A0A096N4E2_PAPAN Loading...

Oligodendrocyte-myelin glycoprotein

Cell adhesion molecule contributing to the interactive process required for myelination in the central nervous system.

AlphaFold DB , UniProt , Accession A0A096N4E2, Species PAPAN (Papio anubis, Olive baboon), Gene OMG, Length 440 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	50.1	Low	54.1	Low	218 Å²	218	133.2 Å²	133.2	100%	1.074	66%	0.661	S	S	*	*				0	-12.4	0	-75.8	-163.8	-74.6	0	0	113.6
2	E	51.4	Low	54.5	Low	171 Å²	171	131.9 Å²	131.9	80%	0.799	66%	0.658	S	S	*	*	H	α-helix	trans	-74.8	-27.5	-178	-66.2	179.6	149.5	0	0	114.8	Q4 I5	E2-Q4 VanDerWaalsContact C-N 3.33Å; E2-Q4 PolarHBondContact O-N 3.28Å; E2-I5 PolarHBondContact O-N 3.31Å
3	Y	49.4	Very low	55	Low	179 Å²	179	131.5 Å²	131.5	70%	0.702	65%	0.65	S	S	*	*	H	α-helix	trans	-69	-26.7	-177.2	-161.4	-101.4	0	0	0	114.2
4	Q	50.1	Low	55.4	Low	133 Å²	133	128.1 Å²	128.1	62%	0.621	63%	0.634	S	S	*	*	H	α-helix	trans	-78.8	-26.3	179.7	-74.8	-71.1	-2.2	0	0	112.8	E2 M8	E2-Q4 VanDerWaalsContact C-N 3.33Å; E2-Q4 PolarHBondContact O-N 3.28Å; Q4-M8 PolarHBondContact O-N 3.27Å
5	I	54.3	Low	55.5	Low	125 Å²	125	126.9 Å²	126.9	64%	0.641	63%	0.63	S	S	*	*	H	α-helix	trans	-74.6	-37	-179.9	-60	172.5	0	0	0	110.3	E2 S9	E2-I5 PolarHBondContact O-N 3.31Å; I5-S9 PolarHBondContact O-N 3.25Å; I5-S9 VanDerWaalsContact O-N 3.17Å
6	L	51.9	Low	55.5	Low	133 Å²	133	126.4 Å²	126.4	70%	0.696	63%	0.63	S	S	*	*	H	α-helix	trans	-70.5	-36.8	179.3	-148.9	77.3	0	0	0	112.6	S9 L10	L6-S9 PolarHBondContact O-N 3.44Å; L6-L10 PolarHBondContact O-N 2.85Å; L6-L10 VanDerWaalsContact O-N 3.14Å
7	K	53.5	Low	55.5	Low	113 Å²	113	128.8 Å²	128.8	49%	0.491	64%	0.636	S	S	.	*	H	α-helix	trans	-68.3	-39	176.4	-108	-173	175.2	-170.2	0	112.7	S9 L10 C11	K7-S9 VanDerWaalsContact C-N 3.33Å; K7-L10 PolarHBondContact O-N 3.03Å; K7-C11 PolarHBondContact O-N 3.3Å; K7-C11 VanDerWaalsContact O-N 3.11Å
8	M	54.5	Low	55.3	Low	136 Å²	136	128.3 Å²	128.3	67%	0.67	64%	0.635	S	S	*	*	H	α-helix	trans	-66.9	-35	174.7	-75.7	-64.4	-178.5	0	0	112.2	Q4 L12	Q4-M8 PolarHBondContact O-N 3.27Å; M8-L12 WeakPolarHBondContact O-CB 3.48Å; M8-L12 PolarHBondContact O-N 3.45Å
9	S	60	Low	55.1	Low	68 Å²	68	125.4 Å²	125.4	48%	0.476	63%	0.625	S	S	.	*	H	α-helix	trans	-66.1	-41.4	175.6	-178.2	0	0	0	0	112.6	I5 L6 K7 L12 F13	I5-S9 PolarHBondContact O-N 3.25Å; I5-S9 VanDerWaalsContact O-N 3.17Å; L6-S9 PolarHBondContact O-N 3.44Å; K7-S9 VanDerWaalsContact C-N 3.33Å; S9-L12 PolarHBondContact O-N 3.04Å; S9-F13 PolarHBondContact O-N 3.24Å
10	L	61.5	Low	54.9	Low	115 Å²	115	124.8 Å²	124.8	60%	0.602	63%	0.631	S	S	*	*	H	α-helix	trans	-69.1	-40.1	178.1	-158.6	78	0	0	0	112.1	L6 K7 F13 I14	L6-L10 PolarHBondContact O-N 2.85Å; L6-L10 VanDerWaalsContact O-N 3.14Å; K7-L10 PolarHBondContact O-N 3.03Å; L10-F13 PolarHBondContact O-N 3.33Å; L10-I14 HydrophobicContact CD2-CD1 4.34Å; L10-I14 HydrophobicContact CG-CD1 4.05Å; L10-I14 WeakPolarHBondContact O-CB 3.39Å; L10-I14 WeakPolarHBondContact O-CD1 3.29Å; L10-I14 WeakPolarHBondContact O-CG1 3.41Å; L10-I14 PolarHBondContact O-N 3.2Å
11	C	58.4	Low	54.5	Low	74 Å²	74	121.1 Å²	121.1	50%	0.5	63%	0.625	S	S	.	*	H	α-helix	trans	-63.9	-38.7	173.8	-110.1	0	0	0	0	112.3	K7 I14 L15	K7-C11 PolarHBondContact O-N 3.3Å; K7-C11 VanDerWaalsContact O-N 3.11Å; C11-I14 PolarHBondContact O-N 3.04Å; C11-L15 WeakPolarHBondContact O-CB 3.42Å; C11-L15 PolarHBondContact O-N 3.21Å
12	L	59	Low	54.6	Low	118 Å²	118	117.3 Å²	117.3	62%	0.618	61%	0.607	S	S	*	*	H	α-helix	trans	-66.9	-38.3	175.8	-156.5	82.1	0	0	0	111.7	M8 S9 L15 L16	M8-L12 WeakPolarHBondContact O-CB 3.48Å; M8-L12 PolarHBondContact O-N 3.45Å; S9-L12 PolarHBondContact O-N 3.04Å; L12-L15 PolarHBondContact O-N 2.88Å; L12-L16 PolarHBondContact O-N 3.22Å
13	F	60.3	Low	54.6	Low	127 Å²	127	115.8 Å²	115.8	56%	0.557	60%	0.604	S	S	*	*	H	α-helix	trans	-66.3	-43.4	174.4	-124.5	-93.1	0	0	0	111.6	S9 L10 L16 F17	S9-F13 PolarHBondContact O-N 3.24Å; L10-F13 PolarHBondContact O-N 3.33Å; F13-L16 WeakPolarHBondContact O-CB 3.48Å; F13-L16 PolarHBondContact O-N 3.19Å; F13-F17 HydrophobicContact CD1-CD2 4.26Å; F13-F17 AromaticContact CD1-CE2 3.81Å; F13-F17 HydrophobicContact CD1-CE2 3.81Å; F13-F17 AromaticContact CE1-CE2 3.98Å; F13-F17 HydrophobicContact CE1-CE2 3.98Å; F13-F17 VanDerWaalsContact O-CD2 3.29Å; F13-F17 WeakPolarHBondContact O-CD2 3.48Å; F13-F17 PolarHBondContact O-N 3.33Å
14	I	61.5	Low	55	Low	83 Å²	83	110 Å²	110	43%	0.426	59%	0.589	S	S	.	*	H	α-helix	trans	-66.5	-36.5	176.3	-69	164.4	0	0	0	110.9	L10 C11 F17 L18	L10-I14 HydrophobicContact CD2-CD1 4.34Å; L10-I14 HydrophobicContact CG-CD1 4.05Å; L10-I14 WeakPolarHBondContact O-CB 3.39Å; L10-I14 WeakPolarHBondContact O-CD1 3.29Å; L10-I14 WeakPolarHBondContact O-CG1 3.41Å; L10-I14 PolarHBondContact O-N 3.2Å; C11-I14 PolarHBondContact O-N 3.04Å; I14-F17 CarbonylContact O-C 3.6Å; I14-F17 PolarHBondContact O-N 2.99Å; I14-L18 HydrophobicContact CG2-CD1 3.47Å; I14-L18 VanDerWaalsContact CG2-CD1 3.47Å; I14-L18 HydrophobicContact CG2-CG 4.35Å; I14-L18 WeakPolarHBondContact O-CB 3.47Å; I14-L18 WeakPolarHBondContact O-CG 2.89Å; I14-L18 PolarHBondContact O-N 2.81Å
15	L	56.8	Low	56	Low	111 Å²	111	107.9 Å²	107.9	58%	0.581	58%	0.581	S	S	*	*	H	α-helix	trans	-64.7	-35.7	171.3	-113	107	0	0	0	112.6	C11 L12 F17 L18 T19	C11-L15 WeakPolarHBondContact O-CB 3.42Å; C11-L15 PolarHBondContact O-N 3.21Å; L12-L15 PolarHBondContact O-N 2.88Å; L15-F17 VanDerWaalsContact C-N 3.27Å; L15-F17 PolarHBondContact O-N 3.37Å; L15-L18 PolarHBondContact O-N 2.99Å; L15-T19 WeakPolarHBondContact O-CG2 3.18Å; L15-T19 PolarHBondContact O-N 3.49Å; L15-T19 PolarHBondContact O-OG1 2.91Å
16	L	55.9	Low	57.5	Low	119 Å²	119	103.2 Å²	103.2	62%	0.623	56%	0.559	S	S	*	*	H	α-helix	trans	-64.9	-28.2	173.5	-101.3	148.6	0	0	0	113	L12 F13 T19	L12-L16 PolarHBondContact O-N 3.22Å; F13-L16 WeakPolarHBondContact O-CB 3.48Å; F13-L16 PolarHBondContact O-N 3.19Å; L16-T19 PolarHBondContact O-OG1 2.76Å
17	F	55.6	Low	59.4	Low	167 Å²	167	97.2 Å²	97.2	73%	0.732	53%	0.528	S	S	*	.	H	α-helix	trans	-90.2	-20.4	173.8	-79.5	-77.9	0	0	0	114	F13 I14 L15	F13-F17 HydrophobicContact CD1-CD2 4.26Å; F13-F17 AromaticContact CD1-CE2 3.81Å; F13-F17 HydrophobicContact CD1-CE2 3.81Å; F13-F17 AromaticContact CE1-CE2 3.98Å; F13-F17 HydrophobicContact CE1-CE2 3.98Å; F13-F17 VanDerWaalsContact O-CD2 3.29Å; F13-F17 WeakPolarHBondContact O-CD2 3.48Å; F13-F17 PolarHBondContact O-N 3.33Å; I14-F17 CarbonylContact O-C 3.6Å; I14-F17 PolarHBondContact O-N 2.99Å; L15-F17 VanDerWaalsContact C-N 3.27Å; L15-F17 PolarHBondContact O-N 3.37Å
18	L	51.7	Low	61	Low	120 Å²	120	100.2 Å²	100.2	63%	0.628	55%	0.548	S	S	*	.	H	α-helix	trans	-99.9	-14.4	179.2	-80.5	164.9	0	0	0	114.4	I14 L15 P20	I14-L18 HydrophobicContact CG2-CD1 3.47Å; I14-L18 VanDerWaalsContact CG2-CD1 3.47Å; I14-L18 HydrophobicContact CG2-CG 4.35Å; I14-L18 WeakPolarHBondContact O-CB 3.47Å; I14-L18 WeakPolarHBondContact O-CG 2.89Å; I14-L18 PolarHBondContact O-N 2.81Å; L15-L18 PolarHBondContact O-N 2.99Å; L18-P20 WeakPolarHBondContact O-CD 3.37Å
19	T	51.3	Low	62.7	Low	72 Å²	72	98.3 Å²	98.3	44%	0.442	54%	0.538	S	S	.	.	S	Bend	trans	-61.6	121.2	152.1	52.9	0	0	0	0	104.8	L15 L16 G21	L15-T19 WeakPolarHBondContact O-CG2 3.18Å; L15-T19 PolarHBondContact O-N 3.49Å; L15-T19 PolarHBondContact O-OG1 2.91Å; L16-T19 PolarHBondContact O-OG1 2.76Å; T19-G21 PolarHBondContact O-N 2.69Å
20	P	50.3	Low	64.4	Low	113 Å²	113	95.7 Å²	95.7	73%	0.734	52%	0.519	S	S	*	.			trans	-60.2	93	151.8	27.5	-26.6	0	0	0	102.6	L18 I22	L18-P20 WeakPolarHBondContact O-CD 3.37Å; P20-I22 PolarHBondContact O-N 3.2Å
21	G	47.7	Very low	65.9	Low	49 Å²	49	94.6 Å²	94.6	51%	0.505	51%	0.513	S	S	.	.			trans	-48.5	110.2	157.3	0	0	0	0	0	101.8	T19 L23	T19-G21 PolarHBondContact O-N 2.69Å; G21-L23 PolarHBondContact O-N 3.41Å
22	I	52.2	Low	67.6	Low	138 Å²	138	92.4 Å²	92.4	71%	0.708	50%	0.499	S	S	*	.			trans	-58.3	92	178.9	-65.5	163.1	0	0	0	102.2	P20 C24	P20-I22 PolarHBondContact O-N 3.2Å; I22-C24 PolarHBondContact O-N 3.04Å
23	L	51	Low	69.2	Low	138 Å²	138	90.4 Å²	90.4	72%	0.723	49%	0.491	S	S	*	.			trans	-69.3	94.9	-179.9	-110.9	153.2	0	0	0	100.2	G21 I25	G21-L23 PolarHBondContact O-N 3.41Å; L23-I25 HydrophobicContact CB-CD1 3.66Å; L23-I25 HydrophobicContact CB-CG1 3.83Å; L23-I25 HydrophobicContact CD2-CD1 4.06Å; L23-I25 HydrophobicContact CD2-CG1 3.97Å; L23-I25 HydrophobicContact CG-CD1 4.33Å; L23-I25 WeakPolarHBondContact O-CG1 3.48Å; L23-I25 PolarHBondContact O-N 3.47Å
24	C	58	Low	70.4	Confident	57 Å²	57	90.4 Å²	90.4	39%	0.385	49%	0.493	S	S	.	.			trans	-67.3	74.9	178.7	-132.3	0	0	0	0	104.9	I22 C26 H36	I22-C24 PolarHBondContact O-N 3.04Å; C24-C26 PolarHBondContact O-N 3.44Å; C24-H36 WeakPolarHBondContact CB-NE2 3.41Å; C24-H36 PolarHBondContact O-CE1 3.47Å; C24-H36 PolarHBondContact O-NE2 2.84Å; C24-H36 PolarHBondContact SG-CD2 3.41Å
25	I	71.4	Confident	71.5	Confident	89 Å²	89	96.5 Å²	96.5	46%	0.456	51%	0.511	S	S	.	.			trans	-92.4	95.2	-173.9	-66	162.7	0	0	0	104.1	L23	L23-I25 HydrophobicContact CB-CD1 3.66Å; L23-I25 HydrophobicContact CB-CG1 3.83Å; L23-I25 HydrophobicContact CD2-CD1 4.06Å; L23-I25 HydrophobicContact CD2-CG1 3.97Å; L23-I25 HydrophobicContact CG-CD1 4.33Å; L23-I25 WeakPolarHBondContact O-CG1 3.48Å; L23-I25 PolarHBondContact O-N 3.47Å
26	C	85.9	Confident	72.8	Confident	27 Å²	27	93.2 Å²	93.2	18%	0.182	49%	0.492	C	S	.	.			trans	-48.6	131.1	154.2	-170.5	0	0	0	0	108.1	C24 L28 C30 C32	C24-C26 PolarHBondContact O-N 3.44Å; C26-L28 PolarHBondContact O-N 3.01Å; C26-C30 PolarHBondContact SG-O 3.29Å; C26-C30 VanDerWaalsContact SG-O 3.37Å; C26-C32 WeakPolarHBondContact CA-SG 3.29Å; C26-C32 HydrophobicContact CB-CB 3.52Å; C26-C32 WeakPolarHBondContact CB-SG 3.33Å; C26-C32 WeakPolarHBondContact SG-CB 3.29Å; C26-C32 PolarHBondContact SG-N 2.86Å; C26-C32 CovalentContact SG-SG 2.02Å; C26-C32 PolarHBondContact SG-SG 3.3Å
27	P	90.4	Very high	74.5	Confident	8 Å²	8	92.7 Å²	92.7	5%	0.052	48%	0.482	C	S	.	.			trans	-55.4	139.5	175.2	-19.4	27.7	0	0	0	110.3	Q29 C30 P50 S51 L53	P27-Q29 PolarHBondContact O-N 2.9Å; P27-C30 HydrophobicContact CB-CB 4.32Å; P27-C30 HydrophobicContact CG-CB 4.45Å; P27-C30 PolarHBondContact O-N 2.59Å; P27-P50 HydrophobicContact CB-CB 3.67Å; P27-P50 HydrophobicContact CB-CG 4.14Å; P27-P50 HydrophobicContact CG-CB 3.95Å; P27-P50 HydrophobicContact CG-CG 4.04Å; P27-S51 WeakPolarHBondContact CG-O 3.32Å; P27-L53 HydrophobicContact CG-CD2 3.82Å; P27-L53 HydrophobicContact CG-CG 4.17Å
28	L	87.8	Confident	76.5	Confident	175 Å²	175	86.9 Å²	86.9	92%	0.916	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-24.8	-176.7	-66.7	173.6	0	0	0	113.5	C26 C30	C26-L28 PolarHBondContact O-N 3.01Å; L28-C30 VanDerWaalsContact C-N 3.31Å
29	Q	90.8	Very high	78.6	Confident	97 Å²	97	81.5 Å²	81.5	45%	0.453	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-13.8	178.8	-64.5	150.6	1.2	0	0	112.2	P27 R44 L46	P27-Q29 PolarHBondContact O-N 2.9Å; Q29-R44 VanDerWaalsContact O-CD 3.3Å; Q29-R44 WeakPolarHBondContact O-CD 3.2Å; Q29-R44 WeakPolarHBondContact O-CG 3.44Å; Q29-R44 PolarHBondContact O-NE 2.99Å; Q29-R44 PolarHBondContact O-NH1 3.35Å; Q29-R44 VanDerWaalsContact O-NH1 3.1Å; Q29-L46 HydrophobicContact CB-CD2 4.31Å; Q29-L46 HydrophobicContact CG-CD2 4.45Å; Q29-L46 VanDerWaalsContact OE1-CD2 3.29Å
30	C	94.2	Very high	80.8	Confident	12 Å²	12	80.9 Å²	80.9	8%	0.081	42%	0.423	C	S	.	.	S	Bend	trans	-116.5	162.7	-173	-53.1	0	0	0	0	111.9	C26 P27 L28 V39 D40 C41 P50	C26-C30 PolarHBondContact SG-O 3.29Å; C26-C30 VanDerWaalsContact SG-O 3.37Å; P27-C30 HydrophobicContact CB-CB 4.32Å; P27-C30 HydrophobicContact CG-CB 4.45Å; P27-C30 PolarHBondContact O-N 2.59Å; L28-C30 VanDerWaalsContact C-N 3.31Å; C30-V39 HydrophobicContact CB-CG1 4.01Å; C30-D40 CarbonylContact C-O 3.4Å; C30-D40 VanDerWaalsContact CA-O 3.28Å; C30-D40 WeakPolarHBondContact CA-O 2.98Å; C30-D40 WeakPolarHBondContact CB-O 3.31Å; C30-C41 HydrophobicContact CB-CB 4.06Å; C30-C41 WeakPolarHBondContact CB-SG 3.45Å; C30-C41 WeakPolarHBondContact SG-CB 3.23Å; C30-C41 CovalentContact SG-SG 2.03Å; C30-C41 PolarHBondContact SG-SG 2.76Å; C30-P50 VanDerWaalsContact SG-CG 3.59Å
31	I	94.4	Very high	83	Confident	93 Å²	93	75.5 Å²	75.5	48%	0.477	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.4	172.5	-60.5	169.7	0	0	0	106.8	D40	I31-D40 HydrophobicContact CB-CB 4.47Å; I31-D40 PolarHBondContact N-O 3.07Å; I31-D40 PolarHBondContact O-N 3.28Å
32	C	94	Very high	85.4	Confident	28 Å²	28	74.6 Å²	74.6	19%	0.189	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	134.1	179.4	-54.5	0	0	0	0	110.3	C26 H36 H38 V39	C26-C32 WeakPolarHBondContact CA-SG 3.29Å; C26-C32 HydrophobicContact CB-CB 3.52Å; C26-C32 WeakPolarHBondContact CB-SG 3.33Å; C26-C32 WeakPolarHBondContact SG-CB 3.29Å; C26-C32 PolarHBondContact SG-N 2.86Å; C26-C32 CovalentContact SG-SG 2.02Å; C26-C32 PolarHBondContact SG-SG 3.3Å; C32-H36 HydrophobicContact CB-CB 4.3Å; C32-H36 WeakPolarHBondContact CB-ND1 3.42Å; C32-H38 CarbonylContact C-O 3.54Å; C32-H38 VanDerWaalsContact CA-O 3.29Å; C32-H38 WeakPolarHBondContact CA-O 3Å; C32-V39 HydrophobicContact CB-CG2 4.49Å
33	T	92.2	Very high	87.6	Confident	76 Å²	76	70.2 Å²	70.2	47%	0.466	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	171.6	178	58.6	0	0	0	0	110.3	R35 H36 R37 H38	T33-R35 PolarHBondContact O-N 3.15Å; T33-H36 WeakPolarHBondContact O-CA 3.37Å; T33-H36 PolarHBondContact O-N 3.15Å; T33-R37 PolarHBondContact O-N 3.08Å; T33-H38 PolarHBondContact N-O 3Å; T33-H38 PolarHBondContact O-N 3.15Å; T33-H38 WeakPolarHBondContact OG1-CB 3.4Å
34	E	85.9	Confident	89.7	Confident	126 Å²	126	68.5 Å²	68.5	59%	0.589	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	57.6	178.1	-59.8	-166.9	-176.3	0	0	114.3	H36 R37 H38	E34-H36 PolarHBondContact O-N 3.24Å; E34-R37 WeakPolarHBondContact O-CB 3.06Å; E34-R37 WeakPolarHBondContact O-CG 3.27Å; E34-R37 PolarHBondContact O-N 2.02Å; E34-H38 IonicContact OE1-CE1 2.84Å; E34-H38 IonicContact OE2-CE1 3.89Å; E34-H38 PolarHBondContact OE2-CE1 3.42Å; E34-H38 IonicContact OE2-ND1 2.59Å; E34-H38 PolarHBondContact OE2-ND1 2.91Å; E34-H38 VanDerWaalsContact OE2-ND1 3.07Å; E34-H38 IonicContact OE2-NE2 3.99Å
35	R	84.5	Confident	91.5	Very high	212 Å²	212	71.2 Å²	71.2	80%	0.8	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	42.2	-177.7	-52.2	178.5	-179.6	175.8	0	111.9	T33 R37	T33-R35 PolarHBondContact O-N 3.15Å; R35-R37 VanDerWaalsContact C-N 3.26Å; R35-R37 PolarHBondContact O-N 3.48Å
36	H	83.9	Confident	92.7	Very high	42 Å²	42	67.6 Å²	67.6	19%	0.194	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	18.1	176.6	-50.3	-94.3	0	0	0	115.7	C24 C32 T33 E34 Q54	C24-H36 WeakPolarHBondContact CB-NE2 3.41Å; C24-H36 PolarHBondContact O-CE1 3.47Å; C24-H36 PolarHBondContact O-NE2 2.84Å; C24-H36 PolarHBondContact SG-CD2 3.41Å; C32-H36 HydrophobicContact CB-CB 4.3Å; C32-H36 WeakPolarHBondContact CB-ND1 3.42Å; T33-H36 WeakPolarHBondContact O-CA 3.37Å; T33-H36 PolarHBondContact O-N 3.15Å; E34-H36 PolarHBondContact O-N 3.24Å; H36-Q54 HydrophobicContact CB-CG 4.19Å
37	R	92.2	Very high	93.2	Very high	108 Å²	108	70.4 Å²	70.4	41%	0.408	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-21.2	176.1	-63.6	-176.6	-177.6	-169.4	-0.1	113.4	T33 E34 R35 I58 H59	T33-R37 PolarHBondContact O-N 3.08Å; E34-R37 WeakPolarHBondContact O-CB 3.06Å; E34-R37 WeakPolarHBondContact O-CG 3.27Å; E34-R37 PolarHBondContact O-N 2.02Å; R35-R37 VanDerWaalsContact C-N 3.26Å; R35-R37 PolarHBondContact O-N 3.48Å; R37-I58 HydrophobicContact CB-CD1 4.22Å; R37-I58 HydrophobicContact CB-CG1 4.16Å; R37-I58 HydrophobicContact CG-CD1 4.47Å; R37-I58 PolarHBondContact O-N 3.38Å; R37-H59 PolarHBondContact O-N 3.2Å
38	H	96.4	Very high	93.4	Very high	45 Å²	45	74.3 Å²	74.3	21%	0.208	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114.2	176.2	-73.8	75.4	0	0	0	107.8	C32 T33 E34 H59	C32-H38 CarbonylContact C-O 3.54Å; C32-H38 VanDerWaalsContact CA-O 3.29Å; C32-H38 WeakPolarHBondContact CA-O 3Å; T33-H38 PolarHBondContact N-O 3Å; T33-H38 PolarHBondContact O-N 3.15Å; T33-H38 WeakPolarHBondContact OG1-CB 3.4Å; E34-H38 IonicContact OE1-CE1 2.84Å; E34-H38 IonicContact OE2-CE1 3.89Å; E34-H38 PolarHBondContact OE2-CE1 3.42Å; E34-H38 IonicContact OE2-ND1 2.59Å; E34-H38 PolarHBondContact OE2-ND1 2.91Å; E34-H38 VanDerWaalsContact OE2-ND1 3.07Å; E34-H38 IonicContact OE2-NE2 3.99Å; H38-H59 AromaticContact CD2-CD2 3.28Å; H38-H59 PolarHBondContact CD2-CD2 3.01Å; H38-H59 AromaticContact CD2-CG 3.49Å; H38-H59 VanDerWaalsContact CD2-CG 3.49Å; H38-H59 AromaticContact CE1-CD2 3.35Å; H38-H59 PolarHBondContact CE1-CD2 3.41Å; H38-H59 AromaticContact CE1-NE2 3.9Å; H38-H59 AromaticContact CG-CD2 3.9Å; H38-H59 AromaticContact ND1-CD2 3.93Å; H38-H59 AromaticContact NE2-CD2 2.89Å; H38-H59 PolarHBondContact NE2-CD2 3.22Å; H38-H59 AromaticContact NE2-CG 3.55Å; H38-H59 AromaticContact NE2-NE2 3.38Å; H38-H59 PolarHBondContact NE2-NE2 3.01Å
39	V	96.5	Very high	93.7	Very high	7 Å²	7	67.4 Å²	67.4	4%	0.042	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	121.2	-173.9	-175.5	0	0	0	0	109.9	C30 C32 L53 I57 H59 L60 N61	C30-V39 HydrophobicContact CB-CG1 4.01Å; C32-V39 HydrophobicContact CB-CG2 4.49Å; V39-L53 HydrophobicContact CB-CD2 4.46Å; V39-L53 HydrophobicContact CG1-CD2 3.65Å; V39-L53 HydrophobicContact CG2-CD2 4.48Å; V39-I57 HydrophobicContact CB-CD1 4.45Å; V39-I57 HydrophobicContact CG2-CD1 3.74Å; V39-I57 HydrophobicContact CG2-CG1 3.79Å; V39-I57 HydrophobicContact CG2-CG2 4.25Å; V39-H59 PolarHBondContact N-O 3.15Å; V39-L60 HydrophobicContact CB-CD1 4.06Å; V39-L60 HydrophobicContact CG1-CD1 4.15Å; V39-L60 WeakPolarHBondContact O-CA 3.38Å; V39-N61 PolarHBondContact O-N 3.15Å
40	D	97.4	Very high	93.8	Very high	58 Å²	58	63.3 Å²	63.3	31%	0.31	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	108.9	176	-171.2	-6.1	0	0	0	110.8	C30 I31 S42 N61	C30-D40 CarbonylContact C-O 3.4Å; C30-D40 VanDerWaalsContact CA-O 3.28Å; C30-D40 WeakPolarHBondContact CA-O 2.98Å; C30-D40 WeakPolarHBondContact CB-O 3.31Å; I31-D40 HydrophobicContact CB-CB 4.47Å; I31-D40 PolarHBondContact N-O 3.07Å; I31-D40 PolarHBondContact O-N 3.28Å; D40-S42 WeakPolarHBondContact OD1-CB 3.45Å; D40-S42 PolarHBondContact OD1-N 3.34Å; D40-S42 PolarHBondContact OD1-OG 3.12Å; D40-N61 HydrophobicContact CB-CB 4.45Å; D40-N61 PolarHBondContact OD1-ND2 3.1Å
41	C	96.9	Very high	93.5	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.359	C	S	.	.			trans	-112.9	22.3	175.9	-56.3	0	0	0	0	111.2	C30 R44 L46 N61 L62 N65	C30-C41 HydrophobicContact CB-CB 4.06Å; C30-C41 WeakPolarHBondContact CB-SG 3.45Å; C30-C41 WeakPolarHBondContact SG-CB 3.23Å; C30-C41 CovalentContact SG-SG 2.03Å; C30-C41 PolarHBondContact SG-SG 2.76Å; C41-R44 WeakPolarHBondContact O-CG 3.48Å; C41-L46 HydrophobicContact CB-CD1 3.78Å; C41-N61 CarbonylContact C-O 3.08Å; C41-N61 WeakPolarHBondContact CA-O 3.39Å; C41-N61 PolarHBondContact N-O 3.37Å; C41-L62 HydrophobicContact CB-CD2 4.03Å; C41-N65 PolarHBondContact O-ND2 3.48Å
42	S	97.9	Very high	93.1	Very high	30 Å²	30	65.5 Å²	65.5	21%	0.21	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	145.3	-175.1	63.1	0	0	0	0	113.6	D40 R44 N61 S63	D40-S42 WeakPolarHBondContact OD1-CB 3.45Å; D40-S42 PolarHBondContact OD1-N 3.34Å; D40-S42 PolarHBondContact OD1-OG 3.12Å; S42-R44 WeakPolarHBondContact O-CG 3.4Å; S42-R44 PolarHBondContact O-N 3.05Å; S42-N61 PolarHBondContact OG-ND2 3.23Å; S42-S63 CarbonylContact C-O 3.43Å; S42-S63 WeakPolarHBondContact CA-O 3.31Å; S42-S63 VanDerWaalsContact CB-O 3.27Å; S42-S63 WeakPolarHBondContact CB-O 3.45Å; S42-S63 VanDerWaalsContact CB-OG 3.31Å; S42-S63 WeakPolarHBondContact CB-OG 3.31Å
43	G	97.2	Very high	93	Very high	47 Å²	47	65.1 Å²	65.1	49%	0.485	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	30.3	174.1	0	0	0	0	0	114.4	S63 Y64	G43-S63 PolarHBondContact N-O 2.98Å; G43-Y64 WeakPolarHBondContact CA-O 3.49Å; G43-Y64 PolarHBondContact N-O 2.8Å
44	R	96	Very high	92.8	Very high	102 Å²	102	64 Å²	64	39%	0.385	34%	0.341	S	S	.	.	S	Bend	trans	-112.5	11.3	-170.8	-58	-58.7	-180	127.2	2.4	113.8	Q29 C41 S42 L46 N65	Q29-R44 VanDerWaalsContact O-CD 3.3Å; Q29-R44 WeakPolarHBondContact O-CD 3.2Å; Q29-R44 WeakPolarHBondContact O-CG 3.44Å; Q29-R44 PolarHBondContact O-NE 2.99Å; Q29-R44 PolarHBondContact O-NH1 3.35Å; Q29-R44 VanDerWaalsContact O-NH1 3.1Å; C41-R44 WeakPolarHBondContact O-CG 3.48Å; S42-R44 WeakPolarHBondContact O-CG 3.4Å; S42-R44 PolarHBondContact O-N 3.05Å; R44-L46 HydrophobicContact CB-CD1 4.01Å; R44-L46 HydrophobicContact CB-CD2 4.24Å; R44-L46 HydrophobicContact CB-CG 3.74Å; R44-L46 PolarHBondContact O-N 3.37Å; R44-N65 WeakPolarHBondContact CA-OD1 3.35Å; R44-N65 PolarHBondContact N-OD1 2.79Å
45	N	96.3	Very high	93.1	Very high	114 Å²	114	64.1 Å²	64.1	61%	0.61	34%	0.341	S	S	*	.			trans	53.2	31.4	-177.1	-58.3	-28.2	0	0	0	113.1	N65	N45-N65 PolarHBondContact N-OD1 3.16Å; N45-N65 VanDerWaalsContact N-OD1 3.07Å
46	L	96.3	Very high	93.4	Very high	12 Å²	12	57.1 Å²	57.1	6%	0.063	32%	0.319	C	S	.	.			trans	-72.4	138	-177.5	-60.1	171	0	0	0	110.8	Q29 C41 R44 N65 H66 F67	Q29-L46 HydrophobicContact CB-CD2 4.31Å; Q29-L46 HydrophobicContact CG-CD2 4.45Å; Q29-L46 VanDerWaalsContact OE1-CD2 3.29Å; C41-L46 HydrophobicContact CB-CD1 3.78Å; R44-L46 HydrophobicContact CB-CD1 4.01Å; R44-L46 HydrophobicContact CB-CD2 4.24Å; R44-L46 HydrophobicContact CB-CG 3.74Å; R44-L46 PolarHBondContact O-N 3.37Å; L46-N65 HydrophobicContact CB-CB 4.21Å; L46-N65 PolarHBondContact N-OD1 3.19Å; L46-H66 CarbonylContact O-C 3.48Å; L46-H66 WeakPolarHBondContact O-CA 3.25Å; L46-H66 PolarHBondContact O-N 3.37Å; L46-F67 HydrophobicContact CB-CE1 4.47Å; L46-F67 HydrophobicContact CB-CE2 3.93Å; L46-F67 HydrophobicContact CB-CZ 3.69Å; L46-F67 HydrophobicContact CD1-CZ 4.39Å; L46-F67 PolarHBondContact O-N 3.33Å
47	T	96.2	Very high	93.9	Very high	87 Å²	87	55.1 Å²	55.1	53%	0.534	31%	0.31	S	S	.	.	S	Bend	trans	-109.9	-20.9	170.7	53.4	0	0	0	0	112	H66 F67	T47-H66 HydrophobicContact CG2-CB 3.99Å; T47-F67 WeakPolarHBondContact O-CD1 3.23Å
48	T	95.1	Very high	94.2	Very high	90 Å²	90	52 Å²	52	55%	0.552	30%	0.301	S	S	*	.	S	Bend	trans	-133.2	155.1	179.4	58.3	0	0	0	0	110.2
49	L	94.5	Very high	94.2	Very high	29 Å²	29	52.7 Å²	52.7	15%	0.152	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-65.3	134.8	177.5	-76.6	171.6	0	0	0	109.8	L53 L62 F67 L70 Q73 L74	L49-L53 HydrophobicContact CD2-CD1 4.18Å; L49-L62 HydrophobicContact CD2-CD1 3.57Å; L49-L62 HydrophobicContact CD2-CD2 3.65Å; L49-L62 HydrophobicContact CD2-CG 4.27Å; L49-F67 HydrophobicContact CD2-CE1 4.45Å; L49-F67 HydrophobicContact CD2-CZ 4.3Å; L49-F67 HydrophobicContact CG-CE1 4.46Å; L49-L70 HydrophobicContact CD1-CD2 4.24Å; L49-L70 HydrophobicContact CD2-CD2 4.25Å; L49-L70 HydrophobicContact CG-CD2 3.93Å; L49-Q73 HydrophobicContact CD1-CB 3.5Å; L49-L74 HydrophobicContact CD1-CD2 4.02Å
50	P	91.7	Very high	94.3	Very high	11 Å²	11	52.5 Å²	52.5	7%	0.071	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-68	141.8	179.3	26.6	-31.5	0	0	0	110.7	P27 C30 L53	P27-P50 HydrophobicContact CB-CB 3.67Å; P27-P50 HydrophobicContact CB-CG 4.14Å; P27-P50 HydrophobicContact CG-CB 3.95Å; P27-P50 HydrophobicContact CG-CG 4.04Å; C30-P50 VanDerWaalsContact SG-CG 3.59Å; P50-L53 HydrophobicContact CG-CD1 4.1Å; P50-L53 HydrophobicContact CG-CD2 4.38Å; P50-L53 HydrophobicContact CG-CG 4.19Å; P50-L53 WeakPolarHBondContact O-CG 3.38Å
51	S	88.6	Confident	94.3	Very high	113 Å²	113	51.5 Å²	51.5	79%	0.79	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	148	173.7	54.7	0	0	0	0	111	P27	P27-S51 WeakPolarHBondContact CG-O 3.32Å
52	G	85.7	Confident	94.4	Very high	39 Å²	39	51.5 Å²	51.5	40%	0.402	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.1	-0.9	178.4	0	0	0	0	0	115.5	Q54	G52-Q54 PolarHBondContact O-N 3.21Å; G52-Q54 PolarHBondContact O-NE2 3.13Å; G52-Q54 VanDerWaalsContact O-NE2 3.16Å
53	L	90.9	Very high	94.4	Very high	20 Å²	20	50.3 Å²	50.3	11%	0.105	29%	0.289	C	S	.	.			trans	-58.7	131.4	168.6	-67.7	178.2	0	0	0	110.7	P27 V39 L49 P50 I57 Y77	P27-L53 HydrophobicContact CG-CD2 3.82Å; P27-L53 HydrophobicContact CG-CG 4.17Å; V39-L53 HydrophobicContact CB-CD2 4.46Å; V39-L53 HydrophobicContact CG1-CD2 3.65Å; V39-L53 HydrophobicContact CG2-CD2 4.48Å; L49-L53 HydrophobicContact CD2-CD1 4.18Å; P50-L53 HydrophobicContact CG-CD1 4.1Å; P50-L53 HydrophobicContact CG-CD2 4.38Å; P50-L53 HydrophobicContact CG-CG 4.19Å; P50-L53 WeakPolarHBondContact O-CG 3.38Å; L53-I57 HydrophobicContact CB-CD1 3.89Å; L53-I57 HydrophobicContact CD2-CD1 3.96Å; L53-I57 HydrophobicContact CG-CD1 4.44Å; L53-Y77 HydrophobicContact CB-CE1 4.04Å; L53-Y77 WeakPolarHBondContact CB-OH 3.38Å; L53-Y77 WeakPolarHBondContact CD1-OH 3.4Å
54	Q	89.6	Confident	94.5	Very high	53 Å²	53	54.9 Å²	54.9	25%	0.248	29%	0.293	C	S	.	.			trans	-81.5	148.6	-178.3	-57.7	-64.6	-58.2	0	0	111	H36 G52 N56 I57 Y77	H36-Q54 HydrophobicContact CB-CG 4.19Å; G52-Q54 PolarHBondContact O-N 3.21Å; G52-Q54 PolarHBondContact O-NE2 3.13Å; G52-Q54 VanDerWaalsContact O-NE2 3.16Å; Q54-N56 VanDerWaalsContact CB-OD1 3.25Å; Q54-N56 WeakPolarHBondContact CB-OD1 3.32Å; Q54-N56 PolarHBondContact O-N 3.25Å; Q54-I57 HydrophobicContact CB-CG1 4.41Å; Q54-I57 WeakPolarHBondContact O-CD1 3.39Å; Q54-I57 WeakPolarHBondContact O-CG1 3.5Å; Q54-Y77 WeakPolarHBondContact O-CD1 3.43Å; Q54-Y77 WeakPolarHBondContact O-CE1 3.47Å
55	E	90.5	Very high	94.6	Very high	127 Å²	127	50.2 Å²	50.2	59%	0.593	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-19.5	179.4	-65.9	-178.8	-172.3	0	0	113.5	I57	E55-I57 VanDerWaalsContact C-N 3.32Å; E55-I57 PolarHBondContact O-N 2.63Å
56	N	91.6	Very high	94.7	Very high	65 Å²	65	47.7 Å²	47.7	35%	0.348	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	16	-177.2	70.5	-12.9	0	0	0	114.1	Q54	Q54-N56 VanDerWaalsContact CB-OD1 3.25Å; Q54-N56 WeakPolarHBondContact CB-OD1 3.32Å; Q54-N56 PolarHBondContact O-N 3.25Å
57	I	95.1	Very high	94.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.257	C	S	.	.			trans	-60.9	137.4	175.7	-65.9	164.1	0	0	0	110.1	V39 L53 Q54 E55 H59 L60 Y77 N79 L80	V39-I57 HydrophobicContact CB-CD1 4.45Å; V39-I57 HydrophobicContact CG2-CD1 3.74Å; V39-I57 HydrophobicContact CG2-CG1 3.79Å; V39-I57 HydrophobicContact CG2-CG2 4.25Å; L53-I57 HydrophobicContact CB-CD1 3.89Å; L53-I57 HydrophobicContact CD2-CD1 3.96Å; L53-I57 HydrophobicContact CG-CD1 4.44Å; Q54-I57 HydrophobicContact CB-CG1 4.41Å; Q54-I57 WeakPolarHBondContact O-CD1 3.39Å; Q54-I57 WeakPolarHBondContact O-CG1 3.5Å; E55-I57 VanDerWaalsContact C-N 3.32Å; E55-I57 PolarHBondContact O-N 2.63Å; I57-H59 VanDerWaalsContact CG2-O 3.25Å; I57-H59 WeakPolarHBondContact CG2-O 3.46Å; I57-L60 HydrophobicContact CG2-CB 4.09Å; I57-Y77 HydrophobicContact CD1-CD1 4.29Å; I57-Y77 HydrophobicContact CD1-CE1 4.11Å; I57-N79 CarbonylContact O-C 3.28Å; I57-L80 HydrophobicContact CG2-CD1 3.8Å; I57-L80 WeakPolarHBondContact O-CA 3.41Å; I57-L80 PolarHBondContact O-N 2.93Å
58	I	97	Very high	94.8	Very high	42 Å²	42	47.3 Å²	47.3	22%	0.215	26%	0.258	C	S	.	.	S	Bend	trans	-107.2	-37.1	177.8	-57.8	-179.9	0	0	0	109.9	R37 R81 T82	R37-I58 HydrophobicContact CB-CD1 4.22Å; R37-I58 HydrophobicContact CB-CG1 4.16Å; R37-I58 HydrophobicContact CG-CD1 4.47Å; R37-I58 PolarHBondContact O-N 3.38Å; I58-R81 HydrophobicContact CG2-CB 3.97Å; I58-R81 HydrophobicContact CG2-CG 3.66Å; I58-R81 PolarHBondContact O-N 3.01Å; I58-T82 PolarHBondContact O-N 2.9Å
59	H	98	Very high	94.7	Very high	60 Å²	60	46.6 Å²	46.6	28%	0.278	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	124.1	179.6	-60.3	-95	0	0	0	110.1	R37 H38 V39 I57 T82	R37-H59 PolarHBondContact O-N 3.2Å; H38-H59 AromaticContact CD2-CD2 3.28Å; H38-H59 PolarHBondContact CD2-CD2 3.01Å; H38-H59 AromaticContact CD2-CG 3.49Å; H38-H59 VanDerWaalsContact CD2-CG 3.49Å; H38-H59 AromaticContact CE1-CD2 3.35Å; H38-H59 PolarHBondContact CE1-CD2 3.41Å; H38-H59 AromaticContact CE1-NE2 3.9Å; H38-H59 AromaticContact CG-CD2 3.9Å; H38-H59 AromaticContact ND1-CD2 3.93Å; H38-H59 AromaticContact NE2-CD2 2.89Å; H38-H59 PolarHBondContact NE2-CD2 3.22Å; H38-H59 AromaticContact NE2-CG 3.55Å; H38-H59 AromaticContact NE2-NE2 3.38Å; H38-H59 PolarHBondContact NE2-NE2 3.01Å; V39-H59 PolarHBondContact N-O 3.15Å; I57-H59 VanDerWaalsContact CG2-O 3.25Å; I57-H59 WeakPolarHBondContact CG2-O 3.46Å; H59-T82 WeakPolarHBondContact CA-O 3.38Å; H59-T82 PolarHBondContact CE1-OG1 3.33Å; H59-T82 VanDerWaalsContact CE1-OG1 3.27Å; H59-T82 WeakPolarHBondContact ND1-CB 3.49Å; H59-T82 PolarHBondContact ND1-OG1 3.23Å
60	L	97.8	Very high	94.7	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.021	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	116	179.1	-178.8	57.8	0	0	0	110.1	V39 I57 L62 L74 L80 T82 L83 D84	V39-L60 HydrophobicContact CB-CD1 4.06Å; V39-L60 HydrophobicContact CG1-CD1 4.15Å; V39-L60 WeakPolarHBondContact O-CA 3.38Å; I57-L60 HydrophobicContact CG2-CB 4.09Å; L60-L62 HydrophobicContact CD1-CD2 4.09Å; L60-L62 HydrophobicContact CD1-CG 4.18Å; L60-L62 HydrophobicContact CD2-CD1 3.92Å; L60-L62 HydrophobicContact CD2-CG 4.24Å; L60-L62 HydrophobicContact CG-CD1 4.13Å; L60-L62 HydrophobicContact CG-CD2 4.35Å; L60-L62 HydrophobicContact CG-CG 3.92Å; L60-L74 HydrophobicContact CD2-CD2 4.01Å; L60-L80 HydrophobicContact CB-CD1 3.64Å; L60-T82 PolarHBondContact N-O 3.3Å; L60-L83 HydrophobicContact CB-CD1 4.26Å; L60-L83 HydrophobicContact CD2-CD1 4.15Å; L60-L83 HydrophobicContact CG-CD1 4.25Å; L60-L83 WeakPolarHBondContact O-CA 3.11Å; L60-D84 PolarHBondContact O-N 3.3Å
61	N	98.4	Very high	94.7	Very high	37 Å²	37	47.8 Å²	47.8	20%	0.198	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	113.6	173.8	-176.4	5.6	0	0	0	110.1	V39 D40 C41 S42 S63	V39-N61 PolarHBondContact O-N 3.15Å; D40-N61 HydrophobicContact CB-CB 4.45Å; D40-N61 PolarHBondContact OD1-ND2 3.1Å; C41-N61 CarbonylContact C-O 3.08Å; C41-N61 WeakPolarHBondContact CA-O 3.39Å; C41-N61 PolarHBondContact N-O 3.37Å; S42-N61 PolarHBondContact OG-ND2 3.23Å; N61-S63 VanDerWaalsContact OD1-CB 3.26Å; N61-S63 WeakPolarHBondContact OD1-CB 3.3Å; N61-S63 PolarHBondContact OD1-N 3.08Å; N61-S63 PolarHBondContact OD1-OG 3.37Å
62	L	98.1	Very high	94.7	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.24	C	C	.	.			trans	-115.7	15.4	177	-62.7	169.6	0	0	0	111.3	C41 L49 L60 N65 F67 L70 L74 L83 D84 I85 N88	C41-L62 HydrophobicContact CB-CD2 4.03Å; L49-L62 HydrophobicContact CD2-CD1 3.57Å; L49-L62 HydrophobicContact CD2-CD2 3.65Å; L49-L62 HydrophobicContact CD2-CG 4.27Å; L60-L62 HydrophobicContact CD1-CD2 4.09Å; L60-L62 HydrophobicContact CD1-CG 4.18Å; L60-L62 HydrophobicContact CD2-CD1 3.92Å; L60-L62 HydrophobicContact CD2-CG 4.24Å; L60-L62 HydrophobicContact CG-CD1 4.13Å; L60-L62 HydrophobicContact CG-CD2 4.35Å; L60-L62 HydrophobicContact CG-CG 3.92Å; L62-N65 PolarHBondContact O-ND2 3.17Å; L62-F67 HydrophobicContact CB-CD2 4.38Å; L62-F67 HydrophobicContact CB-CE2 3.92Å; L62-F67 HydrophobicContact CD2-CE2 4.04Å; L62-F67 HydrophobicContact CD2-CZ 4.1Å; L62-F67 HydrophobicContact CG-CE2 4.4Å; L62-L70 HydrophobicContact CD1-CD1 4.24Å; L62-L74 HydrophobicContact CD1-CD2 4.42Å; L62-L83 HydrophobicContact CD1-CD1 4.3Å; L62-D84 CarbonylContact C-O 3.32Å; L62-D84 WeakPolarHBondContact CA-O 3.45Å; L62-D84 WeakPolarHBondContact CB-O 3.28Å; L62-D84 PolarHBondContact N-O 2.65Å; L62-I85 HydrophobicContact CB-CG2 4.15Å; L62-I85 HydrophobicContact CD1-CG2 3.95Å; L62-N88 PolarHBondContact O-ND2 3.31Å
63	S	98.6	Very high	95	Very high	4 Å²	4	48 Å²	48	3%	0.028	24%	0.236	C	C	.	.			trans	-66.4	159.7	-174.9	62.8	0	0	0	0	113.4	S42 G43 N61 N65 D84 S86	S42-S63 CarbonylContact C-O 3.43Å; S42-S63 WeakPolarHBondContact CA-O 3.31Å; S42-S63 VanDerWaalsContact CB-O 3.27Å; S42-S63 WeakPolarHBondContact CB-O 3.45Å; S42-S63 VanDerWaalsContact CB-OG 3.31Å; S42-S63 WeakPolarHBondContact CB-OG 3.31Å; G43-S63 PolarHBondContact N-O 2.98Å; N61-S63 VanDerWaalsContact OD1-CB 3.26Å; N61-S63 WeakPolarHBondContact OD1-CB 3.3Å; N61-S63 PolarHBondContact OD1-N 3.08Å; N61-S63 PolarHBondContact OD1-OG 3.37Å; S63-N65 PolarHBondContact O-N 3.43Å; S63-N65 PolarHBondContact O-ND2 2.73Å; S63-D84 PolarHBondContact N-O 3.07Å; S63-S86 CarbonylContact C-O 3.08Å; S63-S86 WeakPolarHBondContact CA-O 3.29Å; S63-S86 WeakPolarHBondContact CB-O 3.21Å; S63-S86 WeakPolarHBondContact CB-OG 3.16Å
64	Y	98.4	Very high	95.2	Very high	144 Å²	144	47.1 Å²	47.1	57%	0.565	23%	0.231	S	C	*	.	S	Bend	trans	56.3	47.1	177.3	-60.3	-85.8	0	0	0	112.9	G43 S86 N87	G43-Y64 WeakPolarHBondContact CA-O 3.49Å; G43-Y64 PolarHBondContact N-O 2.8Å; Y64-S86 PolarHBondContact N-O 3.45Å; Y64-N87 VanDerWaalsContact CA-O 3.24Å; Y64-N87 WeakPolarHBondContact CA-O 3.48Å; Y64-N87 HydrophobicContact CD1-CB 3.58Å; Y64-N87 HydrophobicContact CD2-CB 4.32Å; Y64-N87 HydrophobicContact CE1-CB 3.81Å; Y64-N87 VanDerWaalsContact CE1-CG 3.42Å; Y64-N87 HydrophobicContact CG-CB 3.86Å; Y64-N87 PolarHBondContact N-O 3.28Å
65	N	98.4	Very high	95.3	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.021	24%	0.235	C	C	.	.	S	Bend	trans	-123.9	-162	177	-78.9	-58.9	0	0	0	109.8	C41 R44 N45 L46 L62 S63 F67 N87 N88	C41-N65 PolarHBondContact O-ND2 3.48Å; R44-N65 WeakPolarHBondContact CA-OD1 3.35Å; R44-N65 PolarHBondContact N-OD1 2.79Å; N45-N65 PolarHBondContact N-OD1 3.16Å; N45-N65 VanDerWaalsContact N-OD1 3.07Å; L46-N65 HydrophobicContact CB-CB 4.21Å; L46-N65 PolarHBondContact N-OD1 3.19Å; L62-N65 PolarHBondContact O-ND2 3.17Å; S63-N65 PolarHBondContact O-N 3.43Å; S63-N65 PolarHBondContact O-ND2 2.73Å; N65-F67 HydrophobicContact CB-CD2 3.64Å; N65-F67 HydrophobicContact CB-CE2 3.66Å; N65-N87 PolarHBondContact N-O 3.43Å; N65-N88 VanDerWaalsContact CA-OD1 3.23Å; N65-N88 WeakPolarHBondContact CA-OD1 3.43Å; N65-N88 WeakPolarHBondContact CB-OD1 3.38Å; N65-N88 PolarHBondContact N-OD1 3.38Å; N65-N88 PolarHBondContact O-OD1 3.2Å
66	H	97.9	Very high	95.3	Very high	61 Å²	61	45.5 Å²	45.5	28%	0.282	23%	0.227	S	C	.	.			trans	-124.7	31.7	-178.1	-60.2	-30.6	0	0	0	111.8	L46 T47 T68 N88 R89	L46-H66 CarbonylContact O-C 3.48Å; L46-H66 WeakPolarHBondContact O-CA 3.25Å; L46-H66 PolarHBondContact O-N 3.37Å; T47-H66 HydrophobicContact CG2-CB 3.99Å; H66-T68 PolarHBondContact O-N 3.22Å; H66-N88 PolarHBondContact N-OD1 3.1Å; H66-R89 PolarHBondContact ND1-NH2 3.5Å
67	F	97.9	Very high	95.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.212	C	C	.	.			trans	-64.4	123.2	175.5	-68.5	-73.1	0	0	0	110.4	L46 T47 L49 L62 N65 L70 N88 R89 L90	L46-F67 HydrophobicContact CB-CE1 4.47Å; L46-F67 HydrophobicContact CB-CE2 3.93Å; L46-F67 HydrophobicContact CB-CZ 3.69Å; L46-F67 HydrophobicContact CD1-CZ 4.39Å; L46-F67 PolarHBondContact O-N 3.33Å; T47-F67 WeakPolarHBondContact O-CD1 3.23Å; L49-F67 HydrophobicContact CD2-CE1 4.45Å; L49-F67 HydrophobicContact CD2-CZ 4.3Å; L49-F67 HydrophobicContact CG-CE1 4.46Å; L62-F67 HydrophobicContact CB-CD2 4.38Å; L62-F67 HydrophobicContact CB-CE2 3.92Å; L62-F67 HydrophobicContact CD2-CE2 4.04Å; L62-F67 HydrophobicContact CD2-CZ 4.1Å; L62-F67 HydrophobicContact CG-CE2 4.4Å; N65-F67 HydrophobicContact CB-CD2 3.64Å; N65-F67 HydrophobicContact CB-CE2 3.66Å; F67-L70 HydrophobicContact CB-CD1 4.43Å; F67-L70 HydrophobicContact CB-CG 4.33Å; F67-L70 HydrophobicContact CD1-CD2 3.53Å; F67-L70 HydrophobicContact CD1-CG 4.12Å; F67-L70 HydrophobicContact CE1-CD2 3.77Å; F67-L70 HydrophobicContact CG-CD1 4.35Å; F67-L70 HydrophobicContact CG-CD2 4.13Å; F67-L70 HydrophobicContact CG-CG 4.3Å; F67-N88 HydrophobicContact CB-CB 4.24Å; F67-N88 VanDerWaalsContact CD2-OD1 3.26Å; F67-N88 WeakPolarHBondContact CD2-OD1 3.31Å; F67-N88 PolarHBondContact N-OD1 3.14Å; F67-R89 CarbonylContact O-C 3.14Å; F67-R89 WeakPolarHBondContact O-CA 3.32Å; F67-R89 PolarHBondContact O-N 3.38Å; F67-L90 HydrophobicContact CB-CD2 4.1Å; F67-L90 PolarHBondContact O-N 3.03Å
68	T	96.7	Very high	95.4	Very high	91 Å²	91	47 Å²	47	56%	0.558	24%	0.238	S	C	*	.	S	Bend	trans	-97.6	-27.9	171.4	54.6	0	0	0	0	111.6	H66 R89	H66-T68 PolarHBondContact O-N 3.22Å; T68-R89 HydrophobicContact CG2-CB 4.2Å
69	D	93.8	Very high	95.4	Very high	74 Å²	74	48.5 Å²	48.5	40%	0.396	25%	0.247	S	C	.	.			trans	-151.1	141.9	180	-174.4	15.2	0	0	0	111.4	H71	D69-H71 WeakPolarHBondContact OD1-CB 3.36Å; D69-H71 IonicContact OD1-CE1 3.28Å; D69-H71 IonicContact OD1-CG 3.49Å; D69-H71 VanDerWaalsContact OD1-CG 3.28Å; D69-H71 PolarHBondContact OD1-N 3.08Å; D69-H71 IonicContact OD1-ND1 3.6Å; D69-H71 PolarHBondContact OD1-ND1 3.01Å
70	L	94.7	Very high	95.3	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.234	C	C	.	.			trans	-133.2	16.2	174.4	-70.7	172.1	0	0	0	112.6	L49 L62 F67 N72 Q73 L74 I85 L90 P94	L49-L70 HydrophobicContact CD1-CD2 4.24Å; L49-L70 HydrophobicContact CD2-CD2 4.25Å; L49-L70 HydrophobicContact CG-CD2 3.93Å; L62-L70 HydrophobicContact CD1-CD1 4.24Å; F67-L70 HydrophobicContact CB-CD1 4.43Å; F67-L70 HydrophobicContact CB-CG 4.33Å; F67-L70 HydrophobicContact CD1-CD2 3.53Å; F67-L70 HydrophobicContact CD1-CG 4.12Å; F67-L70 HydrophobicContact CE1-CD2 3.77Å; F67-L70 HydrophobicContact CG-CD1 4.35Å; F67-L70 HydrophobicContact CG-CD2 4.13Å; F67-L70 HydrophobicContact CG-CG 4.3Å; L70-N72 PolarHBondContact O-N 3.02Å; L70-Q73 PolarHBondContact O-N 2.89Å; L70-L74 HydrophobicContact CB-CD1 4.41Å; L70-L74 HydrophobicContact CD1-CD1 4.45Å; L70-I85 HydrophobicContact CD1-CB 4.43Å; L70-I85 HydrophobicContact CD1-CG2 3.7Å; L70-L90 HydrophobicContact CD1-CD2 4.45Å; L70-L90 HydrophobicContact CG-CD2 4.37Å; L70-P94 HydrophobicContact CB-CB 4.03Å; L70-P94 HydrophobicContact CB-CG 3.85Å
71	H	91.8	Very high	95.3	Very high	65 Å²	65	49 Å²	49	30%	0.301	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	128.8	-177.1	-81	56.8	0	0	0	111.9	D69 Q73 S92 A95	D69-H71 WeakPolarHBondContact OD1-CB 3.36Å; D69-H71 IonicContact OD1-CE1 3.28Å; D69-H71 IonicContact OD1-CG 3.49Å; D69-H71 VanDerWaalsContact OD1-CG 3.28Å; D69-H71 PolarHBondContact OD1-N 3.08Å; D69-H71 IonicContact OD1-ND1 3.6Å; D69-H71 PolarHBondContact OD1-ND1 3.01Å; H71-Q73 WeakPolarHBondContact O-CG 3.28Å; H71-Q73 PolarHBondContact O-N 3.47Å; H71-S92 PolarHBondContact CE1-OG 2.96Å; H71-A95 HydrophobicContact CB-CB 4.5Å; H71-A95 WeakPolarHBondContact CD2-CB 3.21Å
72	N	87.8	Confident	95.3	Very high	89 Å²	89	49.3 Å²	49.3	48%	0.476	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	-2.4	178.6	-47.7	-39.9	0	0	0	116.2	L70 L74 T75 A95 Q96	L70-N72 PolarHBondContact O-N 3.02Å; N72-L74 VanDerWaalsContact C-N 3.32Å; N72-T75 PolarHBondContact O-OG1 3.3Å; N72-A95 PolarHBondContact N-O 3.37Å; N72-Q96 WeakPolarHBondContact OD1-CG 3.07Å; N72-Q96 PolarHBondContact OD1-NE2 3.37Å
73	Q	92.2	Very high	95.3	Very high	66 Å²	66	49.3 Å²	49.3	31%	0.308	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-21.1	-177	-49.5	-175	1.5	0	0	112.5	L49 L70 H71 Q76	L49-Q73 HydrophobicContact CD1-CB 3.5Å; L70-Q73 PolarHBondContact O-N 2.89Å; H71-Q73 WeakPolarHBondContact O-CG 3.28Å; H71-Q73 PolarHBondContact O-N 3.47Å; Q73-Q76 PolarHBondContact O-NE2 3.42Å
74	L	94	Very high	95.3	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.016	26%	0.259	C	S	.	.	S	Bend	trans	-94.9	-15.5	-176.8	-61.1	173.8	0	0	0	113.1	L49 L60 L62 L70 N72 Q76 Y77 L83 P94 L97 P98	L49-L74 HydrophobicContact CD1-CD2 4.02Å; L60-L74 HydrophobicContact CD2-CD2 4.01Å; L62-L74 HydrophobicContact CD1-CD2 4.42Å; L70-L74 HydrophobicContact CB-CD1 4.41Å; L70-L74 HydrophobicContact CD1-CD1 4.45Å; N72-L74 VanDerWaalsContact C-N 3.32Å; L74-Q76 PolarHBondContact O-N 3.16Å; L74-Q76 VanDerWaalsContact O-N 3.09Å; L74-Y77 HydrophobicContact CB-CD2 4.37Å; L74-Y77 HydrophobicContact CD2-CD2 4.06Å; L74-Y77 HydrophobicContact CD2-CE2 3.98Å; L74-Y77 VanDerWaalsContact O-CD2 3.29Å; L74-Y77 WeakPolarHBondContact O-CD2 3.34Å; L74-Y77 PolarHBondContact O-N 3.24Å; L74-L83 HydrophobicContact CD1-CD1 4.37Å; L74-L83 HydrophobicContact CD1-CD2 3.66Å; L74-P94 HydrophobicContact CD1-CB 4.48Å; L74-P94 HydrophobicContact CD1-CG 4.45Å; L74-L97 HydrophobicContact CD1-CD2 4.18Å; L74-P98 HydrophobicContact CB-CG 4.32Å; L74-P98 WeakPolarHBondContact O-CG 3.47Å
75	T	91.7	Very high	95.3	Very high	53 Å²	53	44.3 Å²	44.3	33%	0.325	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-30.6	-172.2	-45.8	0	0	0	0	113.6	N72 Y77 Q96	N72-T75 PolarHBondContact O-OG1 3.3Å; T75-Y77 VanDerWaalsContact C-N 3.29Å; T75-Y77 PolarHBondContact O-N 3.01Å; T75-Q96 HydrophobicContact CG2-CB 4.39Å; T75-Q96 PolarHBondContact OG1-O 3.13Å; T75-Q96 VanDerWaalsContact OG1-O 3.12Å
76	Q	92.2	Very high	95.3	Very high	92 Å²	92	44.5 Å²	44.5	43%	0.43	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-24.3	179.3	65.8	-172.2	-38.5	0	0	113.9	Q73 L74 T78	Q73-Q76 PolarHBondContact O-NE2 3.42Å; L74-Q76 PolarHBondContact O-N 3.16Å; L74-Q76 VanDerWaalsContact O-N 3.09Å; Q76-T78 PolarHBondContact O-N 3.11Å
77	Y	94.6	Very high	95.4	Very high	6 Å²	6	43.3 Å²	43.3	2%	0.024	23%	0.229	C	C	.	.			trans	-82.3	68.1	-176.6	-51.7	-63.4	0	0	0	111.1	L53 Q54 I57 L74 T75 N79 L80 P98	L53-Y77 HydrophobicContact CB-CE1 4.04Å; L53-Y77 WeakPolarHBondContact CB-OH 3.38Å; L53-Y77 WeakPolarHBondContact CD1-OH 3.4Å; Q54-Y77 WeakPolarHBondContact O-CD1 3.43Å; Q54-Y77 WeakPolarHBondContact O-CE1 3.47Å; I57-Y77 HydrophobicContact CD1-CD1 4.29Å; I57-Y77 HydrophobicContact CD1-CE1 4.11Å; L74-Y77 HydrophobicContact CB-CD2 4.37Å; L74-Y77 HydrophobicContact CD2-CD2 4.06Å; L74-Y77 HydrophobicContact CD2-CE2 3.98Å; L74-Y77 VanDerWaalsContact O-CD2 3.29Å; L74-Y77 WeakPolarHBondContact O-CD2 3.34Å; L74-Y77 PolarHBondContact O-N 3.24Å; T75-Y77 VanDerWaalsContact C-N 3.29Å; T75-Y77 PolarHBondContact O-N 3.01Å; Y77-N79 PolarHBondContact O-N 2.83Å; Y77-N79 VanDerWaalsContact O-N 3.1Å; Y77-L80 WeakPolarHBondContact O-CB 3.34Å; Y77-L80 PolarHBondContact O-N 2.99Å; Y77-P98 WeakPolarHBondContact O-CB 3.46Å
78	T	94.3	Very high	95.4	Very high	90 Å²	90	43.8 Å²	43.8	55%	0.552	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.9	-172.8	56.9	0	0	0	0	114.2	Q76 S100	Q76-T78 PolarHBondContact O-N 3.11Å; T78-S100 WeakPolarHBondContact O-CB 3.29Å; T78-S100 PolarHBondContact O-OG 3.12Å
79	N	95.3	Very high	95.5	Very high	75 Å²	75	45.8 Å²	45.8	40%	0.401	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	1.2	178	-67	-72	0	0	0	114	I57 Y77 R81	I57-N79 CarbonylContact O-C 3.28Å; Y77-N79 PolarHBondContact O-N 2.83Å; Y77-N79 VanDerWaalsContact O-N 3.1Å; N79-R81 WeakPolarHBondContact O-CG 3.47Å; N79-R81 PolarHBondContact O-N 2.78Å
80	L	97.2	Very high	95.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.211	C	C	.	.			trans	-65.3	123.3	-174.4	-167.4	68.1	0	0	0	111.5	I57 L60 Y77 L83 P98 S100 L101	I57-L80 HydrophobicContact CG2-CD1 3.8Å; I57-L80 WeakPolarHBondContact O-CA 3.41Å; I57-L80 PolarHBondContact O-N 2.93Å; L60-L80 HydrophobicContact CB-CD1 3.64Å; Y77-L80 WeakPolarHBondContact O-CB 3.34Å; Y77-L80 PolarHBondContact O-N 2.99Å; L80-L83 HydrophobicContact CD2-CB 4.12Å; L80-L83 HydrophobicContact CD2-CD1 4.23Å; L80-P98 HydrophobicContact CB-CB 4.34Å; L80-P98 HydrophobicContact CB-CG 4.38Å; L80-P98 HydrophobicContact CD2-CG 4.15Å; L80-S100 PolarHBondContact N-OG 2.99Å; L80-S100 CarbonylContact O-C 3.53Å; L80-S100 WeakPolarHBondContact O-CB 3.49Å; L80-S100 PolarHBondContact O-OG 2.98Å; L80-L101 HydrophobicContact CB-CD2 4.36Å; L80-L101 HydrophobicContact CD2-CD2 3.95Å; L80-L101 HydrophobicContact CG-CD2 3.86Å; L80-L101 WeakPolarHBondContact O-CA 3.21Å; L80-L101 PolarHBondContact O-N 3.07Å
81	R	97.8	Very high	95.7	Very high	74 Å²	74	48.3 Å²	48.3	28%	0.279	24%	0.239	S	C	.	.			trans	-107.2	-36.7	179.8	-57	-54.8	-178.7	178.5	-0.6	112.1	I58 N79 S100 W102 N103	I58-R81 HydrophobicContact CG2-CB 3.97Å; I58-R81 HydrophobicContact CG2-CG 3.66Å; I58-R81 PolarHBondContact O-N 3.01Å; N79-R81 WeakPolarHBondContact O-CG 3.47Å; N79-R81 PolarHBondContact O-N 2.78Å; R81-S100 WeakPolarHBondContact CD-O 3.45Å; R81-S100 PolarHBondContact NH1-O 3Å; R81-W102 HydrophobicContact CB-CD2 4.5Å; R81-W102 PolarHBondContact O-N 3.27Å; R81-N103 PolarHBondContact O-N 2.84Å
82	T	98.4	Very high	95.9	Very high	43 Å²	43	47.6 Å²	47.6	26%	0.264	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	126.8	180	-53.5	0	0	0	0	110.4	I58 H59 L60 N103	I58-T82 PolarHBondContact O-N 2.9Å; H59-T82 WeakPolarHBondContact CA-O 3.38Å; H59-T82 PolarHBondContact CE1-OG1 3.33Å; H59-T82 VanDerWaalsContact CE1-OG1 3.27Å; H59-T82 WeakPolarHBondContact ND1-CB 3.49Å; H59-T82 PolarHBondContact ND1-OG1 3.23Å; L60-T82 PolarHBondContact N-O 3.3Å; T82-N103 WeakPolarHBondContact CA-O 3.25Å; T82-N103 HydrophobicContact CG2-CB 4.13Å
83	L	98.3	Very high	96.2	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	122.3	176	176.9	64.5	0	0	0	109.7	L60 L62 L74 L80 I85 L97 L101 N103 M104 S105	L60-L83 HydrophobicContact CB-CD1 4.26Å; L60-L83 HydrophobicContact CD2-CD1 4.15Å; L60-L83 HydrophobicContact CG-CD1 4.25Å; L60-L83 WeakPolarHBondContact O-CA 3.11Å; L62-L83 HydrophobicContact CD1-CD1 4.3Å; L74-L83 HydrophobicContact CD1-CD1 4.37Å; L74-L83 HydrophobicContact CD1-CD2 3.66Å; L80-L83 HydrophobicContact CD2-CB 4.12Å; L80-L83 HydrophobicContact CD2-CD1 4.23Å; L83-I85 HydrophobicContact CD1-CG2 3.75Å; L83-I85 HydrophobicContact CD2-CG2 4.28Å; L83-I85 HydrophobicContact CG-CG2 3.94Å; L83-L97 HydrophobicContact CD2-CD2 3.95Å; L83-L101 HydrophobicContact CB-CD2 3.71Å; L83-L101 HydrophobicContact CD2-CD1 4.38Å; L83-N103 PolarHBondContact N-O 2.84Å; L83-M104 HydrophobicContact CD2-CE 4.24Å; L83-M104 WeakPolarHBondContact O-CA 3.49Å; L83-S105 PolarHBondContact O-N 3.38Å
84	D	98.7	Very high	96.2	Very high	43 Å²	43	40.4 Å²	40.4	23%	0.23	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	112.3	169.7	-170.2	-13.4	0	0	0	109.5	L60 L62 S63 S86	L60-D84 PolarHBondContact O-N 3.3Å; L62-D84 CarbonylContact C-O 3.32Å; L62-D84 WeakPolarHBondContact CA-O 3.45Å; L62-D84 WeakPolarHBondContact CB-O 3.28Å; L62-D84 PolarHBondContact N-O 2.65Å; S63-D84 PolarHBondContact N-O 3.07Å; D84-S86 WeakPolarHBondContact OD1-CB 3.48Å; D84-S86 PolarHBondContact OD1-N 3.36Å; D84-S86 PolarHBondContact OD1-OG 3.39Å
85	I	98.3	Very high	96	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.216	C	C	.	.			trans	-118.5	21.8	174.4	56.3	177.7	0	0	0	110.7	L62 L70 L83 N88 L90 P94 M104 S105 A106 N109	L62-I85 HydrophobicContact CB-CG2 4.15Å; L62-I85 HydrophobicContact CD1-CG2 3.95Å; L70-I85 HydrophobicContact CD1-CB 4.43Å; L70-I85 HydrophobicContact CD1-CG2 3.7Å; L83-I85 HydrophobicContact CD1-CG2 3.75Å; L83-I85 HydrophobicContact CD2-CG2 4.28Å; L83-I85 HydrophobicContact CG-CG2 3.94Å; I85-N88 PolarHBondContact O-ND2 2.93Å; I85-L90 HydrophobicContact CB-CD1 4.14Å; I85-L90 HydrophobicContact CD1-CD1 3.64Å; I85-L90 HydrophobicContact CG1-CD1 4.08Å; I85-P94 HydrophobicContact CD1-CG 3.88Å; I85-M104 HydrophobicContact CD1-CE 3.51Å; I85-M104 HydrophobicContact CG1-CE 4.29Å; I85-S105 VanDerWaalsContact CG1-O 3.27Å; I85-S105 WeakPolarHBondContact CG1-O 3.11Å; I85-S105 PolarHBondContact N-O 3.14Å; I85-A106 HydrophobicContact CD1-CB 3.94Å; I85-A106 HydrophobicContact CG1-CB 3.74Å; I85-N109 PolarHBondContact O-ND2 3.26Å
86	S	98.7	Very high	95.9	Very high	8 Å²	8	44.9 Å²	44.9	6%	0.056	23%	0.227	C	C	.	.			trans	-66.7	160.3	-179.7	68	0	0	0	0	112.8	S63 Y64 D84 N88 S105 A107	S63-S86 CarbonylContact C-O 3.08Å; S63-S86 WeakPolarHBondContact CA-O 3.29Å; S63-S86 WeakPolarHBondContact CB-O 3.21Å; S63-S86 WeakPolarHBondContact CB-OG 3.16Å; Y64-S86 PolarHBondContact N-O 3.45Å; D84-S86 WeakPolarHBondContact OD1-CB 3.48Å; D84-S86 PolarHBondContact OD1-N 3.36Å; D84-S86 PolarHBondContact OD1-OG 3.39Å; S86-N88 VanDerWaalsContact C-N 3.35Å; S86-N88 PolarHBondContact O-N 3.04Å; S86-N88 PolarHBondContact O-ND2 3.09Å; S86-N88 VanDerWaalsContact O-ND2 3.15Å; S86-S105 PolarHBondContact N-O 2.89Å; S86-A107 CarbonylContact C-O 3.55Å; S86-A107 WeakPolarHBondContact CA-O 3.25Å; S86-A107 VanDerWaalsContact CB-O 3.23Å; S86-A107 WeakPolarHBondContact CB-O 3.25Å
87	N	98.6	Very high	95.9	Very high	36 Å²	36	40.9 Å²	40.9	19%	0.193	21%	0.209	C	C	.	.	S	Bend	trans	56.1	48.6	176.5	-56.6	-87.5	0	0	0	112.3	Y64 N65 A107 N108	Y64-N87 VanDerWaalsContact CA-O 3.24Å; Y64-N87 WeakPolarHBondContact CA-O 3.48Å; Y64-N87 HydrophobicContact CD1-CB 3.58Å; Y64-N87 HydrophobicContact CD2-CB 4.32Å; Y64-N87 HydrophobicContact CE1-CB 3.81Å; Y64-N87 VanDerWaalsContact CE1-CG 3.42Å; Y64-N87 HydrophobicContact CG-CB 3.86Å; Y64-N87 PolarHBondContact N-O 3.28Å; N65-N87 PolarHBondContact N-O 3.43Å; N87-A107 PolarHBondContact N-O 2.74Å; N87-N108 VanDerWaalsContact CA-O 3.23Å; N87-N108 WeakPolarHBondContact CA-O 3.34Å; N87-N108 PolarHBondContact N-O 3.17Å; N87-N108 PolarHBondContact OD1-ND2 3.01Å
88	N	98.6	Very high	95.8	Very high	10 Å²	10	40.9 Å²	40.9	5%	0.053	21%	0.209	C	C	.	.	S	Bend	trans	-122	-161.8	175.1	-83.8	-71	0	0	0	109.4	L62 N65 H66 F67 I85 S86 L90 N108 N109	L62-N88 PolarHBondContact O-ND2 3.31Å; N65-N88 VanDerWaalsContact CA-OD1 3.23Å; N65-N88 WeakPolarHBondContact CA-OD1 3.43Å; N65-N88 WeakPolarHBondContact CB-OD1 3.38Å; N65-N88 PolarHBondContact N-OD1 3.38Å; N65-N88 PolarHBondContact O-OD1 3.2Å; H66-N88 PolarHBondContact N-OD1 3.1Å; F67-N88 HydrophobicContact CB-CB 4.24Å; F67-N88 VanDerWaalsContact CD2-OD1 3.26Å; F67-N88 WeakPolarHBondContact CD2-OD1 3.31Å; F67-N88 PolarHBondContact N-OD1 3.14Å; I85-N88 PolarHBondContact O-ND2 2.93Å; S86-N88 VanDerWaalsContact C-N 3.35Å; S86-N88 PolarHBondContact O-N 3.04Å; S86-N88 PolarHBondContact O-ND2 3.09Å; S86-N88 VanDerWaalsContact O-ND2 3.15Å; N88-L90 HydrophobicContact CB-CG 4.25Å; N88-N108 PolarHBondContact N-O 3.28Å; N88-N109 VanDerWaalsContact CA-OD1 3.22Å; N88-N109 WeakPolarHBondContact CA-OD1 3.45Å; N88-N109 WeakPolarHBondContact CB-OD1 3.2Å; N88-N109 PolarHBondContact N-OD1 2.64Å; N88-N109 PolarHBondContact O-OD1 3.02Å
89	R	98.1	Very high	95.7	Very high	133 Å²	133	44.6 Å²	44.6	50%	0.502	21%	0.213	S	C	.	.			trans	-122.5	32.2	179.5	-58	-179.5	-171.6	171.1	4.3	111.4	H66 F67 T68 E91 N109 N110	H66-R89 PolarHBondContact ND1-NH2 3.5Å; F67-R89 CarbonylContact O-C 3.14Å; F67-R89 WeakPolarHBondContact O-CA 3.32Å; F67-R89 PolarHBondContact O-N 3.38Å; T68-R89 HydrophobicContact CG2-CB 4.2Å; R89-E91 PolarHBondContact O-N 3.31Å; R89-N109 PolarHBondContact N-OD1 3.22Å; R89-N110 WeakPolarHBondContact CA-OD1 3.49Å
90	L	97.6	Very high	95.7	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	20%	0.197	C	C	.	.			trans	-68.9	128.6	-176.8	-62.1	171.8	0	0	0	110.3	F67 L70 I85 N88 N109 N110 I111	F67-L90 HydrophobicContact CB-CD2 4.1Å; F67-L90 PolarHBondContact O-N 3.03Å; L70-L90 HydrophobicContact CD1-CD2 4.45Å; L70-L90 HydrophobicContact CG-CD2 4.37Å; I85-L90 HydrophobicContact CB-CD1 4.14Å; I85-L90 HydrophobicContact CD1-CD1 3.64Å; I85-L90 HydrophobicContact CG1-CD1 4.08Å; N88-L90 HydrophobicContact CB-CG 4.25Å; L90-N109 HydrophobicContact CB-CB 4.18Å; L90-N109 WeakPolarHBondContact CB-OD1 3.22Å; L90-N109 WeakPolarHBondContact CG-OD1 3.48Å; L90-N109 PolarHBondContact N-OD1 2.92Å; L90-N110 CarbonylContact O-C 3.37Å; L90-N110 VanDerWaalsContact O-CA 3.25Å; L90-N110 WeakPolarHBondContact O-CA 3.37Å; L90-N110 WeakPolarHBondContact O-CB 3.24Å; L90-N110 PolarHBondContact O-N 3.39Å; L90-I111 HydrophobicContact CB-CG1 4.47Å; L90-I111 PolarHBondContact O-N 3.3Å
91	E	95.9	Very high	95.7	Very high	127 Å²	127	41.6 Å²	41.6	59%	0.593	20%	0.198	S	C	*	.	S	Bend	trans	-89.4	-16.9	176.6	-63	-167.2	-175.5	0	0	113.3	R89 I111	R89-E91 PolarHBondContact O-N 3.31Å; E91-I111 WeakPolarHBondContact O-CA 3.44Å
92	S	95.3	Very high	95.7	Very high	49 Å²	49	43.3 Å²	43.3	34%	0.343	20%	0.204	S	C	.	.	S	Bend	trans	-147	160.9	176.8	52.5	0	0	0	0	110.4	H71	H71-S92 PolarHBondContact CE1-OG 2.96Å
93	L	94.3	Very high	95.7	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-66.5	144.3	168.5	-78.7	-175.9	0	0	0	109.9	A95 M104 A106 I111 L114 D118 V130	L93-A95 PolarHBondContact O-N 3.46Å; L93-M104 HydrophobicContact CD2-CE 3.81Å; L93-A106 HydrophobicContact CD2-CB 3.7Å; L93-I111 HydrophobicContact CD2-CD1 3.73Å; L93-I111 HydrophobicContact CG-CD1 4.13Å; L93-L114 HydrophobicContact CD1-CD1 3.31Å; L93-L114 HydrophobicContact CG-CD1 4.31Å; L93-D118 HydrophobicContact CB-CB 4.19Å; L93-D118 HydrophobicContact CD1-CB 4.18Å; L93-V130 HydrophobicContact CD1-CG1 4.47Å; L93-V130 HydrophobicContact CD2-CG1 4.35Å
94	P	93	Very high	95.7	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.013	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-61	130.9	179.8	-21.5	33	0	0	0	111.3	L70 L74 I85 L97	L70-P94 HydrophobicContact CB-CB 4.03Å; L70-P94 HydrophobicContact CB-CG 3.85Å; L74-P94 HydrophobicContact CD1-CB 4.48Å; L74-P94 HydrophobicContact CD1-CG 4.45Å; I85-P94 HydrophobicContact CD1-CG 3.88Å; P94-L97 HydrophobicContact CB-CD2 4.08Å; P94-L97 HydrophobicContact CG-CD2 4.22Å; P94-L97 WeakPolarHBondContact O-CG 3.36Å
95	A	90.2	Very high	95.6	Very high	31 Å²	31	43.1 Å²	43.1	26%	0.256	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	148.2	171.1	0	0	0	0	0	111.3	H71 N72 L93	H71-A95 HydrophobicContact CB-CB 4.5Å; H71-A95 WeakPolarHBondContact CD2-CB 3.21Å; N72-A95 PolarHBondContact N-O 3.37Å; L93-A95 PolarHBondContact O-N 3.46Å
96	Q	88.3	Confident	95.6	Very high	120 Å²	120	43.1 Å²	43.1	56%	0.561	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	43.7	175.3	-52.1	-174.4	40.1	0	0	114.5	N72 T75	N72-Q96 WeakPolarHBondContact OD1-CG 3.07Å; N72-Q96 PolarHBondContact OD1-NE2 3.37Å; T75-Q96 HydrophobicContact CG2-CB 4.39Å; T75-Q96 PolarHBondContact OG1-O 3.13Å; T75-Q96 VanDerWaalsContact OG1-O 3.12Å
97	L	92.4	Very high	95.6	Very high	8 Å²	8	43.2 Å²	43.2	4%	0.042	20%	0.204	C	C	.	.			trans	-52.9	147.2	171.7	-70.7	162.2	0	0	0	112.3	L74 L83 P94 R99 L101 M104	L74-L97 HydrophobicContact CD1-CD2 4.18Å; L83-L97 HydrophobicContact CD2-CD2 3.95Å; P94-L97 HydrophobicContact CB-CD2 4.08Å; P94-L97 HydrophobicContact CG-CD2 4.22Å; P94-L97 WeakPolarHBondContact O-CG 3.36Å; L97-R99 PolarHBondContact O-N 2.85Å; L97-L101 HydrophobicContact CB-CD1 4.11Å; L97-L101 HydrophobicContact CD2-CD1 4.31Å; L97-M104 HydrophobicContact CD1-CE 3.68Å; L97-M104 HydrophobicContact CD1-SD 3.61Å; L97-M104 HydrophobicContact CD2-CE 3.72Å; L97-M104 HydrophobicContact CD2-SD 4.19Å; L97-M104 HydrophobicContact CG-CE 4.36Å
98	P	92.9	Very high	95.6	Very high	6 Å²	6	45 Å²	45	4%	0.039	21%	0.214	C	C	.	.			trans	-57.8	128.9	176.8	-26.8	36	0	0	0	112.8	L74 Y77 L80 S100 L101	L74-P98 HydrophobicContact CB-CG 4.32Å; L74-P98 WeakPolarHBondContact O-CG 3.47Å; Y77-P98 WeakPolarHBondContact O-CB 3.46Å; L80-P98 HydrophobicContact CB-CB 4.34Å; L80-P98 HydrophobicContact CB-CG 4.38Å; L80-P98 HydrophobicContact CD2-CG 4.15Å; P98-S100 PolarHBondContact O-N 3.39Å; P98-S100 VanDerWaalsContact O-N 3.09Å; P98-L101 HydrophobicContact CB-CG 4.27Å; P98-L101 WeakPolarHBondContact O-CG 3.16Å; P98-L101 PolarHBondContact O-N 2.95Å
99	R	92.6	Very high	95.6	Very high	168 Å²	168	44.9 Å²	44.9	63%	0.634	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-12.3	179.9	-63.2	-174.8	-71.4	-162.8	-3.1	114	L97 N124	L97-R99 PolarHBondContact O-N 2.85Å; R99-N124 PolarHBondContact O-ND2 3.41Å
100	S	95.1	Very high	95.6	Very high	9 Å²	9	42.1 Å²	42.1	6%	0.063	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-10.7	-179.8	39.4	0	0	0	0	113.9	T78 L80 R81 P98	T78-S100 WeakPolarHBondContact O-CB 3.29Å; T78-S100 PolarHBondContact O-OG 3.12Å; L80-S100 PolarHBondContact N-OG 2.99Å; L80-S100 CarbonylContact O-C 3.53Å; L80-S100 WeakPolarHBondContact O-CB 3.49Å; L80-S100 PolarHBondContact O-OG 2.98Å; R81-S100 WeakPolarHBondContact CD-O 3.45Å; R81-S100 PolarHBondContact NH1-O 3Å; P98-S100 PolarHBondContact O-N 3.39Å; P98-S100 VanDerWaalsContact O-N 3.09Å
101	L	96.6	Very high	95.6	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	21%	0.209	C	C	.	.			trans	-59.8	136.1	-175.8	-73.2	172.3	0	0	0	112.6	L80 L83 L97 P98 M104 N124 L125	L80-L101 HydrophobicContact CB-CD2 4.36Å; L80-L101 HydrophobicContact CD2-CD2 3.95Å; L80-L101 HydrophobicContact CG-CD2 3.86Å; L80-L101 WeakPolarHBondContact O-CA 3.21Å; L80-L101 PolarHBondContact O-N 3.07Å; L83-L101 HydrophobicContact CB-CD2 3.71Å; L83-L101 HydrophobicContact CD2-CD1 4.38Å; L97-L101 HydrophobicContact CB-CD1 4.11Å; L97-L101 HydrophobicContact CD2-CD1 4.31Å; P98-L101 HydrophobicContact CB-CG 4.27Å; P98-L101 WeakPolarHBondContact O-CG 3.16Å; P98-L101 PolarHBondContact O-N 2.95Å; L101-M104 HydrophobicContact CD1-SD 4.42Å; L101-N124 CarbonylContact O-C 3.54Å; L101-N124 VanDerWaalsContact O-C 3.28Å; L101-L125 HydrophobicContact CB-CD1 3.91Å; L101-L125 WeakPolarHBondContact O-CA 3.27Å; L101-L125 PolarHBondContact O-N 3.49Å
102	W	97.8	Very high	95.6	Very high	111 Å²	111	42 Å²	42	42%	0.42	21%	0.206	S	C	.	.	S	Bend	trans	-110.9	-36.6	172	-66.7	-6.5	0	0	0	111.2	R81 K126 Y127	R81-W102 HydrophobicContact CB-CD2 4.5Å; R81-W102 PolarHBondContact O-N 3.27Å; W102-K126 WeakPolarHBondContact O-CA 3.27Å; W102-K126 PolarHBondContact O-N 2.64Å; W102-Y127 PolarHBondContact O-N 3.32Å
103	N	98.4	Very high	95.6	Very high	59 Å²	59	43.3 Å²	43.3	32%	0.316	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	126.2	-177.4	-65.8	65.6	0	0	0	109.6	R81 T82 L83	R81-N103 PolarHBondContact O-N 2.84Å; T82-N103 WeakPolarHBondContact CA-O 3.25Å; T82-N103 HydrophobicContact CG2-CB 4.13Å; L83-N103 PolarHBondContact N-O 2.84Å
104	M	97.4	Very high	95.6	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.015	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	127.7	176.1	-174.8	177.6	-178.8	0	0	110.6	L83 I85 L93 L97 L101 A106 L125 Y127 L128 D129	L83-M104 HydrophobicContact CD2-CE 4.24Å; L83-M104 WeakPolarHBondContact O-CA 3.49Å; I85-M104 HydrophobicContact CD1-CE 3.51Å; I85-M104 HydrophobicContact CG1-CE 4.29Å; L93-M104 HydrophobicContact CD2-CE 3.81Å; L97-M104 HydrophobicContact CD1-CE 3.68Å; L97-M104 HydrophobicContact CD1-SD 3.61Å; L97-M104 HydrophobicContact CD2-CE 3.72Å; L97-M104 HydrophobicContact CD2-SD 4.19Å; L97-M104 HydrophobicContact CG-CE 4.36Å; L101-M104 HydrophobicContact CD1-SD 4.42Å; M104-A106 HydrophobicContact CE-CB 4.48Å; M104-L125 HydrophobicContact CB-CD1 3.92Å; M104-Y127 PolarHBondContact N-O 3.44Å; M104-L128 HydrophobicContact CB-CD1 4.32Å; M104-L128 HydrophobicContact CG-CD1 4.44Å; M104-L128 WeakPolarHBondContact O-CA 3.27Å; M104-L128 HydrophobicContact SD-CD1 4.37Å; M104-D129 PolarHBondContact O-N 2.86Å
105	S	98.4	Very high	95.5	Very high	20 Å²	20	46 Å²	46	14%	0.14	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	125.8	166.7	-174.2	0	0	0	0	110.1	L83 I85 S86	L83-S105 PolarHBondContact O-N 3.38Å; I85-S105 VanDerWaalsContact CG1-O 3.27Å; I85-S105 WeakPolarHBondContact CG1-O 3.11Å; I85-S105 PolarHBondContact N-O 3.14Å; S86-S105 PolarHBondContact N-O 2.89Å
106	A	98.1	Very high	95.3	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.235	C	C	.	.			trans	-125.3	29	169.3	0	0	0	0	0	110.6	I85 L93 M104 N109 I111 D129 V130 N133	I85-A106 HydrophobicContact CD1-CB 3.94Å; I85-A106 HydrophobicContact CG1-CB 3.74Å; L93-A106 HydrophobicContact CD2-CB 3.7Å; M104-A106 HydrophobicContact CE-CB 4.48Å; A106-N109 PolarHBondContact O-ND2 3.05Å; A106-I111 HydrophobicContact CB-CD1 4.12Å; A106-D129 PolarHBondContact N-O 3.15Å; A106-V130 HydrophobicContact CB-CG1 4.34Å; A106-N133 PolarHBondContact O-ND2 3.38Å
107	A	98.7	Very high	95.2	Very high	10 Å²	10	47.6 Å²	47.6	8%	0.083	23%	0.231	C	C	.	.			trans	-62.2	152.8	-179.4	0	0	0	0	0	112.3	S86 N87 N109 D129 S131	S86-A107 CarbonylContact C-O 3.55Å; S86-A107 WeakPolarHBondContact CA-O 3.25Å; S86-A107 VanDerWaalsContact CB-O 3.23Å; S86-A107 WeakPolarHBondContact CB-O 3.25Å; N87-A107 PolarHBondContact N-O 2.74Å; A107-N109 PolarHBondContact O-ND2 2.84Å; A107-D129 PolarHBondContact N-O 3.41Å; A107-S131 CarbonylContact C-O 3.26Å; A107-S131 WeakPolarHBondContact CA-O 3.26Å
108	N	98.6	Very high	94.9	Very high	75 Å²	75	48.3 Å²	48.3	40%	0.401	24%	0.235	S	C	.	.	S	Bend	trans	55.5	58.9	176.9	-161.6	40.1	0	0	0	113	N87 N88 S131 K132	N87-N108 VanDerWaalsContact CA-O 3.23Å; N87-N108 WeakPolarHBondContact CA-O 3.34Å; N87-N108 PolarHBondContact N-O 3.17Å; N87-N108 PolarHBondContact OD1-ND2 3.01Å; N88-N108 PolarHBondContact N-O 3.28Å; N108-S131 PolarHBondContact N-O 3.36Å; N108-K132 WeakPolarHBondContact CA-O 3.22Å; N108-K132 HydrophobicContact CB-CB 4.21Å; N108-K132 PolarHBondContact N-O 3.35Å
109	N	98.7	Very high	94.3	Very high	7 Å²	7	48.2 Å²	48.2	4%	0.037	23%	0.234	C	C	.	.	S	Bend	trans	-128.2	-168.3	174	-85.2	-76.4	0	0	0	109.4	I85 N88 R89 L90 A106 A107 I111 N133	I85-N109 PolarHBondContact O-ND2 3.26Å; N88-N109 VanDerWaalsContact CA-OD1 3.22Å; N88-N109 WeakPolarHBondContact CA-OD1 3.45Å; N88-N109 WeakPolarHBondContact CB-OD1 3.2Å; N88-N109 PolarHBondContact N-OD1 2.64Å; N88-N109 PolarHBondContact O-OD1 3.02Å; R89-N109 PolarHBondContact N-OD1 3.22Å; L90-N109 HydrophobicContact CB-CB 4.18Å; L90-N109 WeakPolarHBondContact CB-OD1 3.22Å; L90-N109 WeakPolarHBondContact CG-OD1 3.48Å; L90-N109 PolarHBondContact N-OD1 2.92Å; A106-N109 PolarHBondContact O-ND2 3.05Å; A107-N109 PolarHBondContact O-ND2 2.84Å; N109-I111 HydrophobicContact CB-CD1 4.21Å; N109-I111 HydrophobicContact CB-CG1 4.07Å; N109-N133 VanDerWaalsContact CA-OD1 3.25Å; N109-N133 WeakPolarHBondContact CA-OD1 3.27Å; N109-N133 WeakPolarHBondContact CB-OD1 3.44Å; N109-N133 PolarHBondContact N-OD1 3.07Å; N109-N133 PolarHBondContact O-OD1 3.27Å; N109-N133 VanDerWaalsContact O-OD1 3.12Å
110	N	98.1	Very high	93.9	Very high	74 Å²	74	41.5 Å²	41.5	40%	0.396	22%	0.215	S	C	.	.			trans	-108.4	26.7	-180	-62.3	101.7	0	0	0	112.8	R89 L90 K112 N133	R89-N110 WeakPolarHBondContact CA-OD1 3.49Å; L90-N110 CarbonylContact O-C 3.37Å; L90-N110 VanDerWaalsContact O-CA 3.25Å; L90-N110 WeakPolarHBondContact O-CA 3.37Å; L90-N110 WeakPolarHBondContact O-CB 3.24Å; L90-N110 PolarHBondContact O-N 3.39Å; N110-K112 PolarHBondContact O-N 2.76Å; N110-N133 PolarHBondContact N-OD1 3.06Å
111	I	97.5	Very high	93.5	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.01	24%	0.241	C	C	.	.			trans	-70	126.1	-173.2	-56.3	168.2	0	0	0	110.4	L90 E91 L93 A106 N109 L113 N133 M134 L135	L90-I111 HydrophobicContact CB-CG1 4.47Å; L90-I111 PolarHBondContact O-N 3.3Å; E91-I111 WeakPolarHBondContact O-CA 3.44Å; L93-I111 HydrophobicContact CD2-CD1 3.73Å; L93-I111 HydrophobicContact CG-CD1 4.13Å; A106-I111 HydrophobicContact CB-CD1 4.12Å; N109-I111 HydrophobicContact CB-CD1 4.21Å; N109-I111 HydrophobicContact CB-CG1 4.07Å; I111-L113 WeakPolarHBondContact CG2-O 3.36Å; I111-N133 HydrophobicContact CB-CB 4.22Å; I111-N133 WeakPolarHBondContact CB-OD1 3.34Å; I111-N133 WeakPolarHBondContact CG1-OD1 3.11Å; I111-N133 PolarHBondContact N-OD1 2.88Å; I111-M134 CarbonylContact O-C 3.21Å; I111-M134 VanDerWaalsContact O-CA 3.28Å; I111-M134 WeakPolarHBondContact O-CA 3.33Å; I111-M134 PolarHBondContact O-N 2.99Å; I111-L135 HydrophobicContact CB-CD2 4.46Å; I111-L135 HydrophobicContact CG2-CD2 3.71Å; I111-L135 PolarHBondContact O-N 3.47Å; I111-L135 VanDerWaalsContact O-N 3.13Å
112	K	96	Very high	93.2	Very high	124 Å²	124	48.8 Å²	48.8	54%	0.539	24%	0.242	S	C	.	.			trans	-101.5	-29.4	-176.3	-63.1	176.9	-174.1	165.7	0	114.7	N110 M134 L135 E136	N110-K112 PolarHBondContact O-N 2.76Å; K112-M134 WeakPolarHBondContact CA-O 3.17Å; K112-M134 HydrophobicContact CG-CB 4.24Å; K112-L135 WeakPolarHBondContact O-CA 3.33Å; K112-E136 PolarHBondContact O-N 3.07Å
113	L	95.3	Very high	93	Very high	77 Å²	77	50.6 Å²	50.6	40%	0.403	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	137.9	-177.3	175.6	65.6	0	0	0	109.1	I111 D115 K137	I111-L113 WeakPolarHBondContact CG2-O 3.36Å; L113-D115 HydrophobicContact CD2-CB 4.26Å; L113-D115 HydrophobicContact CG-CB 4.35Å; L113-K137 HydrophobicContact CD1-CB 3.93Å; L113-K137 HydrophobicContact CD1-CD 4.41Å; L113-K137 HydrophobicContact CD1-CG 4.29Å
114	L	93.9	Very high	92.8	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	105.5	163.1	179.9	57.6	0	0	0	107.6	L93 D118 T119 L135 K137 V138 V139 L140	L93-L114 HydrophobicContact CD1-CD1 3.31Å; L93-L114 HydrophobicContact CG-CD1 4.31Å; L114-D118 HydrophobicContact CD1-CB 3.95Å; L114-T119 HydrophobicContact CD1-CG2 4.08Å; L114-L135 HydrophobicContact CB-CD2 4.04Å; L114-K137 PolarHBondContact N-O 3.43Å; L114-V138 HydrophobicContact CB-CB 4.47Å; L114-V138 HydrophobicContact CB-CG1 4.4Å; L114-V138 HydrophobicContact CB-CG2 4.07Å; L114-V138 HydrophobicContact CD2-CG1 3.92Å; L114-V138 HydrophobicContact CD2-CG2 4.37Å; L114-V138 HydrophobicContact CG-CG1 4.4Å; L114-V139 PolarHBondContact O-N 2.98Å; L114-L140 HydrophobicContact CD2-CD2 4.23Å
115	D	90.3	Very high	92.7	Very high	58 Å²	58	50.2 Å²	50.2	31%	0.31	25%	0.247	S	C	.	.			trans	-92.6	162.6	-177.8	-161.1	7.4	0	0	0	111.5	L113 S117 D118 V139	L113-D115 HydrophobicContact CD2-CB 4.26Å; L113-D115 HydrophobicContact CG-CB 4.35Å; D115-S117 PolarHBondContact O-N 3.37Å; D115-D118 PolarHBondContact N-OD2 3.06Å; D115-D118 WeakPolarHBondContact O-CB 3.16Å; D115-D118 PolarHBondContact O-N 3.29Å; D115-D118 VanDerWaalsContact O-N 3.16Å; D115-V139 CarbonylContact C-O 3.1Å
116	K	86.4	Confident	92.7	Very high	116 Å²	116	53.3 Å²	53.3	50%	0.504	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-32.9	-179.8	72.3	-177.1	177.8	179.4	0	113.2	A120 V139 I141	K116-A120 WeakPolarHBondContact O-CB 3.33Å; K116-A120 PolarHBondContact O-N 2.76Å; K116-V139 HydrophobicContact CB-CG1 4.22Å; K116-V139 PolarHBondContact N-O 3.02Å; K116-I141 HydrophobicContact CB-CD1 3.61Å; K116-I141 HydrophobicContact CB-CG1 3.74Å; K116-I141 HydrophobicContact CD-CD1 4.26Å; K116-I141 HydrophobicContact CG-CD1 4.18Å
117	S	86.2	Confident	92.7	Very high	68 Å²	68	57 Å²	57	48%	0.476	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-32.6	179.8	44.5	0	0	0	0	112.8	D115 T119 A120	D115-S117 PolarHBondContact O-N 3.37Å; S117-T119 PolarHBondContact O-N 3.39Å; S117-A120 PolarHBondContact O-N 3.43Å
118	D	85.4	Confident	92.7	Very high	24 Å²	24	56.6 Å²	56.6	13%	0.128	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-28.2	-171.3	-53.9	-18.9	0	0	0	111.2	L93 L114 D115 Q122	L93-D118 HydrophobicContact CB-CB 4.19Å; L93-D118 HydrophobicContact CD1-CB 4.18Å; L114-D118 HydrophobicContact CD1-CB 3.95Å; D115-D118 PolarHBondContact N-OD2 3.06Å; D115-D118 WeakPolarHBondContact O-CB 3.16Å; D115-D118 PolarHBondContact O-N 3.29Å; D115-D118 VanDerWaalsContact O-N 3.16Å; D118-Q122 PolarHBondContact O-NE2 2.65Å
119	T	81.3	Confident	92.7	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.018	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	3.7	-177.1	61.9	0	0	0	0	113.5	L114 S117 Y121 Q122 L128 T144 L145	L114-T119 HydrophobicContact CD1-CG2 4.08Å; S117-T119 PolarHBondContact O-N 3.39Å; T119-Y121 PolarHBondContact O-N 3.1Å; T119-Y121 VanDerWaalsContact O-N 3.1Å; T119-Q122 PolarHBondContact O-N 3.03Å; T119-L128 HydrophobicContact CG2-CD2 4.49Å; T119-T144 WeakPolarHBondContact O-CB 3.13Å; T119-L145 HydrophobicContact CG2-CD1 4.06Å; T119-L145 HydrophobicContact CG2-CD2 4.4Å
120	A	83.5	Confident	92.6	Very high	28 Å²	28	53.6 Å²	53.6	23%	0.231	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-34.2	-171.3	0	0	0	0	0	113.9	K116 S117	K116-A120 WeakPolarHBondContact O-CB 3.33Å; K116-A120 PolarHBondContact O-N 2.76Å; S117-A120 PolarHBondContact O-N 3.43Å
121	Y	86.8	Confident	92.7	Very high	155 Å²	155	50.4 Å²	50.4	61%	0.608	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.7	9.9	-173	-54.9	-70.1	0	0	0	113.7	T119 W123	T119-Y121 PolarHBondContact O-N 3.1Å; T119-Y121 VanDerWaalsContact O-N 3.1Å; Y121-W123 VanDerWaalsContact C-N 3.32Å; Y121-W123 PolarHBondContact O-N 3.13Å
122	Q	91.2	Very high	92.7	Very high	9 Å²	9	56.2 Å²	56.2	4%	0.042	26%	0.262	C	S	.	.			trans	-97.2	41.7	-165.6	-80.8	50.5	-71.6	0	0	112.2	D118 T119 N124 L125 T144 L145	D118-Q122 PolarHBondContact O-NE2 2.65Å; T119-Q122 PolarHBondContact O-N 3.03Å; Q122-N124 VanDerWaalsContact C-N 3.26Å; Q122-N124 PolarHBondContact O-N 3.28Å; Q122-L125 HydrophobicContact CB-CB 4.2Å; Q122-L125 HydrophobicContact CB-CD2 4.49Å; Q122-L125 WeakPolarHBondContact O-CB 3.37Å; Q122-L125 PolarHBondContact O-N 3.25Å; Q122-L125 VanDerWaalsContact O-N 3.11Å; Q122-T144 CarbonylContact C-O 3.1Å; Q122-L145 HydrophobicContact CB-CD2 3.69Å
123	W	92.1	Very high	92.9	Very high	149 Å²	149	50.6 Å²	50.6	56%	0.564	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-26.8	178	57.5	-26.4	0	0	0	117	Y121 T144 S147	Y121-W123 VanDerWaalsContact C-N 3.32Å; Y121-W123 PolarHBondContact O-N 3.13Å; W123-T144 WeakPolarHBondContact CA-O 3.19Å; W123-T144 PolarHBondContact N-O 3.38Å; W123-S147 VanDerWaalsContact O-CB 3.26Å; W123-S147 WeakPolarHBondContact O-CB 3.23Å; W123-S147 PolarHBondContact O-N 3.32Å; W123-S147 PolarHBondContact O-OG 3.3Å
124	N	95	Very high	93	Very high	51 Å²	51	50.3 Å²	50.3	27%	0.273	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-8.9	179.6	-64.9	-48.8	0	0	0	113.6	R99 L101 Q122 K126	R99-N124 PolarHBondContact O-ND2 3.41Å; L101-N124 CarbonylContact O-C 3.54Å; L101-N124 VanDerWaalsContact O-C 3.28Å; Q122-N124 VanDerWaalsContact C-N 3.26Å; Q122-N124 PolarHBondContact O-N 3.28Å; N124-K126 PolarHBondContact O-N 2.64Å
125	L	96.3	Very high	93.2	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.016	24%	0.235	C	C	.	.			trans	-68.7	127.2	-174.8	-164.3	72.9	0	0	0	109.6	L101 M104 Q122 L128 L145 S147 L148	L101-L125 HydrophobicContact CB-CD1 3.91Å; L101-L125 WeakPolarHBondContact O-CA 3.27Å; L101-L125 PolarHBondContact O-N 3.49Å; M104-L125 HydrophobicContact CB-CD1 3.92Å; Q122-L125 HydrophobicContact CB-CB 4.2Å; Q122-L125 HydrophobicContact CB-CD2 4.49Å; Q122-L125 WeakPolarHBondContact O-CB 3.37Å; Q122-L125 PolarHBondContact O-N 3.25Å; Q122-L125 VanDerWaalsContact O-N 3.11Å; L125-L128 HydrophobicContact CD2-CB 3.87Å; L125-L128 HydrophobicContact CD2-CD1 4.16Å; L125-L128 HydrophobicContact CD2-CD2 4.36Å; L125-L128 HydrophobicContact CD2-CG 4.35Å; L125-L145 HydrophobicContact CB-CD2 4.19Å; L125-L145 HydrophobicContact CD2-CD2 3.96Å; L125-S147 CarbonylContact O-C 3.54Å; L125-L148 HydrophobicContact CB-CD1 4.48Å; L125-L148 HydrophobicContact CD2-CD1 4.18Å; L125-L148 HydrophobicContact CG-CD1 4.13Å; L125-L148 WeakPolarHBondContact O-CA 3.29Å; L125-L148 PolarHBondContact O-N 3.38Å
126	K	97.6	Very high	93.5	Very high	85 Å²	85	52.8 Å²	52.8	37%	0.37	25%	0.245	S	C	.	.			trans	-105	-34.3	179.3	-62.1	-170.5	177.2	-168.6	0	112.7	W102 N124 S147 E149 V150	W102-K126 WeakPolarHBondContact O-CA 3.27Å; W102-K126 PolarHBondContact O-N 2.64Å; N124-K126 PolarHBondContact O-N 2.64Å; K126-S147 WeakPolarHBondContact CA-O 3.18Å; K126-E149 PolarHBondContact O-N 3.32Å; K126-V150 PolarHBondContact O-N 2.98Å
127	Y	98.4	Very high	93.8	Very high	76 Å²	76	53.2 Å²	53.2	30%	0.298	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123.8	-178.4	-178	-84	0	0	0	110.2	W102 M104 D129 V150	W102-Y127 PolarHBondContact O-N 3.32Å; M104-Y127 PolarHBondContact N-O 3.44Å; Y127-D129 HydrophobicContact CD1-CB 4.44Å; Y127-D129 HydrophobicContact CE1-CB 3.49Å; Y127-D129 VanDerWaalsContact CE1-CB 3.49Å; Y127-V150 HydrophobicContact CD2-CB 3.63Å; Y127-V150 HydrophobicContact CD2-CG1 3.68Å; Y127-V150 HydrophobicContact CD2-CG2 4.19Å; Y127-V150 HydrophobicContact CE2-CB 4.14Å; Y127-V150 HydrophobicContact CE2-CG1 3.63Å; Y127-V150 HydrophobicContact CG-CB 4.48Å
128	L	97.8	Very high	94.2	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	116.8	173.6	179.7	58.2	0	0	0	110	M104 T119 L125 V130 L148 V150 L151 N152	M104-L128 HydrophobicContact CB-CD1 4.32Å; M104-L128 HydrophobicContact CG-CD1 4.44Å; M104-L128 WeakPolarHBondContact O-CA 3.27Å; M104-L128 HydrophobicContact SD-CD1 4.37Å; T119-L128 HydrophobicContact CG2-CD2 4.49Å; L125-L128 HydrophobicContact CD2-CB 3.87Å; L125-L128 HydrophobicContact CD2-CD1 4.16Å; L125-L128 HydrophobicContact CD2-CD2 4.36Å; L125-L128 HydrophobicContact CD2-CG 4.35Å; L128-V130 HydrophobicContact CD1-CG1 3.94Å; L128-V130 HydrophobicContact CG-CG1 4.31Å; L128-L148 HydrophobicContact CB-CD1 3.78Å; L128-L148 HydrophobicContact CB-CD2 4.5Å; L128-V150 PolarHBondContact N-O 3Å; L128-L151 HydrophobicContact CB-CD1 4.28Å; L128-L151 HydrophobicContact CD2-CD1 4.03Å; L128-L151 HydrophobicContact CG-CD1 4.23Å; L128-N152 PolarHBondContact O-N 2.9Å
129	D	98.7	Very high	94.4	Very high	17 Å²	17	51.7 Å²	51.7	9%	0.091	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	113.5	173.2	-178.1	7.3	0	0	0	110.8	M104 A106 A107 Y127 S131 N152	M104-D129 PolarHBondContact O-N 2.86Å; A106-D129 PolarHBondContact N-O 3.15Å; A107-D129 PolarHBondContact N-O 3.41Å; Y127-D129 HydrophobicContact CD1-CB 4.44Å; Y127-D129 HydrophobicContact CE1-CB 3.49Å; Y127-D129 VanDerWaalsContact CE1-CB 3.49Å; D129-S131 WeakPolarHBondContact OD1-CB 3.42Å; D129-S131 PolarHBondContact OD1-N 3.28Å; D129-S131 PolarHBondContact OD1-OG 3.39Å; D129-N152 HydrophobicContact CB-CB 4.2Å; D129-N152 PolarHBondContact OD1-ND2 2.95Å
130	V	98.1	Very high	94.7	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.012	24%	0.236	C	C	.	.			trans	-124	29.2	172	-61.7	0	0	0	0	110.2	L93 A106 L128 N133 L135 N152 L153 N156	L93-V130 HydrophobicContact CD1-CG1 4.47Å; L93-V130 HydrophobicContact CD2-CG1 4.35Å; A106-V130 HydrophobicContact CB-CG1 4.34Å; L128-V130 HydrophobicContact CD1-CG1 3.94Å; L128-V130 HydrophobicContact CG-CG1 4.31Å; V130-N133 PolarHBondContact O-ND2 2.92Å; V130-L135 HydrophobicContact CB-CD1 4.17Å; V130-L135 HydrophobicContact CG2-CD1 3.59Å; V130-N152 PolarHBondContact N-O 3.1Å; V130-L153 HydrophobicContact CG2-CD2 3.34Å; V130-N156 PolarHBondContact O-ND2 2.86Å; V130-N156 VanDerWaalsContact O-ND2 3.07Å
131	S	98.8	Very high	94.5	Very high	7 Å²	7	54 Å²	54	5%	0.049	24%	0.242	C	C	.	.			trans	-63.8	161.4	177.1	63.5	0	0	0	0	112.8	A107 N108 D129 N133 N152 S154	A107-S131 CarbonylContact C-O 3.26Å; A107-S131 WeakPolarHBondContact CA-O 3.26Å; N108-S131 PolarHBondContact N-O 3.36Å; D129-S131 WeakPolarHBondContact OD1-CB 3.42Å; D129-S131 PolarHBondContact OD1-N 3.28Å; D129-S131 PolarHBondContact OD1-OG 3.39Å; S131-N133 VanDerWaalsContact C-N 3.26Å; S131-N133 PolarHBondContact O-N 3.34Å; S131-N133 PolarHBondContact O-ND2 3.22Å; S131-N133 VanDerWaalsContact O-ND2 3.1Å; S131-N152 PolarHBondContact N-O 2.94Å; S131-S154 CarbonylContact C-O 3.13Å; S131-S154 WeakPolarHBondContact CA-O 3.42Å; S131-S154 WeakPolarHBondContact CB-O 3.46Å; S131-S154 VanDerWaalsContact CB-OG 3.32Å; S131-S154 WeakPolarHBondContact CB-OG 3.46Å
132	K	98.6	Very high	93.7	Very high	124 Å²	124	51.8 Å²	51.8	54%	0.539	24%	0.236	S	C	.	.	S	Bend	trans	55.8	41.3	177.4	-58.4	175.9	-178.9	174.5	0	112.3	N108 S154 S155	N108-K132 WeakPolarHBondContact CA-O 3.22Å; N108-K132 HydrophobicContact CB-CB 4.21Å; N108-K132 PolarHBondContact N-O 3.35Å; K132-S154 PolarHBondContact N-O 2.79Å; K132-S155 WeakPolarHBondContact CA-O 3.45Å; K132-S155 PolarHBondContact N-O 3Å
133	N	98.7	Very high	92.7	Very high	6 Å²	6	54.8 Å²	54.8	3%	0.032	25%	0.252	C	S	.	.	S	Bend	trans	-112.5	-165.2	174.7	-86.5	-78.8	0	0	0	109.4	A106 N109 N110 I111 V130 S131 L135 S155 N156	A106-N133 PolarHBondContact O-ND2 3.38Å; N109-N133 VanDerWaalsContact CA-OD1 3.25Å; N109-N133 WeakPolarHBondContact CA-OD1 3.27Å; N109-N133 WeakPolarHBondContact CB-OD1 3.44Å; N109-N133 PolarHBondContact N-OD1 3.07Å; N109-N133 PolarHBondContact O-OD1 3.27Å; N109-N133 VanDerWaalsContact O-OD1 3.12Å; N110-N133 PolarHBondContact N-OD1 3.06Å; I111-N133 HydrophobicContact CB-CB 4.22Å; I111-N133 WeakPolarHBondContact CB-OD1 3.34Å; I111-N133 WeakPolarHBondContact CG1-OD1 3.11Å; I111-N133 PolarHBondContact N-OD1 2.88Å; V130-N133 PolarHBondContact O-ND2 2.92Å; S131-N133 VanDerWaalsContact C-N 3.26Å; S131-N133 PolarHBondContact O-N 3.34Å; S131-N133 PolarHBondContact O-ND2 3.22Å; S131-N133 VanDerWaalsContact O-ND2 3.1Å; N133-L135 HydrophobicContact CB-CG 4.25Å; N133-S155 PolarHBondContact N-O 3.2Å; N133-N156 VanDerWaalsContact CA-OD1 3.23Å; N133-N156 WeakPolarHBondContact CA-OD1 3.49Å; N133-N156 WeakPolarHBondContact CB-OD1 3.49Å; N133-N156 PolarHBondContact N-OD1 2.89Å; N133-N156 PolarHBondContact O-OD1 2.86Å
134	M	98.1	Very high	92.2	Very high	71 Å²	71	48.5 Å²	48.5	35%	0.35	23%	0.23	S	C	.	.			trans	-113.1	28.2	179.4	-58.3	-65.4	-89.2	0	0	111	I111 K112 E136 N156 K157	I111-M134 CarbonylContact O-C 3.21Å; I111-M134 VanDerWaalsContact O-CA 3.28Å; I111-M134 WeakPolarHBondContact O-CA 3.33Å; I111-M134 PolarHBondContact O-N 2.99Å; K112-M134 WeakPolarHBondContact CA-O 3.17Å; K112-M134 HydrophobicContact CG-CB 4.24Å; M134-E136 PolarHBondContact O-N 3Å; M134-N156 PolarHBondContact N-OD1 2.88Å; M134-K157 HydrophobicContact CE-CD 4.38Å; M134-K157 HydrophobicContact SD-CD 4.48Å
135	L	98	Very high	92	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	22%	0.218	C	C	.	.			trans	-64.2	118	-173.3	-67.7	169.5	0	0	0	110.9	I111 K112 L114 V130 N133 V138 L153 N156 K157 L158	I111-L135 HydrophobicContact CB-CD2 4.46Å; I111-L135 HydrophobicContact CG2-CD2 3.71Å; I111-L135 PolarHBondContact O-N 3.47Å; I111-L135 VanDerWaalsContact O-N 3.13Å; K112-L135 WeakPolarHBondContact O-CA 3.33Å; L114-L135 HydrophobicContact CB-CD2 4.04Å; V130-L135 HydrophobicContact CB-CD1 4.17Å; V130-L135 HydrophobicContact CG2-CD1 3.59Å; N133-L135 HydrophobicContact CB-CG 4.25Å; L135-V138 HydrophobicContact CD1-CG2 4.29Å; L135-L153 HydrophobicContact CD1-CD2 4.12Å; L135-N156 HydrophobicContact CB-CB 4.04Å; L135-N156 VanDerWaalsContact CB-OD1 3.28Å; L135-N156 WeakPolarHBondContact CB-OD1 3.36Å; L135-N156 WeakPolarHBondContact CG-OD1 3.35Å; L135-N156 PolarHBondContact N-OD1 3.11Å; L135-K157 CarbonylContact O-C 3.21Å; L135-K157 VanDerWaalsContact O-CA 3.26Å; L135-K157 WeakPolarHBondContact O-CA 3.49Å; L135-K157 WeakPolarHBondContact O-CB 3.49Å; L135-K157 PolarHBondContact O-N 3.18Å; L135-L158 HydrophobicContact CB-CD2 4.09Å; L135-L158 WeakPolarHBondContact O-CD2 3.44Å; L135-L158 PolarHBondContact O-N 2.77Å; L135-L158 VanDerWaalsContact O-N 3.13Å
136	E	96.3	Very high	91.8	Very high	112 Å²	112	52.8 Å²	52.8	52%	0.523	24%	0.243	S	C	.	.	S	Bend	trans	-97.4	-26.8	174.1	-68	175.7	-172.5	0	0	111.5	K112 M134 K157	K112-E136 PolarHBondContact O-N 3.07Å; M134-E136 PolarHBondContact O-N 3Å; E136-K157 HydrophobicContact CG-CB 4Å; E136-K157 HydrophobicContact CG-CD 4.41Å
137	K	93.4	Very high	91.7	Very high	125 Å²	125	50.2 Å²	50.2	54%	0.543	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	142.2	-179.4	-171.3	178.7	-177.1	-178.3	0	110.8	L113 L114 V139	L113-K137 HydrophobicContact CD1-CB 3.93Å; L113-K137 HydrophobicContact CD1-CD 4.41Å; L113-K137 HydrophobicContact CD1-CG 4.29Å; L114-K137 PolarHBondContact N-O 3.43Å; K137-V139 HydrophobicContact CD-CG2 4.12Å; K137-V139 HydrophobicContact CG-CG2 4.1Å
138	V	94.5	Very high	91.6	Very high	14 Å²	14	46.6 Å²	46.6	9%	0.085	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	121.7	173.6	168.7	0	0	0	0	108.1	L114 L135 L140 L153 L158 P162	L114-V138 HydrophobicContact CB-CB 4.47Å; L114-V138 HydrophobicContact CB-CG1 4.4Å; L114-V138 HydrophobicContact CB-CG2 4.07Å; L114-V138 HydrophobicContact CD2-CG1 3.92Å; L114-V138 HydrophobicContact CD2-CG2 4.37Å; L114-V138 HydrophobicContact CG-CG1 4.4Å; L135-V138 HydrophobicContact CD1-CG2 4.29Å; V138-L140 HydrophobicContact CG1-CD1 4.12Å; V138-L140 HydrophobicContact CG1-CD2 4.1Å; V138-L140 HydrophobicContact CG1-CG 3.75Å; V138-L153 HydrophobicContact CG2-CD1 4.43Å; V138-L153 HydrophobicContact CG2-CD2 4.15Å; V138-L158 HydrophobicContact CG2-CD1 4.45Å; V138-L158 HydrophobicContact CG2-CD2 3.84Å; V138-P162 HydrophobicContact CB-CB 4.11Å; V138-P162 HydrophobicContact CB-CG 4Å; V138-P162 HydrophobicContact CG1-CB 3.99Å; V138-P162 HydrophobicContact CG1-CG 4.21Å
139	V	90.1	Very high	91.6	Very high	45 Å²	45	50 Å²	50	27%	0.273	24%	0.237	S	C	.	.			trans	-114.6	104.3	177.7	-175.3	0	0	0	0	108.5	L114 D115 K116 K137	L114-V139 PolarHBondContact O-N 2.98Å; D115-V139 CarbonylContact C-O 3.1Å; K116-V139 HydrophobicContact CB-CG1 4.22Å; K116-V139 PolarHBondContact N-O 3.02Å; K137-V139 HydrophobicContact CD-CG2 4.12Å; K137-V139 HydrophobicContact CG-CG2 4.1Å
140	L	87.2	Confident	91.6	Very high	8 Å²	8	50.8 Å²	50.8	4%	0.042	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-102.7	142	175.3	-59.9	174.9	0	0	0	109.8	L114 V138 L145 L151 N164 M165	L114-L140 HydrophobicContact CD2-CD2 4.23Å; V138-L140 HydrophobicContact CG1-CD1 4.12Å; V138-L140 HydrophobicContact CG1-CD2 4.1Å; V138-L140 HydrophobicContact CG1-CG 3.75Å; L140-L145 HydrophobicContact CD2-CD1 3.96Å; L140-L151 HydrophobicContact CD1-CD2 4.39Å; L140-N164 WeakPolarHBondContact O-CB 3.33Å; L140-M165 HydrophobicContact CD1-CG 4.16Å
141	I	79.4	Confident	91.6	Very high	71 Å²	71	50.8 Å²	50.8	36%	0.364	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-93.2	130.3	167.6	-63	164.2	0	0	0	107.7	K116 N143 T144	K116-I141 HydrophobicContact CB-CD1 3.61Å; K116-I141 HydrophobicContact CB-CG1 3.74Å; K116-I141 HydrophobicContact CD-CD1 4.26Å; K116-I141 HydrophobicContact CG-CD1 4.18Å; I141-N143 PolarHBondContact O-N 3Å; I141-T144 HydrophobicContact CB-CG2 3.63Å; I141-T144 HydrophobicContact CD1-CG2 4.27Å; I141-T144 HydrophobicContact CG2-CG2 3.87Å; I141-T144 PolarHBondContact O-N 3.16Å; I141-T144 PolarHBondContact O-OG1 2.99Å; I141-T144 VanDerWaalsContact O-OG1 3.09Å
142	K	69.5	Low	91.6	Very high	110 Å²	110	51.6 Å²	51.6	48%	0.478	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	128.7	171	-168.2	178.5	-178.4	175.8	0	109.2	N164	K142-N164 HydrophobicContact CB-CB 4.45Å
143	N	70.8	Confident	91.6	Very high	71 Å²	71	45.7 Å²	45.7	38%	0.38	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	12	177.6	-46.4	-53	0	0	0	118.1	I141 R146	I141-N143 PolarHBondContact O-N 3Å; N143-R146 HydrophobicContact CB-CG 4.39Å; N143-R146 WeakPolarHBondContact O-CG 3.27Å; N143-R146 PolarHBondContact O-NE 3.24Å
144	T	81.6	Confident	91.6	Very high	17 Å²	17	46 Å²	46	10%	0.104	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-44.1	170.6	54.7	0	0	0	0	112	T119 Q122 W123 I141 R146	T119-T144 WeakPolarHBondContact O-CB 3.13Å; Q122-T144 CarbonylContact C-O 3.1Å; W123-T144 WeakPolarHBondContact CA-O 3.19Å; W123-T144 PolarHBondContact N-O 3.38Å; I141-T144 HydrophobicContact CB-CG2 3.63Å; I141-T144 HydrophobicContact CD1-CG2 4.27Å; I141-T144 HydrophobicContact CG2-CG2 3.87Å; I141-T144 PolarHBondContact O-N 3.16Å; I141-T144 PolarHBondContact O-OG1 2.99Å; I141-T144 VanDerWaalsContact O-OG1 3.09Å; T144-R146 PolarHBondContact O-N 3.32Å
145	L	90.8	Very high	91.6	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.22	C	C	.	.	S	Bend	trans	-96.3	53	-179.2	-67.2	165	0	0	0	111.4	T119 Q122 L125 L140 S147 L148 P166	T119-L145 HydrophobicContact CG2-CD1 4.06Å; T119-L145 HydrophobicContact CG2-CD2 4.4Å; Q122-L145 HydrophobicContact CB-CD2 3.69Å; L125-L145 HydrophobicContact CB-CD2 4.19Å; L125-L145 HydrophobicContact CD2-CD2 3.96Å; L140-L145 HydrophobicContact CD2-CD1 3.96Å; L145-S147 PolarHBondContact O-N 3.25Å; L145-S147 VanDerWaalsContact O-N 3.13Å; L145-L148 HydrophobicContact CB-CB 3.93Å; L145-L148 HydrophobicContact CB-CD2 4.24Å; L145-L148 HydrophobicContact CD1-CD2 4.04Å; L145-L148 WeakPolarHBondContact O-CB 3.21Å; L145-L148 PolarHBondContact O-N 3.28Å; L145-L148 VanDerWaalsContact O-N 3.1Å; L145-P166 HydrophobicContact CB-CB 4.37Å; L145-P166 HydrophobicContact CB-CG 3.56Å; L145-P166 HydrophobicContact CD1-CG 4.31Å; L145-P166 WeakPolarHBondContact O-CB 3.14Å
146	R	91.6	Very high	91.7	Very high	144 Å²	144	45 Å²	45	54%	0.543	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-22	-169.7	-61.7	-171.2	-177.2	-168.3	-3.1	115.3	N143 T144 K168	N143-R146 HydrophobicContact CB-CG 4.39Å; N143-R146 WeakPolarHBondContact O-CG 3.27Å; N143-R146 PolarHBondContact O-NE 3.24Å; T144-R146 PolarHBondContact O-N 3.32Å; R146-K168 WeakPolarHBondContact O-CD 3.16Å; R146-K168 WeakPolarHBondContact O-CE 3.15Å; R146-K168 WeakPolarHBondContact O-CG 3.41Å
147	S	95.4	Very high	91.8	Very high	30 Å²	30	44.1 Å²	44.1	21%	0.21	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	4.8	-179	-52.7	0	0	0	0	112.8	W123 L125 K126 L145 E149	W123-S147 VanDerWaalsContact O-CB 3.26Å; W123-S147 WeakPolarHBondContact O-CB 3.23Å; W123-S147 PolarHBondContact O-N 3.32Å; W123-S147 PolarHBondContact O-OG 3.3Å; L125-S147 CarbonylContact O-C 3.54Å; K126-S147 WeakPolarHBondContact CA-O 3.18Å; L145-S147 PolarHBondContact O-N 3.25Å; L145-S147 VanDerWaalsContact O-N 3.13Å; S147-E149 PolarHBondContact O-N 2.81Å
148	L	96.5	Very high	92	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.191	C	C	.	.			trans	-73.1	120.5	-173.5	-167.3	76.1	0	0	0	110.4	L125 L128 L145 L151 P166 K168 L169	L125-L148 HydrophobicContact CB-CD1 4.48Å; L125-L148 HydrophobicContact CD2-CD1 4.18Å; L125-L148 HydrophobicContact CG-CD1 4.13Å; L125-L148 WeakPolarHBondContact O-CA 3.29Å; L125-L148 PolarHBondContact O-N 3.38Å; L128-L148 HydrophobicContact CB-CD1 3.78Å; L128-L148 HydrophobicContact CB-CD2 4.5Å; L145-L148 HydrophobicContact CB-CB 3.93Å; L145-L148 HydrophobicContact CB-CD2 4.24Å; L145-L148 HydrophobicContact CD1-CD2 4.04Å; L145-L148 WeakPolarHBondContact O-CB 3.21Å; L145-L148 PolarHBondContact O-N 3.28Å; L145-L148 VanDerWaalsContact O-N 3.1Å; L148-L151 HydrophobicContact CD2-CB 4.1Å; L148-L151 HydrophobicContact CD2-CD1 4.35Å; L148-P166 HydrophobicContact CB-CB 4.45Å; L148-P166 HydrophobicContact CB-CG 4.41Å; L148-P166 HydrophobicContact CD2-CG 4.22Å; L148-K168 CarbonylContact O-C 3.39Å; L148-L169 HydrophobicContact CB-CD2 4.42Å; L148-L169 HydrophobicContact CD2-CD2 3.92Å; L148-L169 HydrophobicContact CG-CD2 3.92Å; L148-L169 PolarHBondContact O-N 3.02Å
149	E	97.8	Very high	92.1	Very high	75 Å²	75	44 Å²	44	35%	0.35	21%	0.211	S	C	.	.			trans	-105.4	-33.6	-177.3	-68.8	168	-156.9	0	0	110.9	K126 S147 H170 I171	K126-E149 PolarHBondContact O-N 3.32Å; S147-E149 PolarHBondContact O-N 2.81Å; E149-H170 PolarHBondContact O-N 3.05Å; E149-I171 PolarHBondContact O-N 3.47Å; E149-I171 VanDerWaalsContact O-N 3.07Å
150	V	98.6	Very high	92.4	Very high	33 Å²	33	42.9 Å²	42.9	20%	0.2	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	125.1	-178.7	-177	0	0	0	0	110.4	K126 Y127 L128 I171	K126-V150 PolarHBondContact O-N 2.98Å; Y127-V150 HydrophobicContact CD2-CB 3.63Å; Y127-V150 HydrophobicContact CD2-CG1 3.68Å; Y127-V150 HydrophobicContact CD2-CG2 4.19Å; Y127-V150 HydrophobicContact CE2-CB 4.14Å; Y127-V150 HydrophobicContact CE2-CG1 3.63Å; Y127-V150 HydrophobicContact CG-CB 4.48Å; L128-V150 PolarHBondContact N-O 3Å; V150-I171 WeakPolarHBondContact CA-O 3.41Å; V150-I171 HydrophobicContact CG1-CB 4.17Å; V150-I171 HydrophobicContact CG1-CG2 4.33Å; V150-I171 HydrophobicContact CG2-CB 4.19Å; V150-I171 HydrophobicContact CG2-CD1 4.24Å; V150-I171 HydrophobicContact CG2-CG1 4.41Å
151	L	98.1	Very high	92.9	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	113.4	174.7	176.9	59.5	0	0	0	109.8	L128 L140 L148 L153 M165 L169 I171 V172 D173	L128-L151 HydrophobicContact CB-CD1 4.28Å; L128-L151 HydrophobicContact CD2-CD1 4.03Å; L128-L151 HydrophobicContact CG-CD1 4.23Å; L140-L151 HydrophobicContact CD1-CD2 4.39Å; L148-L151 HydrophobicContact CD2-CB 4.1Å; L148-L151 HydrophobicContact CD2-CD1 4.35Å; L151-L153 HydrophobicContact CD1-CD1 4.5Å; L151-L153 HydrophobicContact CD1-CD2 4.12Å; L151-L153 HydrophobicContact CD1-CG 4.04Å; L151-L153 HydrophobicContact CD2-CD1 3.98Å; L151-L153 HydrophobicContact CD2-CG 4.34Å; L151-L153 HydrophobicContact CG-CD1 4.15Å; L151-L153 HydrophobicContact CG-CG 3.96Å; L151-M165 HydrophobicContact CD2-SD 4.46Å; L151-L169 HydrophobicContact CB-CD1 4.48Å; L151-L169 HydrophobicContact CB-CD2 3.65Å; L151-L169 HydrophobicContact CD2-CD1 4.34Å; L151-I171 PolarHBondContact N-O 2.77Å; L151-V172 WeakPolarHBondContact O-CA 3.45Å; L151-D173 PolarHBondContact O-N 3.37Å
152	N	98.8	Very high	93.7	Very high	25 Å²	25	39.4 Å²	39.4	13%	0.134	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	111.2	175.2	-170.9	-2.4	0	0	0	110.9	L128 D129 V130 S131 S154	L128-N152 PolarHBondContact O-N 2.9Å; D129-N152 HydrophobicContact CB-CB 4.2Å; D129-N152 PolarHBondContact OD1-ND2 2.95Å; V130-N152 PolarHBondContact N-O 3.1Å; S131-N152 PolarHBondContact N-O 2.94Å; N152-S154 WeakPolarHBondContact OD1-CB 3.08Å; N152-S154 PolarHBondContact OD1-N 3.4Å; N152-S154 PolarHBondContact OD1-OG 2.97Å
153	L	98.6	Very high	94.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.181	C	C	.	.			trans	-115.7	15.1	176.1	-64.2	175	0	0	0	111.4	V130 L135 V138 L151 N156 L158 P162 D173 L174 N177	V130-L153 HydrophobicContact CG2-CD2 3.34Å; L135-L153 HydrophobicContact CD1-CD2 4.12Å; V138-L153 HydrophobicContact CG2-CD1 4.43Å; V138-L153 HydrophobicContact CG2-CD2 4.15Å; L151-L153 HydrophobicContact CD1-CD1 4.5Å; L151-L153 HydrophobicContact CD1-CD2 4.12Å; L151-L153 HydrophobicContact CD1-CG 4.04Å; L151-L153 HydrophobicContact CD2-CD1 3.98Å; L151-L153 HydrophobicContact CD2-CG 4.34Å; L151-L153 HydrophobicContact CG-CD1 4.15Å; L151-L153 HydrophobicContact CG-CG 3.96Å; L153-N156 PolarHBondContact O-ND2 3.28Å; L153-L158 HydrophobicContact CB-CD1 4.1Å; L153-L158 HydrophobicContact CD1-CD1 4.18Å; L153-P162 HydrophobicContact CD1-CG 3.79Å; L153-D173 CarbonylContact C-O 3.35Å; L153-D173 WeakPolarHBondContact CA-O 3.47Å; L153-D173 WeakPolarHBondContact CB-O 3.19Å; L153-D173 PolarHBondContact N-O 2.99Å; L153-L174 HydrophobicContact CB-CD2 4.02Å; L153-L174 HydrophobicContact CD1-CD2 3.81Å; L153-N177 PolarHBondContact O-ND2 3.42Å
154	S	98.8	Very high	95.7	Very high	11 Å²	11	37.6 Å²	37.6	8%	0.077	19%	0.185	C	C	.	.			trans	-63.8	156.1	-174.1	84.2	0	0	0	0	112.4	S131 K132 N152 N156 D173 S175	S131-S154 CarbonylContact C-O 3.13Å; S131-S154 WeakPolarHBondContact CA-O 3.42Å; S131-S154 WeakPolarHBondContact CB-O 3.46Å; S131-S154 VanDerWaalsContact CB-OG 3.32Å; S131-S154 WeakPolarHBondContact CB-OG 3.46Å; K132-S154 PolarHBondContact N-O 2.79Å; N152-S154 WeakPolarHBondContact OD1-CB 3.08Å; N152-S154 PolarHBondContact OD1-N 3.4Å; N152-S154 PolarHBondContact OD1-OG 2.97Å; S154-N156 PolarHBondContact O-N 3.04Å; S154-N156 PolarHBondContact O-ND2 2.81Å; S154-N156 VanDerWaalsContact O-ND2 3.15Å; S154-D173 VanDerWaalsContact CB-CG 3.5Å; S154-D173 WeakPolarHBondContact CB-OD1 3.37Å; S154-D173 PolarHBondContact N-O 3.32Å; S154-S175 CarbonylContact C-O 3.58Å; S154-S175 WeakPolarHBondContact CA-O 3.28Å; S154-S175 WeakPolarHBondContact CB-OG 3.24Å
155	S	98.7	Very high	96.2	Very high	42 Å²	42	37.3 Å²	37.3	29%	0.294	18%	0.183	S	C	.	.	S	Bend	trans	57.2	49.4	174.1	-55.6	0	0	0	0	112.7	K132 N133 S175 N176	K132-S155 WeakPolarHBondContact CA-O 3.45Å; K132-S155 PolarHBondContact N-O 3Å; N133-S155 PolarHBondContact N-O 3.2Å; S155-S175 PolarHBondContact N-O 2.89Å; S155-N176 WeakPolarHBondContact CA-O 3.22Å; S155-N176 PolarHBondContact N-O 3.39Å
156	N	98.8	Very high	96.3	Very high	11 Å²	11	37.6 Å²	37.6	6%	0.059	18%	0.184	C	C	.	.	S	Bend	trans	-123.3	-165.9	177.1	-86.1	-73.1	0	0	0	110.1	V130 N133 M134 L135 L153 S154 L158 N176 N177	V130-N156 PolarHBondContact O-ND2 2.86Å; V130-N156 VanDerWaalsContact O-ND2 3.07Å; N133-N156 VanDerWaalsContact CA-OD1 3.23Å; N133-N156 WeakPolarHBondContact CA-OD1 3.49Å; N133-N156 WeakPolarHBondContact CB-OD1 3.49Å; N133-N156 PolarHBondContact N-OD1 2.89Å; N133-N156 PolarHBondContact O-OD1 2.86Å; M134-N156 PolarHBondContact N-OD1 2.88Å; L135-N156 HydrophobicContact CB-CB 4.04Å; L135-N156 VanDerWaalsContact CB-OD1 3.28Å; L135-N156 WeakPolarHBondContact CB-OD1 3.36Å; L135-N156 WeakPolarHBondContact CG-OD1 3.35Å; L135-N156 PolarHBondContact N-OD1 3.11Å; L153-N156 PolarHBondContact O-ND2 3.28Å; S154-N156 PolarHBondContact O-N 3.04Å; S154-N156 PolarHBondContact O-ND2 2.81Å; S154-N156 VanDerWaalsContact O-ND2 3.15Å; N156-L158 HydrophobicContact CB-CG 4.32Å; N156-N176 PolarHBondContact N-O 2.99Å; N156-N177 VanDerWaalsContact CA-OD1 3.27Å; N156-N177 WeakPolarHBondContact CA-OD1 3.25Å; N156-N177 WeakPolarHBondContact CB-OD1 3.27Å; N156-N177 PolarHBondContact N-OD1 3.27Å; N156-N177 PolarHBondContact O-OD1 3.25Å
157	K	98.3	Very high	96.3	Very high	92 Å²	92	34.5 Å²	34.5	40%	0.4	18%	0.175	S	C	.	.			trans	-114.4	26.9	-179.8	-62.9	-175.7	173.6	-173.2	0	112.7	M134 L135 E136 N177	M134-K157 HydrophobicContact CE-CD 4.38Å; M134-K157 HydrophobicContact SD-CD 4.48Å; L135-K157 CarbonylContact O-C 3.21Å; L135-K157 VanDerWaalsContact O-CA 3.26Å; L135-K157 WeakPolarHBondContact O-CA 3.49Å; L135-K157 WeakPolarHBondContact O-CB 3.49Å; L135-K157 PolarHBondContact O-N 3.18Å; E136-K157 HydrophobicContact CG-CB 4Å; E136-K157 HydrophobicContact CG-CD 4.41Å; K157-N177 PolarHBondContact N-OD1 2.96Å
158	L	98.3	Very high	96.3	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.016	18%	0.184	C	C	.	.			trans	-66.5	138.3	-178	-58.8	175.2	0	0	0	110.4	L135 V138 L153 N156 P162 L174 N177 S178 L179	L135-L158 HydrophobicContact CB-CD2 4.09Å; L135-L158 WeakPolarHBondContact O-CD2 3.44Å; L135-L158 PolarHBondContact O-N 2.77Å; L135-L158 VanDerWaalsContact O-N 3.13Å; V138-L158 HydrophobicContact CG2-CD1 4.45Å; V138-L158 HydrophobicContact CG2-CD2 3.84Å; L153-L158 HydrophobicContact CB-CD1 4.1Å; L153-L158 HydrophobicContact CD1-CD1 4.18Å; N156-L158 HydrophobicContact CB-CG 4.32Å; L158-P162 HydrophobicContact CD1-CG 4.3Å; L158-L174 HydrophobicContact CD1-CD2 4.04Å; L158-N177 HydrophobicContact CB-CB 4.28Å; L158-N177 WeakPolarHBondContact CB-OD1 3.09Å; L158-N177 WeakPolarHBondContact CG-OD1 3.43Å; L158-N177 PolarHBondContact N-OD1 2.92Å; L158-S178 CarbonylContact O-C 3.54Å; L158-S178 VanDerWaalsContact O-CA 3.23Å; L158-S178 WeakPolarHBondContact O-CA 3.26Å; L158-S178 PolarHBondContact O-N 2.99Å; L158-L179 HydrophobicContact CB-CD2 3.72Å; L158-L179 PolarHBondContact O-N 3.28Å; L158-L179 VanDerWaalsContact O-N 3.16Å
159	W	97.1	Very high	96.3	Very high	133 Å²	133	37.3 Å²	37.3	50%	0.504	18%	0.184	S	C	.	.	S	Bend	trans	-106.1	-21.9	179.6	70.9	-88.4	0	0	0	113.4	L179 T180	W159-L179 WeakPolarHBondContact O-CA 3.4Å; W159-T180 PolarHBondContact O-N 3.26Å; W159-T180 PolarHBondContact O-OG1 3.22Å
160	T	96.9	Very high	96.4	Very high	22 Å²	22	36.9 Å²	36.9	14%	0.135	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-134.7	150.3	176.4	-171.3	0	0	0	0	110.3	L179	T160-L179 VanDerWaalsContact O-CD2 3.24Å; T160-L179 WeakPolarHBondContact O-CD2 3.11Å
161	V	97.1	Very high	96.4	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-62.8	129.9	175.1	176.7	0	0	0	0	109	T163 M165 L174 L179 Q181 I182 T186 L187 F203	V161-T163 PolarHBondContact O-N 3.24Å; V161-M165 HydrophobicContact CG1-CE 3.68Å; V161-L174 HydrophobicContact CG1-CD1 3.96Å; V161-L174 HydrophobicContact CG2-CD1 4.37Å; V161-L179 HydrophobicContact CG2-CD1 4.17Å; V161-Q181 PolarHBondContact N-O 3.15Å; V161-I182 HydrophobicContact CB-CG2 4.4Å; V161-I182 HydrophobicContact CG2-CB 4.43Å; V161-I182 HydrophobicContact CG2-CD1 4.34Å; V161-I182 HydrophobicContact CG2-CG1 3.79Å; V161-I182 HydrophobicContact CG2-CG2 4.49Å; V161-T186 HydrophobicContact CB-CG2 4.26Å; V161-T186 HydrophobicContact CG1-CG2 3.68Å; V161-L187 HydrophobicContact CG1-CD2 4.14Å; V161-F203 HydrophobicContact CG2-CZ 3.97Å
162	P	94.9	Very high	96.4	Very high	6 Å²	6	37.8 Å²	37.8	4%	0.039	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-58.9	132.9	-178.9	-25.1	34.2	0	0	0	112.5	V138 L153 L158 M165 L174 T186	V138-P162 HydrophobicContact CB-CB 4.11Å; V138-P162 HydrophobicContact CB-CG 4Å; V138-P162 HydrophobicContact CG1-CB 3.99Å; V138-P162 HydrophobicContact CG1-CG 4.21Å; L153-P162 HydrophobicContact CD1-CG 3.79Å; L158-P162 HydrophobicContact CD1-CG 4.3Å; P162-M165 HydrophobicContact CB-CG 4.37Å; P162-M165 WeakPolarHBondContact O-CE 3.32Å; P162-L174 HydrophobicContact CG-CD2 4.33Å; P162-T186 VanDerWaalsContact O-CG2 3.27Å; P162-T186 WeakPolarHBondContact O-CG2 3.13Å
163	T	91.9	Very high	96.4	Very high	56 Å²	56	38 Å²	38	34%	0.344	19%	0.186	S	C	.	.	S	Bend	trans	-81.8	162.7	174.4	59	0	0	0	0	111.1	V161 M165 L183 T186	V161-T163 PolarHBondContact O-N 3.24Å; T163-M165 VanDerWaalsContact C-N 3.27Å; T163-M165 PolarHBondContact O-N 3.09Å; T163-L183 HydrophobicContact CG2-CD1 3.92Å; T163-T186 HydrophobicContact CG2-CG2 4.48Å
164	N	90.9	Very high	96.4	Very high	87 Å²	87	38 Å²	38	47%	0.465	19%	0.186	S	C	.	.	S	Bend	trans	59	32.2	176.8	-56.7	-48	0	0	0	114.8	L140 K142	L140-N164 WeakPolarHBondContact O-CB 3.33Å; K142-N164 HydrophobicContact CB-CB 4.45Å
165	M	92.9	Very high	96.4	Very high	11 Å²	11	37.6 Å²	37.6	5%	0.054	18%	0.183	C	C	.	.			trans	-59.7	143.9	172.1	-76.4	-172.2	-79.1	0	0	111.6	L140 L151 V161 P162 T163 L169 V172 T186 L187 L190	L140-M165 HydrophobicContact CD1-CG 4.16Å; L151-M165 HydrophobicContact CD2-SD 4.46Å; V161-M165 HydrophobicContact CG1-CE 3.68Å; P162-M165 HydrophobicContact CB-CG 4.37Å; P162-M165 WeakPolarHBondContact O-CE 3.32Å; T163-M165 VanDerWaalsContact C-N 3.27Å; T163-M165 PolarHBondContact O-N 3.09Å; M165-L169 HydrophobicContact CB-CD1 3.92Å; M165-L169 HydrophobicContact CG-CD1 4.48Å; M165-L169 HydrophobicContact SD-CD1 4.47Å; M165-V172 HydrophobicContact SD-CG1 4.17Å; M165-V172 HydrophobicContact SD-CG2 4.41Å; M165-T186 HydrophobicContact CE-CG2 4.25Å; M165-L187 HydrophobicContact CE-CD2 3.52Å; M165-L190 HydrophobicContact CB-CD1 4.43Å; M165-L190 HydrophobicContact CB-CD2 4.02Å; M165-L190 HydrophobicContact CE-CD1 3.85Å; M165-L190 HydrophobicContact SD-CD1 4.42Å
166	P	92.8	Very high	96.4	Very high	6 Å²	6	38.5 Å²	38.5	4%	0.039	18%	0.184	C	C	.	.			trans	-60.6	137.2	179.4	-25.7	34.2	0	0	0	113.8	L145 L148 K168 L169 L190	L145-P166 HydrophobicContact CB-CB 4.37Å; L145-P166 HydrophobicContact CB-CG 3.56Å; L145-P166 HydrophobicContact CD1-CG 4.31Å; L145-P166 WeakPolarHBondContact O-CB 3.14Å; L148-P166 HydrophobicContact CB-CB 4.45Å; L148-P166 HydrophobicContact CB-CG 4.41Å; L148-P166 HydrophobicContact CD2-CG 4.22Å; P166-K168 VanDerWaalsContact C-N 3.28Å; P166-K168 PolarHBondContact O-N 3.32Å; P166-L169 HydrophobicContact CB-CD1 4.44Å; P166-L169 HydrophobicContact CB-CG 4.31Å; P166-L169 WeakPolarHBondContact O-CD1 3.18Å; P166-L169 VanDerWaalsContact O-CG 3.27Å; P166-L169 WeakPolarHBondContact O-CG 3.1Å; P166-L169 PolarHBondContact O-N 3.25Å; P166-L190 VanDerWaalsContact O-CD2 3.25Å; P166-L190 WeakPolarHBondContact O-CD2 3.49Å
167	F	92.4	Very high	96.4	Very high	80 Å²	80	38.3 Å²	38.3	35%	0.351	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-17.5	-174.9	64.8	-90.6	0	0	0	114.8	L169 N189	F167-L169 VanDerWaalsContact C-N 3.3Å; F167-N189 WeakPolarHBondContact CB-O 3.23Å
168	K	95	Very high	96.4	Very high	88 Å²	88	36.8 Å²	36.8	38%	0.383	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	2.5	178.4	-75.3	-150.6	-171.4	175.7	0	114.4	R146 L148 P166 H170	R146-K168 WeakPolarHBondContact O-CD 3.16Å; R146-K168 WeakPolarHBondContact O-CE 3.15Å; R146-K168 WeakPolarHBondContact O-CG 3.41Å; L148-K168 CarbonylContact O-C 3.39Å; P166-K168 VanDerWaalsContact C-N 3.28Å; P166-K168 PolarHBondContact O-N 3.32Å; K168-H170 PolarHBondContact O-CE1 3.02Å; K168-H170 PolarHBondContact O-N 3.02Å; K168-H170 PolarHBondContact O-ND1 3.28Å
169	L	96.8	Very high	96.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.			trans	-63.7	130.3	-179.3	-75.1	168.6	0	0	0	111.2	L148 L151 M165 P166 F167 V172 L190 N192 L193	L148-L169 HydrophobicContact CB-CD2 4.42Å; L148-L169 HydrophobicContact CD2-CD2 3.92Å; L148-L169 HydrophobicContact CG-CD2 3.92Å; L148-L169 PolarHBondContact O-N 3.02Å; L151-L169 HydrophobicContact CB-CD1 4.48Å; L151-L169 HydrophobicContact CB-CD2 3.65Å; L151-L169 HydrophobicContact CD2-CD1 4.34Å; M165-L169 HydrophobicContact CB-CD1 3.92Å; M165-L169 HydrophobicContact CG-CD1 4.48Å; M165-L169 HydrophobicContact SD-CD1 4.47Å; P166-L169 HydrophobicContact CB-CD1 4.44Å; P166-L169 HydrophobicContact CB-CG 4.31Å; P166-L169 WeakPolarHBondContact O-CD1 3.18Å; P166-L169 VanDerWaalsContact O-CG 3.27Å; P166-L169 WeakPolarHBondContact O-CG 3.1Å; P166-L169 PolarHBondContact O-N 3.25Å; F167-L169 VanDerWaalsContact C-N 3.3Å; L169-V172 HydrophobicContact CB-CG2 4.09Å; L169-V172 HydrophobicContact CD1-CG2 3.72Å; L169-V172 HydrophobicContact CD2-CG2 4.36Å; L169-V172 HydrophobicContact CG-CG2 4.29Å; L169-L190 HydrophobicContact CB-CD2 4.49Å; L169-L190 HydrophobicContact CD1-CD2 4.28Å; L169-N192 CarbonylContact O-C 3.56Å; L169-L193 HydrophobicContact CB-CD1 4.25Å; L169-L193 WeakPolarHBondContact O-CA 3.26Å; L169-L193 PolarHBondContact O-N 3.4Å
170	H	98.1	Very high	96.4	Very high	66 Å²	66	33.3 Å²	33.3	31%	0.306	18%	0.178	S	C	.	.	S	Bend	trans	-103.4	-33.2	171.6	-64.6	80.5	0	0	0	111.1	E149 K168 T194 H195	E149-H170 PolarHBondContact O-N 3.05Å; K168-H170 PolarHBondContact O-CE1 3.02Å; K168-H170 PolarHBondContact O-N 3.02Å; K168-H170 PolarHBondContact O-ND1 3.28Å; H170-T194 WeakPolarHBondContact O-CA 3.44Å; H170-T194 PolarHBondContact O-N 3.23Å; H170-T194 PolarHBondContact O-OG1 2.81Å; H170-H195 PolarHBondContact O-N 2.85Å
171	I	98.8	Very high	96.3	Very high	54 Å²	54	35.7 Å²	35.7	28%	0.277	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	125.2	-178.1	-55	-179.5	0	0	0	109.3	E149 V150 L151 H195 Y197	E149-I171 PolarHBondContact O-N 3.47Å; E149-I171 VanDerWaalsContact O-N 3.07Å; V150-I171 WeakPolarHBondContact CA-O 3.41Å; V150-I171 HydrophobicContact CG1-CB 4.17Å; V150-I171 HydrophobicContact CG1-CG2 4.33Å; V150-I171 HydrophobicContact CG2-CB 4.19Å; V150-I171 HydrophobicContact CG2-CD1 4.24Å; V150-I171 HydrophobicContact CG2-CG1 4.41Å; L151-I171 PolarHBondContact N-O 2.77Å; I171-H195 HydrophobicContact CB-CB 4.44Å; I171-H195 HydrophobicContact CG1-CB 4.14Å; I171-H195 HydrophobicContact CG2-CB 4.15Å; I171-Y197 HydrophobicContact CG2-CE2 4.02Å
172	V	98.6	Very high	96.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	116.9	172.4	174.4	0	0	0	0	109	L151 M165 L169 L174 L193 H195 L196 Y197	L151-V172 WeakPolarHBondContact O-CA 3.45Å; M165-V172 HydrophobicContact SD-CG1 4.17Å; M165-V172 HydrophobicContact SD-CG2 4.41Å; L169-V172 HydrophobicContact CB-CG2 4.09Å; L169-V172 HydrophobicContact CD1-CG2 3.72Å; L169-V172 HydrophobicContact CD2-CG2 4.36Å; L169-V172 HydrophobicContact CG-CG2 4.29Å; V172-L174 HydrophobicContact CG1-CD1 3.72Å; V172-L174 HydrophobicContact CG1-CG 3.75Å; V172-L193 HydrophobicContact CB-CD1 4.07Å; V172-L193 HydrophobicContact CG2-CD1 3.6Å; V172-H195 PolarHBondContact N-O 2.88Å; V172-L196 HydrophobicContact CB-CD1 4.15Å; V172-L196 HydrophobicContact CG1-CD1 4.14Å; V172-Y197 PolarHBondContact O-N 2.75Å
173	D	98.9	Very high	96.3	Very high	29 Å²	29	38.8 Å²	38.8	16%	0.155	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	111.4	172.5	-166.9	-16.2	0	0	0	110.6	L151 L153 S154 S175 Y197	L151-D173 PolarHBondContact O-N 3.37Å; L153-D173 CarbonylContact C-O 3.35Å; L153-D173 WeakPolarHBondContact CA-O 3.47Å; L153-D173 WeakPolarHBondContact CB-O 3.19Å; L153-D173 PolarHBondContact N-O 2.99Å; S154-D173 VanDerWaalsContact CB-CG 3.5Å; S154-D173 WeakPolarHBondContact CB-OD1 3.37Å; S154-D173 PolarHBondContact N-O 3.32Å; D173-S175 WeakPolarHBondContact OD1-CB 3.24Å; D173-S175 PolarHBondContact OD1-N 2.64Å; D173-S175 PolarHBondContact OD1-OG 3.06Å; D173-Y197 HydrophobicContact CB-CD2 3.82Å; D173-Y197 WeakPolarHBondContact OD1-CB 3.42Å
174	L	98.8	Very high	96.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.			trans	-117.1	13.2	176.6	-75.3	165.5	0	0	0	111	L153 L158 V161 P162 V172 N177 L179 L196 Y197 L198 N201	L153-L174 HydrophobicContact CB-CD2 4.02Å; L153-L174 HydrophobicContact CD1-CD2 3.81Å; L158-L174 HydrophobicContact CD1-CD2 4.04Å; V161-L174 HydrophobicContact CG1-CD1 3.96Å; V161-L174 HydrophobicContact CG2-CD1 4.37Å; P162-L174 HydrophobicContact CG-CD2 4.33Å; V172-L174 HydrophobicContact CG1-CD1 3.72Å; V172-L174 HydrophobicContact CG1-CG 3.75Å; L174-N177 PolarHBondContact O-ND2 2.78Å; L174-N177 VanDerWaalsContact O-ND2 3.14Å; L174-L179 HydrophobicContact CB-CD1 3.89Å; L174-L179 HydrophobicContact CD2-CD1 4.39Å; L174-L196 HydrophobicContact CD1-CD1 4.42Å; L174-Y197 CarbonylContact C-O 3.17Å; L174-Y197 VanDerWaalsContact C-O 3.26Å; L174-Y197 WeakPolarHBondContact CA-O 3.44Å; L174-Y197 WeakPolarHBondContact CB-O 3.39Å; L174-Y197 PolarHBondContact N-O 2.98Å; L174-L198 HydrophobicContact CB-CD2 3.98Å; L174-L198 HydrophobicContact CD1-CD2 4.02Å; L174-N201 PolarHBondContact O-ND2 3.13Å
175	S	98.8	Very high	96.2	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.014	22%	0.223	C	C	.	.			trans	-65.8	158.8	-177.2	69.1	0	0	0	0	112	S154 S155 D173 N177 Y197 H199	S154-S175 CarbonylContact C-O 3.58Å; S154-S175 WeakPolarHBondContact CA-O 3.28Å; S154-S175 WeakPolarHBondContact CB-OG 3.24Å; S155-S175 PolarHBondContact N-O 2.89Å; D173-S175 WeakPolarHBondContact OD1-CB 3.24Å; D173-S175 PolarHBondContact OD1-N 2.64Å; D173-S175 PolarHBondContact OD1-OG 3.06Å; S175-N177 PolarHBondContact O-N 2.8Å; S175-N177 PolarHBondContact O-ND2 3.32Å; S175-N177 VanDerWaalsContact O-ND2 3.14Å; S175-Y197 PolarHBondContact N-O 3.49Å; S175-Y197 VanDerWaalsContact N-O 3.12Å; S175-H199 VanDerWaalsContact CA-O 3.25Å; S175-H199 WeakPolarHBondContact CA-O 3.36Å; S175-H199 VanDerWaalsContact CB-CD2 3.43Å; S175-H199 WeakPolarHBondContact CB-CD2 3.49Å; S175-H199 VanDerWaalsContact CB-CE1 3.48Å; S175-H199 WeakPolarHBondContact CB-CE1 3.45Å; S175-H199 WeakPolarHBondContact CB-NE2 3.27Å
176	N	98.7	Very high	96.3	Very high	61 Å²	61	39.8 Å²	39.8	33%	0.326	22%	0.224	S	C	.	.	S	Bend	trans	56.9	46.4	175.6	-54.4	-76.4	0	0	0	112.8	S155 N156 H199 N200	S155-N176 WeakPolarHBondContact CA-O 3.22Å; S155-N176 PolarHBondContact N-O 3.39Å; N156-N176 PolarHBondContact N-O 2.99Å; N176-H199 PolarHBondContact N-O 2.64Å; N176-N200 VanDerWaalsContact CA-O 3.29Å; N176-N200 WeakPolarHBondContact CA-O 3.49Å; N176-N200 HydrophobicContact CB-CB 4.44Å; N176-N200 PolarHBondContact N-O 3.18Å; N176-N200 VanDerWaalsContact OD1-CB 3.31Å; N176-N200 WeakPolarHBondContact OD1-CB 3.31Å; N176-N200 PolarHBondContact OD1-ND2 3.19Å
177	N	98.8	Very high	96.4	Very high	8 Å²	8	39.7 Å²	39.7	4%	0.043	22%	0.224	C	C	.	.	S	Bend	trans	-118.9	-168.2	174.5	-85.8	-81.5	0	0	0	109.7	L153 N156 K157 L158 L174 S175 L179 N200 N201	L153-N177 PolarHBondContact O-ND2 3.42Å; N156-N177 VanDerWaalsContact CA-OD1 3.27Å; N156-N177 WeakPolarHBondContact CA-OD1 3.25Å; N156-N177 WeakPolarHBondContact CB-OD1 3.27Å; N156-N177 PolarHBondContact N-OD1 3.27Å; N156-N177 PolarHBondContact O-OD1 3.25Å; K157-N177 PolarHBondContact N-OD1 2.96Å; L158-N177 HydrophobicContact CB-CB 4.28Å; L158-N177 WeakPolarHBondContact CB-OD1 3.09Å; L158-N177 WeakPolarHBondContact CG-OD1 3.43Å; L158-N177 PolarHBondContact N-OD1 2.92Å; L174-N177 PolarHBondContact O-ND2 2.78Å; L174-N177 VanDerWaalsContact O-ND2 3.14Å; S175-N177 PolarHBondContact O-N 2.8Å; S175-N177 PolarHBondContact O-ND2 3.32Å; S175-N177 VanDerWaalsContact O-ND2 3.14Å; N177-L179 HydrophobicContact CB-CD1 4.33Å; N177-L179 HydrophobicContact CB-CG 3.88Å; N177-N200 PolarHBondContact N-O 3.04Å; N177-N201 VanDerWaalsContact CA-OD1 3.27Å; N177-N201 WeakPolarHBondContact CA-OD1 3.39Å; N177-N201 WeakPolarHBondContact CB-OD1 3.09Å; N177-N201 PolarHBondContact N-OD1 3.12Å; N177-N201 PolarHBondContact O-OD1 3.08Å
178	S	98.2	Very high	96.4	Very high	59 Å²	59	40.1 Å²	40.1	41%	0.413	23%	0.229	S	C	.	.			trans	-110.7	31.9	173.8	-61	0	0	0	0	111.8	L158 T180	L158-S178 CarbonylContact O-C 3.54Å; L158-S178 VanDerWaalsContact O-CA 3.23Å; L158-S178 WeakPolarHBondContact O-CA 3.26Å; L158-S178 PolarHBondContact O-N 2.99Å; S178-T180 PolarHBondContact O-N 2.87Å
179	L	98.4	Very high	96.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.231	C	C	.	.			trans	-65.8	127.7	-173.4	-59.6	172.8	0	0	0	111.2	L158 W159 T160 V161 L174 N177 L198 N201 K202 F203	L158-L179 HydrophobicContact CB-CD2 3.72Å; L158-L179 PolarHBondContact O-N 3.28Å; L158-L179 VanDerWaalsContact O-N 3.16Å; W159-L179 WeakPolarHBondContact O-CA 3.4Å; T160-L179 VanDerWaalsContact O-CD2 3.24Å; T160-L179 WeakPolarHBondContact O-CD2 3.11Å; V161-L179 HydrophobicContact CG2-CD1 4.17Å; L174-L179 HydrophobicContact CB-CD1 3.89Å; L174-L179 HydrophobicContact CD2-CD1 4.39Å; N177-L179 HydrophobicContact CB-CD1 4.33Å; N177-L179 HydrophobicContact CB-CG 3.88Å; L179-L198 HydrophobicContact CD1-CD2 4.37Å; L179-N201 HydrophobicContact CB-CB 4.13Å; L179-N201 VanDerWaalsContact CB-OD1 3.27Å; L179-N201 WeakPolarHBondContact CB-OD1 3.28Å; L179-N201 VanDerWaalsContact CG-OD1 3.22Å; L179-N201 WeakPolarHBondContact CG-OD1 3.32Å; L179-N201 PolarHBondContact N-OD1 3.26Å; L179-K202 CarbonylContact O-C 3.51Å; L179-K202 WeakPolarHBondContact O-CA 3.34Å; L179-K202 WeakPolarHBondContact O-CB 3.47Å; L179-K202 PolarHBondContact O-N 3.46Å; L179-F203 HydrophobicContact CB-CD2 4.47Å; L179-F203 HydrophobicContact CB-CE1 4.17Å; L179-F203 HydrophobicContact CB-CE2 3.68Å; L179-F203 HydrophobicContact CB-CZ 3.5Å; L179-F203 VanDerWaalsContact CB-CZ 3.5Å; L179-F203 HydrophobicContact CD1-CE2 4.1Å; L179-F203 HydrophobicContact CD1-CZ 4.03Å; L179-F203 HydrophobicContact CG-CZ 4.38Å; L179-F203 PolarHBondContact O-N 3.06Å; L179-F203 VanDerWaalsContact O-N 3.13Å
180	T	97.2	Very high	96.1	Very high	64 Å²	64	39.8 Å²	39.8	39%	0.393	23%	0.231	S	C	.	.			trans	-109.2	-26.7	178.3	56.3	0	0	0	0	113.2	W159 S178 K202	W159-T180 PolarHBondContact O-N 3.26Å; W159-T180 PolarHBondContact O-OG1 3.22Å; S178-T180 PolarHBondContact O-N 2.87Å; T180-K202 HydrophobicContact CG2-CB 3.99Å
181	Q	94.4	Very high	96	Very high	72 Å²	72	39.2 Å²	39.2	34%	0.336	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-149.7	159.3	-174.4	64.7	179.8	0.9	0	0	113.1	V161	V161-Q181 PolarHBondContact N-O 3.15Å
182	I	96.8	Very high	95.9	Very high	4 Å²	4	39 Å²	39	2%	0.021	23%	0.232	C	C	.	.			trans	-111.2	129.8	167.5	-49.3	-170.1	0	0	0	106	V161 T186 L187 F203 I206 P207 F211	V161-I182 HydrophobicContact CB-CG2 4.4Å; V161-I182 HydrophobicContact CG2-CB 4.43Å; V161-I182 HydrophobicContact CG2-CD1 4.34Å; V161-I182 HydrophobicContact CG2-CG1 3.79Å; V161-I182 HydrophobicContact CG2-CG2 4.49Å; I182-T186 HydrophobicContact CG2-CG2 4.47Å; I182-L187 HydrophobicContact CD1-CD1 4.08Å; I182-L187 HydrophobicContact CG2-CD1 4.23Å; I182-L187 HydrophobicContact CG2-CG 4.23Å; I182-F203 HydrophobicContact CD1-CE1 4.38Å; I182-F203 HydrophobicContact CD1-CZ 4.5Å; I182-F203 HydrophobicContact CG1-CE1 3.67Å; I182-F203 HydrophobicContact CG1-CZ 4.08Å; I182-I206 HydrophobicContact CD1-CD1 3.85Å; I182-I206 HydrophobicContact CD1-CG2 4.44Å; I182-I206 HydrophobicContact CG1-CD1 4.39Å; I182-P207 HydrophobicContact CB-CG 4.47Å; I182-P207 VanDerWaalsContact O-CG 3.28Å; I182-P207 WeakPolarHBondContact O-CG 3.39Å; I182-F211 HydrophobicContact CD1-CE1 3.91Å; I182-F211 HydrophobicContact CD1-CZ 4.21Å
183	L	95.1	Very high	95.9	Very high	67 Å²	67	39 Å²	39	35%	0.351	23%	0.232	S	C	.	.			trans	-76.3	142.5	174.8	-62.9	174.7	0	0	0	109.8	T163 G185 T186	T163-L183 HydrophobicContact CG2-CD1 3.92Å; L183-G185 PolarHBondContact O-N 3.39Å; L183-T186 WeakPolarHBondContact CB-OG1 3.23Å; L183-T186 WeakPolarHBondContact O-CB 3.23Å; L183-T186 PolarHBondContact O-N 3.32Å; L183-T186 PolarHBondContact O-OG1 3.48Å
184	P	92	Very high	95.9	Very high	116 Å²	116	38.5 Å²	38.5	75%	0.753	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	136	178.3	-28.1	35.3	0	0	0	112.2	T186	P184-T186 PolarHBondContact O-N 3.43Å
185	G	89.5	Confident	95.9	Very high	45 Å²	45	40.5 Å²	40.5	46%	0.464	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	-0.8	-179.1	0	0	0	0	0	115.8	L183 L187 I188	L183-G185 PolarHBondContact O-N 3.39Å; G185-L187 VanDerWaalsContact C-N 3.3Å; G185-L187 PolarHBondContact O-N 3.38Å; G185-I188 WeakPolarHBondContact O-CG2 3.22Å; G185-I188 PolarHBondContact O-N 2.88Å
186	T	94.1	Very high	95.9	Very high	14 Å²	14	40.4 Å²	40.4	9%	0.086	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-39.3	-178.8	-64.6	0	0	0	0	113.1	V161 P162 T163 M165 I182 L183 P184	V161-T186 HydrophobicContact CB-CG2 4.26Å; V161-T186 HydrophobicContact CG1-CG2 3.68Å; P162-T186 VanDerWaalsContact O-CG2 3.27Å; P162-T186 WeakPolarHBondContact O-CG2 3.13Å; T163-T186 HydrophobicContact CG2-CG2 4.48Å; M165-T186 HydrophobicContact CE-CG2 4.25Å; I182-T186 HydrophobicContact CG2-CG2 4.47Å; L183-T186 WeakPolarHBondContact CB-OG1 3.23Å; L183-T186 WeakPolarHBondContact O-CB 3.23Å; L183-T186 PolarHBondContact O-N 3.32Å; L183-T186 PolarHBondContact O-OG1 3.48Å; P184-T186 PolarHBondContact O-N 3.43Å
187	L	95.1	Very high	95.9	Very high	5 Å²	5	40 Å²	40	3%	0.026	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-2.3	-174.4	-57	178.5	0	0	0	113.4	V161 M165 I182 G185 N189 L190 L196 S210 F211 L214	V161-L187 HydrophobicContact CG1-CD2 4.14Å; M165-L187 HydrophobicContact CE-CD2 3.52Å; I182-L187 HydrophobicContact CD1-CD1 4.08Å; I182-L187 HydrophobicContact CG2-CD1 4.23Å; I182-L187 HydrophobicContact CG2-CG 4.23Å; G185-L187 VanDerWaalsContact C-N 3.3Å; G185-L187 PolarHBondContact O-N 3.38Å; L187-N189 PolarHBondContact O-N 3.42Å; L187-N189 VanDerWaalsContact O-N 3.09Å; L187-L190 HydrophobicContact CD2-CD1 3.69Å; L187-L190 PolarHBondContact O-N 3.18Å; L187-L196 HydrophobicContact CD1-CD2 4.37Å; L187-S210 WeakPolarHBondContact CB-O 3.07Å; L187-F211 HydrophobicContact CD1-CD1 3.85Å; L187-F211 HydrophobicContact CD1-CE1 3.74Å; L187-L214 HydrophobicContact CB-CD2 4.5Å
188	I	92.4	Very high	95.9	Very high	89 Å²	89	39.8 Å²	39.8	46%	0.456	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-28.1	-169.3	-157.3	173.6	0	0	0	113.6	G185 Q213	G185-I188 WeakPolarHBondContact O-CG2 3.22Å; G185-I188 PolarHBondContact O-N 2.88Å; I188-Q213 HydrophobicContact CG1-CB 4.45Å; I188-Q213 HydrophobicContact CG1-CG 3.56Å; I188-Q213 WeakPolarHBondContact O-CB 3.5Å
189	N	91.3	Very high	95.9	Very high	80 Å²	80	38 Å²	38	43%	0.428	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	0.5	-177.2	-63.7	-47.9	0	0	0	113.4	F167 L187 T191	F167-N189 WeakPolarHBondContact CB-O 3.23Å; L187-N189 PolarHBondContact O-N 3.42Å; L187-N189 VanDerWaalsContact O-N 3.09Å; N189-T191 PolarHBondContact O-N 2.91Å
190	L	95.3	Very high	95.9	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	23%	0.226	C	C	.	.			trans	-90.7	52	-176.7	-56.9	-175	0	0	0	111.3	M165 P166 L169 L187 N192 L193 L214	M165-L190 HydrophobicContact CB-CD1 4.43Å; M165-L190 HydrophobicContact CB-CD2 4.02Å; M165-L190 HydrophobicContact CE-CD1 3.85Å; M165-L190 HydrophobicContact SD-CD1 4.42Å; P166-L190 VanDerWaalsContact O-CD2 3.25Å; P166-L190 WeakPolarHBondContact O-CD2 3.49Å; L169-L190 HydrophobicContact CB-CD2 4.49Å; L169-L190 HydrophobicContact CD1-CD2 4.28Å; L187-L190 HydrophobicContact CD2-CD1 3.69Å; L187-L190 PolarHBondContact O-N 3.18Å; L190-N192 PolarHBondContact O-N 3.29Å; L190-L193 HydrophobicContact CB-CB 4.1Å; L190-L193 HydrophobicContact CB-CD2 4.41Å; L190-L193 HydrophobicContact CD1-CD2 4.22Å; L190-L193 VanDerWaalsContact O-CB 3.25Å; L190-L193 WeakPolarHBondContact O-CB 2.95Å; L190-L193 PolarHBondContact O-N 2.02Å; L190-L193 VanDerWaalsContact O-N 3.16Å; L190-L214 HydrophobicContact CB-CD2 3.98Å; L190-L214 WeakPolarHBondContact O-CD2 3.28Å
191	T	95.4	Very high	96	Very high	54 Å²	54	36.8 Å²	36.8	33%	0.331	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-21	-173.9	57.6	0	0	0	0	113.8	N189 Q216	N189-T191 PolarHBondContact O-N 2.91Å; T191-Q216 WeakPolarHBondContact O-CG 3.48Å
192	N	96.6	Very high	96.1	Very high	49 Å²	49	37.3 Å²	37.3	26%	0.262	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	3.7	-179.8	-63.8	7	0	0	0	112.9	L169 L190 T194	L169-N192 CarbonylContact O-C 3.56Å; L190-N192 PolarHBondContact O-N 3.29Å; N192-T194 PolarHBondContact O-N 3.19Å
193	L	98.2	Very high	96.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.208	C	C	.	.			trans	-70	125.7	-175.7	-164.6	71.4	0	0	0	110.2	L169 V172 L190 L196 L214 Q216 L217	L169-L193 HydrophobicContact CB-CD1 4.25Å; L169-L193 WeakPolarHBondContact O-CA 3.26Å; L169-L193 PolarHBondContact O-N 3.4Å; V172-L193 HydrophobicContact CB-CD1 4.07Å; V172-L193 HydrophobicContact CG2-CD1 3.6Å; L190-L193 HydrophobicContact CB-CB 4.1Å; L190-L193 HydrophobicContact CB-CD2 4.41Å; L190-L193 HydrophobicContact CD1-CD2 4.22Å; L190-L193 VanDerWaalsContact O-CB 3.25Å; L190-L193 WeakPolarHBondContact O-CB 2.95Å; L190-L193 PolarHBondContact O-N 2.02Å; L190-L193 VanDerWaalsContact O-N 3.16Å; L193-L196 HydrophobicContact CD2-CB 3.93Å; L193-L196 HydrophobicContact CD2-CD1 4.27Å; L193-L196 HydrophobicContact CD2-CD2 4.18Å; L193-L196 HydrophobicContact CD2-CG 4.34Å; L193-L214 HydrophobicContact CB-CD2 4.28Å; L193-L214 HydrophobicContact CD2-CD1 4.46Å; L193-L214 HydrophobicContact CD2-CD2 4.11Å; L193-Q216 CarbonylContact O-C 3.02Å; L193-L217 HydrophobicContact CD2-CD1 4.4Å; L193-L217 HydrophobicContact CG-CD1 4.39Å; L193-L217 VanDerWaalsContact O-CA 3.29Å; L193-L217 WeakPolarHBondContact O-CA 3.3Å; L193-L217 PolarHBondContact O-N 3.09Å; L193-L217 VanDerWaalsContact O-N 3.15Å
194	T	98.6	Very high	96.2	Very high	18 Å²	18	36.7 Å²	36.7	11%	0.11	21%	0.208	C	C	.	.			trans	-107.2	-35.7	179.8	62.3	0	0	0	0	111.9	H170 N192 Q218 E219	H170-T194 WeakPolarHBondContact O-CA 3.44Å; H170-T194 PolarHBondContact O-N 3.23Å; H170-T194 PolarHBondContact O-OG1 2.81Å; N192-T194 PolarHBondContact O-N 3.19Å; T194-Q218 WeakPolarHBondContact O-CA 3.22Å; T194-Q218 WeakPolarHBondContact O-CB 3.36Å; T194-Q218 PolarHBondContact O-N 3.2Å; T194-E219 PolarHBondContact O-N 3.36Å
195	H	98.8	Very high	96.3	Very high	42 Å²	42	34.4 Å²	34.4	19%	0.194	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	126.2	-178.6	-62.8	70.3	0	0	0	110.3	H170 I171 V172 Y197 E219	H170-H195 PolarHBondContact O-N 2.85Å; I171-H195 HydrophobicContact CB-CB 4.44Å; I171-H195 HydrophobicContact CG1-CB 4.14Å; I171-H195 HydrophobicContact CG2-CB 4.15Å; V172-H195 PolarHBondContact N-O 2.88Å; H195-Y197 HydrophobicContact CB-CE2 4.04Å; H195-Y197 PolarHBondContact CD2-OH 2.84Å; H195-E219 WeakPolarHBondContact CA-O 3.15Å
196	L	98.7	Very high	96.6	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	110.4	177.5	179.4	55.7	0	0	0	110.8	V172 L174 L187 L193 L198 F211 L214 L217 E219 I220 T221	V172-L196 HydrophobicContact CB-CD1 4.15Å; V172-L196 HydrophobicContact CG1-CD1 4.14Å; L174-L196 HydrophobicContact CD1-CD1 4.42Å; L187-L196 HydrophobicContact CD1-CD2 4.37Å; L193-L196 HydrophobicContact CD2-CB 3.93Å; L193-L196 HydrophobicContact CD2-CD1 4.27Å; L193-L196 HydrophobicContact CD2-CD2 4.18Å; L193-L196 HydrophobicContact CD2-CG 4.34Å; L196-L198 HydrophobicContact CD1-CD2 4.27Å; L196-L198 HydrophobicContact CD1-CG 4.19Å; L196-L198 HydrophobicContact CD2-CD1 3.98Å; L196-L198 HydrophobicContact CD2-CG 4.44Å; L196-L198 HydrophobicContact CG-CD1 4.08Å; L196-L198 HydrophobicContact CG-CG 4Å; L196-F211 HydrophobicContact CD2-CE1 4.23Å; L196-L214 HydrophobicContact CD2-CD1 4.09Å; L196-L217 HydrophobicContact CB-CD1 3.97Å; L196-E219 PolarHBondContact N-O 3.27Å; L196-I220 HydrophobicContact CB-CG1 4.32Å; L196-I220 HydrophobicContact CD2-CD1 4.15Å; L196-I220 HydrophobicContact CG-CG1 4.44Å; L196-I220 VanDerWaalsContact O-CA 3.31Å; L196-I220 WeakPolarHBondContact O-CA 3.26Å; L196-I220 WeakPolarHBondContact O-CG1 2.96Å; L196-T221 PolarHBondContact O-N 3.1Å
197	Y	98.8	Very high	96.7	Very high	53 Å²	53	32.7 Å²	32.7	21%	0.208	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	110.4	-179.5	-53.3	-72.1	0	0	0	111.5	I171 V172 D173 L174 S175 H195 E219 T221	I171-Y197 HydrophobicContact CG2-CE2 4.02Å; V172-Y197 PolarHBondContact O-N 2.75Å; D173-Y197 HydrophobicContact CB-CD2 3.82Å; D173-Y197 WeakPolarHBondContact OD1-CB 3.42Å; L174-Y197 CarbonylContact C-O 3.17Å; L174-Y197 VanDerWaalsContact C-O 3.26Å; L174-Y197 WeakPolarHBondContact CA-O 3.44Å; L174-Y197 WeakPolarHBondContact CB-O 3.39Å; L174-Y197 PolarHBondContact N-O 2.98Å; S175-Y197 PolarHBondContact N-O 3.49Å; S175-Y197 VanDerWaalsContact N-O 3.12Å; H195-Y197 HydrophobicContact CB-CE2 4.04Å; H195-Y197 PolarHBondContact CD2-OH 2.84Å; Y197-E219 WeakPolarHBondContact CE1-OE1 3.23Å; Y197-T221 VanDerWaalsContact CA-OG1 3.3Å; Y197-T221 WeakPolarHBondContact CA-OG1 3.5Å; Y197-T221 HydrophobicContact CD1-CG2 3.6Å; Y197-T221 HydrophobicContact CE1-CG2 4.1Å
198	L	98.6	Very high	96.6	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	20%	0.195	C	C	.	.			trans	-118.8	8	179.3	-65	171.2	0	0	0	113.5	L174 L179 L196 N201 F203 F211 I220 T221 L222 N225	L174-L198 HydrophobicContact CB-CD2 3.98Å; L174-L198 HydrophobicContact CD1-CD2 4.02Å; L179-L198 HydrophobicContact CD1-CD2 4.37Å; L196-L198 HydrophobicContact CD1-CD2 4.27Å; L196-L198 HydrophobicContact CD1-CG 4.19Å; L196-L198 HydrophobicContact CD2-CD1 3.98Å; L196-L198 HydrophobicContact CD2-CG 4.44Å; L196-L198 HydrophobicContact CG-CD1 4.08Å; L196-L198 HydrophobicContact CG-CG 4Å; L198-N201 PolarHBondContact O-ND2 3.01Å; L198-F203 HydrophobicContact CB-CE2 4.23Å; L198-F203 HydrophobicContact CD2-CE2 3.96Å; L198-F203 HydrophobicContact CD2-CZ 4.24Å; L198-F211 HydrophobicContact CD1-CE1 4.3Å; L198-F211 HydrophobicContact CD1-CZ 4.04Å; L198-I220 HydrophobicContact CD1-CD1 4.4Å; L198-T221 CarbonylContact C-O 3.12Å; L198-T221 WeakPolarHBondContact CA-O 3.06Å; L198-T221 WeakPolarHBondContact CB-O 3.22Å; L198-T221 PolarHBondContact N-O 3Å; L198-T221 VanDerWaalsContact N-O 3.11Å; L198-T221 PolarHBondContact N-OG1 3.07Å; L198-L222 HydrophobicContact CB-CD2 4.27Å; L198-L222 HydrophobicContact CD1-CD2 4.2Å; L198-N225 PolarHBondContact O-ND2 3Å
199	H	98.4	Very high	96.7	Very high	21 Å²	21	40.6 Å²	40.6	10%	0.097	21%	0.206	C	C	.	.			trans	-67.6	161.1	-178.2	71.7	88.4	0	0	0	112.9	S175 N176 N201 T221 Y223	S175-H199 VanDerWaalsContact CA-O 3.25Å; S175-H199 WeakPolarHBondContact CA-O 3.36Å; S175-H199 VanDerWaalsContact CB-CD2 3.43Å; S175-H199 WeakPolarHBondContact CB-CD2 3.49Å; S175-H199 VanDerWaalsContact CB-CE1 3.48Å; S175-H199 WeakPolarHBondContact CB-CE1 3.45Å; S175-H199 WeakPolarHBondContact CB-NE2 3.27Å; N176-H199 PolarHBondContact N-O 2.64Å; H199-N201 PolarHBondContact O-N 3.13Å; H199-N201 PolarHBondContact O-ND2 3.38Å; H199-T221 PolarHBondContact CD2-OG1 3.02Å; H199-T221 PolarHBondContact N-O 2.98Å; H199-T221 PolarHBondContact N-OG1 3.18Å; H199-Y223 VanDerWaalsContact CA-O 3.23Å; H199-Y223 WeakPolarHBondContact CA-O 3.39Å; H199-Y223 HydrophobicContact CB-CD1 3.6Å; H199-Y223 HydrophobicContact CB-CD2 3.85Å; H199-Y223 HydrophobicContact CB-CE1 3.39Å; H199-Y223 HydrophobicContact CB-CE2 3.66Å; H199-Y223 HydrophobicContact CB-CG 3.83Å; H199-Y223 VanDerWaalsContact CB-CZ 3.43Å; H199-Y223 WeakPolarHBondContact CB-O 3.44Å; H199-Y223 AromaticContact CD2-CE1 3.88Å; H199-Y223 AromaticContact CD2-CZ 3.73Å; H199-Y223 PolarHBondContact CD2-OH 3.38Å; H199-Y223 AromaticContact CE1-CZ 3.81Å; H199-Y223 PolarHBondContact CE1-OH 3.02Å; H199-Y223 AromaticContact CG-CE1 3.55Å; H199-Y223 AromaticContact CG-CE2 3.72Å; H199-Y223 AromaticContact CG-CZ 3.23Å; H199-Y223 VanDerWaalsContact CG-OH 3.28Å; H199-Y223 AromaticContact ND1-CE2 3.52Å; H199-Y223 AromaticContact ND1-CZ 3.3Å; H199-Y223 VanDerWaalsContact ND1-CZ 3.3Å; H199-Y223 PolarHBondContact ND1-OH 2.84Å; H199-Y223 PolarHBondContact NE2-OH 2.88Å
200	N	98.4	Very high	96.9	Very high	38 Å²	38	37.4 Å²	37.4	20%	0.203	19%	0.19	C	C	.	.	S	Bend	trans	55.7	48.3	-179.7	-57.6	-22	0	0	0	112.3	N176 N177 Y223 N224	N176-N200 VanDerWaalsContact CA-O 3.29Å; N176-N200 WeakPolarHBondContact CA-O 3.49Å; N176-N200 HydrophobicContact CB-CB 4.44Å; N176-N200 PolarHBondContact N-O 3.18Å; N176-N200 VanDerWaalsContact OD1-CB 3.31Å; N176-N200 WeakPolarHBondContact OD1-CB 3.31Å; N176-N200 PolarHBondContact OD1-ND2 3.19Å; N177-N200 PolarHBondContact N-O 3.04Å; N200-Y223 PolarHBondContact N-O 3.47Å; N200-Y223 VanDerWaalsContact N-O 3.1Å; N200-N224 VanDerWaalsContact CA-O 3.29Å; N200-N224 WeakPolarHBondContact CA-O 3.25Å; N200-N224 PolarHBondContact N-O 2.81Å; N200-N224 WeakPolarHBondContact OD1-CB 3.08Å; N200-N224 PolarHBondContact OD1-ND2 3.05Å
201	N	98.8	Very high	97	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.19	C	C	.	.	S	Bend	trans	-121.8	-163.4	176.4	-86.6	-67	0	0	0	110.4	L174 N177 L179 L198 H199 F203 N224 N225	L174-N201 PolarHBondContact O-ND2 3.13Å; N177-N201 VanDerWaalsContact CA-OD1 3.27Å; N177-N201 WeakPolarHBondContact CA-OD1 3.39Å; N177-N201 WeakPolarHBondContact CB-OD1 3.09Å; N177-N201 PolarHBondContact N-OD1 3.12Å; N177-N201 PolarHBondContact O-OD1 3.08Å; L179-N201 HydrophobicContact CB-CB 4.13Å; L179-N201 VanDerWaalsContact CB-OD1 3.27Å; L179-N201 WeakPolarHBondContact CB-OD1 3.28Å; L179-N201 VanDerWaalsContact CG-OD1 3.22Å; L179-N201 WeakPolarHBondContact CG-OD1 3.32Å; L179-N201 PolarHBondContact N-OD1 3.26Å; L198-N201 PolarHBondContact O-ND2 3.01Å; H199-N201 PolarHBondContact O-N 3.13Å; H199-N201 PolarHBondContact O-ND2 3.38Å; N201-F203 HydrophobicContact CB-CD2 3.79Å; N201-F203 HydrophobicContact CB-CE2 3.93Å; N201-N224 PolarHBondContact N-O 3.25Å; N201-N225 VanDerWaalsContact CA-OD1 3.28Å; N201-N225 WeakPolarHBondContact CA-OD1 3.38Å; N201-N225 WeakPolarHBondContact CB-OD1 3.5Å; N201-N225 PolarHBondContact N-OD1 3.29Å; N201-N225 PolarHBondContact O-OD1 3.07Å
202	K	97.9	Very high	97	Very high	84 Å²	84	38 Å²	38	37%	0.365	19%	0.19	S	C	.	.			trans	-122.6	23.9	-177.9	-53.7	-61.9	170.4	-156.2	0	112.2	L179 T180 T204 N225	L179-K202 CarbonylContact O-C 3.51Å; L179-K202 WeakPolarHBondContact O-CA 3.34Å; L179-K202 WeakPolarHBondContact O-CB 3.47Å; L179-K202 PolarHBondContact O-N 3.46Å; T180-K202 HydrophobicContact CG2-CB 3.99Å; K202-T204 PolarHBondContact O-N 3.31Å; K202-N225 PolarHBondContact N-OD1 3.06Å
203	F	97.4	Very high	97	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.			trans	-62.3	134	177.9	-69.7	-71.4	0	0	0	110.7	V161 L179 I182 L198 N201 I206 N225 R226 W227	V161-F203 HydrophobicContact CG2-CZ 3.97Å; L179-F203 HydrophobicContact CB-CD2 4.47Å; L179-F203 HydrophobicContact CB-CE1 4.17Å; L179-F203 HydrophobicContact CB-CE2 3.68Å; L179-F203 HydrophobicContact CB-CZ 3.5Å; L179-F203 VanDerWaalsContact CB-CZ 3.5Å; L179-F203 HydrophobicContact CD1-CE2 4.1Å; L179-F203 HydrophobicContact CD1-CZ 4.03Å; L179-F203 HydrophobicContact CG-CZ 4.38Å; L179-F203 PolarHBondContact O-N 3.06Å; L179-F203 VanDerWaalsContact O-N 3.13Å; I182-F203 HydrophobicContact CD1-CE1 4.38Å; I182-F203 HydrophobicContact CD1-CZ 4.5Å; I182-F203 HydrophobicContact CG1-CE1 3.67Å; I182-F203 HydrophobicContact CG1-CZ 4.08Å; L198-F203 HydrophobicContact CB-CE2 4.23Å; L198-F203 HydrophobicContact CD2-CE2 3.96Å; L198-F203 HydrophobicContact CD2-CZ 4.24Å; N201-F203 HydrophobicContact CB-CD2 3.79Å; N201-F203 HydrophobicContact CB-CE2 3.93Å; F203-I206 HydrophobicContact CD1-CD1 4.13Å; F203-I206 HydrophobicContact CE1-CD1 4.46Å; F203-I206 HydrophobicContact CG-CD1 4.34Å; F203-N225 HydrophobicContact CB-CB 4.3Å; F203-N225 WeakPolarHBondContact CD2-OD1 3.25Å; F203-N225 PolarHBondContact N-OD1 3.35Å; F203-N225 VanDerWaalsContact N-OD1 3.08Å; F203-R226 CarbonylContact O-C 3.55Å; F203-R226 WeakPolarHBondContact O-CA 3.06Å; F203-R226 PolarHBondContact O-N 2.85Å; F203-W227 HydrophobicContact CB-CE3 4.29Å; F203-W227 HydrophobicContact CB-CH2 3.56Å; F203-W227 HydrophobicContact CB-CZ2 4.32Å; F203-W227 HydrophobicContact CB-CZ3 3.54Å; F203-W227 HydrophobicContact CG-CH2 4.23Å; F203-W227 HydrophobicContact CG-CZ3 4.49Å; F203-W227 PolarHBondContact O-N 3Å
204	T	95.6	Very high	96.9	Very high	58 Å²	58	39.6 Å²	39.6	36%	0.356	20%	0.197	S	C	.	.	S	Bend	trans	-102.8	-28.5	170.6	54.3	0	0	0	0	111.5	K202 R226 W227 S228	K202-T204 PolarHBondContact O-N 3.31Å; T204-R226 WeakPolarHBondContact CA-O 3.05Å; T204-R226 HydrophobicContact CG2-CB 4.49Å; T204-W227 WeakPolarHBondContact O-CA 3.44Å; T204-S228 PolarHBondContact O-N 3.28Å
205	F	95.4	Very high	96.7	Very high	68 Å²	68	45.5 Å²	45.5	30%	0.298	22%	0.221	S	C	.	.			trans	-155.6	170.4	173.8	69.8	-83.5	0	0	0	110.8	P207 N234	F205-P207 HydrophobicContact CE2-CG 4.22Å; F205-N234 HydrophobicContact CB-CB 3.79Å; F205-N234 VanDerWaalsContact CB-O 3.31Å; F205-N234 WeakPolarHBondContact CB-O 3.4Å; F205-N234 HydrophobicContact CD1-CB 4.47Å; F205-N234 HydrophobicContact CG-CB 4.12Å
206	I	95.8	Very high	96.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.234	C	C	.	.			trans	-114.9	127.5	169.8	-61.1	-59.1	0	0	0	107.2	I182 F203 F211 W227 Y237 L238	I182-I206 HydrophobicContact CD1-CD1 3.85Å; I182-I206 HydrophobicContact CD1-CG2 4.44Å; I182-I206 HydrophobicContact CG1-CD1 4.39Å; F203-I206 HydrophobicContact CD1-CD1 4.13Å; F203-I206 HydrophobicContact CE1-CD1 4.46Å; F203-I206 HydrophobicContact CG-CD1 4.34Å; I206-F211 HydrophobicContact CB-CE2 4.29Å; I206-F211 HydrophobicContact CB-CZ 4.45Å; I206-F211 HydrophobicContact CD1-CE2 4.42Å; I206-F211 HydrophobicContact CD1-CZ 3.91Å; I206-F211 HydrophobicContact CG1-CE2 3.92Å; I206-F211 HydrophobicContact CG1-CZ 3.93Å; I206-F211 HydrophobicContact CG2-CD2 4.19Å; I206-F211 HydrophobicContact CG2-CE1 4.25Å; I206-F211 HydrophobicContact CG2-CE2 3.69Å; I206-F211 HydrophobicContact CG2-CZ 3.72Å; I206-W227 HydrophobicContact CD1-CH2 3.88Å; I206-W227 HydrophobicContact CD1-CZ3 4.02Å; I206-W227 HydrophobicContact CG1-CH2 3.92Å; I206-W227 HydrophobicContact CG1-CZ3 3.84Å; I206-Y237 HydrophobicContact CB-CD1 4.44Å; I206-Y237 HydrophobicContact CG2-CD1 4.18Å; I206-Y237 HydrophobicContact CG2-CE1 3.85Å; I206-L238 HydrophobicContact CB-CD1 4.49Å; I206-L238 HydrophobicContact CG1-CD1 4.06Å; I206-L238 HydrophobicContact CG1-CD2 4.18Å
207	P	94.9	Very high	96.6	Very high	23 Å²	23	48.7 Å²	48.7	15%	0.149	24%	0.237	C	C	.	.			trans	-59.8	148.2	176.4	-17.4	26.4	0	0	0	111.8	I182 F205 S210 Y237	I182-P207 HydrophobicContact CB-CG 4.47Å; I182-P207 VanDerWaalsContact O-CG 3.28Å; I182-P207 WeakPolarHBondContact O-CG 3.39Å; F205-P207 HydrophobicContact CE2-CG 4.22Å; P207-S210 VanDerWaalsContact O-CB 3.25Å; P207-S210 WeakPolarHBondContact O-CB 3.11Å; P207-S210 PolarHBondContact O-N 3.25Å; P207-S210 PolarHBondContact O-OG 3.1Å; P207-Y237 WeakPolarHBondContact O-CD1 3.35Å; P207-Y237 WeakPolarHBondContact O-CE1 3.37Å
208	D	93.8	Very high	96.6	Very high	112 Å²	112	51.9 Å²	51.9	60%	0.599	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	142.6	177	-66.2	10.9	0	0	0	111.5	S210 Y237	D208-S210 PolarHBondContact O-N 3.43Å; D208-S210 VanDerWaalsContact O-N 3.1Å; D208-Y237 HydrophobicContact CB-CD2 4.36Å; D208-Y237 HydrophobicContact CB-CG 4.4Å; D208-Y237 WeakPolarHBondContact OD1-CB 3.5Å
209	Q	94.2	Very high	96.6	Very high	148 Å²	148	53.7 Å²	53.7	69%	0.692	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	4	178.3	-50.3	173.6	-20.7	0	0	115.9	F211 D212 Y237	Q209-F211 PolarHBondContact O-N 3.22Å; Q209-F211 VanDerWaalsContact O-N 3.15Å; Q209-D212 VanDerWaalsContact CA-CG 3.48Å; Q209-D212 WeakPolarHBondContact CA-OD1 3.12Å; Q209-D212 WeakPolarHBondContact CA-OD2 3.44Å; Q209-D212 WeakPolarHBondContact CB-OD2 3.22Å; Q209-D212 WeakPolarHBondContact CG-OD2 3.37Å; Q209-D212 PolarHBondContact O-N 3.38Å; Q209-Y237 WeakPolarHBondContact CA-OH 3.41Å
210	S	95.8	Very high	96.6	Very high	13 Å²	13	52.7 Å²	52.7	9%	0.091	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-29.9	-177.3	-66.1	0	0	0	0	114.1	L187 P207 D208 Y237	L187-S210 WeakPolarHBondContact CB-O 3.07Å; P207-S210 VanDerWaalsContact O-CB 3.25Å; P207-S210 WeakPolarHBondContact O-CB 3.11Å; P207-S210 PolarHBondContact O-N 3.25Å; P207-S210 PolarHBondContact O-OG 3.1Å; D208-S210 PolarHBondContact O-N 3.43Å; D208-S210 VanDerWaalsContact O-N 3.1Å; S210-Y237 PolarHBondContact N-OH 3.12Å
211	F	96.6	Very high	96.6	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.009	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	2.2	-175.6	-57.8	-32.8	0	0	0	114	I182 L187 L196 L198 I206 Q209 Q213 L214 I220 Y237 L238 W241	I182-F211 HydrophobicContact CD1-CE1 3.91Å; I182-F211 HydrophobicContact CD1-CZ 4.21Å; L187-F211 HydrophobicContact CD1-CD1 3.85Å; L187-F211 HydrophobicContact CD1-CE1 3.74Å; L196-F211 HydrophobicContact CD2-CE1 4.23Å; L198-F211 HydrophobicContact CD1-CE1 4.3Å; L198-F211 HydrophobicContact CD1-CZ 4.04Å; I206-F211 HydrophobicContact CB-CE2 4.29Å; I206-F211 HydrophobicContact CB-CZ 4.45Å; I206-F211 HydrophobicContact CD1-CE2 4.42Å; I206-F211 HydrophobicContact CD1-CZ 3.91Å; I206-F211 HydrophobicContact CG1-CE2 3.92Å; I206-F211 HydrophobicContact CG1-CZ 3.93Å; I206-F211 HydrophobicContact CG2-CD2 4.19Å; I206-F211 HydrophobicContact CG2-CE1 4.25Å; I206-F211 HydrophobicContact CG2-CE2 3.69Å; I206-F211 HydrophobicContact CG2-CZ 3.72Å; Q209-F211 PolarHBondContact O-N 3.22Å; Q209-F211 VanDerWaalsContact O-N 3.15Å; F211-Q213 VanDerWaalsContact C-N 3.29Å; F211-Q213 PolarHBondContact O-N 2.87Å; F211-L214 HydrophobicContact CB-CD1 4.1Å; F211-L214 HydrophobicContact CD1-CD1 3.79Å; F211-L214 HydrophobicContact CG-CD1 4.29Å; F211-L214 WeakPolarHBondContact O-CB 3.34Å; F211-L214 PolarHBondContact O-N 2.86Å; F211-L214 VanDerWaalsContact O-N 3.13Å; F211-I220 HydrophobicContact CD2-CD1 4.49Å; F211-I220 HydrophobicContact CE1-CD1 4.4Å; F211-I220 HydrophobicContact CE2-CD1 4.02Å; F211-I220 HydrophobicContact CZ-CD1 3.98Å; F211-Y237 HydrophobicContact CD2-CE1 4.49Å; F211-Y237 PolarHBondContact N-OH 2.87Å; F211-L238 HydrophobicContact CE2-CD1 3.99Å; F211-W241 HydrophobicContact CB-CD2 4.11Å; F211-W241 VanDerWaalsContact CB-CE2 3.47Å; F211-W241 HydrophobicContact CB-CG 4.42Å; F211-W241 HydrophobicContact CB-CZ2 3.75Å; F211-W241 AromaticContact CD2-CD2 3.93Å; F211-W241 HydrophobicContact CD2-CD2 3.93Å; F211-W241 AromaticContact CD2-CE3 3.98Å; F211-W241 HydrophobicContact CD2-CE3 3.98Å; F211-W241 HydrophobicContact CD2-CH2 4.25Å; F211-W241 HydrophobicContact CD2-CZ2 4.19Å; F211-W241 HydrophobicContact CD2-CZ3 4.14Å; F211-W241 HydrophobicContact CG-CZ2 4.26Å
212	D	95.3	Very high	96.5	Very high	64 Å²	64	51.1 Å²	51.1	34%	0.342	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-29	-168.2	-69.8	12	0	0	0	113.1	Q209 F215 Y237	Q209-D212 VanDerWaalsContact CA-CG 3.48Å; Q209-D212 WeakPolarHBondContact CA-OD1 3.12Å; Q209-D212 WeakPolarHBondContact CA-OD2 3.44Å; Q209-D212 WeakPolarHBondContact CB-OD2 3.22Å; Q209-D212 WeakPolarHBondContact CG-OD2 3.37Å; Q209-D212 PolarHBondContact O-N 3.38Å; D212-F215 WeakPolarHBondContact O-CE1 3.44Å; D212-Y237 WeakPolarHBondContact OD1-CE2 3.25Å; D212-Y237 PolarHBondContact OD1-OH 3.16Å
213	Q	95.9	Very high	96.5	Very high	73 Å²	73	51.3 Å²	51.3	34%	0.341	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-0.4	179.3	-59.5	-56.4	-59.9	0	0	114	I188 F211 F215	I188-Q213 HydrophobicContact CG1-CB 4.45Å; I188-Q213 HydrophobicContact CG1-CG 3.56Å; I188-Q213 WeakPolarHBondContact O-CB 3.5Å; F211-Q213 VanDerWaalsContact C-N 3.29Å; F211-Q213 PolarHBondContact O-N 2.87Å; Q213-F215 HydrophobicContact CB-CE2 4.32Å; Q213-F215 VanDerWaalsContact O-CD2 3.27Å; Q213-F215 WeakPolarHBondContact O-CD2 3.21Å; Q213-F215 PolarHBondContact O-N 2.69Å; Q213-F215 VanDerWaalsContact OE1-CE2 3.28Å; Q213-F215 VanDerWaalsContact OE1-CZ 3.29Å
214	L	96.8	Very high	96.4	Very high	10 Å²	10	56.7 Å²	56.7	5%	0.052	28%	0.276	C	S	.	.			trans	-82.4	56.9	-178.5	-54.4	-177.6	0	0	0	110.7	L187 L190 L193 L196 F211 Q216 L217	L187-L214 HydrophobicContact CB-CD2 4.5Å; L190-L214 HydrophobicContact CB-CD2 3.98Å; L190-L214 WeakPolarHBondContact O-CD2 3.28Å; L193-L214 HydrophobicContact CB-CD2 4.28Å; L193-L214 HydrophobicContact CD2-CD1 4.46Å; L193-L214 HydrophobicContact CD2-CD2 4.11Å; L196-L214 HydrophobicContact CD2-CD1 4.09Å; F211-L214 HydrophobicContact CB-CD1 4.1Å; F211-L214 HydrophobicContact CD1-CD1 3.79Å; F211-L214 HydrophobicContact CG-CD1 4.29Å; F211-L214 WeakPolarHBondContact O-CB 3.34Å; F211-L214 PolarHBondContact O-N 2.86Å; F211-L214 VanDerWaalsContact O-N 3.13Å; L214-Q216 PolarHBondContact O-N 2.87Å; L214-L217 HydrophobicContact CB-CB 4.05Å; L214-L217 HydrophobicContact CB-CD2 4.27Å; L214-L217 HydrophobicContact CD1-CD2 4.17Å; L214-L217 VanDerWaalsContact O-CB 3.23Å; L214-L217 WeakPolarHBondContact O-CB 3.48Å; L214-L217 PolarHBondContact O-N 3.33Å; L214-L217 VanDerWaalsContact O-N 3.15Å
215	F	94.4	Very high	96.5	Very high	142 Å²	142	54.9 Å²	54.9	62%	0.623	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.1	-171.3	-54.1	-60.7	0	0	0	114.1	D212 Q213	D212-F215 WeakPolarHBondContact O-CE1 3.44Å; Q213-F215 HydrophobicContact CB-CE2 4.32Å; Q213-F215 VanDerWaalsContact O-CD2 3.27Å; Q213-F215 WeakPolarHBondContact O-CD2 3.21Å; Q213-F215 PolarHBondContact O-N 2.69Å; Q213-F215 VanDerWaalsContact OE1-CE2 3.28Å; Q213-F215 VanDerWaalsContact OE1-CZ 3.29Å
216	Q	97.3	Very high	96.5	Very high	99 Å²	99	60 Å²	60	46%	0.463	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	7.4	179.7	-63	-169.4	-1.1	0	0	113.2	T191 L193 L214 Q218	T191-Q216 WeakPolarHBondContact O-CG 3.48Å; L193-Q216 CarbonylContact O-C 3.02Å; L214-Q216 PolarHBondContact O-N 2.87Å; Q216-Q218 PolarHBondContact O-N 3.1Å
217	L	98.3	Very high	96.4	Very high	12 Å²	12	61.4 Å²	61.4	6%	0.063	29%	0.287	C	S	.	.			trans	-65.2	125.5	-176	-162.9	70.2	0	0	0	110.5	L193 L196 L214 I220 W241 A247	L193-L217 HydrophobicContact CD2-CD1 4.4Å; L193-L217 HydrophobicContact CG-CD1 4.39Å; L193-L217 VanDerWaalsContact O-CA 3.29Å; L193-L217 WeakPolarHBondContact O-CA 3.3Å; L193-L217 PolarHBondContact O-N 3.09Å; L193-L217 VanDerWaalsContact O-N 3.15Å; L196-L217 HydrophobicContact CB-CD1 3.97Å; L214-L217 HydrophobicContact CB-CB 4.05Å; L214-L217 HydrophobicContact CB-CD2 4.27Å; L214-L217 HydrophobicContact CD1-CD2 4.17Å; L214-L217 VanDerWaalsContact O-CB 3.23Å; L214-L217 WeakPolarHBondContact O-CB 3.48Å; L214-L217 PolarHBondContact O-N 3.33Å; L214-L217 VanDerWaalsContact O-N 3.15Å; L217-I220 HydrophobicContact CD2-CB 4.12Å; L217-I220 HydrophobicContact CD2-CD1 4.4Å; L217-I220 HydrophobicContact CD2-CG2 4.5Å; L217-W241 HydrophobicContact CD2-CH2 3.81Å; L217-W241 HydrophobicContact CD2-CZ2 3.88Å; L217-A247 HydrophobicContact CB-CB 4.16Å; L217-A247 HydrophobicContact CD2-CB 4.12Å; L217-A247 HydrophobicContact CG-CB 4.03Å; L217-A247 WeakPolarHBondContact O-CB 3.4Å
218	Q	98.3	Very high	96.3	Very high	120 Å²	120	61.6 Å²	61.6	56%	0.561	29%	0.289	S	S	*	.			trans	-105	-39.8	179.3	-63.4	179.4	0.5	0	0	110.7	T194 Q216 A247 Q248	T194-Q218 WeakPolarHBondContact O-CA 3.22Å; T194-Q218 WeakPolarHBondContact O-CB 3.36Å; T194-Q218 PolarHBondContact O-N 3.2Å; Q216-Q218 PolarHBondContact O-N 3.1Å; Q218-A247 CarbonylContact O-C 3.52Å; Q218-Q248 WeakPolarHBondContact O-CB 3.36Å; Q218-Q248 PolarHBondContact O-N 3.44Å
219	E	98.6	Very high	96.1	Very high	40 Å²	40	57.5 Å²	57.5	19%	0.187	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	137	-178.9	-170.3	174.7	117.9	0	0	111.9	T194 H195 L196 Y197 Q248 I250	T194-E219 PolarHBondContact O-N 3.36Å; H195-E219 WeakPolarHBondContact CA-O 3.15Å; L196-E219 PolarHBondContact N-O 3.27Å; Y197-E219 WeakPolarHBondContact CE1-OE1 3.23Å; E219-Q248 WeakPolarHBondContact CA-O 3.48Å; E219-I250 VanDerWaalsContact CD-CD1 3.44Å; E219-I250 HydrophobicContact CG-CD1 3.87Å; E219-I250 HydrophobicContact CG-CG1 4.32Å; E219-I250 WeakPolarHBondContact OE1-CD1 3.42Å
220	I	98.4	Very high	95.8	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	134.2	169.6	-169.2	172.8	0	0	0	110.6	L196 L198 F211 L217 L222 W241 Q248 V249 I250	L196-I220 HydrophobicContact CB-CG1 4.32Å; L196-I220 HydrophobicContact CD2-CD1 4.15Å; L196-I220 HydrophobicContact CG-CG1 4.44Å; L196-I220 VanDerWaalsContact O-CA 3.31Å; L196-I220 WeakPolarHBondContact O-CA 3.26Å; L196-I220 WeakPolarHBondContact O-CG1 2.96Å; L198-I220 HydrophobicContact CD1-CD1 4.4Å; F211-I220 HydrophobicContact CD2-CD1 4.49Å; F211-I220 HydrophobicContact CE1-CD1 4.4Å; F211-I220 HydrophobicContact CE2-CD1 4.02Å; F211-I220 HydrophobicContact CZ-CD1 3.98Å; L217-I220 HydrophobicContact CD2-CB 4.12Å; L217-I220 HydrophobicContact CD2-CD1 4.4Å; L217-I220 HydrophobicContact CD2-CG2 4.5Å; I220-L222 HydrophobicContact CD1-CD2 4Å; I220-L222 HydrophobicContact CD1-CG 4.35Å; I220-L222 HydrophobicContact CG1-CD2 4.12Å; I220-L222 HydrophobicContact CG1-CG 4.21Å; I220-W241 HydrophobicContact CD1-CH2 4.16Å; I220-W241 HydrophobicContact CD1-CZ3 4.42Å; I220-W241 HydrophobicContact CG2-CH2 3.94Å; I220-W241 HydrophobicContact CG2-CZ3 4.11Å; I220-Q248 PolarHBondContact N-O 2.88Å; I220-V249 HydrophobicContact CG2-CB 4.17Å; I220-V249 HydrophobicContact CG2-CG1 4.16Å; I220-V249 HydrophobicContact CG2-CG2 3.77Å; I220-V249 WeakPolarHBondContact O-CA 3.24Å; I220-I250 PolarHBondContact O-N 3.34Å
221	T	98.4	Very high	95.3	Very high	5 Å²	5	62.3 Å²	62.3	3%	0.031	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.7	174.7	64.2	0	0	0	0	110.8	L196 Y197 L198 H199 Y223 I250	L196-T221 PolarHBondContact O-N 3.1Å; Y197-T221 VanDerWaalsContact CA-OG1 3.3Å; Y197-T221 WeakPolarHBondContact CA-OG1 3.5Å; Y197-T221 HydrophobicContact CD1-CG2 3.6Å; Y197-T221 HydrophobicContact CE1-CG2 4.1Å; L198-T221 CarbonylContact C-O 3.12Å; L198-T221 WeakPolarHBondContact CA-O 3.06Å; L198-T221 WeakPolarHBondContact CB-O 3.22Å; L198-T221 PolarHBondContact N-O 3Å; L198-T221 VanDerWaalsContact N-O 3.11Å; L198-T221 PolarHBondContact N-OG1 3.07Å; H199-T221 PolarHBondContact CD2-OG1 3.02Å; H199-T221 PolarHBondContact N-O 2.98Å; H199-T221 PolarHBondContact N-OG1 3.18Å; T221-Y223 HydrophobicContact CG2-CE1 4.01Å; T221-I250 CarbonylContact C-O 3.59Å; T221-I250 WeakPolarHBondContact CA-O 3.4Å; T221-I250 HydrophobicContact CG2-CB 4.01Å; T221-I250 HydrophobicContact CG2-CD1 4.21Å; T221-I250 HydrophobicContact CG2-CG2 4.43Å
222	L	97.4	Very high	94.7	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	33%	0.328	C	S	.	.			trans	-126	-1.5	-176.7	-64.5	177	0	0	0	113.6	L198 I220 N225 W227 L238 M242 V249 I250 P253	L198-L222 HydrophobicContact CB-CD2 4.27Å; L198-L222 HydrophobicContact CD1-CD2 4.2Å; I220-L222 HydrophobicContact CD1-CD2 4Å; I220-L222 HydrophobicContact CD1-CG 4.35Å; I220-L222 HydrophobicContact CG1-CD2 4.12Å; I220-L222 HydrophobicContact CG1-CG 4.21Å; L222-N225 PolarHBondContact O-ND2 2.9Å; L222-N225 VanDerWaalsContact O-ND2 3.16Å; L222-W227 HydrophobicContact CB-CZ2 3.94Å; L222-W227 HydrophobicContact CD2-CH2 4.24Å; L222-W227 HydrophobicContact CD2-CZ2 4.02Å; L222-W227 HydrophobicContact CG-CZ2 4.46Å; L222-W227 PolarHBondContact O-NE1 3.28Å; L222-W227 VanDerWaalsContact O-NE1 3.08Å; L222-L238 HydrophobicContact CD1-CD1 3.97Å; L222-M242 HydrophobicContact CD1-SD 4.41Å; L222-V249 HydrophobicContact CD1-CG1 3.9Å; L222-V249 HydrophobicContact CG-CG1 4.5Å; L222-I250 PolarHBondContact N-O 2.67Å; L222-P253 HydrophobicContact CB-CG 3.89Å; L222-P253 HydrophobicContact CD1-CG 3.98Å
223	Y	96.8	Very high	94.1	Very high	89 Å²	89	75.1 Å²	75.1	35%	0.349	35%	0.35	S	S	.	.			trans	-63.7	158	-178.8	66	-90.5	0	0	0	113	H199 N200 T221 N225 I250	H199-Y223 VanDerWaalsContact CA-O 3.23Å; H199-Y223 WeakPolarHBondContact CA-O 3.39Å; H199-Y223 HydrophobicContact CB-CD1 3.6Å; H199-Y223 HydrophobicContact CB-CD2 3.85Å; H199-Y223 HydrophobicContact CB-CE1 3.39Å; H199-Y223 HydrophobicContact CB-CE2 3.66Å; H199-Y223 HydrophobicContact CB-CG 3.83Å; H199-Y223 VanDerWaalsContact CB-CZ 3.43Å; H199-Y223 WeakPolarHBondContact CB-O 3.44Å; H199-Y223 AromaticContact CD2-CE1 3.88Å; H199-Y223 AromaticContact CD2-CZ 3.73Å; H199-Y223 PolarHBondContact CD2-OH 3.38Å; H199-Y223 AromaticContact CE1-CZ 3.81Å; H199-Y223 PolarHBondContact CE1-OH 3.02Å; H199-Y223 AromaticContact CG-CE1 3.55Å; H199-Y223 AromaticContact CG-CE2 3.72Å; H199-Y223 AromaticContact CG-CZ 3.23Å; H199-Y223 VanDerWaalsContact CG-OH 3.28Å; H199-Y223 AromaticContact ND1-CE2 3.52Å; H199-Y223 AromaticContact ND1-CZ 3.3Å; H199-Y223 VanDerWaalsContact ND1-CZ 3.3Å; H199-Y223 PolarHBondContact ND1-OH 2.84Å; H199-Y223 PolarHBondContact NE2-OH 2.88Å; N200-Y223 PolarHBondContact N-O 3.47Å; N200-Y223 VanDerWaalsContact N-O 3.1Å; T221-Y223 HydrophobicContact CG2-CE1 4.01Å; Y223-N225 PolarHBondContact O-N 2.91Å; Y223-N225 PolarHBondContact O-ND2 3.22Å; Y223-I250 HydrophobicContact CD1-CG2 4Å; Y223-I250 HydrophobicContact CE1-CG2 4.17Å; Y223-I250 PolarHBondContact N-O 3.3Å
224	N	96.8	Very high	93.7	Very high	112 Å²	112	74.5 Å²	74.5	60%	0.599	35%	0.349	S	S	*	.	S	Bend	trans	53.1	51.3	-179.7	-163.5	24.1	0	0	0	113.5	N200 N201	N200-N224 VanDerWaalsContact CA-O 3.29Å; N200-N224 WeakPolarHBondContact CA-O 3.25Å; N200-N224 PolarHBondContact N-O 2.81Å; N200-N224 WeakPolarHBondContact OD1-CB 3.08Å; N200-N224 PolarHBondContact OD1-ND2 3.05Å; N201-N224 PolarHBondContact N-O 3.25Å
225	N	97.1	Very high	93.4	Very high	20 Å²	20	74.1 Å²	74.1	11%	0.107	35%	0.347	C	S	.	.	S	Bend	trans	-120.9	166.7	166.9	-83.6	-71.8	0	0	0	108.7	L198 N201 K202 F203 L222 Y223 W227	L198-N225 PolarHBondContact O-ND2 3Å; N201-N225 VanDerWaalsContact CA-OD1 3.28Å; N201-N225 WeakPolarHBondContact CA-OD1 3.38Å; N201-N225 WeakPolarHBondContact CB-OD1 3.5Å; N201-N225 PolarHBondContact N-OD1 3.29Å; N201-N225 PolarHBondContact O-OD1 3.07Å; K202-N225 PolarHBondContact N-OD1 3.06Å; F203-N225 HydrophobicContact CB-CB 4.3Å; F203-N225 WeakPolarHBondContact CD2-OD1 3.25Å; F203-N225 PolarHBondContact N-OD1 3.35Å; F203-N225 VanDerWaalsContact N-OD1 3.08Å; L222-N225 PolarHBondContact O-ND2 2.9Å; L222-N225 VanDerWaalsContact O-ND2 3.16Å; Y223-N225 PolarHBondContact O-N 2.91Å; Y223-N225 PolarHBondContact O-ND2 3.22Å; N225-W227 HydrophobicContact CB-CD2 4.08Å; N225-W227 VanDerWaalsContact CB-CE2 3.44Å; N225-W227 HydrophobicContact CB-CG 4.45Å; N225-W227 HydrophobicContact CB-CH2 4.35Å; N225-W227 HydrophobicContact CB-CZ2 3.59Å; N225-W227 PolarHBondContact O-N 3.36Å
226	R	94.6	Very high	93.3	Very high	176 Å²	176	70.6 Å²	70.6	66%	0.664	34%	0.337	S	S	*	.			trans	-99.3	51.4	-174.7	-64.9	-173.8	174.4	-177.2	-1.8	111.7	F203 T204 S228	F203-R226 CarbonylContact O-C 3.55Å; F203-R226 WeakPolarHBondContact O-CA 3.06Å; F203-R226 PolarHBondContact O-N 2.85Å; T204-R226 WeakPolarHBondContact CA-O 3.05Å; T204-R226 HydrophobicContact CG2-CB 4.49Å; R226-S228 PolarHBondContact O-N 3.48Å
227	W	94.4	Very high	93.2	Very high	30 Å²	30	67.1 Å²	67.1	11%	0.114	32%	0.32	C	S	.	.			trans	-53	123.8	-175.6	-56.7	115.4	0	0	0	111.8	F203 T204 I206 L222 N225 C229 I235 L238 P253	F203-W227 HydrophobicContact CB-CE3 4.29Å; F203-W227 HydrophobicContact CB-CH2 3.56Å; F203-W227 HydrophobicContact CB-CZ2 4.32Å; F203-W227 HydrophobicContact CB-CZ3 3.54Å; F203-W227 HydrophobicContact CG-CH2 4.23Å; F203-W227 HydrophobicContact CG-CZ3 4.49Å; F203-W227 PolarHBondContact O-N 3Å; T204-W227 WeakPolarHBondContact O-CA 3.44Å; I206-W227 HydrophobicContact CD1-CH2 3.88Å; I206-W227 HydrophobicContact CD1-CZ3 4.02Å; I206-W227 HydrophobicContact CG1-CH2 3.92Å; I206-W227 HydrophobicContact CG1-CZ3 3.84Å; L222-W227 HydrophobicContact CB-CZ2 3.94Å; L222-W227 HydrophobicContact CD2-CH2 4.24Å; L222-W227 HydrophobicContact CD2-CZ2 4.02Å; L222-W227 HydrophobicContact CG-CZ2 4.46Å; L222-W227 PolarHBondContact O-NE1 3.28Å; L222-W227 VanDerWaalsContact O-NE1 3.08Å; N225-W227 HydrophobicContact CB-CD2 4.08Å; N225-W227 VanDerWaalsContact CB-CE2 3.44Å; N225-W227 HydrophobicContact CB-CG 4.45Å; N225-W227 HydrophobicContact CB-CH2 4.35Å; N225-W227 HydrophobicContact CB-CZ2 3.59Å; N225-W227 PolarHBondContact O-N 3.36Å; W227-C229 VanDerWaalsContact C-N 3.29Å; W227-C229 PolarHBondContact O-N 3.24Å; W227-C229 PolarHBondContact O-SG 3.21Å; W227-I235 HydrophobicContact CB-CD1 4.19Å; W227-I235 HydrophobicContact CE3-CD1 4.28Å; W227-L238 HydrophobicContact CD2-CD2 4.23Å; W227-L238 HydrophobicContact CE3-CD2 3.87Å; W227-L238 HydrophobicContact CH2-CD2 4.01Å; W227-L238 HydrophobicContact CZ2-CD2 4.34Å; W227-L238 HydrophobicContact CZ3-CD2 3.76Å; W227-P253 HydrophobicContact CD2-CB 4.16Å; W227-P253 HydrophobicContact CG-CB 3.94Å; W227-P253 HydrophobicContact CZ2-CG 4.44Å
228	S	92.5	Very high	93	Very high	27 Å²	27	66.6 Å²	66.6	19%	0.189	32%	0.317	C	S	.	.			trans	-82.9	75.7	-179.3	-171.5	0	0	0	0	109.7	T204 R226 D230 H231	T204-S228 PolarHBondContact O-N 3.28Å; R226-S228 PolarHBondContact O-N 3.48Å; S228-D230 VanDerWaalsContact C-N 3.26Å; S228-D230 PolarHBondContact O-N 3.42Å; S228-H231 PolarHBondContact O-N 2.7Å; S228-H231 PolarHBondContact OG-ND1 3.12Å
229	C	90.1	Very high	92.8	Very high	26 Å²	26	61 Å²	61	18%	0.176	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-29.5	-175.8	-53.5	0	0	0	0	112.4	W227 H231 C254 Q257	W227-C229 VanDerWaalsContact C-N 3.29Å; W227-C229 PolarHBondContact O-N 3.24Å; W227-C229 PolarHBondContact O-SG 3.21Å; C229-H231 PolarHBondContact O-N 2.03Å; C229-C254 WeakPolarHBondContact CA-SG 3.21Å; C229-C254 HydrophobicContact CB-CB 3.7Å; C229-C254 WeakPolarHBondContact CB-SG 3.49Å; C229-C254 WeakPolarHBondContact SG-CA 3.22Å; C229-C254 WeakPolarHBondContact SG-CB 3.43Å; C229-C254 CovalentContact SG-SG 2.02Å; C229-C254 PolarHBondContact SG-SG 2.93Å; C229-Q257 PolarHBondContact O-NE2 2.88Å; C229-Q257 PolarHBondContact O-OE1 3.38Å
230	D	87.8	Confident	92.6	Very high	150 Å²	150	64.9 Å²	64.9	80%	0.802	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.6	-176.8	-53.6	-40.4	0	0	0	112.8	S228	S228-D230 VanDerWaalsContact C-N 3.26Å; S228-D230 PolarHBondContact O-N 3.42Å
231	H	86.3	Confident	92.4	Very high	112 Å²	112	66 Å²	66	52%	0.519	31%	0.312	S	S	.	.			trans	-101.7	93.3	-178.8	-63.5	86.8	0	0	0	110.8	S228 C229 Q233 N234 I235	S228-H231 PolarHBondContact O-N 2.7Å; S228-H231 PolarHBondContact OG-ND1 3.12Å; C229-H231 PolarHBondContact O-N 2.03Å; H231-Q233 VanDerWaalsContact C-N 3.26Å; H231-Q233 PolarHBondContact O-N 2.74Å; H231-Q233 VanDerWaalsContact O-N 3.12Å; H231-N234 HydrophobicContact CB-CB 4.37Å; H231-N234 PolarHBondContact O-N 2.6Å; H231-I235 PolarHBondContact O-N 3.41Å
232	K	83.3	Confident	92.2	Very high	161 Å²	161	67.5 Å²	67.5	70%	0.7	32%	0.319	S	S	*	.	H	α-helix	trans	-50.1	-42.2	-176.2	-168.3	174.3	-177.8	179.6	0	113.4	N234 I235 T236	K232-N234 VanDerWaalsContact C-N 3.31Å; K232-N234 PolarHBondContact O-N 3.16Å; K232-I235 PolarHBondContact O-N 3.35Å; K232-T236 WeakPolarHBondContact O-CB 3.47Å; K232-T236 PolarHBondContact O-N 3.04Å; K232-T236 PolarHBondContact O-OG1 3.09Å
233	Q	83.8	Confident	92	Very high	174 Å²	174	71.7 Å²	71.7	81%	0.813	34%	0.34	S	S	*	.	H	α-helix	trans	-57.9	-42	-179.2	-71.2	173.2	-8.8	0	0	112.7	H231	H231-Q233 VanDerWaalsContact C-N 3.26Å; H231-Q233 PolarHBondContact O-N 2.74Å; H231-Q233 VanDerWaalsContact O-N 3.12Å
234	N	86.2	Confident	91.9	Very high	60 Å²	60	73.8 Å²	73.8	32%	0.321	35%	0.352	S	S	.	.	H	α-helix	trans	-74	-32.4	-174.9	-72.2	-6.2	0	0	0	112.5	F205 H231 K232	F205-N234 HydrophobicContact CB-CB 3.79Å; F205-N234 VanDerWaalsContact CB-O 3.31Å; F205-N234 WeakPolarHBondContact CB-O 3.4Å; F205-N234 HydrophobicContact CD1-CB 4.47Å; F205-N234 HydrophobicContact CG-CB 4.12Å; H231-N234 HydrophobicContact CB-CB 4.37Å; H231-N234 PolarHBondContact O-N 2.6Å; K232-N234 VanDerWaalsContact C-N 3.31Å; K232-N234 PolarHBondContact O-N 3.16Å
235	I	91.6	Very high	91.8	Very high	1 Å²	1	70.2 Å²	70.2	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-98.8	-16.7	-172.8	-154.6	74.3	0	0	0	114	W227 H231 K232 Y237 L238 L239 C254	W227-I235 HydrophobicContact CB-CD1 4.19Å; W227-I235 HydrophobicContact CE3-CD1 4.28Å; H231-I235 PolarHBondContact O-N 3.41Å; K232-I235 PolarHBondContact O-N 3.35Å; I235-Y237 VanDerWaalsContact C-N 3.33Å; I235-Y237 PolarHBondContact O-N 2.8Å; I235-L238 HydrophobicContact CD1-CD2 4.06Å; I235-L238 PolarHBondContact O-N 3.39Å; I235-L238 VanDerWaalsContact O-N 3.15Å; I235-L239 HydrophobicContact CG1-CD1 4.24Å; I235-L239 HydrophobicContact CG1-CD2 4.43Å; I235-L239 HydrophobicContact CG1-CG 3.98Å; I235-L239 HydrophobicContact CG2-CD1 3.95Å; I235-L239 HydrophobicContact CG2-CG 4.46Å; I235-L239 PolarHBondContact O-N 3.49Å; I235-C254 HydrophobicContact CG1-CB 4.41Å; I235-C254 VanDerWaalsContact CG1-SG 3.57Å
236	T	91.8	Very high	91.7	Very high	69 Å²	69	79.5 Å²	79.5	42%	0.423	37%	0.374	S	S	.	.	H	α-helix	trans	-55.9	-45.1	-172.8	-67.9	0	0	0	0	112.4	K232 L239 K240	K232-T236 WeakPolarHBondContact O-CB 3.47Å; K232-T236 PolarHBondContact O-N 3.04Å; K232-T236 PolarHBondContact O-OG1 3.09Å; T236-L239 PolarHBondContact O-N 3.29Å; T236-K240 WeakPolarHBondContact O-CB 3.38Å; T236-K240 PolarHBondContact O-N 3.3Å
237	Y	94.4	Very high	91.8	Very high	26 Å²	26	71.7 Å²	71.7	10%	0.102	35%	0.347	C	S	.	.	H	α-helix	trans	-57.8	-51.8	177.4	168	-104.4	0	0	0	112	I206 P207 D208 Q209 S210 F211 D212 I235 L239 K240 W241	I206-Y237 HydrophobicContact CB-CD1 4.44Å; I206-Y237 HydrophobicContact CG2-CD1 4.18Å; I206-Y237 HydrophobicContact CG2-CE1 3.85Å; P207-Y237 WeakPolarHBondContact O-CD1 3.35Å; P207-Y237 WeakPolarHBondContact O-CE1 3.37Å; D208-Y237 HydrophobicContact CB-CD2 4.36Å; D208-Y237 HydrophobicContact CB-CG 4.4Å; D208-Y237 WeakPolarHBondContact OD1-CB 3.5Å; Q209-Y237 WeakPolarHBondContact CA-OH 3.41Å; S210-Y237 PolarHBondContact N-OH 3.12Å; F211-Y237 HydrophobicContact CD2-CE1 4.49Å; F211-Y237 PolarHBondContact N-OH 2.87Å; D212-Y237 WeakPolarHBondContact OD1-CE2 3.25Å; D212-Y237 PolarHBondContact OD1-OH 3.16Å; I235-Y237 VanDerWaalsContact C-N 3.33Å; I235-Y237 PolarHBondContact O-N 2.8Å; Y237-L239 PolarHBondContact O-N 3.46Å; Y237-K240 PolarHBondContact O-N 3.19Å; Y237-W241 HydrophobicContact CE2-CB 4.5Å; Y237-W241 WeakPolarHBondContact O-CB 3.4Å; Y237-W241 PolarHBondContact O-N 3.34Å
238	L	95	Very high	92	Very high	0 Å²	0	76 Å²	76	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-61	-44.9	-177.3	-178.9	61	0	0	0	111.4	I206 F211 L222 W227 I235 W241 M242 P253	I206-L238 HydrophobicContact CB-CD1 4.49Å; I206-L238 HydrophobicContact CG1-CD1 4.06Å; I206-L238 HydrophobicContact CG1-CD2 4.18Å; F211-L238 HydrophobicContact CE2-CD1 3.99Å; L222-L238 HydrophobicContact CD1-CD1 3.97Å; W227-L238 HydrophobicContact CD2-CD2 4.23Å; W227-L238 HydrophobicContact CE3-CD2 3.87Å; W227-L238 HydrophobicContact CH2-CD2 4.01Å; W227-L238 HydrophobicContact CZ2-CD2 4.34Å; W227-L238 HydrophobicContact CZ3-CD2 3.76Å; I235-L238 HydrophobicContact CD1-CD2 4.06Å; I235-L238 PolarHBondContact O-N 3.39Å; I235-L238 VanDerWaalsContact O-N 3.15Å; L238-W241 HydrophobicContact CD1-CE3 4.49Å; L238-W241 PolarHBondContact O-N 3.23Å; L238-M242 HydrophobicContact CD1-CG 4.27Å; L238-M242 HydrophobicContact CD1-SD 4.27Å; L238-M242 HydrophobicContact CG-CG 4.46Å; L238-M242 HydrophobicContact CG-SD 3.98Å; L238-M242 WeakPolarHBondContact O-CB 3.46Å; L238-M242 WeakPolarHBondContact O-CG 3.38Å; L238-M242 PolarHBondContact O-N 3.37Å; L238-P253 HydrophobicContact CD2-CB 3.93Å; L238-P253 HydrophobicContact CD2-CG 4.12Å
239	L	93.5	Very high	92.2	Very high	4 Å²	4	76.5 Å²	76.5	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-64.4	-43.3	179.1	-65.9	-177.9	0	0	0	112	I235 T236 Y237 M242 M243 C254 Q257 I258 L261	I235-L239 HydrophobicContact CG1-CD1 4.24Å; I235-L239 HydrophobicContact CG1-CD2 4.43Å; I235-L239 HydrophobicContact CG1-CG 3.98Å; I235-L239 HydrophobicContact CG2-CD1 3.95Å; I235-L239 HydrophobicContact CG2-CG 4.46Å; I235-L239 PolarHBondContact O-N 3.49Å; T236-L239 PolarHBondContact O-N 3.29Å; Y237-L239 PolarHBondContact O-N 3.46Å; L239-M242 PolarHBondContact O-N 2.85Å; L239-M243 WeakPolarHBondContact O-CG 3.45Å; L239-M243 PolarHBondContact O-N 3.33Å; L239-C254 HydrophobicContact CD2-CB 4.35Å; L239-Q257 HydrophobicContact CD1-CB 4.03Å; L239-I258 HydrophobicContact CD2-CD1 4.01Å; L239-I258 HydrophobicContact CD2-CG1 3.74Å; L239-L261 HydrophobicContact CB-CD1 4.02Å; L239-L261 HydrophobicContact CD1-CD1 3.74Å
240	K	93.9	Very high	92.5	Very high	121 Å²	121	78 Å²	78	53%	0.526	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-49.9	176	-178.4	-177.8	174	-174.8	0	110.9	T236 Y237 M242 M243 E244	T236-K240 WeakPolarHBondContact O-CB 3.38Å; T236-K240 PolarHBondContact O-N 3.3Å; Y237-K240 PolarHBondContact O-N 3.19Å; K240-M242 VanDerWaalsContact C-N 3.29Å; K240-M242 PolarHBondContact O-N 2.59Å; K240-M243 WeakPolarHBondContact O-CB 3.37Å; K240-M243 PolarHBondContact O-N 3Å; K240-E244 WeakPolarHBondContact CE-OE1 3.49Å; K240-E244 WeakPolarHBondContact CG-OE1 3.29Å; K240-E244 IonicContact NZ-OE1 3.61Å; K240-E244 PolarHBondContact O-N 3.22Å
241	W	95.5	Very high	92.6	Very high	23 Å²	23	71.9 Å²	71.9	9%	0.087	35%	0.349	C	S	.	.	H	α-helix	trans	-58.4	-41.4	178.5	-179.9	89.8	0	0	0	111.8	F211 L217 I220 Y237 L238 M243 E244 T245 V249	F211-W241 HydrophobicContact CB-CD2 4.11Å; F211-W241 VanDerWaalsContact CB-CE2 3.47Å; F211-W241 HydrophobicContact CB-CG 4.42Å; F211-W241 HydrophobicContact CB-CZ2 3.75Å; F211-W241 AromaticContact CD2-CD2 3.93Å; F211-W241 HydrophobicContact CD2-CD2 3.93Å; F211-W241 AromaticContact CD2-CE3 3.98Å; F211-W241 HydrophobicContact CD2-CE3 3.98Å; F211-W241 HydrophobicContact CD2-CH2 4.25Å; F211-W241 HydrophobicContact CD2-CZ2 4.19Å; F211-W241 HydrophobicContact CD2-CZ3 4.14Å; F211-W241 HydrophobicContact CG-CZ2 4.26Å; L217-W241 HydrophobicContact CD2-CH2 3.81Å; L217-W241 HydrophobicContact CD2-CZ2 3.88Å; I220-W241 HydrophobicContact CD1-CH2 4.16Å; I220-W241 HydrophobicContact CD1-CZ3 4.42Å; I220-W241 HydrophobicContact CG2-CH2 3.94Å; I220-W241 HydrophobicContact CG2-CZ3 4.11Å; Y237-W241 HydrophobicContact CE2-CB 4.5Å; Y237-W241 WeakPolarHBondContact O-CB 3.4Å; Y237-W241 PolarHBondContact O-N 3.34Å; L238-W241 HydrophobicContact CD1-CE3 4.49Å; L238-W241 PolarHBondContact O-N 3.23Å; W241-M243 VanDerWaalsContact C-N 3.27Å; W241-M243 PolarHBondContact O-N 3.2Å; W241-E244 PolarHBondContact O-N 3.42Å; W241-T245 HydrophobicContact CE3-CG2 4.16Å; W241-T245 HydrophobicContact CH2-CG2 4.04Å; W241-T245 HydrophobicContact CZ2-CG2 4.39Å; W241-T245 HydrophobicContact CZ3-CG2 3.92Å; W241-T245 VanDerWaalsContact O-CB 3.29Å; W241-T245 WeakPolarHBondContact O-CB 3.45Å; W241-T245 WeakPolarHBondContact O-CG2 3.29Å; W241-T245 PolarHBondContact O-N 3.2Å; W241-V249 HydrophobicContact CZ3-CG2 4.12Å
242	M	94.3	Very high	92.6	Very high	37 Å²	37	71.6 Å²	71.6	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-64	-27.6	176.4	-76	173.2	56.9	0	0	113.8	L222 L238 L239 K240 V249 P253 I258	L222-M242 HydrophobicContact CD1-SD 4.41Å; L238-M242 HydrophobicContact CD1-CG 4.27Å; L238-M242 HydrophobicContact CD1-SD 4.27Å; L238-M242 HydrophobicContact CG-CG 4.46Å; L238-M242 HydrophobicContact CG-SD 3.98Å; L238-M242 WeakPolarHBondContact O-CB 3.46Å; L238-M242 WeakPolarHBondContact O-CG 3.38Å; L238-M242 PolarHBondContact O-N 3.37Å; L239-M242 PolarHBondContact O-N 2.85Å; K240-M242 VanDerWaalsContact C-N 3.29Å; K240-M242 PolarHBondContact O-N 2.59Å; M242-V249 HydrophobicContact CE-CG1 4.04Å; M242-V249 HydrophobicContact CG-CG1 4.28Å; M242-V249 HydrophobicContact CG-CG2 4.34Å; M242-V249 HydrophobicContact SD-CG1 4.44Å; M242-P253 HydrophobicContact CE-CG 4.19Å; M242-P253 HydrophobicContact SD-CB 4.1Å; M242-P253 HydrophobicContact SD-CG 3.75Å; M242-I258 HydrophobicContact CE-CD1 4.01Å
243	M	92	Very high	92.8	Very high	88 Å²	88	63.9 Å²	63.9	43%	0.433	32%	0.322	S	S	.	.	H	α-helix	trans	-78.9	-29.5	176.1	-69.9	-176.4	175.9	0	0	112.6	L239 K240 W241 I258 L261	L239-M243 WeakPolarHBondContact O-CG 3.45Å; L239-M243 PolarHBondContact O-N 3.33Å; K240-M243 WeakPolarHBondContact O-CB 3.37Å; K240-M243 PolarHBondContact O-N 3Å; W241-M243 VanDerWaalsContact C-N 3.27Å; W241-M243 PolarHBondContact O-N 3.2Å; M243-I258 HydrophobicContact CE-CG2 4.03Å; M243-L261 HydrophobicContact CE-CB 3.45Å; M243-L261 VanDerWaalsContact CE-CB 3.45Å; M243-L261 HydrophobicContact CE-CD1 4.04Å; M243-L261 HydrophobicContact CE-CG 4.36Å; M243-L261 HydrophobicContact SD-CB 4.4Å
244	E	94.2	Very high	92.9	Very high	132 Å²	132	56 Å²	56	62%	0.617	29%	0.285	S	S	*	.	H	α-helix	trans	-95	-26	-174.3	-67.1	173.4	178.5	0	0	112.9	K240 W241	K240-E244 WeakPolarHBondContact CE-OE1 3.49Å; K240-E244 WeakPolarHBondContact CG-OE1 3.29Å; K240-E244 IonicContact NZ-OE1 3.61Å; K240-E244 PolarHBondContact O-N 3.22Å; W241-E244 PolarHBondContact O-N 3.42Å
245	T	95.1	Very high	92.3	Very high	38 Å²	38	56.6 Å²	56.6	23%	0.233	29%	0.294	C	S	.	.			trans	-67.9	142.2	-175.9	-168.7	0	0	0	0	112.5	W241 A247 V249	W241-T245 HydrophobicContact CE3-CG2 4.16Å; W241-T245 HydrophobicContact CH2-CG2 4.04Å; W241-T245 HydrophobicContact CZ2-CG2 4.39Å; W241-T245 HydrophobicContact CZ3-CG2 3.92Å; W241-T245 VanDerWaalsContact O-CB 3.29Å; W241-T245 WeakPolarHBondContact O-CB 3.45Å; W241-T245 WeakPolarHBondContact O-CG2 3.29Å; W241-T245 PolarHBondContact O-N 3.2Å; T245-A247 VanDerWaalsContact C-N 3.33Å; T245-A247 HydrophobicContact CG2-CB 4.5Å; T245-A247 WeakPolarHBondContact OG1-CB 3.42Å; T245-A247 PolarHBondContact OG1-N 3.01Å; T245-V249 HydrophobicContact CG2-CG2 3.8Å
246	K	95.8	Very high	91.3	Very high	215 Å²	215	61.6 Å²	61.6	94%	0.935	33%	0.325	S	S	*	.			trans	-85	-11.6	170.6	-62.4	179.5	-176.8	175.7	0	112.4
247	A	96.9	Very high	89.9	Confident	11 Å²	11	60.7 Å²	60.7	9%	0.091	32%	0.316	C	S	.	.	S	Bend	trans	-69.3	145.9	179.8	0	0	0	0	0	110.7	L217 Q218 T245 V249	L217-A247 HydrophobicContact CB-CB 4.16Å; L217-A247 HydrophobicContact CD2-CB 4.12Å; L217-A247 HydrophobicContact CG-CB 4.03Å; L217-A247 WeakPolarHBondContact O-CB 3.4Å; Q218-A247 CarbonylContact O-C 3.52Å; T245-A247 VanDerWaalsContact C-N 3.33Å; T245-A247 HydrophobicContact CG2-CB 4.5Å; T245-A247 WeakPolarHBondContact OG1-CB 3.42Å; T245-A247 PolarHBondContact OG1-N 3.01Å; A247-V249 PolarHBondContact O-N 3.23Å
248	Q	97.4	Very high	88.3	Confident	120 Å²	120	61.3 Å²	61.3	56%	0.561	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	112.4	168.9	-176.5	173.8	-1.5	0	0	109.6	Q218 E219 I220 I250	Q218-Q248 WeakPolarHBondContact O-CB 3.36Å; Q218-Q248 PolarHBondContact O-N 3.44Å; E219-Q248 WeakPolarHBondContact CA-O 3.48Å; I220-Q248 PolarHBondContact N-O 2.88Å; Q248-I250 HydrophobicContact CG-CG1 4.13Å
249	V	96.9	Very high	86.5	Confident	38 Å²	38	64.6 Å²	64.6	23%	0.23	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	113.8	174.4	-175	0	0	0	0	109.4	I220 L222 W241 M242 T245 A247	I220-V249 HydrophobicContact CG2-CB 4.17Å; I220-V249 HydrophobicContact CG2-CG1 4.16Å; I220-V249 HydrophobicContact CG2-CG2 3.77Å; I220-V249 WeakPolarHBondContact O-CA 3.24Å; L222-V249 HydrophobicContact CD1-CG1 3.9Å; L222-V249 HydrophobicContact CG-CG1 4.5Å; W241-V249 HydrophobicContact CZ3-CG2 4.12Å; M242-V249 HydrophobicContact CE-CG1 4.04Å; M242-V249 HydrophobicContact CG-CG1 4.28Å; M242-V249 HydrophobicContact CG-CG2 4.34Å; M242-V249 HydrophobicContact SD-CG1 4.44Å; T245-V249 HydrophobicContact CG2-CG2 3.8Å; A247-V249 PolarHBondContact O-N 3.23Å
250	I	96.3	Very high	84.7	Confident	57 Å²	57	67 Å²	67	29%	0.292	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	113.2	177.7	-56.2	-179.1	0	0	0	109.4	E219 I220 T221 L222 Y223 Q248	E219-I250 VanDerWaalsContact CD-CD1 3.44Å; E219-I250 HydrophobicContact CG-CD1 3.87Å; E219-I250 HydrophobicContact CG-CG1 4.32Å; E219-I250 WeakPolarHBondContact OE1-CD1 3.42Å; I220-I250 PolarHBondContact O-N 3.34Å; T221-I250 CarbonylContact C-O 3.59Å; T221-I250 WeakPolarHBondContact CA-O 3.4Å; T221-I250 HydrophobicContact CG2-CB 4.01Å; T221-I250 HydrophobicContact CG2-CD1 4.21Å; T221-I250 HydrophobicContact CG2-CG2 4.43Å; L222-I250 PolarHBondContact N-O 2.67Å; Y223-I250 HydrophobicContact CD1-CG2 4Å; Y223-I250 HydrophobicContact CE1-CG2 4.17Å; Y223-I250 PolarHBondContact N-O 3.3Å; Q248-I250 HydrophobicContact CG-CG1 4.13Å
251	G	91	Very high	82.8	Confident	23 Å²	23	64.9 Å²	64.9	24%	0.237	36%	0.355	C	S	.	.	S	Bend	trans	114.4	156.9	-175.1	0	0	0	0	0	111.4	P253	G251-P253 VanDerWaalsContact C-CD 3.44Å; G251-P253 VanDerWaalsContact O-CD 3.29Å; G251-P253 WeakPolarHBondContact O-CD 3.41Å
252	T	85.4	Confident	80.8	Confident	105 Å²	105	70.9 Å²	70.9	64%	0.644	38%	0.382	S	S	*	.			trans	-120.5	77.4	-176.2	56.8	0	0	0	0	110.8	C254	T252-C254 PolarHBondContact O-N 2.88Å; T252-C254 VanDerWaalsContact O-N 3.15Å
253	P	87.1	Confident	78.4	Confident	0 Å²	0	76 Å²	76	0%	0	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	121	164.3	-23.6	31.3	0	0	0	110	L222 W227 L238 M242 G251 S255	L222-P253 HydrophobicContact CB-CG 3.89Å; L222-P253 HydrophobicContact CD1-CG 3.98Å; W227-P253 HydrophobicContact CD2-CB 4.16Å; W227-P253 HydrophobicContact CG-CB 3.94Å; W227-P253 HydrophobicContact CZ2-CG 4.44Å; L238-P253 HydrophobicContact CD2-CB 3.93Å; L238-P253 HydrophobicContact CD2-CG 4.12Å; M242-P253 HydrophobicContact CE-CG 4.19Å; M242-P253 HydrophobicContact SD-CB 4.1Å; M242-P253 HydrophobicContact SD-CG 3.75Å; G251-P253 VanDerWaalsContact C-CD 3.44Å; G251-P253 VanDerWaalsContact O-CD 3.29Å; G251-P253 WeakPolarHBondContact O-CD 3.41Å; P253-S255 PolarHBondContact O-N 3.43Å
254	C	86.1	Confident	76	Confident	7 Å²	7	79.6 Å²	79.6	5%	0.047	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	52	53.6	173.6	-51.2	0	0	0	0	114.8	C229 I235 L239 T252 T256 Q257	C229-C254 WeakPolarHBondContact CA-SG 3.21Å; C229-C254 HydrophobicContact CB-CB 3.7Å; C229-C254 WeakPolarHBondContact CB-SG 3.49Å; C229-C254 WeakPolarHBondContact SG-CA 3.22Å; C229-C254 WeakPolarHBondContact SG-CB 3.43Å; C229-C254 CovalentContact SG-SG 2.02Å; C229-C254 PolarHBondContact SG-SG 2.93Å; I235-C254 HydrophobicContact CG1-CB 4.41Å; I235-C254 VanDerWaalsContact CG1-SG 3.57Å; L239-C254 HydrophobicContact CD2-CB 4.35Å; T252-C254 PolarHBondContact O-N 2.88Å; T252-C254 VanDerWaalsContact O-N 3.15Å; C254-T256 PolarHBondContact O-N 3.29Å; C254-Q257 PolarHBondContact O-N 3.24Å
255	S	74.9	Confident	73.2	Confident	73 Å²	73	78.4 Å²	78.4	51%	0.51	43%	0.426	S	S	.	.	H	α-helix	trans	-49.8	-29.9	-176.8	55.8	0	0	0	0	115.1	P253	P253-S255 PolarHBondContact O-N 3.43Å
256	T	68.8	Low	70.3	Confident	106 Å²	106	83.3 Å²	83.3	65%	0.65	45%	0.45	S	S	*	.	H	α-helix	trans	-75.9	-21.5	-179.4	52.8	0	0	0	0	114.5	C254 S259	C254-T256 PolarHBondContact O-N 3.29Å; T256-S259 PolarHBondContact O-OG 3.45Å
257	Q	63.1	Low	67.3	Low	51 Å²	51	83.4 Å²	83.4	24%	0.238	45%	0.446	C	S	.	.	H	α-helix	trans	-94.2	-22.8	-176.6	-67.2	-176.2	-8.7	0	0	113	C229 L239 C254 S259 S260 L261	C229-Q257 PolarHBondContact O-NE2 2.88Å; C229-Q257 PolarHBondContact O-OE1 3.38Å; L239-Q257 HydrophobicContact CD1-CB 4.03Å; C254-Q257 PolarHBondContact O-N 3.24Å; Q257-S259 VanDerWaalsContact C-N 3.3Å; Q257-S259 PolarHBondContact O-N 3.36Å; Q257-S260 PolarHBondContact O-N 3.14Å; Q257-L261 PolarHBondContact O-N 3.34Å
258	I	61.5	Low	64.2	Low	38 Å²	38	88.6 Å²	88.6	20%	0.195	48%	0.479	C	S	.	.	H	α-helix	trans	-66.1	-34.9	178.4	-67.2	169.9	0	0	0	111.1	L239 M242 M243 K262	L239-I258 HydrophobicContact CD2-CD1 4.01Å; L239-I258 HydrophobicContact CD2-CG1 3.74Å; M242-I258 HydrophobicContact CE-CD1 4.01Å; M243-I258 HydrophobicContact CE-CG2 4.03Å; I258-K262 PolarHBondContact O-N 3.11Å
259	S	57.3	Low	60.9	Low	69 Å²	69	89.3 Å²	89.3	48%	0.483	49%	0.492	S	S	.	.	H	α-helix	trans	-65.4	-41.5	173	42.1	0	0	0	0	112	T256 Q257 K262 E263	T256-S259 PolarHBondContact O-OG 3.45Å; Q257-S259 VanDerWaalsContact C-N 3.3Å; Q257-S259 PolarHBondContact O-N 3.36Å; S259-K262 PolarHBondContact O-N 3.39Å; S259-E263 PolarHBondContact O-N 3.02Å
260	S	54.1	Low	57.9	Low	54 Å²	54	92.8 Å²	92.8	38%	0.378	52%	0.515	S	S	.	.	H	α-helix	trans	-72	-31.1	-179.5	107.7	0	0	0	0	113.1	Q257 K262 E263 H264	Q257-S260 PolarHBondContact O-N 3.14Å; S260-K262 VanDerWaalsContact C-N 3.34Å; S260-E263 PolarHBondContact O-N 3.46Å; S260-H264 PolarHBondContact O-N 3.4Å; S260-H264 PolarHBondContact O-ND1 3.17Å
261	L	55.6	Low	54.8	Low	77 Å²	77	95.9 Å²	95.9	40%	0.403	54%	0.541	S	S	.	.	H	α-helix	trans	-69.1	-30.9	172.6	-80.7	157.5	0	0	0	112.4	L239 M243 Q257 E263	L239-L261 HydrophobicContact CB-CD1 4.02Å; L239-L261 HydrophobicContact CD1-CD1 3.74Å; M243-L261 HydrophobicContact CE-CB 3.45Å; M243-L261 VanDerWaalsContact CE-CB 3.45Å; M243-L261 HydrophobicContact CE-CD1 4.04Å; M243-L261 HydrophobicContact CE-CG 4.36Å; M243-L261 HydrophobicContact SD-CB 4.4Å; Q257-L261 PolarHBondContact O-N 3.34Å; L261-E263 VanDerWaalsContact C-N 3.33Å
262	K	53	Low	51.7	Low	150 Å²	150	97.9 Å²	97.9	65%	0.652	56%	0.562	S	S	*	*	H	α-helix	trans	-70.2	-28.5	172.5	-77.5	-178	177	-177.1	0	112.8	I258 S259 S260	I258-K262 PolarHBondContact O-N 3.11Å; S259-K262 PolarHBondContact O-N 3.39Å; S260-K262 VanDerWaalsContact C-N 3.34Å
263	E	43.3	Very low	49	Very low	143 Å²	143	102.8 Å²	102.8	67%	0.668	58%	0.575	S	S	*	*	H	α-helix	trans	-76.6	-21.4	177.6	-74.3	176.3	173.9	0	0	113.5	S259 S260 L261 S265	S259-E263 PolarHBondContact O-N 3.02Å; S260-E263 PolarHBondContact O-N 3.46Å; L261-E263 VanDerWaalsContact C-N 3.33Å; E263-S265 PolarHBondContact O-N 2.86Å
264	H	42.2	Very low	46.2	Very low	164 Å²	164	108.6 Å²	108.6	76%	0.759	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	11.5	-179.9	-77.2	73.9	0	0	0	114.5	S260	S260-H264 PolarHBondContact O-N 3.4Å; S260-H264 PolarHBondContact O-ND1 3.17Å
265	S	36.1	Very low	43.4	Very low	107 Å²	107	113.4 Å²	113.4	75%	0.748	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	30.4	175.8	-144.1	0	0	0	0	113.6	E263	E263-S265 PolarHBondContact O-N 2.86Å
266	I	33.7	Very low	41.3	Very low	141 Å²	141	114.9 Å²	114.9	72%	0.723	66%	0.655	S	S	*	*			trans	-120.2	114.6	173.3	-55.2	178.8	0	0	0	109.2
267	Y	31.8	Very low	39.5	Very low	217 Å²	217	117.6 Å²	117.6	85%	0.851	66%	0.664	S	S	*	*			trans	-56.1	139.6	169.7	-80.1	-93.4	0	0	0	111.1
268	P	32.9	Very low	37.8	Very low	121 Å²	121	124.5 Å²	124.5	79%	0.786	69%	0.694	S	S	*	*			trans	-83.3	131.4	178.3	32.2	-29.9	0	0	0	110.8
269	T	28.2	Very low	36.1	Very low	135 Å²	135	128.4 Å²	128.4	83%	0.828	72%	0.72	S	S	*	*			trans	-132.1	154.1	155.1	41.6	0	0	0	0	109.5
270	P	33.5	Very low	34.6	Very low	111 Å²	111	131.4 Å²	131.4	72%	0.721	74%	0.735	S	S	*	*			trans	-101	150.5	-132.7	36.3	-34.3	0	0	0	115
271	S	31	Very low	33.2	Very low	121 Å²	121	134.3 Å²	134.3	85%	0.846	76%	0.755	S	S	*	*			trans	44.3	124.8	144.8	64.8	0	0	0	0	120.6
272	G	27.1	Very low	31.7	Very low	65 Å²	65	133.9 Å²	133.9	67%	0.67	77%	0.769	S	S	*	*			trans	135.1	96.9	140	0	0	0	0	0	113.8
273	F	28.4	Very low	30.5	Very low	209 Å²	209	136.5 Å²	136.5	92%	0.917	79%	0.786	S	S	*	*				174.8	137.2	108.1	-97	-77.6	0	0	0	110
274	T	27.6	Very low	29.7	Very low	121 Å²	121	137.8 Å²	137.8	74%	0.742	79%	0.792	S	S	*	*			trans	-75.2	142.1	-174.3	45.7	0	0	0	0	113
275	S	28.4	Very low	28.9	Very low	108 Å²	108	135.8 Å²	135.8	76%	0.755	79%	0.791	S	S	*	*			trans	30.9	125.3	144.3	74.9	0	0	0	0	119.6
276	S	29	Very low	28.4	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	79%	0.791	S	S	*	*				-170.2	132.7	110.9	39.4	0	0	0	0	111
277	L	31.4	Very low	28.1	Very low	163 Å²	163	137.9 Å²	137.9	85%	0.853	80%	0.8	S	S	*	*			trans	-62.8	128.7	159.6	-81.1	125.1	0	0	0	109
278	F	27.1	Very low	27.8	Very low	195 Å²	195	132.7 Å²	132.7	86%	0.855	79%	0.791	S	S	*	*			trans	-141.6	117.2	144.7	-89.5	-78.2	0	0	0	109.3
279	T	25.8	Very low	27.4	Very low	120 Å²	120	133.5 Å²	133.5	74%	0.736	79%	0.787	S	S	*	*			trans	-64.4	145.4	159	33.3	0	0	0	0	109.7
280	V	27.1	Very low	27.2	Very low	133 Å²	133	134 Å²	134	81%	0.806	79%	0.785	S	S	*	*				172.4	121.7	120.4	159.3	0	0	0	0	110.7
281	S	24.4	Very low	26.7	Very low	115 Å²	115	132.8 Å²	132.8	80%	0.804	78%	0.779	S	S	*	*			trans	13.5	126.8	141	-151.7	0	0	0	0	121.2
282	G	24.6	Very low	26.4	Very low	67 Å²	67	134.2 Å²	134.2	69%	0.691	78%	0.776	S	S	*	*				92.1	106.1	120.9	0	0	0	0	0	118.6
283	M	27.3	Very low	26.2	Very low	206 Å²	206	135.8 Å²	135.8	100%	1.015	78%	0.777	S	S	*	*				-177.2	148.4	114.5	-102.5	170.1	96.1	0	0	111.5
284	Q	26.8	Very low	25.9	Very low	170 Å²	170	132 Å²	132	79%	0.794	77%	0.771	S	S	*	*			trans	-100.3	153.9	-165	-119.9	175.7	5.9	0	0	112.2
285	T	25.3	Very low	25.7	Very low	121 Å²	121	132.3 Å²	132.3	74%	0.742	77%	0.772	S	S	*	*			trans	71.6	137.8	152.8	63.9	0	0	0	0	116.9
286	V	25.5	Very low	25.3	Very low	123 Å²	123	133.6 Å²	133.6	75%	0.745	78%	0.776	S	S	*	*				-151.7	131.7	52.3	167	0	0	0	0	111.3
287	D	26.6	Very low	25.1	Very low	170 Å²	170	136.4 Å²	136.4	91%	0.909	78%	0.777	S	S	*	*			trans	-88.3	147.7	164	-92.2	-37.7	0	0	0	111.6
288	T	25.4	Very low	24.6	Very low	108 Å²	108	134.7 Å²	134.7	66%	0.663	78%	0.776	S	S	*	*			trans	-116.1	121.4	-171.9	-59	0	0	0	0	109.6
289	I	25.6	Very low	24.4	Very low	138 Å²	138	134.4 Å²	134.4	71%	0.708	77%	0.774	S	S	*	*			trans	71.3	117.1	139.6	-62.8	175.8	0	0	0	120.6
290	N	23.2	Very low	24.3	Very low	146 Å²	146	135 Å²	135	78%	0.781	78%	0.778	S	S	*	*				40.6	150.9	130	-65.9	-10.4	0	0	0	120.9
291	S	22.8	Very low	24	Very low	85 Å²	85	135.1 Å²	135.1	59%	0.594	78%	0.779	S	S	*	*			cis	172.8	167.8	-7.2	53.9	0	0	0	0	107.3
292	L	24.5	Very low	23.9	Very low	150 Å²	150	138.4 Å²	138.4	79%	0.785	78%	0.779	S	S	*	*			trans	95.9	98.3	152.2	-70.2	149.8	0	0	0	120.5
293	S	23	Very low	23.9	Very low	98 Å²	98	142.9 Å²	142.9	69%	0.685	79%	0.785	S	S	*	*				54.5	128.4	119.9	55.2	0	0	0	0	122
294	V	23.7	Very low	23.7	Very low	129 Å²	129	138.2 Å²	138.2	78%	0.782	77%	0.77	S	S	*	*				-172.9	134.2	94.6	157.4	0	0	0	0	109.4
295	V	21.4	Very low	23.6	Very low	128 Å²	128	139.6 Å²	139.6	78%	0.776	77%	0.773	S	S	*	*			trans	-106.7	133	175	167.3	0	0	0	0	108.5
296	T	21.2	Very low	23.6	Very low	136 Å²	136	142.5 Å²	142.5	83%	0.834	78%	0.778	S	S	*	*			trans	-147.9	113.2	149.3	14.6	0	0	0	0	109.3
297	Q	24	Very low	23.4	Very low	164 Å²	164	147.2 Å²	147.2	77%	0.766	78%	0.784	S	S	*	*			trans	-84.9	174.4	167.3	-71.5	-172.8	-18.7	0	0	110.7
298	P	22.1	Very low	23.1	Very low	127 Å²	127	150.3 Å²	150.3	83%	0.825	78%	0.783	S	S	*	*				-136.2	129.6	105.1	30.3	-15.1	0	0	0	116
299	K	21.5	Very low	23	Very low	188 Å²	188	151.7 Å²	151.7	82%	0.817	79%	0.792	S	S	*	*			trans	48.9	102.5	132.7	-97.8	171.8	172.9	174.8	0	119.9
300	V	23.4	Very low	22.9	Very low	133 Å²	133	154 Å²	154	81%	0.806	80%	0.797	S	S	*	*			trans	-98.1	125.2	150.2	173.1	0	0	0	0	108.8
301	T	22.1	Very low	22.8	Very low	135 Å²	135	156 Å²	156	83%	0.828	80%	0.802	S	S	*	*			trans	-79.6	113.7	172.1	-40.8	0	0	0	0	109.2
302	K	22.8	Very low	22.7	Very low	185 Å²	185	157.8 Å²	157.8	80%	0.804	81%	0.809	S	S	*	*			trans	-97.3	138.7	166.8	-73.9	-177.8	178.1	178.5	0	109.4
303	I	23	Very low	22.5	Very low	161 Å²	161	156.6 Å²	156.6	83%	0.826	81%	0.808	S	S	*	*			trans	-129.2	128.9	146.6	-61.9	-179.2	0	0	0	107.6
304	P	24.5	Very low	22.5	Very low	107 Å²	107	161.7 Å²	161.7	70%	0.695	82%	0.818	S	S	*	*			trans	-97.3	154.1	-171.5	37.6	-32.4	0	0	0	112.2
305	K	25.1	Very low	22.4	Very low	200 Å²	200	158.9 Å²	158.9	87%	0.87	82%	0.816	S	S	*	*			trans	-139.1	104.1	148.9	-75.7	-167.5	178.4	176.4	0	110.5
306	Q	23.5	Very low	22.5	Very low	181 Å²	181	157.6 Å²	157.6	85%	0.846	82%	0.818	S	S	*	*			trans	-67	139.3	156.8	-77.4	173.2	-29.8	0	0	108.9
307	Y	22.7	Very low	22.5	Very low	222 Å²	222	158.5 Å²	158.5	87%	0.871	82%	0.824	S	S	*	*			trans	-133.1	125.8	143.3	-95.1	-83.8	0	0	0	109.9
308	R	20.4	Very low	22.4	Very low	236 Å²	236	158.9 Å²	158.9	89%	0.891	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-84.3	116.9	177.5	-179.8	-179.1	-171.5	169.5	2.5	107.6
309	T	22.4	Very low	22.4	Very low	136 Å²	136	158.1 Å²	158.1	83%	0.834	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-87.9	122.6	172.9	-13.4	0	0	0	0	109.3
310	K	22.7	Very low	22.6	Very low	187 Å²	187	158.8 Å²	158.8	81%	0.813	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-70.9	132.1	167.8	-79.1	177.2	172.2	179.6	0	108.9
311	E	21.4	Very low	22.5	Very low	189 Å²	189	159.8 Å²	159.8	88%	0.883	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-65.8	135.1	164.1	-69.9	172.4	156.8	0	0	109.3
312	T	22.2	Very low	22.5	Very low	122 Å²	122	159.2 Å²	159.2	75%	0.748	83%	0.828	S	S	*	*			trans	-141.5	107.1	161.7	-43.9	0	0	0	0	108.3
313	T	20.5	Very low	22.4	Very low	125 Å²	125	156.3 Å²	156.3	77%	0.767	83%	0.826	S	S	*	*			trans	-63.1	133.3	173	-31.8	0	0	0	0	110.2
314	F	21.8	Very low	22.4	Very low	204 Å²	204	157.8 Å²	157.8	90%	0.895	83%	0.827	S	S	*	*			trans	-139	134.8	152.6	-98.7	-78.9	0	0	0	110
315	G	22.5	Very low	22.2	Very low	71 Å²	71	159.4 Å²	159.4	73%	0.732	84%	0.835	S	S	*	*			trans	-76.6	159.7	-163.6	0	0	0	0	0	115.1
316	A	22.1	Very low	22.1	Very low	101 Å²	101	155.4 Å²	155.4	84%	0.835	83%	0.832	S	S	*	*			trans	-67.1	153.6	173.9	0	0	0	0	0	112.9
317	T	23	Very low	22.2	Very low	154 Å²	154	152.5 Å²	152.5	95%	0.945	83%	0.827	S	S	*	*			trans	-136.3	140.1	147.6	13	0	0	0	0	110.6
318	L	21.9	Very low	22.3	Very low	172 Å²	172	149.9 Å²	149.9	90%	0.901	83%	0.828	S	S	*	*			trans	-94.7	140.2	-161.6	-179.4	86.2	0	0	0	111.8
319	S	22	Very low	22.5	Very low	111 Å²	111	148.6 Å²	148.6	78%	0.776	83%	0.829	S	S	*	*			trans	172.9	135.4	144.9	56.2	0	0	0	0	108.2
320	K	24.5	Very low	22.5	Very low	203 Å²	203	146.3 Å²	146.3	88%	0.883	82%	0.824	S	S	*	*			cis	-164.1	140	8.4	-151.4	173.2	-176.6	177.9	0	106.2
321	D	20.7	Very low	22.4	Very low	154 Å²	154	147.5 Å²	147.5	82%	0.824	83%	0.829	S	S	*	*			trans	-69.2	142.6	174.9	-74.3	-49.9	0	0	0	112.6
322	T	23.3	Very low	22.6	Very low	122 Å²	122	143.6 Å²	143.6	75%	0.748	82%	0.818	S	S	*	*			trans	-141.4	106.6	148.9	-33.7	0	0	0	0	109.3	F324	T322-F324 HydrophobicContact CG2-CD2 4.38Å; T322-F324 HydrophobicContact CG2-CE2 4.03Å
323	T	19.7	Very low	22.7	Very low	124 Å²	124	143.6 Å²	143.6	76%	0.761	82%	0.82	S	S	*	*			trans	-71.8	133.6	169	41.4	0	0	0	0	111.2
324	F	22.6	Very low	22.8	Very low	193 Å²	193	147.4 Å²	147.4	85%	0.846	82%	0.822	S	S	*	*			trans	-130.6	117.6	156.2	-86.5	-83	0	0	0	109.3	T322	T322-F324 HydrophobicContact CG2-CD2 4.38Å; T322-F324 HydrophobicContact CG2-CE2 4.03Å
325	T	21.5	Very low	23.1	Very low	140 Å²	140	143.7 Å²	143.7	86%	0.859	82%	0.818	S	S	*	*			trans	-80.3	131.9	165.7	45.2	0	0	0	0	109.4
326	S	23.4	Very low	23.2	Very low	116 Å²	116	148.5 Å²	148.5	81%	0.811	82%	0.822	S	S	*	*			trans	-148.9	119	153.4	-164.6	0	0	0	0	109.9
327	T	24.6	Very low	23.3	Very low	120 Å²	120	149.8 Å²	149.8	74%	0.736	82%	0.815	S	S	*	*			trans	-59	136.6	163	41.7	0	0	0	0	110.2
328	D	25	Very low	23.3	Very low	167 Å²	167	148.9 Å²	148.9	89%	0.893	81%	0.809	S	S	*	*				-170.2	140.3	123.6	-91.5	-22.5	0	0	0	112
329	K	24.7	Very low	23.3	Very low	210 Å²	210	145.6 Å²	145.6	91%	0.913	80%	0.8	S	S	*	*			trans	-95.8	160.7	-173.2	-124.1	178	-176.5	178.8	0	110.7
330	A	21.9	Very low	23.4	Very low	88 Å²	88	146.5 Å²	146.5	73%	0.727	80%	0.801	S	S	*	*			trans	-59.4	155.6	-170.3	0	0	0	0	0	117.5
331	F	22.1	Very low	23.4	Very low	211 Å²	211	145.7 Å²	145.7	93%	0.925	80%	0.801	S	S	*	*			trans	-132.1	128.6	153.2	-118.8	-89.3	0	0	0	110.1
332	V	23.6	Very low	23.6	Very low	107 Å²	107	145 Å²	145	65%	0.648	80%	0.803	S	S	*	*			trans	-106.5	149.3	171.8	173.5	0	0	0	0	107.1
333	P	24.6	Very low	23.8	Very low	122 Å²	122	146 Å²	146	79%	0.792	80%	0.802	S	S	*	*			trans	-137.5	135.4	133.4	25.3	-6.6	0	0	0	114.1
334	Y	22.3	Very low	24	Very low	205 Å²	205	148.1 Å²	148.1	80%	0.804	81%	0.808	S	S	*	*			trans	-75.9	169.4	153.3	-98.8	-94.3	0	0	0	110.4
335	P	29.6	Very low	24.3	Very low	127 Å²	127	143.9 Å²	143.9	83%	0.825	80%	0.803	S	S	*	*				-139.3	150	124.7	31.7	-15.7	0	0	0	115
336	E	23.5	Very low	24.7	Very low	171 Å²	171	146.2 Å²	146.2	80%	0.799	80%	0.803	S	S	*	*			trans	-107.1	145.5	165.8	-96.4	-173.9	170.5	0	0	111.2
337	D	25.1	Very low	25.1	Very low	129 Å²	129	149.9 Å²	149.9	69%	0.69	81%	0.808	S	S	*	*			trans	69.5	117.5	144.5	-69.9	-5.9	0	0	0	126.7
338	T	21.9	Very low	25.3	Very low	134 Å²	134	149.2 Å²	149.2	82%	0.822	81%	0.814	S	S	*	*			trans	58.8	138.6	137.8	57.6	0	0	0	0	120
339	S	22.7	Very low	25.4	Very low	103 Å²	103	146.1 Å²	146.1	72%	0.72	81%	0.812	S	S	*	*			cis	-164.4	150.6	45.5	53.2	0	0	0	0	113.7
340	T	24.6	Very low	25.6	Very low	131 Å²	131	140.6 Å²	140.6	80%	0.804	81%	0.805	S	S	*	*			trans	17	117.8	151.1	54	0	0	0	0	121.3
341	E	24.5	Very low	25.9	Very low	185 Å²	185	141.3 Å²	141.3	86%	0.864	81%	0.811	S	S	*	*				-159.1	129.5	129.7	-117.4	178.1	-169	0	0	111
342	T	24.9	Very low	26.2	Very low	141 Å²	141	137.3 Å²	137.3	87%	0.865	81%	0.805	S	S	*	*			trans	-81	116.7	175.4	40.5	0	0	0	0	110.7
343	I	26.9	Very low	26.4	Very low	143 Å²	143	139.5 Å²	139.5	73%	0.733	81%	0.812	S	S	*	*			trans	-137.9	115.7	157.1	-59.4	-178.2	0	0	0	109.1
344	N	24.2	Very low	26.6	Very low	167 Å²	167	139 Å²	139	89%	0.893	81%	0.806	S	S	*	*			trans	-76.2	120.6	163.4	-80	-28.3	0	0	0	109
345	S	29.5	Very low	26.9	Very low	104 Å²	104	135.3 Å²	135.3	73%	0.727	80%	0.799	S	S	*	*			trans	-176.3	135	140	49	0	0	0	0	110.7
346	H	29.2	Very low	26.8	Very low	190 Å²	190	137.3 Å²	137.3	88%	0.88	80%	0.797	S	S	*	*			trans	-44.5	127.7	172.7	-64	-77.4	0	0	0	114
347	E	31.8	Very low	27.1	Very low	193 Å²	193	136.8 Å²	136.8	90%	0.902	80%	0.799	S	S	*	*			trans	-168.7	118.7	136.8	-108.2	166.2	-169.7	0	0	110.2	A349	E347-A349 PolarHBondContact O-N 2.8Å
348	A	28.5	Very low	27.2	Very low	106 Å²	106	139.3 Å²	139.3	88%	0.876	81%	0.807	S	S	*	*			trans	-80.9	105.4	179	0	0	0	0	0	109.6	A350	A348-A350 PolarHBondContact O-N 3.48Å
349	A	28.5	Very low	27.6	Very low	102 Å²	102	140.6 Å²	140.6	84%	0.843	81%	0.809	S	S	*	*			trans	-85.6	105.1	167.6	0	0	0	0	0	109.4	E347 A351	E347-A349 PolarHBondContact O-N 2.8Å; A349-A351 PolarHBondContact O-N 3.26Å
350	A	28.9	Very low	27.9	Very low	93 Å²	93	139.4 Å²	139.4	77%	0.769	81%	0.813	S	S	*	*			trans	-68.3	113.4	167	0	0	0	0	0	109.1	A348 T352	A348-A350 PolarHBondContact O-N 3.48Å; A350-T352 PolarHBondContact O-N 3.3Å
351	A	27.8	Very low	28	Very low	104 Å²	104	141.8 Å²	141.8	86%	0.86	82%	0.817	S	S	*	*			trans	-77.3	103.9	173.2	0	0	0	0	0	109.8	A349	A349-A351 PolarHBondContact O-N 3.26Å
352	T	27.9	Very low	28.2	Very low	127 Å²	127	140 Å²	140	78%	0.779	82%	0.818	S	S	*	*			trans	-83.3	109.1	173.1	-45.2	0	0	0	0	109	A350	A350-T352 PolarHBondContact O-N 3.3Å
353	L	27.5	Very low	28.5	Very low	152 Å²	152	138.2 Å²	138.2	80%	0.796	81%	0.807	S	S	*	*			trans	-92	107	175	-155.3	98.7	0	0	0	109.7	I355	L353-I355 HydrophobicContact CD2-CD1 4.15Å; L353-I355 HydrophobicContact CD2-CG1 3.98Å
354	T	28.8	Very low	28.5	Very low	111 Å²	111	138.6 Å²	138.6	68%	0.681	81%	0.811	S	S	*	*			trans	-90.7	112.4	175.7	-42.5	0	0	0	0	109.5
355	I	29.1	Very low	28.7	Very low	129 Å²	129	136.7 Å²	136.7	66%	0.662	81%	0.806	S	S	*	*			trans	-96.2	113.5	174.8	-57.4	175.5	0	0	0	108.4	L353 L357	L353-I355 HydrophobicContact CD2-CD1 4.15Å; L353-I355 HydrophobicContact CD2-CG1 3.98Å; I355-L357 HydrophobicContact CG2-CG 4.43Å
356	H	27.7	Very low	28.6	Very low	168 Å²	168	136.4 Å²	136.4	78%	0.778	80%	0.803	S	S	*	*			trans	-86.1	112.2	168.5	-86.5	-76.9	0	0	0	109.5
357	L	28.2	Very low	28.6	Very low	160 Å²	160	135.1 Å²	135.1	84%	0.838	80%	0.802	S	S	*	*			trans	-90.4	119.1	166.6	-69.8	168.2	0	0	0	108.3	I355	I355-L357 HydrophobicContact CG2-CG 4.43Å
358	Q	28.2	Very low	28.5	Very low	183 Å²	183	131.9 Å²	131.9	86%	0.855	80%	0.796	S	S	*	*			trans	-115.6	102	176.1	-168	136.5	-0.6	0	0	108.2	G360	Q358-G360 PolarHBondContact O-N 3.47Å
359	D	30.4	Very low	28.4	Very low	160 Å²	160	132.5 Å²	132.5	86%	0.856	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-72.7	121.4	176.8	-80.9	-26.6	0	0	0	110.3
360	G	28.1	Very low	28.4	Very low	79 Å²	79	132.6 Å²	132.6	81%	0.814	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-73.8	124.5	173.9	0	0	0	0	0	111.6	Q358	Q358-G360 PolarHBondContact O-N 3.47Å
361	M	28.2	Very low	28.4	Very low	180 Å²	180	134.6 Å²	134.6	89%	0.887	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71	127.5	167.9	-87.6	-178	154.9	0	0	111
362	V	28.3	Very low	28.5	Very low	147 Å²	147	140.2 Å²	140.2	89%	0.891	80%	0.796	S	S	*	*			trans	-123.7	119.9	145.4	177.7	0	0	0	0	107.8
363	T	29.7	Very low	28.5	Very low	104 Å²	104	139.6 Å²	139.6	64%	0.638	80%	0.797	S	S	*	*			trans	-78.4	138.6	-179.6	46.3	0	0	0	0	111.8
364	N	27	Very low	28.7	Very low	152 Å²	152	137.3 Å²	137.3	81%	0.813	79%	0.794	S	S	*	*				-166.3	116.1	127.8	-90.4	-14.9	0	0	0	111.6
365	T	29	Very low	28.9	Very low	127 Å²	127	138.1 Å²	138.1	78%	0.779	80%	0.801	S	S	*	*			trans	9.8	134.5	152.5	50.2	0	0	0	0	119
366	S	28.8	Very low	29.2	Very low	97 Å²	97	138 Å²	138	68%	0.678	81%	0.806	S	S	*	*				-172.5	146.5	55.9	-36.1	0	0	0	0	112.4
367	L	29.1	Very low	29.3	Very low	163 Å²	163	136 Å²	136	85%	0.853	81%	0.808	S	S	*	*			trans	62.7	125.2	151.9	-65.4	145.6	0	0	0	116.8
368	T	28.7	Very low	29.3	Very low	126 Å²	126	137 Å²	137	77%	0.773	81%	0.811	S	S	*	*			cis	-156.8	159.9	25.4	40.3	0	0	0	0	110.3
369	S	26.9	Very low	29.5	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	81%	0.809	S	S	*	*			trans	-50.1	132.1	179.8	52.7	0	0	0	0	118.2
370	S	28.4	Very low	29.3	Very low	105 Å²	105	134 Å²	134	73%	0.734	81%	0.805	S	S	*	*			trans	-164.6	120.2	132.9	59.6	0	0	0	0	111.8
371	T	28.9	Very low	29.4	Very low	134 Å²	134	135.2 Å²	135.2	82%	0.822	80%	0.801	S	S	*	*			trans	47.5	102.2	153.1	52	0	0	0	0	119.2	S373	T371-S373 PolarHBondContact O-N 3.44Å
372	K	28.5	Very low	29.6	Very low	222 Å²	222	133.5 Å²	133.5	97%	0.965	79%	0.794	S	S	*	*			trans	-56.1	123.9	161.8	-76.7	175.2	173.8	177	0	110.6
373	S	29.5	Very low	29.8	Very low	115 Å²	115	133.2 Å²	133.2	80%	0.804	79%	0.793	S	S	*	*			trans	-121	131	154.4	60.8	0	0	0	0	108	T371	T371-S373 PolarHBondContact O-N 3.44Å
374	S	30.5	Very low	29.9	Very low	104 Å²	104	133.6 Å²	133.6	73%	0.727	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-68.9	138.4	178.6	45.5	0	0	0	0	111	T376	S374-T376 PolarHBondContact O-N 3.43Å
375	P	33.5	Very low	30.1	Very low	127 Å²	127	129.8 Å²	129.8	83%	0.825	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.8	119.1	173.8	30.2	-29.5	0	0	0	109.4
376	T	35.2	Very low	30.3	Very low	126 Å²	126	132 Å²	132	77%	0.773	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-70.2	136.2	164.6	33.3	0	0	0	0	109.4	S374	S374-T376 PolarHBondContact O-N 3.43Å
377	P	29.4	Very low	30.5	Very low	126 Å²	126	133.3 Å²	133.3	82%	0.818	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-70.6	133.8	178	27.5	-31.7	0	0	0	110.5
378	M	29.4	Very low	30.7	Very low	181 Å²	181	133 Å²	133	89%	0.892	81%	0.805	S	S	*	*			trans	-98.2	115.1	177.5	-157	-179.3	-62.2	0	0	108.6
379	T	31.1	Very low	30.7	Very low	134 Å²	134	134.6 Å²	134.6	82%	0.822	81%	0.809	S	S	*	*			trans	-89.5	119.6	178.3	-48.7	0	0	0	0	109.7
380	L	26.6	Very low	31.3	Very low	147 Å²	147	138.9 Å²	138.9	77%	0.77	81%	0.813	S	S	*	*			trans	-98.7	110.6	173.7	-153.2	102.3	0	0	0	108.7	I382	L380-I382 HydrophobicContact CD2-CD1 3.95Å; L380-I382 HydrophobicContact CD2-CG1 4.05Å
381	S	30.3	Very low	31.5	Very low	105 Å²	105	139.2 Å²	139.2	73%	0.734	82%	0.815	S	S	*	*			trans	-104	121.8	172.4	53.2	0	0	0	0	110.1
382	I	32.6	Very low	31.6	Very low	144 Å²	144	142 Å²	142	74%	0.738	82%	0.819	S	S	*	*			trans	-110.8	107.6	173.7	-57.8	174.6	0	0	0	107.1	L380	L380-I382 HydrophobicContact CD2-CD1 3.95Å; L380-I382 HydrophobicContact CD2-CG1 4.05Å
383	T	31.8	Very low	31.9	Very low	141 Å²	141	140.5 Å²	140.5	87%	0.865	82%	0.818	S	S	*	*			trans	-97.7	102.5	171.6	34.2	0	0	0	0	109.2	G385	T383-G385 PolarHBondContact O-N 3.4Å
384	S	32.4	Very low	31.8	Very low	112 Å²	112	140.5 Å²	140.5	78%	0.783	82%	0.815	S	S	*	*			trans	-88	101.3	167.5	72.5	0	0	0	0	109.6
385	G	32.3	Very low	32.1	Very low	72 Å²	72	144.8 Å²	144.8	74%	0.742	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-82.8	120.5	164.4	0	0	0	0	0	109.7	T383	T383-G385 PolarHBondContact O-N 3.4Å
386	M	32.6	Very low	32	Very low	174 Å²	174	147.8 Å²	147.8	86%	0.857	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-84.3	127.7	163.9	-83.7	-157.2	-119.4	0	0	109.4
387	P	32.4	Very low	31.6	Very low	123 Å²	123	146.6 Å²	146.6	80%	0.799	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-77.9	122.4	169.4	28.3	-28.5	0	0	0	110.2
388	N	33	Very low	31.5	Very low	156 Å²	156	147.3 Å²	147.3	83%	0.834	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-84.8	132.9	163.4	-79	-17.6	0	0	0	109.2
389	N	28.7	Very low	31.3	Very low	161 Å²	161	143.6 Å²	143.6	86%	0.861	81%	0.814	S	S	*	*			trans	93.4	125.8	173.1	-87.2	-20.2	0	0	0	120.1
390	F	39.9	Very low	31	Very low	207 Å²	207	144.9 Å²	144.9	91%	0.908	81%	0.814	S	S	*	*			trans	-70.7	116.7	169.8	-85.1	-102.2	0	0	0	110.7
391	S	33.5	Very low	30.9	Very low	112 Å²	112	144.8 Å²	144.8	78%	0.783	82%	0.815	S	S	*	*			trans	173	136.2	134.2	-75.3	0	0	0	0	108.2
392	E	31.1	Very low	30.6	Very low	192 Å²	192	147.8 Å²	147.8	90%	0.897	82%	0.821	S	S	*	*			trans	78.4	121	-180	-58.5	-173.4	147.6	0	0	117.4	P394	E392-P394 WeakPolarHBondContact O-CD 3.32Å
393	M	33.4	Very low	30.3	Very low	192 Å²	192	151 Å²	151	95%	0.946	82%	0.824	S	S	*	*			trans	-74.8	136.8	171.7	-73.8	174.8	78	0	0	110.7
394	P	28.8	Very low	30	Very low	115 Å²	115	153.7 Å²	153.7	75%	0.747	82%	0.819	S	S	*	*			trans	-123.4	146.5	144.1	19.3	0.3	0	0	0	112.5	E392	E392-P394 WeakPolarHBondContact O-CD 3.32Å
395	Q	37	Very low	29.6	Very low	194 Å²	194	155.6 Å²	155.6	91%	0.907	82%	0.815	S	S	*	*			trans	-57.4	127.8	175.9	-61.9	178.3	-24.7	0	0	111.1
396	Q	29.7	Very low	29.4	Very low	190 Å²	190	159.2 Å²	159.2	89%	0.888	81%	0.813	S	S	*	*			trans	-95.4	101.4	169.5	-73.7	-171.4	-9.8	0	0	110.4
397	S	28.2	Very low	29	Very low	101 Å²	101	157.1 Å²	157.1	71%	0.706	81%	0.81	S	S	*	*			trans	-88.1	119.3	156.9	46.4	0	0	0	0	108.8	T399	S397-T399 PolarHBondContact O-N 3.44Å
398	T	27.3	Very low	28.6	Very low	140 Å²	140	157.3 Å²	157.3	86%	0.859	81%	0.809	S	S	*	*			trans	-83.9	107.9	173.4	-37.9	0	0	0	0	109.2
399	T	25.3	Very low	28.4	Very low	104 Å²	104	156.4 Å²	156.4	64%	0.638	81%	0.809	S	S	*	*			trans	-90.6	117	176.1	-42.9	0	0	0	0	109.6	S397 N401	S397-T399 PolarHBondContact O-N 3.44Å; T399-N401 PolarHBondContact O-N 3.41Å
400	L	23.6	Very low	28.3	Very low	160 Å²	160	156 Å²	156	84%	0.838	81%	0.807	S	S	*	*			trans	-77.4	106.8	166.7	-89.6	152.9	0	0	0	108.8
401	N	25	Very low	27.8	Very low	146 Å²	146	152.7 Å²	152.7	78%	0.781	80%	0.804	S	S	*	*			trans	-99.1	103.6	170.5	-81.1	-26	0	0	0	109.9	T399	T399-N401 PolarHBondContact O-N 3.41Å
402	L	24.4	Very low	27.4	Very low	167 Å²	167	156.4 Å²	156.4	87%	0.874	81%	0.806	S	S	*	*			trans	-90.3	109.5	167.2	-124.1	117.6	0	0	0	107.8
403	R	24.7	Very low	27.2	Very low	212 Å²	212	154 Å²	154	80%	0.8	80%	0.804	S	S	*	*			trans	-101.5	110.1	173.9	-171.7	171.6	173.9	154.6	-4.7	109.2	E405	R403-E405 IonicContact CZ-OE1 2.83Å; R403-E405 IonicContact NE-OE1 3.88Å; R403-E405 PolarHBondContact NE-OE1 3.42Å; R403-E405 IonicContact NH2-OE1 3.32Å; R403-E405 PolarHBondContact NH2-OE1 3.39Å
404	R	26.2	Very low	26.9	Very low	198 Å²	198	154.1 Å²	154.1	75%	0.747	80%	0.802	S	S	*	*			trans	-103.6	118.5	166	175.9	-178.3	-91.5	-178	-4	107.2	E406	R404-E406 WeakPolarHBondContact CD-OE1 3.43Å; R404-E406 HydrophobicContact CG-CG 4.08Å; R404-E406 IonicContact CZ-OE1 3.07Å; R404-E406 IonicContact NE-OE1 3.76Å
405	E	25.3	Very low	26.9	Very low	152 Å²	152	156.7 Å²	156.7	71%	0.71	81%	0.809	S	S	*	*			trans	-90.6	111.7	167.3	-81.3	179	177.1	0	0	108.4	R403	R403-E405 IonicContact CZ-OE1 2.83Å; R403-E405 IonicContact NE-OE1 3.88Å; R403-E405 PolarHBondContact NE-OE1 3.42Å; R403-E405 IonicContact NH2-OE1 3.32Å; R403-E405 PolarHBondContact NH2-OE1 3.39Å
406	E	27.3	Very low	26.6	Very low	148 Å²	148	153.1 Å²	153.1	69%	0.692	80%	0.803	S	S	*	*			trans	-129.8	125	167.4	-83.7	174.3	-170.3	0	0	109.1	R404	R404-E406 WeakPolarHBondContact CD-OE1 3.43Å; R404-E406 HydrophobicContact CG-CG 4.08Å; R404-E406 IonicContact CZ-OE1 3.07Å; R404-E406 IonicContact NE-OE1 3.76Å
407	T	23.4	Very low	26.5	Very low	130 Å²	130	149.8 Å²	149.8	80%	0.798	80%	0.8	S	S	*	*			trans	-78.5	127.7	170.8	37.8	0	0	0	0	109.5
408	T	25.6	Very low	26.6	Very low	127 Å²	127	151.5 Å²	151.5	78%	0.779	81%	0.806	S	S	*	*				153.5	134.1	127	46.3	0	0	0	0	114.4
409	T	27.4	Very low	26.7	Very low	137 Å²	137	149.1 Å²	149.1	84%	0.84	80%	0.801	S	S	*	*			trans	66.2	108.8	149	52.2	0	0	0	0	121.2
410	N	27.1	Very low	26.9	Very low	152 Å²	152	151.7 Å²	151.7	81%	0.813	81%	0.811	S	S	*	*			trans	-54.9	129.6	163.9	-85.6	-58.8	0	0	0	114
411	V	28.7	Very low	27.3	Very low	138 Å²	138	148.6 Å²	148.6	84%	0.836	81%	0.808	S	S	*	*			trans	-145.1	119.6	136.3	179.8	0	0	0	0	108.2
412	K	26.8	Very low	27.5	Very low	190 Å²	190	153 Å²	153	83%	0.826	81%	0.814	S	S	*	*			trans	-89.7	129.2	174.2	-81.8	177.4	175.7	176.1	0	110
413	T	26.9	Very low	27.9	Very low	141 Å²	141	155 Å²	155	87%	0.865	82%	0.815	S	S	*	*			trans	-141.9	110.5	153.2	28	0	0	0	0	109.3
414	Q	27.1	Very low	28.6	Very low	194 Å²	194	149.8 Å²	149.8	91%	0.907	81%	0.807	S	S	*	*			trans	-78.8	138	170	-81.3	175	-45.4	0	0	109.9
415	L	27.7	Very low	29.2	Very low	170 Å²	170	145.9 Å²	145.9	89%	0.89	80%	0.801	S	S	*	*			trans	-130.8	132.4	159.3	-137	80.7	0	0	0	108.5
416	P	31.8	Very low	29.8	Very low	118 Å²	118	142.3 Å²	142.3	77%	0.766	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-87.9	156.7	-168.3	33.3	-33.2	0	0	0	114.2
417	S	25.8	Very low	30.6	Very low	120 Å²	120	138.9 Å²	138.9	84%	0.839	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-65.4	132.4	177.5	62.4	0	0	0	0	113.1
418	V	31.4	Very low	31.6	Very low	137 Å²	137	140.8 Å²	140.8	83%	0.83	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-87.9	118.3	168.5	177.6	0	0	0	0	108.9
419	A	29.6	Very low	32.5	Very low	90 Å²	90	140 Å²	140	74%	0.744	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-72.9	133.1	170.8	0	0	0	0	0	110.5	A421	A419-A421 PolarHBondContact O-N 3.47Å; A419-A421 VanDerWaalsContact O-N 3.13Å
420	N	30.2	Very low	33.3	Very low	159 Å²	159	139.5 Å²	139.5	85%	0.85	77%	0.769	S	S	*	*			trans	-67.6	105.1	173.6	-89.9	-22.3	0	0	0	110.4
421	A	31.4	Very low	34.1	Very low	94 Å²	94	138.9 Å²	138.9	78%	0.777	76%	0.763	S	S	*	*			trans	-67.9	127.1	167	0	0	0	0	0	110	A419 K423	A419-A421 PolarHBondContact O-N 3.47Å; A419-A421 VanDerWaalsContact O-N 3.13Å; A421-K423 PolarHBondContact O-N 3.37Å; A421-K423 VanDerWaalsContact O-N 3.13Å
422	W	30	Very low	34.9	Very low	240 Å²	240	138 Å²	138	91%	0.909	75%	0.753	S	S	*	*			trans	-60.9	110.5	169.1	-79.2	32.5	0	0	0	109.5	V424	W422-V424 VanDerWaalsContact C-N 3.27Å; W422-V424 PolarHBondContact O-N 3.46Å
423	K	31.9	Very low	35.6	Very low	207 Å²	207	133.9 Å²	133.9	90%	0.9	74%	0.74	S	S	*	*			trans	-70.9	87.9	162.9	-100.9	178.6	176	174.9	0	108.1	A421 N425	A421-K423 PolarHBondContact O-N 3.37Å; A421-K423 VanDerWaalsContact O-N 3.13Å; K423-N425 PolarHBondContact O-N 3.03Å
424	V	38.6	Very low	36.6	Very low	104 Å²	104	131 Å²	131	63%	0.63	72%	0.722	S	S	*	*			trans	-67.5	119.1	159.9	-179.4	0	0	0	0	106.6	W422 A426	W422-V424 VanDerWaalsContact C-N 3.27Å; W422-V424 PolarHBondContact O-N 3.46Å; V424-A426 PolarHBondContact O-N 3.07Å
425	N	38.9	Very low	37.6	Very low	116 Å²	116	126 Å²	126	62%	0.62	71%	0.705	S	S	*	*			trans	-54.5	108.3	179.7	-102	-26.6	0	0	0	110.8	K423 S427 F428	K423-N425 PolarHBondContact O-N 3.03Å; N425-S427 PolarHBondContact O-N 3.03Å; N425-F428 PolarHBondContact O-N 3.47Å
426	A	38.7	Very low	38.5	Very low	76 Å²	76	122.3 Å²	122.3	63%	0.628	69%	0.689	S	S	*	*	H	α-helix	trans	-60	-15.8	175.6	0	0	0	0	0	113.3	V424 F428 L430	V424-A426 PolarHBondContact O-N 3.07Å; A426-F428 VanDerWaalsContact C-N 3.3Å; A426-F428 PolarHBondContact O-N 3.29Å; A426-L430 PolarHBondContact O-N 3.25Å
427	S	44.5	Very low	39.1	Very low	77 Å²	77	124.2 Å²	124.2	54%	0.538	69%	0.689	S	S	.	*	H	α-helix	trans	-67.8	-24	172.9	30	0	0	0	0	113.6	N425	N425-S427 PolarHBondContact O-N 3.03Å
428	F	42.9	Very low	40.1	Very low	170 Å²	170	125.4 Å²	125.4	75%	0.746	69%	0.686	S	S	*	*	H	α-helix	trans	-81.9	-33.6	179.2	-135.4	-93.4	0	0	0	112.5	N425 A426 L432	N425-F428 PolarHBondContact O-N 3.47Å; A426-F428 VanDerWaalsContact C-N 3.3Å; A426-F428 PolarHBondContact O-N 3.29Å; F428-L432 PolarHBondContact O-N 2.97Å
429	L	44.4	Very low	40.8	Very low	110 Å²	110	122.3 Å²	122.3	58%	0.576	68%	0.675	S	S	*	*	H	α-helix	trans	-73.8	-28.9	176.3	-101.2	137.6	0	0	0	112.8	N433	L429-N433 PolarHBondContact O-ND2 3.42Å
430	L	45	Very low	41.5	Very low	127 Å²	127	126.9 Å²	126.9	67%	0.665	69%	0.693	S	S	*	*	H	α-helix	trans	-71.8	-37.3	176.4	-131.2	102.7	0	0	0	112	A426 N433 V434	A426-L430 PolarHBondContact O-N 3.25Å; L430-N433 PolarHBondContact O-N 3.36Å; L430-V434 WeakPolarHBondContact O-CG2 3.44Å; L430-V434 PolarHBondContact O-N 3.13Å
431	M	44.8	Very low	42	Very low	139 Å²	139	125.3 Å²	125.3	69%	0.685	69%	0.685	S	S	*	*	H	α-helix	trans	-71.3	-30	179	-69.7	-64.7	-104.5	0	0	112.7	V435	M431-V435 WeakPolarHBondContact O-CG2 3.47Å; M431-V435 PolarHBondContact O-N 3.34Å
432	L	44.8	Very low	42.6	Very low	118 Å²	118	126.9 Å²	126.9	62%	0.618	68%	0.68	S	S	*	*	H	α-helix	trans	-70	-35.2	177.4	-151.5	79.6	0	0	0	112.2	F428 V436	F428-L432 PolarHBondContact O-N 2.97Å; L432-V436 WeakPolarHBondContact O-CG2 3.45Å; L432-V436 PolarHBondContact O-N 3.13Å
433	N	42.1	Very low	43.3	Very low	104 Å²	104	120.6 Å²	120.6	56%	0.556	67%	0.667	S	S	*	*	H	α-helix	trans	-75.1	-29.1	179	-78.6	-46.5	0	0	0	113.4	L429 L430 M437	L429-N433 PolarHBondContact O-ND2 3.42Å; L430-N433 PolarHBondContact O-N 3.36Å; N433-M437 PolarHBondContact O-N 2.83Å
434	V	47.8	Very low	43.9	Very low	80 Å²	80	115.5 Å²	115.5	49%	0.485	65%	0.654	S	S	.	*	H	α-helix	trans	-71.6	-33.3	176.2	175.4	0	0	0	0	111.4	L430 L438	L430-V434 WeakPolarHBondContact O-CG2 3.44Å; L430-V434 PolarHBondContact O-N 3.13Å; V434-L438 HydrophobicContact CG1-CD1 4.36Å
435	V	47.2	Very low	44.3	Very low	91 Å²	91	116.3 Å²	116.3	55%	0.552	66%	0.655	S	S	*	*	H	α-helix	trans	-71.5	-32.3	176.9	175.7	0	0	0	0	112	M431	M431-V435 WeakPolarHBondContact O-CG2 3.47Å; M431-V435 PolarHBondContact O-N 3.34Å
436	V	47.2	Very low	44.6	Very low	92 Å²	92	116.3 Å²	116.3	56%	0.558	66%	0.658	S	S	*	*	H	α-helix	trans	-74.4	-32.2	177.9	175.4	0	0	0	0	112.2	L432 L438 A439	L432-V436 WeakPolarHBondContact O-CG2 3.45Å; L432-V436 PolarHBondContact O-N 3.13Å; V436-L438 VanDerWaalsContact C-N 3.33Å; V436-L438 PolarHBondContact O-N 3.32Å; V436-A439 PolarHBondContact O-N 3.41Å
437	M	44.8	Very low	45.1	Very low	157 Å²	157	119.1 Å²	119.1	77%	0.773	66%	0.66	S	S	*	*	H	α-helix	trans	-76.2	-15.8	178	-78.1	-67.2	-167.5	0	0	114.6	N433	N433-M437 PolarHBondContact O-N 2.83Å
438	L	45.3	Very low	45.1	Very low	145 Å²	145	122.4 Å²	122.4	76%	0.759	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	0.3	175.6	-78.4	161.9	0	0	0	113.4	V434 V436	V434-L438 HydrophobicContact CG1-CD1 4.36Å; V436-L438 VanDerWaalsContact C-N 3.33Å; V436-L438 PolarHBondContact O-N 3.32Å
439	A	46.6	Very low	45.3	Very low	73 Å²	73	118.4 Å²	118.4	60%	0.603	66%	0.663	S	S	*	*			trans	-110.6	-1.1	-175.3	0	0	0	0	0	115.2	V436	V436-A439 PolarHBondContact O-N 3.41Å
440	V	43.4	Very low	45.4	Very low	185 Å²	185	119.2 Å²	119.2	100%	1.121	67%	0.67	S	S	*	*			trans	-103.1	0	168.3	-175.9	0	0	0	0	108.2

Retrieved 440 of 440 residues in 102.9 ms (Link to these results)

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