 3.66Å; W348-L355 HydrophobicContact CZ3-CD1 3.96Å; W348-L355 HydrophobicContact CZ3-CG 4.38Å
349	D	94.6	Very high	94.4	Very high	37 Å²	37	35.9 Å²	35.9	20%	0.198	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	116.6	161.2	-170.6	-26.6	0	0	0	108.6	K351 D352 G353 K354 L356	D349-K351 VanDerWaalsContact C-N 3.29Å; D349-K351 PolarHBondContact O-N 3.04Å; D349-K351 WeakPolarHBondContact OD1-CB 3.45Å; D349-K351 PolarHBondContact OD1-N 2.8Å; D349-D352 HydrophobicContact CB-CB 4.28Å; D349-D352 PolarHBondContact OD1-N 2.5Å; D349-G353 WeakPolarHBondContact O-CA 3.2Å; D349-G353 PolarHBondContact O-N 3.24Å; D349-K354 PolarHBondContact N-O 2.82Å; D349-L356 HydrophobicContact CB-CD1 3.91Å; D349-L356 HydrophobicContact CB-CD2 4.1Å; D349-L356 HydrophobicContact CB-CG 3.95Å
350	A	92	Very high	94.2	Very high	3 Å²	3	40.5 Å²	40.5	3%	0.025	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-28.6	-179.9	0	0	0	0	0	112.8	L293 W329 R334	L293-A350 HydrophobicContact CD1-CB 4.17Å; W329-A350 HydrophobicContact CH2-CB 3.89Å; W329-A350 HydrophobicContact CZ3-CB 3.5Å; W329-A350 VanDerWaalsContact CZ3-CB 3.5Å; R334-A350 VanDerWaalsContact O-CB 3.32Å; R334-A350 WeakPolarHBondContact O-CB 3.49Å; R334-A350 PolarHBondContact O-N 3.43Å
351	K	87.7	Confident	93.8	Very high	97 Å²	97	42.5 Å²	42.5	42%	0.422	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-40.4	-177.7	178.7	173.8	175.9	168	0	112.3	E2 R315 D349	E2-K351 IonicContact OE1-NZ 3.25Å; E2-K351 PolarHBondContact OE1-NZ 3.18Å; E2-K351 WeakPolarHBondContact OE2-CE 3.4Å; E2-K351 IonicContact OE2-NZ 3.91Å; E2-K351 PolarHBondContact OE2-NZ 3.43Å; R315-K351 PolarHBondContact NH1-O 3.11Å; R315-K351 PolarHBondContact NH2-O 2.91Å; D349-K351 VanDerWaalsContact C-N 3.29Å; D349-K351 PolarHBondContact O-N 3.04Å; D349-K351 WeakPolarHBondContact OD1-CB 3.45Å; D349-K351 PolarHBondContact OD1-N 2.8Å
352	D	88.6	Confident	93.6	Very high	77 Å²	77	42.7 Å²	42.7	41%	0.412	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-26.5	179.8	-88.2	14.8	0	0	0	112.1	R315 D349 K354	R315-D352 PolarHBondContact NH1-O 2.99Å; D349-D352 HydrophobicContact CB-CB 4.28Å; D349-D352 PolarHBondContact OD1-N 2.5Å; D352-K354 VanDerWaalsContact C-N 3.3Å; D352-K354 HydrophobicContact CB-CB 4.38Å; D352-K354 HydrophobicContact CB-CD 4.04Å; D352-K354 HydrophobicContact CB-CG 4.05Å; D352-K354 IonicContact OD2-NZ 3.45Å; D352-K354 PolarHBondContact OD2-NZ 3.42Å; D352-K354 VanDerWaalsContact OD2-NZ 3.08Å
353	G	90.6	Very high	93.5	Very high	18 Å²	18	46.1 Å²	46.1	19%	0.186	27%	0.272	C	S	.	.			trans	73.1	22.9	-172.4	0	0	0	0	0	113.5	D349	D349-G353 WeakPolarHBondContact O-CA 3.2Å; D349-G353 PolarHBondContact O-N 3.24Å
354	K	92.8	Very high	93.4	Very high	125 Å²	125	46.8 Å²	46.8	54%	0.543	27%	0.272	S	S	.	.			trans	-97.4	147.3	-179.4	-69.4	173.7	-174.1	158.8	0	110.6	W348 D349 D352 L356	W348-K354 WeakPolarHBondContact CA-O 3.34Å; D349-K354 PolarHBondContact N-O 2.82Å; D352-K354 VanDerWaalsContact C-N 3.3Å; D352-K354 HydrophobicContact CB-CB 4.38Å; D352-K354 HydrophobicContact CB-CD 4.04Å; D352-K354 HydrophobicContact CB-CG 4.05Å; D352-K354 IonicContact OD2-NZ 3.45Å; D352-K354 PolarHBondContact OD2-NZ 3.42Å; D352-K354 VanDerWaalsContact OD2-NZ 3.08Å; K354-L356 PolarHBondContact O-N 2.75Å
355	L	95.4	Very high	93.4	Very high	74 Å²	74	47.8 Å²	47.8	39%	0.387	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	123.3	165.8	-176.9	67.3	0	0	0	108.3	K346 W348	K346-L355 HydrophobicContact CB-CD1 3.62Å; K346-L355 HydrophobicContact CD-CD1 4.01Å; K346-L355 HydrophobicContact CG-CD1 3.89Å; W348-L355 HydrophobicContact CD2-CD1 4.2Å; W348-L355 HydrophobicContact CE3-CB 3.97Å; W348-L355 HydrophobicContact CE3-CD1 4.1Å; W348-L355 HydrophobicContact CH2-CB 4.28Å; W348-L355 HydrophobicContact CH2-CD1 3.91Å; W348-L355 HydrophobicContact CZ2-CD1 4.04Å; W348-L355 HydrophobicContact CZ3-CB 3.66Å; W348-L355 HydrophobicContact CZ3-CD1 3.96Å; W348-L355 HydrophobicContact CZ3-CG 4.38Å
356	L	94.4	Very high	93.3	Very high	82 Å²	82	47.4 Å²	47.4	43%	0.429	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-49.1	176.9	-68.2	175	0	0	0	111.3	L335 L347 D349 K354	L335-L356 HydrophobicContact CD2-CD1 3.45Å; L335-L356 VanDerWaalsContact CD2-CD1 3.45Å; L347-L356 HydrophobicContact CD2-CB 4.41Å; L347-L356 HydrophobicContact CD2-CD1 4.44Å; L347-L356 PolarHBondContact O-N 3.42Å; D349-L356 HydrophobicContact CB-CD1 3.91Å; D349-L356 HydrophobicContact CB-CD2 4.1Å; D349-L356 HydrophobicContact CB-CG 3.95Å; K354-L356 PolarHBondContact O-N 2.75Å
357	V	94.4	Very high	93.2	Very high	30 Å²	30	49.6 Å²	49.6	18%	0.182	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	134.4	-176.1	-173.8	0	0	0	0	108.9	T38 L347 L359	T38-V357 HydrophobicContact CG2-CG2 4.28Å; L347-V357 HydrophobicContact CB-CB 4.15Å; L347-V357 HydrophobicContact CD2-CB 4.45Å; L347-V357 HydrophobicContact CD2-CG2 4.24Å; L347-V357 PolarHBondContact N-O 3.28Å; L347-V357 PolarHBondContact O-N 2.83Å; V357-L359 HydrophobicContact CG1-CD2 3.68Å; V357-L359 HydrophobicContact CG1-CG 4.01Å
358	D	94.5	Very high	93	Very high	75 Å²	75	49.5 Å²	49.5	40%	0.401	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.5	166.2	-159.5	3.5	0	0	0	108.7	K346 P360	K346-D358 IonicContact NZ-OD1 3.08Å; K346-D358 PolarHBondContact NZ-OD1 3.13Å; K346-D358 IonicContact NZ-OD2 3.6Å; K346-D358 PolarHBondContact NZ-OD2 3.42Å; D358-P360 VanDerWaalsContact C-CD 3.42Å; D358-P360 WeakPolarHBondContact O-CD 3.37Å
359	L	93.6	Very high	92.9	Very high	24 Å²	24	49.6 Å²	49.6	13%	0.126	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	80.7	-174.5	-66	172.9	0	0	0	109.1	L345 V357	L345-L359 HydrophobicContact CB-CB 3.87Å; L345-L359 HydrophobicContact CB-CD1 4.39Å; L345-L359 PolarHBondContact N-O 2.82Å; L345-L359 WeakPolarHBondContact O-CA 3.44Å; L345-L359 WeakPolarHBondContact O-CB 3.23Å; L345-L359 PolarHBondContact O-N 3.39Å; V357-L359 HydrophobicContact CG1-CD2 3.68Å; V357-L359 HydrophobicContact CG1-CG 4.01Å
360	P	92.1	Very high	93	Very high	97 Å²	97	48.1 Å²	48.1	63%	0.63	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	154.3	170.9	32.2	-35.2	0	0	0	110.5	D358	D358-P360 VanDerWaalsContact C-CD 3.42Å; D358-P360 WeakPolarHBondContact O-CD 3.37Å
361	G	88	Confident	93.1	Very high	42 Å²	42	48.1 Å²	48.1	43%	0.433	27%	0.274	S	S	.	.			trans	159.4	-23.2	168.3	0	0	0	0	0	115.7	K388	G361-K388 VanDerWaalsContact C-CE 3.41Å; G361-K388 WeakPolarHBondContact O-CE 3.35Å; G361-K388 PolarHBondContact O-NZ 2.79Å
362	H	93	Very high	93.3	Very high	12 Å²	12	43.6 Å²	43.6	6%	0.056	25%	0.254	C	S	.	.			trans	-72.9	146.9	170.9	-79.2	-77.5	0	0	0	110.2	V366 S380 D384 V386	H362-V366 HydrophobicContact CB-CG2 3.82Å; H362-V366 VanDerWaalsContact CD2-CG2 3.44Å; H362-V366 WeakPolarHBondContact CD2-CG2 3.24Å; H362-S380 WeakPolarHBondContact NE2-CB 3.29Å; H362-S380 PolarHBondContact NE2-OG 3.22Å; H362-D384 VanDerWaalsContact CA-OD2 3.32Å; H362-D384 WeakPolarHBondContact CA-OD2 3.32Å; H362-D384 WeakPolarHBondContact CB-OD2 3.19Å; H362-D384 IonicContact CE1-OD1 3.44Å; H362-D384 IonicContact CE1-OD2 3.6Å; H362-D384 IonicContact CG-OD2 3.7Å; H362-D384 IonicContact ND1-OD1 3.5Å; H362-D384 PolarHBondContact ND1-OD1 2.82Å; H362-D384 VanDerWaalsContact ND1-OD1 3.12Å; H362-D384 IonicContact ND1-OD2 2.85Å; H362-D384 PolarHBondContact ND1-OD2 3.01Å; H362-V386 PolarHBondContact CE1-O 3.32Å
363	A	93.2	Very high	93.2	Very high	94 Å²	94	40.6 Å²	40.6	78%	0.777	24%	0.239	S	C	*	.	S	Bend	trans	-91	-8.8	179.5	0	0	0	0	0	113.1	D384	A363-D384 HydrophobicContact CB-CB 4.1Å; A363-D384 PolarHBondContact N-OD2 3.26Å; A363-D384 VanDerWaalsContact N-OD2 3.14Å
364	D	94.5	Very high	92.8	Very high	52 Å²	52	41.5 Å²	41.5	28%	0.278	24%	0.239	S	C	.	.	S	Bend	trans	-151.9	-175.3	-177	-152.8	-32.3	0	0	0	108.8	S343 K383 D384	S343-D364 WeakPolarHBondContact CA-O 3.12Å; S343-D364 VanDerWaalsContact CB-O 3.24Å; S343-D364 WeakPolarHBondContact CB-O 3.41Å; D364-K383 HydrophobicContact CB-CB 3.93Å; D364-K383 HydrophobicContact CB-CG 4.33Å; D364-K383 IonicContact OD1-NZ 3.13Å; D364-K383 PolarHBondContact OD1-NZ 3.37Å; D364-K383 WeakPolarHBondContact OD2-CD 3.4Å; D364-K383 WeakPolarHBondContact OD2-CE 3.26Å; D364-K383 WeakPolarHBondContact OD2-CG 3.25Å; D364-K383 IonicContact OD2-NZ 2.8Å; D364-K383 PolarHBondContact OD2-NZ 3.05Å; D364-D384 HydrophobicContact CB-CB 4.1Å
365	E	95.2	Very high	92.5	Very high	41 Å²	41	35.8 Å²	35.8	19%	0.192	22%	0.216	C	C	.	.			trans	-52.3	137.9	-177.5	-63.7	162.1	-138.7	0	0	113.7	Y325 A341 Y367 G382 K383	Y325-E365 HydrophobicContact CE2-CB 4.24Å; Y325-E365 PolarHBondContact OH-OE2 3.21Å; A341-E365 HydrophobicContact CB-CG 4.08Å; E365-Y367 HydrophobicContact CB-CD1 4.4Å; E365-Y367 HydrophobicContact CB-CE1 3.7Å; E365-Y367 WeakPolarHBondContact OE2-CE1 3.5Å; E365-Y367 VanDerWaalsContact OE2-CZ 3.3Å; E365-Y367 PolarHBondContact OE2-OH 2.93Å; E365-G382 CarbonylContact O-C 3.59Å; E365-G382 WeakPolarHBondContact O-CA 3.39Å; E365-K383 HydrophobicContact CB-CB 4.39Å; E365-K383 PolarHBondContact O-N 2.83Å; E365-K383 IonicContact OE1-NZ 2.65Å; E365-K383 PolarHBondContact OE1-NZ 3.44Å
366	V	95.7	Very high	92.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	106.5	178	-175.9	0	0	0	0	110.5	Y325 S340 L345 H362 V369	Y325-V366 WeakPolarHBondContact CD2-O 3.42Å; S340-V366 PolarHBondContact O-N 3.29Å; L345-V366 HydrophobicContact CD1-CG1 4.09Å; L345-V366 HydrophobicContact CD1-CG2 4.02Å; L345-V366 HydrophobicContact CG-CG1 4.45Å; H362-V366 HydrophobicContact CB-CG2 3.82Å; H362-V366 VanDerWaalsContact CD2-CG2 3.44Å; H362-V366 WeakPolarHBondContact CD2-CG2 3.24Å; V366-V369 HydrophobicContact CG1-CG2 3.83Å
367	Y	93.9	Very high	91.9	Very high	57 Å²	57	39.9 Å²	39.9	22%	0.224	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-33.5	-175.5	-62.2	-39.2	0	0	0	114.2	A50 Y325 Q326 E365 G381 K383	A50-Y367 HydrophobicContact CB-CD2 4.43Å; A50-Y367 HydrophobicContact CB-CE2 4.1Å; Y325-Y367 AromaticContact CD2-CD1 3.79Å; Y325-Y367 HydrophobicContact CD2-CD1 3.79Å; Y325-Y367 HydrophobicContact CD2-CE1 4.25Å; Y325-Y367 AromaticContact CE2-CD1 3.79Å; Y325-Y367 HydrophobicContact CE2-CD1 3.79Å; Y325-Y367 AromaticContact CE2-CE1 3.75Å; Y325-Y367 HydrophobicContact CE2-CE1 3.75Å; Y325-Y367 HydrophobicContact CG-CD1 4.39Å; Q326-Y367 VanDerWaalsContact CG-O 3.27Å; Q326-Y367 WeakPolarHBondContact CG-O 3.46Å; Q326-Y367 PolarHBondContact NE2-O 3.46Å; E365-Y367 HydrophobicContact CB-CD1 4.4Å; E365-Y367 HydrophobicContact CB-CE1 3.7Å; E365-Y367 WeakPolarHBondContact OE2-CE1 3.5Å; E365-Y367 VanDerWaalsContact OE2-CZ 3.3Å; E365-Y367 PolarHBondContact OE2-OH 2.93Å; Y367-G381 PolarHBondContact N-O 2.97Å; Y367-K383 HydrophobicContact CE2-CB 3.77Å; Y367-K383 WeakPolarHBondContact OH-CD 3.45Å
368	A	92.8	Very high	91.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	135.7	-171.8	0	0	0	0	0	112.4	T54 Q326 S380 G381	T54-A368 HydrophobicContact CG2-CB 3.73Å; Q326-A368 VanDerWaalsContact OE1-CA 3.27Å; A368-S380 VanDerWaalsContact O-CA 3.31Å; A368-S380 WeakPolarHBondContact O-CA 3.34Å; A368-G381 PolarHBondContact N-O 3.45Å; A368-G381 PolarHBondContact O-N 3.42Å
369	V	94.9	Very high	91.9	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.03	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	136.4	178.8	-175.3	0	0	0	0	109.5	V337 L345 V366 V378 V379	V337-V369 HydrophobicContact CB-CG1 4.45Å; V337-V369 HydrophobicContact CG1-CG1 3.53Å; V337-V369 HydrophobicContact CG2-CG1 4.14Å; L345-V369 HydrophobicContact CD2-CG1 3.88Å; L345-V369 HydrophobicContact CD2-CG2 3.82Å; L345-V369 HydrophobicContact CG-CG2 4.43Å; V366-V369 HydrophobicContact CG1-CG2 3.83Å; V369-V378 HydrophobicContact CG1-CG1 3.92Å; V369-V379 VanDerWaalsContact CA-O 3.32Å; V369-V379 WeakPolarHBondContact CA-O 3.47Å
370	D	95.3	Very high	91.9	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.027	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	148.4	173.1	-171.5	37.5	0	0	0	111.4	L55 F56 R223 S328 V378 V379	L55-D370 WeakPolarHBondContact CA-OD2 3.43Å; L55-D370 HydrophobicContact CD2-CB 4.28Å; F56-D370 HydrophobicContact CD2-CB 4.33Å; F56-D370 WeakPolarHBondContact CE2-O 3.29Å; F56-D370 PolarHBondContact N-OD2 3.11Å; R223-D370 IonicContact CZ-OD1 3.34Å; R223-D370 IonicContact CZ-OD2 3.58Å; R223-D370 IonicContact NH1-OD1 3.88Å; R223-D370 PolarHBondContact NH1-OD1 2.93Å; R223-D370 IonicContact NH1-OD2 3.8Å; R223-D370 PolarHBondContact NH1-OD2 2.79Å; R223-D370 IonicContact NH2-OD1 2.88Å; R223-D370 IonicContact NH2-OD2 3.28Å; R223-D370 PolarHBondContact NH2-OD2 3.43Å; S328-D370 PolarHBondContact OG-OD1 3.21Å; D370-V378 WeakPolarHBondContact O-CA 3.42Å; D370-V379 HydrophobicContact CB-CG1 3.85Å; D370-V379 PolarHBondContact N-O 2.89Å; D370-V379 PolarHBondContact O-N 3.26Å
371	W	93.7	Very high	92	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.015	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	131.6	175.5	-153.8	-46	0	0	0	108.5	V34 V37 S328 L335 V337 L347 G375 R377 V378	V34-W371 HydrophobicContact CG1-CH2 4.45Å; V34-W371 HydrophobicContact CG1-CZ2 3.52Å; V37-W371 HydrophobicContact CG2-CZ2 4.23Å; S328-W371 PolarHBondContact OG-N 3.39Å; S328-W371 VanDerWaalsContact OG-N 3.09Å; L335-W371 HydrophobicContact CB-CH2 3.66Å; L335-W371 HydrophobicContact CB-CZ3 3.82Å; L335-W371 HydrophobicContact CD1-CH2 3.73Å; L335-W371 HydrophobicContact CD1-CZ2 4.25Å; L335-W371 HydrophobicContact CG-CH2 4.35Å; V337-W371 HydrophobicContact CB-CE3 4.13Å; V337-W371 HydrophobicContact CB-CZ3 4.09Å; V337-W371 HydrophobicContact CG1-CE3 3.8Å; V337-W371 HydrophobicContact CG1-CZ3 4.28Å; L347-W371 HydrophobicContact CD1-CH2 3.41Å; L347-W371 VanDerWaalsContact CD1-CH2 3.41Å; L347-W371 HydrophobicContact CD1-CZ3 3.42Å; L347-W371 VanDerWaalsContact CD1-CZ3 3.42Å; W371-G375 PolarHBondContact NE1-O 2.81Å; W371-R377 VanDerWaalsContact CD1-O 3.27Å; W371-V378 HydrophobicContact CB-CG2 4.46Å; W371-V378 HydrophobicContact CD2-CG2 3.62Å; W371-V378 HydrophobicContact CE3-CG2 3.97Å; W371-V378 HydrophobicContact CG-CG2 3.88Å; W371-V378 HydrophobicContact CZ2-CG2 4.29Å; W371-V378 HydrophobicContact CZ3-CG2 4.44Å
372	S	91.9	Very high	92.2	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.007	15%	0.146	C	C	.	.			trans	-59.9	136.4	175.3	65.6	0	0	0	0	110.9	F56 N374 G375 E376 R377	F56-S372 VanDerWaalsContact CD2-N 3.29Å; S372-N374 WeakPolarHBondContact CB-OD1 3.35Å; S372-N374 PolarHBondContact O-N 2.7Å; S372-N374 VanDerWaalsContact O-N 3.1Å; S372-N374 PolarHBondContact OG-OD1 3.39Å; S372-G375 WeakPolarHBondContact O-CA 3.49Å; S372-G375 PolarHBondContact O-N 3.08Å; S372-E376 PolarHBondContact OG-N 3.29Å; S372-R377 WeakPolarHBondContact CB-O 3.45Å; S372-R377 PolarHBondContact N-O 2.85Å; S372-R377 PolarHBondContact OG-N 3.36Å; S372-R377 PolarHBondContact OG-O 2.93Å
373	P	87.4	Confident	92.1	Very high	15 Å²	15	31.1 Å²	31.1	10%	0.097	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.8	-179.9	-29.6	37.2	0	0	0	114.6	P58 Y220 S331 G375	P58-P373 WeakPolarHBondContact O-CB 3.45Å; Y220-P373 PolarHBondContact OH-O 3.11Å; S331-P373 VanDerWaalsContact CB-O 3.23Å; S331-P373 WeakPolarHBondContact CB-O 3.36Å; S331-P373 PolarHBondContact OG-O 2.82Å; P373-G375 PolarHBondContact O-N 2.99Å
374	N	83	Confident	92	Very high	36 Å²	36	28.1 Å²	28.1	19%	0.193	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-10.7	173.4	68.3	2.7	0	0	0	113.6	R229 S372 E376	R229-N374 PolarHBondContact NH2-O 3.26Å; S372-N374 WeakPolarHBondContact CB-OD1 3.35Å; S372-N374 PolarHBondContact O-N 2.7Å; S372-N374 VanDerWaalsContact O-N 3.1Å; S372-N374 PolarHBondContact OG-OD1 3.39Å; N374-E376 VanDerWaalsContact C-N 3.33Å; N374-E376 PolarHBondContact ND2-OE2 3.35Å; N374-E376 PolarHBondContact OD1-N 3.41Å
375	G	85.8	Confident	91.8	Very high	6 Å²	6	30.2 Å²	30.2	6%	0.062	14%	0.138	C	C	.	.	S	Bend	trans	83.1	-4.9	-179.8	0	0	0	0	0	115.4	V34 W371 S372 P373	V34-G375 WeakPolarHBondContact CG1-O 3.36Å; W371-G375 PolarHBondContact NE1-O 2.81Å; S372-G375 WeakPolarHBondContact O-CA 3.49Å; S372-G375 PolarHBondContact O-N 3.08Å; P373-G375 PolarHBondContact O-N 2.99Å
376	E	87.3	Confident	91.5	Very high	114 Å²	114	29.8 Å²	29.8	53%	0.533	14%	0.138	S	C	.	.	S	Bend	trans	-82.5	-26.9	-167.3	-67.9	171.9	-165	0	0	114.8	R229 S372 N374	R229-E376 IonicContact NH2-OE1 2.99Å; R229-E376 PolarHBondContact NH2-OE1 3.15Å; R229-E376 VanDerWaalsContact NH2-OE1 3.13Å; S372-E376 PolarHBondContact OG-N 3.29Å; N374-E376 VanDerWaalsContact C-N 3.33Å; N374-E376 PolarHBondContact ND2-OE2 3.35Å; N374-E376 PolarHBondContact OD1-N 3.41Å
377	R	90.9	Very high	91.3	Very high	128 Å²	128	30 Å²	30	48%	0.483	14%	0.139	S	C	.	.			trans	-138	151.4	-170.6	-57.2	-176.1	-167.1	-179.1	3.3	111.2	F56 W371 S372	F56-R377 HydrophobicContact CE1-CB 4.1Å; F56-R377 HydrophobicContact CZ-CB 3.67Å; W371-R377 VanDerWaalsContact CD1-O 3.27Å; S372-R377 WeakPolarHBondContact CB-O 3.45Å; S372-R377 PolarHBondContact N-O 2.85Å; S372-R377 PolarHBondContact OG-N 3.36Å; S372-R377 PolarHBondContact OG-O 2.93Å
378	V	94	Very high	91.2	Very high	5 Å²	5	28.7 Å²	28.7	3%	0.03	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	138.1	168.9	168.5	0	0	0	0	106.7	V37 V337 L345 V369 D370 W371 L389	V37-V378 HydrophobicContact CB-CG2 4.42Å; V37-V378 HydrophobicContact CG2-CB 4.3Å; V37-V378 HydrophobicContact CG2-CG2 3.75Å; V337-V378 HydrophobicContact CG1-CG1 4.12Å; V337-V378 HydrophobicContact CG1-CG2 4.29Å; V337-V378 HydrophobicContact CG2-CG1 4.16Å; L345-V378 HydrophobicContact CD2-CG1 4.3Å; V369-V378 HydrophobicContact CG1-CG1 3.92Å; D370-V378 WeakPolarHBondContact O-CA 3.42Å; W371-V378 HydrophobicContact CB-CG2 4.46Å; W371-V378 HydrophobicContact CD2-CG2 3.62Å; W371-V378 HydrophobicContact CE3-CG2 3.97Å; W371-V378 HydrophobicContact CG-CG2 3.88Å; W371-V378 HydrophobicContact CZ2-CG2 4.29Å; W371-V378 HydrophobicContact CZ3-CG2 4.44Å; V378-L389 CarbonylContact O-C 3.55Å; V378-L389 WeakPolarHBondContact O-CA 3.4Å; V378-L389 VanDerWaalsContact O-OXT 3.05Å
379	V	93.5	Very high	91.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	142.5	173.4	65.9	0	0	0	0	108.9	T54 F56 V63 V369 D370 L387 K388 L389	T54-V379 HydrophobicContact CG2-CG1 3.78Å; T54-V379 HydrophobicContact CG2-CG2 4.18Å; T54-V379 WeakPolarHBondContact OG1-CG1 3.49Å; T54-V379 WeakPolarHBondContact OG1-CG2 3.3Å; F56-V379 HydrophobicContact CD2-CB 4.37Å; F56-V379 HydrophobicContact CD2-CG1 3.73Å; F56-V379 HydrophobicContact CE2-CB 3.59Å; F56-V379 HydrophobicContact CE2-CG1 3.41Å; F56-V379 VanDerWaalsContact CE2-CG1 3.41Å; F56-V379 HydrophobicContact CZ-CB 3.83Å; F56-V379 HydrophobicContact CZ-CG1 4.11Å; V63-V379 HydrophobicContact CG1-CB 4.28Å; V63-V379 HydrophobicContact CG1-CG1 4.43Å; V63-V379 HydrophobicContact CG1-CG2 3.72Å; V369-V379 VanDerWaalsContact CA-O 3.32Å; V369-V379 WeakPolarHBondContact CA-O 3.47Å; D370-V379 HydrophobicContact CB-CG1 3.85Å; D370-V379 PolarHBondContact N-O 2.89Å; D370-V379 PolarHBondContact O-N 3.26Å; V379-L387 HydrophobicContact CG2-CD1 3.58Å; V379-L387 HydrophobicContact CG2-CD2 3.95Å; V379-L387 HydrophobicContact CG2-CG 3.66Å; V379-K388 CarbonylContact C-O 3.58Å; V379-K388 WeakPolarHBondContact CA-O 3.23Å; V379-L389 HydrophobicContact CB-CD2 3.63Å; V379-L389 HydrophobicContact CG2-CD2 3.73Å
380	S	94.5	Very high	91	Very high	9 Å²	9	31.2 Å²	31.2	6%	0.063	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	146.7	176.3	51.1	0	0	0	0	111.4	H362 A368 L387 K388	H362-S380 WeakPolarHBondContact NE2-CB 3.29Å; H362-S380 PolarHBondContact NE2-OG 3.22Å; A368-S380 VanDerWaalsContact O-CA 3.31Å; A368-S380 WeakPolarHBondContact O-CA 3.34Å; S380-L387 WeakPolarHBondContact O-CA 3.41Å; S380-L387 WeakPolarHBondContact O-CD1 3.39Å; S380-K388 PolarHBondContact N-O 3.11Å; S380-K388 PolarHBondContact O-N 3.15Å; S380-K388 PolarHBondContact OG-O 3.02Å
381	G	92.8	Very high	90.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	150.4	179.4	0	0	0	0	0	110.8	Y367 A368	Y367-G381 PolarHBondContact N-O 2.97Å; A368-G381 PolarHBondContact N-O 3.45Å; A368-G381 PolarHBondContact O-N 3.42Å
382	G	92.4	Very high	90.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	-149.9	-176.1	0	0	0	0	0	113.8	A50 V51 E365 D384 K385	A50-G382 WeakPolarHBondContact CA-O 3.4Å; V51-G382 PolarHBondContact N-O 3.42Å; E365-G382 CarbonylContact O-C 3.59Å; E365-G382 WeakPolarHBondContact O-CA 3.39Å; G382-D384 VanDerWaalsContact C-N 3.3Å; G382-D384 PolarHBondContact O-N 3.33Å; G382-K385 PolarHBondContact O-N 2.76Å
383	K	91.9	Very high	90.5	Very high	81 Å²	81	36.1 Å²	36.1	35%	0.352	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-21.1	-172.4	-173.4	165.2	146	-136.6	0	114.1	D364 E365 Y367 K385	D364-K383 HydrophobicContact CB-CB 3.93Å; D364-K383 HydrophobicContact CB-CG 4.33Å; D364-K383 IonicContact OD1-NZ 3.13Å; D364-K383 PolarHBondContact OD1-NZ 3.37Å; D364-K383 WeakPolarHBondContact OD2-CD 3.4Å; D364-K383 WeakPolarHBondContact OD2-CE 3.26Å; D364-K383 WeakPolarHBondContact OD2-CG 3.25Å; D364-K383 IonicContact OD2-NZ 2.8Å; D364-K383 PolarHBondContact OD2-NZ 3.05Å; E365-K383 HydrophobicContact CB-CB 4.39Å; E365-K383 PolarHBondContact O-N 2.83Å; E365-K383 IonicContact OE1-NZ 2.65Å; E365-K383 PolarHBondContact OE1-NZ 3.44Å; Y367-K383 HydrophobicContact CE2-CB 3.77Å; Y367-K383 WeakPolarHBondContact OH-CD 3.45Å; K383-K385 WeakPolarHBondContact O-CG 3.43Å; K383-K385 PolarHBondContact O-N 3.29Å
384	D	91.4	Very high	90.7	Very high	32 Å²	32	37.4 Å²	37.4	17%	0.171	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-2.2	173.6	70.6	-7.2	0	0	0	114	H362 A363 D364 G382 V386	H362-D384 VanDerWaalsContact CA-OD2 3.32Å; H362-D384 WeakPolarHBondContact CA-OD2 3.32Å; H362-D384 WeakPolarHBondContact CB-OD2 3.19Å; H362-D384 IonicContact CE1-OD1 3.44Å; H362-D384 IonicContact CE1-OD2 3.6Å; H362-D384 IonicContact CG-OD2 3.7Å; H362-D384 IonicContact ND1-OD1 3.5Å; H362-D384 PolarHBondContact ND1-OD1 2.82Å; H362-D384 VanDerWaalsContact ND1-OD1 3.12Å; H362-D384 IonicContact ND1-OD2 2.85Å; H362-D384 PolarHBondContact ND1-OD2 3.01Å; A363-D384 HydrophobicContact CB-CB 4.1Å; A363-D384 PolarHBondContact N-OD2 3.26Å; A363-D384 VanDerWaalsContact N-OD2 3.14Å; D364-D384 HydrophobicContact CB-CB 4.1Å; G382-D384 VanDerWaalsContact C-N 3.3Å; G382-D384 PolarHBondContact O-N 3.33Å; D384-V386 PolarHBondContact O-N 3.27Å; D384-V386 PolarHBondContact OD1-N 2.72Å
385	K	89.5	Confident	91.2	Very high	96 Å²	96	37.5 Å²	37.5	42%	0.417	17%	0.172	S	C	.	.			trans	64.3	16.8	174.3	-39.1	-179.9	179.9	-172.6	0	113.9	H47 G48 E49 G382 K383	H47-K385 HydrophobicContact CB-CB 4.17Å; H47-K385 WeakPolarHBondContact CB-O 3.42Å; H47-K385 WeakPolarHBondContact O-CB 3.28Å; G48-K385 WeakPolarHBondContact O-CD 3.1Å; G48-K385 WeakPolarHBondContact O-CE 3.37Å; G48-K385 PolarHBondContact O-NZ 3.44Å; E49-K385 WeakPolarHBondContact O-CB 3.47Å; G382-K385 PolarHBondContact O-N 2.76Å; K383-K385 WeakPolarHBondContact O-CG 3.43Å; K383-K385 PolarHBondContact O-N 3.29Å
386	V	90.3	Very high	91.6	Very high	31 Å²	31	39.7 Å²	39.7	19%	0.188	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135.2	178.9	178.2	0	0	0	0	108.5	H362 D384 K388	H362-V386 PolarHBondContact CE1-O 3.32Å; D384-V386 PolarHBondContact O-N 3.27Å; D384-V386 PolarHBondContact OD1-N 2.72Å; V386-K388 HydrophobicContact CG1-CG 4.09Å
387	L	90.8	Very high	91.9	Very high	5 Å²	5	34 Å²	34	3%	0.026	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	128.5	167.9	-164.6	77.3	0	0	0	108.7	L44 V51 T54 V63 A65 I68 V379 S380	L44-L387 HydrophobicContact CB-CB 4.25Å; L44-L387 HydrophobicContact CD1-CD2 4.3Å; L44-L387 PolarHBondContact N-O 2.95Å; L44-L387 PolarHBondContact O-N 3.46Å; L44-L387 VanDerWaalsContact O-N 3.11Å; V51-L387 HydrophobicContact CG1-CD1 4.22Å; T54-L387 HydrophobicContact CG2-CD1 4.43Å; V63-L387 HydrophobicContact CG1-CD2 3.76Å; A65-L387 HydrophobicContact CB-CD1 3.61Å; A65-L387 HydrophobicContact CB-CD2 3.87Å; A65-L387 HydrophobicContact CB-CG 4.35Å; I68-L387 HydrophobicContact CD1-CB 3.5Å; I68-L387 HydrophobicContact CD1-CD2 3.86Å; I68-L387 HydrophobicContact CD1-CG 4.31Å; V379-L387 HydrophobicContact CG2-CD1 3.58Å; V379-L387 HydrophobicContact CG2-CD2 3.95Å; V379-L387 HydrophobicContact CG2-CG 3.66Å; S380-L387 WeakPolarHBondContact O-CA 3.41Å; S380-L387 WeakPolarHBondContact O-CD1 3.39Å
388	K	92	Very high	92	Very high	30 Å²	30	26.2 Å²	26.2	13%	0.13	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.4	178	-67.5	-176.7	-176	-95.1	0	110.9	S42 S43 G361 V379 S380 V386	S42-K388 WeakPolarHBondContact O-CA 3.01Å; S43-K388 PolarHBondContact OG-NZ 3.24Å; G361-K388 VanDerWaalsContact C-CE 3.41Å; G361-K388 WeakPolarHBondContact O-CE 3.35Å; G361-K388 PolarHBondContact O-NZ 2.79Å; V379-K388 CarbonylContact C-O 3.58Å; V379-K388 WeakPolarHBondContact CA-O 3.23Å; S380-K388 PolarHBondContact N-O 3.11Å; S380-K388 PolarHBondContact O-N 3.15Å; S380-K388 PolarHBondContact OG-O 3.02Å; V386-K388 HydrophobicContact CG1-CG 4.09Å
389	L	91	Very high	91.8	Very high	25 Å²	25	28.1 Å²	28.1	13%	0.131	13%	0.134	C	C	.	.			trans	-118.3	0	175.4	-66.5	169.6	0	0	0	112.2	C40 T41 S42 L44 F56 V63 V378 V379	C40-L389 CarbonylContact C-O 3.6Å; C40-L389 WeakPolarHBondContact CA-O 3.23Å; T41-L389 PolarHBondContact N-O 2.89Å; T41-L389 VanDerWaalsContact OG1-C 3.31Å; T41-L389 PolarHBondContact OG1-O 3.5Å; S42-L389 PolarHBondContact N-O 3.48Å; S42-L389 PolarHBondContact O-N 2.86Å; L44-L389 HydrophobicContact CD1-CD1 4.03Å; F56-L389 HydrophobicContact CE1-CD2 4.33Å; F56-L389 HydrophobicContact CZ-CD2 3.84Å; V63-L389 HydrophobicContact CG2-CD2 4.05Å; V378-L389 CarbonylContact O-C 3.55Å; V378-L389 WeakPolarHBondContact O-CA 3.4Å; V378-L389 VanDerWaalsContact O-OXT 3.05Å; V379-L389 HydrophobicContact CB-CD2 3.63Å; V379-L389 HydrophobicContact CG2-CD2 3.73Å

Retrieved 389 of 389 residues in 576.1 ms (Link to these results)

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