A0A093H6Y3_STRCA Loading...

Leucine-rich repeat and fibronectin type-III domain-containing protein 2

AlphaFold DB , UniProt , Accession A0A093H6Y3, Species STRCA (Struthio camelus australis), Gene n/a, Length 764 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	50.9	Low	52.4	Low	215 Å²	215	132.7 Å²	132.7	100%	1.059	68%	0.68	S	S	*	*				0	-36.4	0	-73	-173.1	-78.8	0	0	112.6	K3 L4 L5	M1-K3 PolarHBondContact O-N 3.22Å; M1-K3 VanDerWaalsContact O-N 3.16Å; M1-L4 WeakPolarHBondContact O-CB 3.23Å; M1-L4 PolarHBondContact O-N 2.73Å; M1-L5 PolarHBondContact O-N 3.37Å
2	E	51.1	Low	51.7	Low	162 Å²	162	126.9 Å²	126.9	76%	0.757	68%	0.677	S	S	*	*	H	α-helix	trans	-48.4	-43.6	-174.1	-62.4	155.5	156.4	0	0	115.6	L4 L5 C6	E2-L4 PolarHBondContact O-N 2.69Å; E2-L5 WeakPolarHBondContact O-CA 2.99Å; E2-L5 WeakPolarHBondContact O-CB 3.48Å; E2-L5 PolarHBondContact O-N 3.12Å; E2-C6 PolarHBondContact O-N 3.09Å; E2-C6 PolarHBondContact O-SG 3.33Å
3	K	52.3	Low	51.4	Low	186 Å²	186	128.8 Å²	128.8	81%	0.809	68%	0.682	S	S	*	*	H	α-helix	trans	-58.6	-33.9	177.1	-70.8	-169.5	176	-174.8	0	113.5	M1 S7	M1-K3 PolarHBondContact O-N 3.22Å; M1-K3 VanDerWaalsContact O-N 3.16Å; K3-S7 PolarHBondContact O-N 2.61Å; K3-S7 VanDerWaalsContact O-N 3.08Å; K3-S7 PolarHBondContact O-OG 3.28Å
4	L	54.3	Low	50.9	Low	125 Å²	125	126.4 Å²	126.4	65%	0.654	69%	0.69	S	S	*	*	H	α-helix	trans	-72.2	-37.8	175.6	-154.6	81	0	0	0	111.1	M1 E2 S7 I8	M1-L4 WeakPolarHBondContact O-CB 3.23Å; M1-L4 PolarHBondContact O-N 2.73Å; E2-L4 PolarHBondContact O-N 2.69Å; L4-S7 PolarHBondContact O-N 2.85Å; L4-I8 HydrophobicContact CG-CD1 4.5Å; L4-I8 WeakPolarHBondContact O-CG1 3.36Å; L4-I8 PolarHBondContact O-N 3.28Å
5	L	54.5	Low	50.4	Low	112 Å²	112	127.5 Å²	127.5	59%	0.586	69%	0.693	S	S	*	*	H	α-helix	trans	-63.5	-43.7	175.4	-136.9	80.1	0	0	0	111.2	M1 E2 I8 L9	M1-L5 PolarHBondContact O-N 3.37Å; E2-L5 WeakPolarHBondContact O-CA 2.99Å; E2-L5 WeakPolarHBondContact O-CB 3.48Å; E2-L5 PolarHBondContact O-N 3.12Å; L5-I8 PolarHBondContact O-N 2.92Å; L5-L9 WeakPolarHBondContact O-CB 3.32Å; L5-L9 WeakPolarHBondContact O-CG 3.36Å; L5-L9 PolarHBondContact O-N 3.45Å
6	C	53.3	Low	50.2	Low	75 Å²	75	125.3 Å²	125.3	51%	0.507	69%	0.685	S	S	.	*	H	α-helix	trans	-62.9	-41.5	174	-66.2	0	0	0	0	112.1	E2 I8 L9 V10	E2-C6 PolarHBondContact O-N 3.09Å; E2-C6 PolarHBondContact O-SG 3.33Å; C6-I8 VanDerWaalsContact C-N 3.32Å; C6-I8 PolarHBondContact O-N 2.96Å; C6-L9 PolarHBondContact O-N 2.79Å; C6-V10 WeakPolarHBondContact O-CB 3.16Å; C6-V10 VanDerWaalsContact O-CG2 3.29Å; C6-V10 WeakPolarHBondContact O-CG2 3.36Å; C6-V10 PolarHBondContact O-N 2.72Å
7	S	52.4	Low	50.4	Low	68 Å²	68	125.4 Å²	125.4	48%	0.476	69%	0.69	S	S	.	*	H	α-helix	trans	-60.8	-39.5	174.7	-66.1	0	0	0	0	112.6	K3 L4 F11	K3-S7 PolarHBondContact O-N 2.61Å; K3-S7 VanDerWaalsContact O-N 3.08Å; K3-S7 PolarHBondContact O-OG 3.28Å; L4-S7 PolarHBondContact O-N 2.85Å; S7-F11 PolarHBondContact O-N 3.28Å
8	I	55.2	Low	51.1	Low	112 Å²	112	123.7 Å²	123.7	57%	0.574	68%	0.68	S	S	*	*	H	α-helix	trans	-71.2	-39.1	177.2	-67.2	165.3	0	0	0	111.2	L4 L5 C6 F11 G12	L4-I8 HydrophobicContact CG-CD1 4.5Å; L4-I8 WeakPolarHBondContact O-CG1 3.36Å; L4-I8 PolarHBondContact O-N 3.28Å; L5-I8 PolarHBondContact O-N 2.92Å; C6-I8 VanDerWaalsContact C-N 3.32Å; C6-I8 PolarHBondContact O-N 2.96Å; I8-F11 PolarHBondContact O-N 2.97Å; I8-G12 PolarHBondContact O-N 3.02Å
9	L	52.3	Low	52	Low	118 Å²	118	119.4 Å²	119.4	62%	0.618	66%	0.663	S	S	*	*	H	α-helix	trans	-68.5	-32.9	175.7	-74.5	165.8	0	0	0	112.9	L5 C6 G12	L5-L9 WeakPolarHBondContact O-CB 3.32Å; L5-L9 WeakPolarHBondContact O-CG 3.36Å; L5-L9 PolarHBondContact O-N 3.45Å; C6-L9 PolarHBondContact O-N 2.79Å; L9-G12 PolarHBondContact O-N 3.38Å
10	V	51.8	Low	53.7	Low	107 Å²	107	116.1 Å²	116.1	65%	0.648	65%	0.647	S	S	*	*	H	α-helix	trans	-73.6	-38.6	173.9	171	0	0	0	0	111.4	C6 G12 M13	C6-V10 WeakPolarHBondContact O-CB 3.16Å; C6-V10 VanDerWaalsContact O-CG2 3.29Å; C6-V10 WeakPolarHBondContact O-CG2 3.36Å; C6-V10 PolarHBondContact O-N 2.72Å; V10-G12 PolarHBondContact O-N 2.91Å; V10-M13 PolarHBondContact O-N 3.04Å
11	F	48.4	Very low	55.3	Low	180 Å²	180	110.7 Å²	110.7	79%	0.789	62%	0.618	S	S	*	*	H	α-helix	trans	-71.9	-15.7	170.2	-97.5	-84.1	0	0	0	113.9	S7 I8 M13	S7-F11 PolarHBondContact O-N 3.28Å; I8-F11 PolarHBondContact O-N 2.97Å; F11-M13 VanDerWaalsContact C-N 3.26Å
12	G	43.8	Very low	56.8	Low	63 Å²	63	109.1 Å²	109.1	65%	0.649	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-10	170.7	0	0	0	0	0	114	I8 L9 V10	I8-G12 PolarHBondContact O-N 3.02Å; L9-G12 PolarHBondContact O-N 3.38Å; V10-G12 PolarHBondContact O-N 2.91Å
13	M	48.4	Very low	58.4	Low	151 Å²	151	109 Å²	109	74%	0.744	60%	0.599	S	S	*	*	S	Bend	trans	-96	140.2	172.5	-71.1	-69.2	-151.9	0	0	110.5	V10 F11	V10-M13 PolarHBondContact O-N 3.04Å; F11-M13 VanDerWaalsContact C-N 3.26Å
14	A	44.6	Very low	60.2	Low	96 Å²	96	100.9 Å²	100.9	79%	0.793	57%	0.565	S	S	*	*	S	Bend	trans	67.3	36.6	175.1	0	0	0	0	0	117.6
15	I	43.4	Very low	62	Low	142 Å²	142	97.9 Å²	97.9	73%	0.728	55%	0.552	S	S	*	*			trans	-98.3	83.5	134.4	-54.2	-178.1	0	0	0	107.4	V17	I15-V17 HydrophobicContact CG2-CG2 3.96Å; I15-V17 PolarHBondContact O-N 3.28Å; I15-V17 VanDerWaalsContact O-N 3.08Å
16	T	47.2	Very low	63.6	Low	93 Å²	93	94.2 Å²	94.2	57%	0.571	54%	0.535	S	S	*	.			trans	-68	101.9	159.7	47	0	0	0	0	107	N18	T16-N18 VanDerWaalsContact C-N 3.31Å; T16-N18 PolarHBondContact O-N 2.72Å; T16-N18 PolarHBondContact O-OD1 3.4Å
17	V	53.3	Low	65.2	Low	126 Å²	126	95.5 Å²	95.5	76%	0.764	53%	0.533	S	S	*	.			trans	-69.4	95.7	169	-178.8	0	0	0	0	106.5	I15 A19	I15-V17 HydrophobicContact CG2-CG2 3.96Å; I15-V17 PolarHBondContact O-N 3.28Å; I15-V17 VanDerWaalsContact O-N 3.08Å; V17-A19 PolarHBondContact O-N 3.31Å
18	N	62.5	Low	66.7	Low	95 Å²	95	98 Å²	98	51%	0.508	54%	0.541	S	S	.	.			trans	-51.8	123.2	178.9	-64.3	0.2	0	0	0	108.9	T16 C20	T16-N18 VanDerWaalsContact C-N 3.31Å; T16-N18 PolarHBondContact O-N 2.72Å; T16-N18 PolarHBondContact O-OD1 3.4Å; N18-C20 PolarHBondContact O-N 3.14Å
19	A	69.3	Low	67.4	Low	43 Å²	43	95.4 Å²	95.4	36%	0.355	53%	0.528	S	S	.	.			trans	-74.7	92.3	-172.6	0	0	0	0	0	109.7	V17 D48 D50	V17-A19 PolarHBondContact O-N 3.31Å; A19-D48 CarbonylContact C-O 3.31Å; A19-D50 HydrophobicContact CB-CB 4.06Å; A19-D50 PolarHBondContact O-N 2.99Å
20	C	84.4	Confident	67.9	Low	52 Å²	52	95.5 Å²	95.5	35%	0.351	54%	0.539	S	S	.	.			trans	-110.5	118.8	-178.4	-165.2	0	0	0	0	110.9	N18 C26	N18-C20 PolarHBondContact O-N 3.14Å; C20-C26 WeakPolarHBondContact CA-SG 3.42Å; C20-C26 HydrophobicContact CB-CB 3.79Å; C20-C26 WeakPolarHBondContact CB-SG 3.45Å; C20-C26 WeakPolarHBondContact SG-CB 3.36Å; C20-C26 PolarHBondContact SG-N 2.97Å; C20-C26 CovalentContact SG-SG 2.04Å; C20-C26 PolarHBondContact SG-SG 3.1Å
21	P	87.5	Confident	68.7	Low	4 Å²	4	99.6 Å²	99.6	3%	0.026	55%	0.551	C	S	.	*			trans	-59.3	139.3	177.9	-24.7	32.8	0	0	0	112.5	Y23 C24 P46 D48 I49	P21-Y23 PolarHBondContact O-N 2.94Å; P21-C24 HydrophobicContact CB-CB 4.17Å; P21-C24 HydrophobicContact CG-CB 4.48Å; P21-C24 PolarHBondContact O-N 3.15Å; P21-P46 HydrophobicContact CB-CB 3.78Å; P21-P46 HydrophobicContact CB-CG 4.23Å; P21-P46 HydrophobicContact CG-CB 3.79Å; P21-P46 HydrophobicContact CG-CG 4.39Å; P21-D48 WeakPolarHBondContact CA-OD2 3.5Å; P21-D48 WeakPolarHBondContact CB-OD1 3.24Å; P21-I49 HydrophobicContact CG-CG1 3.74Å
22	K	83.4	Confident	70.3	Confident	181 Å²	181	92.7 Å²	92.7	79%	0.787	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-22.8	-170	-66.2	179	-179.1	173.5	0	116.6
23	Y	84.6	Confident	72.3	Confident	161 Å²	161	91.2 Å²	91.2	63%	0.631	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-8.8	-178.2	-54.1	-64.1	0	0	0	113.4	P21 K40 L42	P21-Y23 PolarHBondContact O-N 2.94Å; Y23-K40 WeakPolarHBondContact O-CD 3.01Å; Y23-K40 WeakPolarHBondContact O-CE 3.14Å; Y23-K40 PolarHBondContact O-NZ 2.92Å; Y23-L42 HydrophobicContact CD2-CD2 4.42Å
24	C	90.3	Very high	74.3	Confident	14 Å²	14	84 Å²	84	10%	0.095	47%	0.467	C	S	.	.	S	Bend	trans	-97.4	171.4	-177.8	-56.8	0	0	0	0	111.6	P21 T35 L36 C37	P21-C24 HydrophobicContact CB-CB 4.17Å; P21-C24 HydrophobicContact CG-CB 4.48Å; P21-C24 PolarHBondContact O-N 3.15Å; C24-T35 HydrophobicContact CB-CG2 4.43Å; C24-L36 CarbonylContact C-O 3.53Å; C24-L36 WeakPolarHBondContact CA-O 3.4Å; C24-L36 WeakPolarHBondContact CB-O 3.17Å; C24-C37 HydrophobicContact CB-CB 4.08Å; C24-C37 WeakPolarHBondContact CB-SG 3.45Å; C24-C37 WeakPolarHBondContact SG-CB 3.47Å; C24-C37 CovalentContact SG-SG 2.03Å; C24-C37 PolarHBondContact SG-SG 3.07Å
25	V	90.9	Very high	76.6	Confident	63 Å²	63	79.4 Å²	79.4	38%	0.382	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	109.4	179.5	178	0	0	0	0	107.5	Q27 L36	V25-Q27 HydrophobicContact CG1-CG 4.01Å; V25-Q27 VanDerWaalsContact CG1-NE2 3.32Å; V25-L36 PolarHBondContact N-O 2.85Å; V25-L36 WeakPolarHBondContact O-CB 3.39Å; V25-L36 PolarHBondContact O-N 2.77Å
26	C	89.8	Confident	78.9	Confident	35 Å²	35	74.4 Å²	74.4	24%	0.236	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	126.2	-178.2	-43.9	0	0	0	0	109.4	C20 G34	C20-C26 WeakPolarHBondContact CA-SG 3.42Å; C20-C26 HydrophobicContact CB-CB 3.79Å; C20-C26 WeakPolarHBondContact CB-SG 3.45Å; C20-C26 WeakPolarHBondContact SG-CB 3.36Å; C20-C26 PolarHBondContact SG-N 2.97Å; C20-C26 CovalentContact SG-SG 2.04Å; C20-C26 PolarHBondContact SG-SG 3.1Å; C26-G34 CarbonylContact C-O 3.53Å; C26-G34 VanDerWaalsContact CA-O 3.32Å; C26-G34 WeakPolarHBondContact CA-O 3.47Å
27	Q	85.9	Confident	81.2	Confident	101 Å²	101	70 Å²	70	47%	0.472	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	152.6	-173	-67.1	-176.4	6.3	0	0	110.7	V25 L29 G34	V25-Q27 HydrophobicContact CG1-CG 4.01Å; V25-Q27 VanDerWaalsContact CG1-NE2 3.32Å; Q27-L29 PolarHBondContact O-N 3.09Å; Q27-G34 PolarHBondContact N-O 3.48Å; Q27-G34 PolarHBondContact O-N 2.03Å
28	N	83.2	Confident	83	Confident	121 Å²	121	67 Å²	67	65%	0.647	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	97.3	169.9	-170.7	-10.9	0	0	0	108.4	E31 S32	N28-E31 WeakPolarHBondContact OD1-CA 3.26Å; N28-E31 PolarHBondContact OD1-N 3.31Å; N28-S32 CarbonylContact C-O 3.45Å; N28-S32 WeakPolarHBondContact CA-O 3.22Å; N28-S32 PolarHBondContact OD1-N 3.18Å; N28-S32 PolarHBondContact OD1-O 3.36Å
29	L	71	Confident	84.5	Confident	57 Å²	57	67 Å²	67	30%	0.298	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	106.3	177.7	-78	137.3	0	0	0	108.4	Q27 E31 S32 L36	Q27-L29 PolarHBondContact O-N 3.09Å; L29-E31 PolarHBondContact O-N 3.29Å; L29-S32 PolarHBondContact N-O 3.15Å; L29-S32 WeakPolarHBondContact O-CA 3.22Å; L29-S32 WeakPolarHBondContact O-CB 3.17Å; L29-S32 PolarHBondContact O-N 3.36Å; L29-S32 PolarHBondContact O-OG 2.97Å; L29-L36 HydrophobicContact CD1-CD1 4.47Å
30	S	63.3	Low	85.6	Confident	121 Å²	121	69.4 Å²	69.4	85%	0.846	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	47.3	173.2	-51.8	0	0	0	0	113.9	S32	S30-S32 PolarHBondContact O-N 3.11Å
31	E	68.4	Low	86	Confident	193 Å²	193	68.6 Å²	68.6	90%	0.902	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	-0.6	-174.9	-50.1	-171.8	158.3	0	0	115.8	N28 L29	N28-E31 WeakPolarHBondContact OD1-CA 3.26Å; N28-E31 PolarHBondContact OD1-N 3.31Å; L29-E31 PolarHBondContact O-N 3.29Å
32	S	80.5	Confident	86.3	Confident	35 Å²	35	69.3 Å²	69.3	25%	0.245	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	146.5	175.1	77.6	0	0	0	0	112.9	N28 L29 S30 G34	N28-S32 CarbonylContact C-O 3.45Å; N28-S32 WeakPolarHBondContact CA-O 3.22Å; N28-S32 PolarHBondContact OD1-N 3.18Å; N28-S32 PolarHBondContact OD1-O 3.36Å; L29-S32 PolarHBondContact N-O 3.15Å; L29-S32 WeakPolarHBondContact O-CA 3.22Å; L29-S32 WeakPolarHBondContact O-CB 3.17Å; L29-S32 PolarHBondContact O-N 3.36Å; L29-S32 PolarHBondContact O-OG 2.97Å; S30-S32 PolarHBondContact O-N 3.11Å; S32-G34 PolarHBondContact O-N 3.28Å
33	L	85.6	Confident	86.7	Confident	31 Å²	31	66 Å²	66	16%	0.162	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	113.1	179	179.8	63.1	0	0	0	110.7	D50 R52 T53 V54 E55	L33-D50 HydrophobicContact CD2-CB 3.91Å; L33-R52 HydrophobicContact CD2-CB 4.29Å; L33-T53 CarbonylContact O-C 3.57Å; L33-T53 WeakPolarHBondContact O-CA 3.31Å; L33-V54 PolarHBondContact O-N 3.14Å; L33-E55 PolarHBondContact O-N 2.82Å
34	G	90.8	Very high	87.2	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	135.8	172.6	0	0	0	0	0	112.6	C26 Q27 S32 E55	C26-G34 CarbonylContact C-O 3.53Å; C26-G34 VanDerWaalsContact CA-O 3.32Å; C26-G34 WeakPolarHBondContact CA-O 3.47Å; Q27-G34 PolarHBondContact N-O 3.48Å; Q27-G34 PolarHBondContact O-N 2.03Å; S32-G34 PolarHBondContact O-N 3.28Å; G34-E55 CarbonylContact C-O 3.19Å; G34-E55 VanDerWaalsContact CA-O 3.31Å; G34-E55 WeakPolarHBondContact CA-O 3.46Å
35	T	92.8	Very high	87.4	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	108.5	177.5	-66.5	0	0	0	0	109.4	C24 T53 E55 L56 R57	C24-T35 HydrophobicContact CB-CG2 4.43Å; T35-T53 PolarHBondContact OG1-OG1 3.13Å; T35-E55 PolarHBondContact N-O 2.87Å; T35-L56 HydrophobicContact CG2-CD1 3.85Å; T35-R57 PolarHBondContact O-N 3.35Å
36	L	93.2	Very high	87.4	Confident	36 Å²	36	61.6 Å²	61.6	19%	0.188	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	109.1	-171.9	-51.9	178.7	0	0	0	111.3	C24 V25 L29 R57	C24-L36 CarbonylContact C-O 3.53Å; C24-L36 WeakPolarHBondContact CA-O 3.4Å; C24-L36 WeakPolarHBondContact CB-O 3.17Å; V25-L36 PolarHBondContact N-O 2.85Å; V25-L36 WeakPolarHBondContact O-CB 3.39Å; V25-L36 PolarHBondContact O-N 2.77Å; L29-L36 HydrophobicContact CD1-CD1 4.47Å; L36-R57 HydrophobicContact CD2-CB 3.95Å; L36-R57 HydrophobicContact CD2-CG 3.72Å
37	C	93.6	Very high	87.3	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	36%	0.36	C	S	.	.			trans	-115.7	30.8	179.3	-56.7	0	0	0	0	114.9	C24 K40 L42 R57 L58 N61	C24-C37 HydrophobicContact CB-CB 4.08Å; C24-C37 WeakPolarHBondContact CB-SG 3.45Å; C24-C37 WeakPolarHBondContact SG-CB 3.47Å; C24-C37 CovalentContact SG-SG 2.03Å; C24-C37 PolarHBondContact SG-SG 3.07Å; C37-K40 WeakPolarHBondContact O-CG 3.22Å; C37-L42 HydrophobicContact CB-CD1 3.99Å; C37-R57 CarbonylContact C-O 3.54Å; C37-R57 VanDerWaalsContact CA-O 3.29Å; C37-R57 WeakPolarHBondContact CA-O 3.46Å; C37-R57 WeakPolarHBondContact CB-O 3.36Å; C37-R57 PolarHBondContact N-O 3.15Å; C37-L58 HydrophobicContact CB-CD2 3.76Å; C37-N61 PolarHBondContact O-ND2 3.26Å
38	P	92.3	Very high	87.5	Confident	64 Å²	64	64.4 Å²	64.4	42%	0.416	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	140.3	-173.1	30.7	-36.4	0	0	0	112.8	K40 G59	P38-K40 VanDerWaalsContact C-N 3.35Å; P38-K40 WeakPolarHBondContact O-CE 3.01Å; P38-K40 WeakPolarHBondContact O-CG 3.46Å; P38-K40 PolarHBondContact O-N 3.09Å; P38-G59 VanDerWaalsContact CA-O 3.3Å; P38-G59 WeakPolarHBondContact CA-O 3.28Å
39	S	93.1	Very high	87.8	Confident	95 Å²	95	58.9 Å²	58.9	66%	0.664	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	46.2	173.1	-55.1	0	0	0	0	115	G59 G60	S39-G59 PolarHBondContact N-O 3.27Å; S39-G59 VanDerWaalsContact N-O 3.15Å; S39-G60 WeakPolarHBondContact CA-O 3Å
40	K	92.5	Very high	88.7	Confident	93 Å²	93	57.4 Å²	57.4	40%	0.404	32%	0.321	S	S	.	.	S	Bend	trans	-99.4	-5	179.7	-57	-57.8	179.6	160.9	0	114	Y23 C37 P38 L42 N61	Y23-K40 WeakPolarHBondContact O-CD 3.01Å; Y23-K40 WeakPolarHBondContact O-CE 3.14Å; Y23-K40 PolarHBondContact O-NZ 2.92Å; C37-K40 WeakPolarHBondContact O-CG 3.22Å; P38-K40 VanDerWaalsContact C-N 3.35Å; P38-K40 WeakPolarHBondContact O-CE 3.01Å; P38-K40 WeakPolarHBondContact O-CG 3.46Å; P38-K40 PolarHBondContact O-N 3.09Å; K40-L42 HydrophobicContact CB-CD1 4.46Å; K40-L42 HydrophobicContact CB-CD2 4.45Å; K40-L42 HydrophobicContact CB-CG 4.04Å; K40-N61 WeakPolarHBondContact CA-OD1 3.01Å; K40-N61 PolarHBondContact N-OD1 3.38Å
41	G	92.7	Very high	90.1	Very high	36 Å²	36	54.7 Å²	54.7	37%	0.371	29%	0.292	S	S	.	.			trans	74.1	25.7	-177	0	0	0	0	0	113.9	N61	G41-N61 PolarHBondContact N-OD1 3.13Å
42	L	93.6	Very high	91.1	Very high	19 Å²	19	54.2 Å²	54.2	10%	0.099	28%	0.282	C	S	.	.			trans	-65.6	133.6	179.5	-59.1	171.6	0	0	0	110.9	Y23 C37 K40 P46 L58 N61 F62 I63	Y23-L42 HydrophobicContact CD2-CD2 4.42Å; C37-L42 HydrophobicContact CB-CD1 3.99Å; K40-L42 HydrophobicContact CB-CD1 4.46Å; K40-L42 HydrophobicContact CB-CD2 4.45Å; K40-L42 HydrophobicContact CB-CG 4.04Å; L42-P46 HydrophobicContact CD1-CG 3.89Å; L42-P46 HydrophobicContact CD2-CG 4.34Å; L42-L58 HydrophobicContact CD1-CD2 4Å; L42-N61 HydrophobicContact CB-CB 4.06Å; L42-N61 PolarHBondContact N-OD1 2.85Å; L42-F62 CarbonylContact O-C 3.45Å; L42-F62 WeakPolarHBondContact O-CA 3.44Å; L42-F62 PolarHBondContact O-N 2.92Å; L42-I63 PolarHBondContact O-N 3.01Å
43	L	93	Very high	91.6	Very high	110 Å²	110	52.5 Å²	52.5	58%	0.576	27%	0.27	S	S	*	.	S	Bend	trans	-93.8	-13.9	176.3	-64.8	169.1	0	0	0	113	F62	L43-F62 HydrophobicContact CD2-CB 4.01Å
44	F	94.1	Very high	92	Very high	137 Å²	137	53.1 Å²	53.1	60%	0.601	28%	0.275	S	S	*	.	S	Bend	trans	-153.5	160.7	-175.6	51.3	-94.2	0	0	0	109.2
45	V	94.7	Very high	92.1	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.012	28%	0.281	C	S	.	.			trans	-69	130	174.8	-176	0	0	0	0	109.6	L47 I49 L58 I63 D70 F71	V45-L47 PolarHBondContact O-N 3.11Å; V45-I49 HydrophobicContact CG1-CD1 3.78Å; V45-L58 HydrophobicContact CG1-CD1 3.97Å; V45-L58 HydrophobicContact CG2-CD1 4.33Å; V45-I63 HydrophobicContact CG2-CD1 4.22Å; V45-I63 HydrophobicContact CG2-CG2 4.49Å; V45-D70 HydrophobicContact CB-CB 3.82Å; V45-D70 HydrophobicContact CG1-CB 4Å; V45-D70 HydrophobicContact CG2-CB 3.97Å; V45-D70 WeakPolarHBondContact CG2-OD2 3.48Å; V45-F71 HydrophobicContact CG1-CE1 4.08Å; V45-F71 HydrophobicContact CG1-CZ 4.33Å; V45-F71 HydrophobicContact CG2-CE1 4.47Å; V45-F71 HydrophobicContact CG2-CZ 3.9Å
46	P	92.3	Very high	92.3	Very high	7 Å²	7	54.5 Å²	54.5	5%	0.045	28%	0.281	C	S	.	.			trans	-62.2	130.6	177.2	-22.3	32.6	0	0	0	112.3	P21 L42 D48 I49	P21-P46 HydrophobicContact CB-CB 3.78Å; P21-P46 HydrophobicContact CB-CG 4.23Å; P21-P46 HydrophobicContact CG-CB 3.79Å; P21-P46 HydrophobicContact CG-CG 4.39Å; L42-P46 HydrophobicContact CD1-CG 3.89Å; L42-P46 HydrophobicContact CD2-CG 4.34Å; P46-D48 VanDerWaalsContact C-N 3.26Å; P46-D48 WeakPolarHBondContact CB-OD1 3.47Å; P46-D48 PolarHBondContact O-N 2.85Å; P46-I49 HydrophobicContact CB-CD1 4.45Å; P46-I49 HydrophobicContact CB-CG1 4.26Å; P46-I49 VanDerWaalsContact O-CD1 3.26Å; P46-I49 WeakPolarHBondContact O-CD1 3.34Å; P46-I49 WeakPolarHBondContact O-CG1 3.45Å
47	L	87.4	Confident	92.4	Very high	117 Å²	117	58.4 Å²	58.4	61%	0.613	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-19.1	-179.8	-62.8	174.7	0	0	0	113	V45 I49 R51	V45-L47 PolarHBondContact O-N 3.11Å; L47-I49 PolarHBondContact O-N 2.97Å; L47-R51 PolarHBondContact O-NH2 2.82Å
48	D	89	Confident	92.5	Very high	78 Å²	78	58.4 Å²	58.4	42%	0.417	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	25.7	-174.5	56.2	-22.6	0	0	0	114.3	A19 P21 P46	A19-D48 CarbonylContact C-O 3.31Å; P21-D48 WeakPolarHBondContact CA-OD2 3.5Å; P21-D48 WeakPolarHBondContact CB-OD1 3.24Å; P46-D48 VanDerWaalsContact C-N 3.26Å; P46-D48 WeakPolarHBondContact CB-OD1 3.47Å; P46-D48 PolarHBondContact O-N 2.85Å
49	I	90.8	Very high	92.6	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.026	28%	0.277	C	S	.	.			trans	-76.8	132.4	173	-64.3	166.5	0	0	0	110.9	P21 V45 P46 L47 R51 L56 M74	P21-I49 HydrophobicContact CG-CG1 3.74Å; V45-I49 HydrophobicContact CG1-CD1 3.78Å; P46-I49 HydrophobicContact CB-CD1 4.45Å; P46-I49 HydrophobicContact CB-CG1 4.26Å; P46-I49 VanDerWaalsContact O-CD1 3.26Å; P46-I49 WeakPolarHBondContact O-CD1 3.34Å; P46-I49 WeakPolarHBondContact O-CG1 3.45Å; L47-I49 PolarHBondContact O-N 2.97Å; I49-R51 PolarHBondContact O-N 2.84Å; I49-L56 HydrophobicContact CD1-CD1 4.07Å; I49-L56 HydrophobicContact CD1-CD2 4.08Å; I49-M74 HydrophobicContact CG2-CE 3.88Å; I49-M74 HydrophobicContact CG2-SD 4.37Å
50	D	90.1	Very high	92.7	Very high	27 Å²	27	52.3 Å²	52.3	14%	0.144	26%	0.258	C	S	.	.			trans	-62.8	121.5	169.6	-162.9	-38.4	0	0	0	111.1	A19 L33 R52 T53	A19-D50 HydrophobicContact CB-CB 4.06Å; A19-D50 PolarHBondContact O-N 2.99Å; L33-D50 HydrophobicContact CD2-CB 3.91Å; D50-R52 PolarHBondContact O-N 2.81Å; D50-R52 VanDerWaalsContact O-N 3.12Å; D50-R52 WeakPolarHBondContact OD1-CB 3.35Å; D50-R52 WeakPolarHBondContact OD1-CG 3.2Å; D50-R52 PolarHBondContact OD1-N 3.23Å; D50-T53 VanDerWaalsContact O-CB 3.26Å; D50-T53 WeakPolarHBondContact O-CB 3.3Å; D50-T53 PolarHBondContact O-N 3.14Å; D50-T53 PolarHBondContact O-OG1 2.89Å
51	R	91.3	Very high	92.9	Very high	64 Å²	64	48 Å²	48	24%	0.242	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-5.9	-177.6	-53.8	-60	168.9	169.1	-10.9	113.8	L47 I49 T53 D70 A72 M74	L47-R51 PolarHBondContact O-NH2 2.82Å; I49-R51 PolarHBondContact O-N 2.84Å; R51-T53 VanDerWaalsContact C-N 3.33Å; R51-D70 PolarHBondContact NH1-O 3.09Å; R51-A72 WeakPolarHBondContact CD-O 3.27Å; R51-A72 PolarHBondContact NH1-O 2.78Å; R51-A72 VanDerWaalsContact NH1-O 3.12Å; R51-M74 HydrophobicContact CB-CG 4.27Å; R51-M74 VanDerWaalsContact CD-CG 3.47Å; R51-M74 HydrophobicContact CG-CG 4.47Å
52	R	89.6	Confident	93.1	Very high	182 Å²	182	51.9 Å²	51.9	69%	0.687	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	4.3	170.1	-56.7	173.1	-179.5	-177.4	0.7	113.4	L33 D50 V54	L33-R52 HydrophobicContact CD2-CB 4.29Å; D50-R52 PolarHBondContact O-N 2.81Å; D50-R52 VanDerWaalsContact O-N 3.12Å; D50-R52 WeakPolarHBondContact OD1-CB 3.35Å; D50-R52 WeakPolarHBondContact OD1-CG 3.2Å; D50-R52 PolarHBondContact OD1-N 3.23Å; R52-V54 PolarHBondContact O-N 3.3Å
53	T	91.4	Very high	93.2	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.241	C	C	.	.			trans	-62.7	126.4	176.2	-63.4	0	0	0	0	110.3	L33 T35 D50 R51 E55 L56 L77	L33-T53 CarbonylContact O-C 3.57Å; L33-T53 WeakPolarHBondContact O-CA 3.31Å; T35-T53 PolarHBondContact OG1-OG1 3.13Å; D50-T53 VanDerWaalsContact O-CB 3.26Å; D50-T53 WeakPolarHBondContact O-CB 3.3Å; D50-T53 PolarHBondContact O-N 3.14Å; D50-T53 PolarHBondContact O-OG1 2.89Å; R51-T53 VanDerWaalsContact C-N 3.33Å; T53-E55 WeakPolarHBondContact CG2-O 3.29Å; T53-L56 HydrophobicContact CG2-CB 4.06Å; T53-L77 HydrophobicContact CG2-CD1 4.16Å; T53-L77 WeakPolarHBondContact O-CD1 3.48Å
54	V	93.8	Very high	93.3	Very high	44 Å²	44	49.6 Å²	49.6	27%	0.267	23%	0.234	S	C	.	.	S	Bend	trans	-92.4	-28.5	176.6	-179.7	0	0	0	0	111.3	L33 R52 V78 D79	L33-V54 PolarHBondContact O-N 3.14Å; R52-V54 PolarHBondContact O-N 3.3Å; V54-V78 HydrophobicContact CG1-CB 4.03Å; V54-V78 HydrophobicContact CG1-CG2 3.83Å; V54-V78 PolarHBondContact O-N 3.44Å; V54-D79 PolarHBondContact O-N 3.04Å
55	E	94.1	Very high	93.4	Very high	28 Å²	28	47.3 Å²	47.3	13%	0.131	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	117.7	-178.8	-177.8	-173.2	172.6	0	0	110.5	L33 G34 T35 T53 R57 D79	L33-E55 PolarHBondContact O-N 2.82Å; G34-E55 CarbonylContact C-O 3.19Å; G34-E55 VanDerWaalsContact CA-O 3.31Å; G34-E55 WeakPolarHBondContact CA-O 3.46Å; T35-E55 PolarHBondContact N-O 2.87Å; T53-E55 WeakPolarHBondContact CG2-O 3.29Å; E55-R57 HydrophobicContact CG-CG 4.42Å; E55-R57 IonicContact OE1-CZ 3.32Å; E55-R57 IonicContact OE1-NE 2.78Å; E55-R57 PolarHBondContact OE1-NE 2.79Å; E55-R57 IonicContact OE1-NH2 3.26Å; E55-R57 PolarHBondContact OE1-NH2 2.02Å; E55-D79 HydrophobicContact CG-CB 4.38Å
56	L	95	Very high	93.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	105.9	-175.8	179.3	54.7	0	0	0	111.6	T35 I49 T53 L58 F71 M74 L77 D79 L80 T81	T35-L56 HydrophobicContact CG2-CD1 3.85Å; I49-L56 HydrophobicContact CD1-CD1 4.07Å; I49-L56 HydrophobicContact CD1-CD2 4.08Å; T53-L56 HydrophobicContact CG2-CB 4.06Å; L56-L58 HydrophobicContact CD1-CD1 4.12Å; L56-L58 HydrophobicContact CD1-CG 4.03Å; L56-L58 HydrophobicContact CD2-CD1 3.91Å; L56-L58 HydrophobicContact CG-CD1 3.85Å; L56-L58 HydrophobicContact CG-CG 4.13Å; L56-F71 HydrophobicContact CD2-CD1 4.03Å; L56-F71 HydrophobicContact CD2-CE1 3.75Å; L56-M74 HydrophobicContact CD2-CE 4.19Å; L56-L77 HydrophobicContact CB-CD1 3.67Å; L56-D79 PolarHBondContact N-O 3.35Å; L56-L80 HydrophobicContact CB-CD1 4.13Å; L56-L80 HydrophobicContact CD2-CD1 3.99Å; L56-L80 HydrophobicContact CG-CD1 4.01Å; L56-T81 PolarHBondContact O-N 3.06Å
57	R	95.5	Very high	93.6	Very high	118 Å²	118	48.8 Å²	48.8	45%	0.445	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	100.6	-179.8	-56.7	-159	-166.2	-163.8	1.6	112.5	T35 L36 C37 E55	T35-R57 PolarHBondContact O-N 3.35Å; L36-R57 HydrophobicContact CD2-CB 3.95Å; L36-R57 HydrophobicContact CD2-CG 3.72Å; C37-R57 CarbonylContact C-O 3.54Å; C37-R57 VanDerWaalsContact CA-O 3.29Å; C37-R57 WeakPolarHBondContact CA-O 3.46Å; C37-R57 WeakPolarHBondContact CB-O 3.36Å; C37-R57 PolarHBondContact N-O 3.15Å; E55-R57 HydrophobicContact CG-CG 4.42Å; E55-R57 IonicContact OE1-CZ 3.32Å; E55-R57 IonicContact OE1-NE 2.78Å; E55-R57 PolarHBondContact OE1-NE 2.79Å; E55-R57 IonicContact OE1-NH2 3.26Å; E55-R57 PolarHBondContact OE1-NH2 2.02Å
58	L	95.8	Very high	93.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.23	C	C	.	.			trans	-105.7	10.2	178.5	-73.2	160.7	0	0	0	113.4	C37 L42 V45 L56 N61 I63 F71 T81 L82 N85	C37-L58 HydrophobicContact CB-CD2 3.76Å; L42-L58 HydrophobicContact CD1-CD2 4Å; V45-L58 HydrophobicContact CG1-CD1 3.97Å; V45-L58 HydrophobicContact CG2-CD1 4.33Å; L56-L58 HydrophobicContact CD1-CD1 4.12Å; L56-L58 HydrophobicContact CD1-CG 4.03Å; L56-L58 HydrophobicContact CD2-CD1 3.91Å; L56-L58 HydrophobicContact CG-CD1 3.85Å; L56-L58 HydrophobicContact CG-CG 4.13Å; L58-N61 PolarHBondContact O-ND2 3.2Å; L58-I63 HydrophobicContact CB-CD1 4.24Å; L58-I63 HydrophobicContact CD2-CD1 4.43Å; L58-F71 HydrophobicContact CD1-CE1 3.96Å; L58-F71 HydrophobicContact CD1-CZ 4.21Å; L58-T81 CarbonylContact C-O 3.38Å; L58-T81 WeakPolarHBondContact CA-O 3.34Å; L58-T81 PolarHBondContact N-O 3.11Å; L58-L82 HydrophobicContact CB-CD2 3.82Å; L58-L82 HydrophobicContact CD1-CD2 3.91Å; L58-N85 PolarHBondContact O-ND2 2.94Å
59	G	94.6	Very high	94.1	Very high	8 Å²	8	51.9 Å²	51.9	8%	0.082	24%	0.242	C	C	.	.			trans	-70.4	153.8	-174	0	0	0	0	0	115.9	P38 S39 N61 T81 S83	P38-G59 VanDerWaalsContact CA-O 3.3Å; P38-G59 WeakPolarHBondContact CA-O 3.28Å; S39-G59 PolarHBondContact N-O 3.27Å; S39-G59 VanDerWaalsContact N-O 3.15Å; G59-N61 PolarHBondContact O-ND2 2.85Å; G59-T81 PolarHBondContact N-O 2.83Å; G59-T81 VanDerWaalsContact N-O 3.16Å; G59-S83 CarbonylContact C-O 3.14Å; G59-S83 WeakPolarHBondContact CA-O 3.31Å
60	G	95.6	Very high	94.3	Very high	24 Å²	24	52.2 Å²	52.2	25%	0.247	24%	0.243	C	C	.	.	S	Bend	trans	76.7	22.3	179.2	0	0	0	0	0	114.7	S39 S83 R84	S39-G60 WeakPolarHBondContact CA-O 3Å; G60-S83 PolarHBondContact N-O 2.91Å; G60-R84 CarbonylContact C-O 3.57Å; G60-R84 WeakPolarHBondContact CA-O 3.47Å; G60-R84 PolarHBondContact N-O 3.32Å; G60-R84 VanDerWaalsContact N-O 3.15Å
61	N	96.2	Very high	94.5	Very high	3 Å²	3	51 Å²	51	2%	0.016	24%	0.237	C	C	.	.	S	Bend	trans	-105.9	-164	179.3	-72.8	-70.5	0	0	0	110.9	C37 K40 G41 L42 L58 G59 I63 R84 N85	C37-N61 PolarHBondContact O-ND2 3.26Å; K40-N61 WeakPolarHBondContact CA-OD1 3.01Å; K40-N61 PolarHBondContact N-OD1 3.38Å; G41-N61 PolarHBondContact N-OD1 3.13Å; L42-N61 HydrophobicContact CB-CB 4.06Å; L42-N61 PolarHBondContact N-OD1 2.85Å; L58-N61 PolarHBondContact O-ND2 3.2Å; G59-N61 PolarHBondContact O-ND2 2.85Å; N61-I63 HydrophobicContact CB-CG1 4.33Å; N61-R84 PolarHBondContact N-O 3.25Å; N61-N85 WeakPolarHBondContact CA-OD1 3.42Å; N61-N85 WeakPolarHBondContact CB-OD1 3.21Å; N61-N85 PolarHBondContact N-OD1 2.79Å; N61-N85 PolarHBondContact O-OD1 2.81Å
62	F	96.8	Very high	94.6	Very high	117 Å²	117	49.5 Å²	49.5	51%	0.513	24%	0.238	S	C	.	.			trans	-123.8	36.2	-179	-55	-58.8	0	0	0	111.1	L42 L43 I64 N85 T86	L42-F62 CarbonylContact O-C 3.45Å; L42-F62 WeakPolarHBondContact O-CA 3.44Å; L42-F62 PolarHBondContact O-N 2.92Å; L43-F62 HydrophobicContact CD2-CB 4.01Å; F62-I64 WeakPolarHBondContact O-CG1 3.37Å; F62-N85 PolarHBondContact N-OD1 2.61Å; F62-T86 VanDerWaalsContact C-OG1 3.29Å; F62-T86 PolarHBondContact O-OG1 2.86Å
63	I	96.7	Very high	94.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.235	C	C	.	.			trans	-66.5	133.6	177.4	-58.3	169.8	0	0	0	108.2	L42 V45 L58 N61 L82 N85 T86 I87	L42-I63 PolarHBondContact O-N 3.01Å; V45-I63 HydrophobicContact CG2-CD1 4.22Å; V45-I63 HydrophobicContact CG2-CG2 4.49Å; L58-I63 HydrophobicContact CB-CD1 4.24Å; L58-I63 HydrophobicContact CD2-CD1 4.43Å; N61-I63 HydrophobicContact CB-CG1 4.33Å; I63-L82 HydrophobicContact CD1-CD2 4.4Å; I63-N85 HydrophobicContact CB-CB 4.41Å; I63-N85 WeakPolarHBondContact CB-OD1 3.5Å; I63-N85 WeakPolarHBondContact CG1-OD1 3.29Å; I63-N85 PolarHBondContact N-OD1 3.34Å; I63-T86 CarbonylContact O-C 3.21Å; I63-T86 VanDerWaalsContact O-CA 3.32Å; I63-T86 WeakPolarHBondContact O-CA 3.1Å; I63-T86 PolarHBondContact O-N 3.05Å; I63-T86 PolarHBondContact O-OG1 3.49Å; I63-I87 HydrophobicContact CB-CG1 4.25Å; I63-I87 HydrophobicContact CG2-CG1 4.11Å; I63-I87 PolarHBondContact O-N 2.7Å; I63-I87 VanDerWaalsContact O-N 3.11Å
64	I	94.9	Very high	94.9	Very high	81 Å²	81	46.4 Å²	46.4	42%	0.415	24%	0.235	S	C	.	.			trans	-108.8	-41.6	-175	-51.3	178	0	0	0	111.6	F62 I87 S88	F62-I64 WeakPolarHBondContact O-CG1 3.37Å; I64-I87 CarbonylContact O-C 3.58Å; I64-I87 VanDerWaalsContact O-CA 3.3Å; I64-I87 WeakPolarHBondContact O-CA 3.26Å; I64-S88 PolarHBondContact O-N 3.33Å; I64-S88 PolarHBondContact O-OG 3.28Å
65	N	96	Very high	94.8	Very high	88 Å²	88	47 Å²	47	47%	0.471	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147.4	-179.8	-65.3	-7.6	0	0	0	109.7	Y89	N65-Y89 WeakPolarHBondContact CA-O 3.44Å
66	I	96.5	Very high	94.7	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	131.8	164.6	-65.3	174.1	0	0	0	108.7	D70 F71 L82 I87 Y89 I90 Q91 F95 L106	I66-D70 WeakPolarHBondContact CA-OD2 3.36Å; I66-F71 HydrophobicContact CD1-CE2 4.16Å; I66-F71 HydrophobicContact CG1-CE2 4.36Å; I66-F71 HydrophobicContact CG2-CD2 4Å; I66-F71 HydrophobicContact CG2-CE2 3.62Å; I66-L82 HydrophobicContact CD1-CD1 3.8Å; I66-I87 HydrophobicContact CD1-CD1 4.19Å; I66-I87 HydrophobicContact CD1-CG2 4.36Å; I66-I87 HydrophobicContact CG1-CD1 4.48Å; I66-I87 HydrophobicContact CG1-CG2 4.32Å; I66-Y89 PolarHBondContact N-O 2.93Å; I66-I90 HydrophobicContact CB-CB 4.48Å; I66-I90 HydrophobicContact CB-CG1 4.44Å; I66-I90 HydrophobicContact CB-CG2 4.09Å; I66-I90 HydrophobicContact CD1-CD1 4.07Å; I66-I90 HydrophobicContact CD1-CG1 4.02Å; I66-I90 HydrophobicContact CD1-CG2 4.4Å; I66-I90 HydrophobicContact CG2-CG2 4.17Å; I66-Q91 WeakPolarHBondContact O-CB 3.45Å; I66-Q91 PolarHBondContact O-N 3.05Å; I66-F95 HydrophobicContact CD1-CE1 4.3Å; I66-F95 HydrophobicContact CD1-CZ 3.93Å; I66-L106 HydrophobicContact CD1-CD2 4.5Å
67	S	95.1	Very high	94.7	Very high	38 Å²	38	47.3 Å²	47.3	27%	0.266	25%	0.252	S	S	.	.			trans	-103.7	156.5	173.4	100.6	0	0	0	0	112.2	Q69 D70	S67-Q69 PolarHBondContact O-N 3.25Å; S67-Q69 VanDerWaalsContact O-N 3.09Å; S67-Q69 PolarHBondContact OG-N 2.82Å; S67-Q69 VanDerWaalsContact OG-N 3.15Å; S67-D70 WeakPolarHBondContact CB-OD1 3.12Å; S67-D70 PolarHBondContact N-OD2 2.88Å; S67-D70 VanDerWaalsContact O-CB 3.3Å; S67-D70 WeakPolarHBondContact O-CB 3.34Å; S67-D70 VanDerWaalsContact O-CG 3.27Å; S67-D70 PolarHBondContact O-N 3.27Å; S67-D70 PolarHBondContact OG-OD1 3.46Å
68	R	93.5	Very high	94.7	Very high	120 Å²	120	43.9 Å²	43.9	45%	0.453	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-17.4	176.5	-173.7	167.6	-174.8	-152.7	-3.8	113.9	Y93 S94	R68-Y93 WeakPolarHBondContact CG-O 2.97Å; R68-Y93 PolarHBondContact NE-O 3.49Å; R68-S94 PolarHBondContact N-OG 2.99Å
69	Q	92.8	Very high	94.8	Very high	141 Å²	141	45.5 Å²	45.5	66%	0.659	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-14.4	177.5	-61.2	-175.8	12.1	0	0	113.2	S67	S67-Q69 PolarHBondContact O-N 3.25Å; S67-Q69 VanDerWaalsContact O-N 3.09Å; S67-Q69 PolarHBondContact OG-N 2.82Å; S67-Q69 VanDerWaalsContact OG-N 3.15Å
70	D	94.9	Very high	94.9	Very high	12 Å²	12	45.1 Å²	45.1	6%	0.064	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-48.8	-172.1	-62.5	3.3	0	0	0	110.4	V45 R51 I66 S67	V45-D70 HydrophobicContact CB-CB 3.82Å; V45-D70 HydrophobicContact CG1-CB 4Å; V45-D70 HydrophobicContact CG2-CB 3.97Å; V45-D70 WeakPolarHBondContact CG2-OD2 3.48Å; R51-D70 PolarHBondContact NH1-O 3.09Å; I66-D70 WeakPolarHBondContact CA-OD2 3.36Å; S67-D70 WeakPolarHBondContact CB-OD1 3.12Å; S67-D70 PolarHBondContact N-OD2 2.88Å; S67-D70 VanDerWaalsContact O-CB 3.3Å; S67-D70 WeakPolarHBondContact O-CB 3.34Å; S67-D70 VanDerWaalsContact O-CG 3.27Å; S67-D70 PolarHBondContact O-N 3.27Å; S67-D70 PolarHBondContact OG-OD1 3.46Å
71	F	95.3	Very high	95	Very high	1 Å²	1	45 Å²	45	0%	0.004	24%	0.243	C	C	.	.	S	Bend	trans	-110.2	9.3	-177	-51.5	-61.6	0	0	0	114.2	V45 L56 L58 I66 M74 L80 L82 F95 L98	V45-F71 HydrophobicContact CG1-CE1 4.08Å; V45-F71 HydrophobicContact CG1-CZ 4.33Å; V45-F71 HydrophobicContact CG2-CE1 4.47Å; V45-F71 HydrophobicContact CG2-CZ 3.9Å; L56-F71 HydrophobicContact CD2-CD1 4.03Å; L56-F71 HydrophobicContact CD2-CE1 3.75Å; L58-F71 HydrophobicContact CD1-CE1 3.96Å; L58-F71 HydrophobicContact CD1-CZ 4.21Å; I66-F71 HydrophobicContact CD1-CE2 4.16Å; I66-F71 HydrophobicContact CG1-CE2 4.36Å; I66-F71 HydrophobicContact CG2-CD2 4Å; I66-F71 HydrophobicContact CG2-CE2 3.62Å; F71-M74 WeakPolarHBondContact O-CB 3.22Å; F71-M74 WeakPolarHBondContact O-CG 3.42Å; F71-M74 PolarHBondContact O-N 3.13Å; F71-L80 HydrophobicContact CD1-CD1 4.46Å; F71-L80 HydrophobicContact CD1-CD2 4.29Å; F71-L80 HydrophobicContact CD2-CD2 4.43Å; F71-L80 HydrophobicContact CE1-CD1 3.84Å; F71-L80 HydrophobicContact CE1-CD2 4.17Å; F71-L80 HydrophobicContact CE2-CD2 4.31Å; F71-L80 HydrophobicContact CG-CD2 4.42Å; F71-L80 HydrophobicContact CZ-CD1 4.16Å; F71-L80 HydrophobicContact CZ-CD2 4.19Å; F71-L82 HydrophobicContact CE2-CD1 4.27Å; F71-L82 HydrophobicContact CZ-CD1 4.04Å; F71-L82 HydrophobicContact CZ-CD2 4.19Å; F71-F95 AromaticContact CD2-CD1 3.98Å; F71-F95 HydrophobicContact CD2-CD1 3.98Å; F71-F95 AromaticContact CD2-CE1 3.73Å; F71-F95 HydrophobicContact CD2-CE1 3.73Å; F71-F95 AromaticContact CE2-CE1 3.82Å; F71-F95 HydrophobicContact CE2-CE1 3.82Å; F71-L98 HydrophobicContact CB-CD1 4.18Å; F71-L98 HydrophobicContact CB-CD2 4.2Å; F71-L98 HydrophobicContact CB-CG 4.49Å
72	A	93.6	Very high	95	Very high	32 Å²	32	44.8 Å²	44.8	26%	0.264	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	139.7	179.1	0	0	0	0	0	112.6	R51 M74 D97	R51-A72 WeakPolarHBondContact CD-O 3.27Å; R51-A72 PolarHBondContact NH1-O 2.78Å; R51-A72 VanDerWaalsContact NH1-O 3.12Å; A72-M74 VanDerWaalsContact C-N 3.28Å; A72-M74 PolarHBondContact O-N 2.63Å; A72-D97 WeakPolarHBondContact CA-OD2 3.4Å
73	N	93.4	Very high	95.1	Very high	117 Å²	117	39.4 Å²	39.4	63%	0.626	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	36	177.8	-169.2	55.8	0	0	0	114.2	D97	N73-D97 PolarHBondContact N-OD2 2.78Å
74	M	93.5	Very high	95.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.245	C	C	.	.			trans	-107.1	44	177.5	-62.6	-169	63.5	0	0	112.7	I49 R51 L56 F71 A72 G76 L77 L98	I49-M74 HydrophobicContact CG2-CE 3.88Å; I49-M74 HydrophobicContact CG2-SD 4.37Å; R51-M74 HydrophobicContact CB-CG 4.27Å; R51-M74 VanDerWaalsContact CD-CG 3.47Å; R51-M74 HydrophobicContact CG-CG 4.47Å; L56-M74 HydrophobicContact CD2-CE 4.19Å; F71-M74 WeakPolarHBondContact O-CB 3.22Å; F71-M74 WeakPolarHBondContact O-CG 3.42Å; F71-M74 PolarHBondContact O-N 3.13Å; A72-M74 VanDerWaalsContact C-N 3.28Å; A72-M74 PolarHBondContact O-N 2.63Å; M74-G76 PolarHBondContact O-N 2.82Å; M74-L77 HydrophobicContact CB-CB 4.39Å; M74-L77 HydrophobicContact CE-CD1 4.34Å; M74-L77 HydrophobicContact CE-CD2 4.48Å; M74-L77 VanDerWaalsContact O-CB 3.23Å; M74-L77 WeakPolarHBondContact O-CB 3.37Å; M74-L77 PolarHBondContact O-N 2.82Å; M74-L98 HydrophobicContact CB-CD2 3.74Å; M74-L98 WeakPolarHBondContact O-CD2 3.48Å
75	S	91.9	Very high	95.2	Very high	58 Å²	58	43.1 Å²	43.1	41%	0.406	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-9.8	-173.4	57.9	0	0	0	0	115.9	D97 S100	S75-D97 WeakPolarHBondContact CA-O 3.47Å; S75-D97 WeakPolarHBondContact CB-O 3.47Å; S75-D97 PolarHBondContact N-O 3.04Å; S75-S100 WeakPolarHBondContact O-CB 3.04Å; S75-S100 PolarHBondContact O-OG 3.12Å
76	G	91.6	Very high	95.3	Very high	34 Å²	34	40.6 Å²	40.6	35%	0.351	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	0.5	171.6	0	0	0	0	0	115.2	M74	M74-G76 PolarHBondContact O-N 2.82Å
77	L	95.1	Very high	95.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.216	C	C	.	.			trans	-73.2	134.2	179.3	-169.8	69.2	0	0	0	110.8	T53 L56 M74 L80 L98 S100 L101	T53-L77 HydrophobicContact CG2-CD1 4.16Å; T53-L77 WeakPolarHBondContact O-CD1 3.48Å; L56-L77 HydrophobicContact CB-CD1 3.67Å; M74-L77 HydrophobicContact CB-CB 4.39Å; M74-L77 HydrophobicContact CE-CD1 4.34Å; M74-L77 HydrophobicContact CE-CD2 4.48Å; M74-L77 VanDerWaalsContact O-CB 3.23Å; M74-L77 WeakPolarHBondContact O-CB 3.37Å; M74-L77 PolarHBondContact O-N 2.82Å; L77-L80 HydrophobicContact CD2-CB 4.09Å; L77-L80 HydrophobicContact CD2-CD1 4.41Å; L77-L80 HydrophobicContact CD2-CD2 4.25Å; L77-L80 HydrophobicContact CD2-CG 4.48Å; L77-L98 HydrophobicContact CB-CD2 4.26Å; L77-L98 HydrophobicContact CD2-CD1 4.35Å; L77-L98 HydrophobicContact CD2-CD2 4.02Å; L77-S100 CarbonylContact O-C 3.53Å; L77-L101 HydrophobicContact CB-CD1 4.44Å; L77-L101 HydrophobicContact CD2-CD1 4.07Å; L77-L101 HydrophobicContact CG-CD1 3.89Å; L77-L101 WeakPolarHBondContact O-CA 3.2Å; L77-L101 PolarHBondContact O-N 3.18Å
78	V	95.8	Very high	95.4	Very high	46 Å²	46	41 Å²	41	28%	0.279	22%	0.22	S	C	.	.			trans	-118.7	-36.7	-175.1	176.3	0	0	0	0	112.3	V54 R102 S103	V54-V78 HydrophobicContact CG1-CB 4.03Å; V54-V78 HydrophobicContact CG1-CG2 3.83Å; V54-V78 PolarHBondContact O-N 3.44Å; V78-R102 HydrophobicContact CG1-CB 4.13Å; V78-R102 HydrophobicContact CG1-CG 4.04Å; V78-R102 PolarHBondContact O-N 3.22Å; V78-S103 PolarHBondContact O-N 3.08Å; V78-S103 VanDerWaalsContact O-N 3.08Å
79	D	96.3	Very high	95.5	Very high	34 Å²	34	41 Å²	41	18%	0.182	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.1	174.7	175.4	20.9	0	0	0	110.7	V54 E55 L56 H105	V54-D79 PolarHBondContact O-N 3.04Å; E55-D79 HydrophobicContact CG-CB 4.38Å; L56-D79 PolarHBondContact N-O 3.35Å; D79-H105 IonicContact OD1-CD2 3.2Å
80	L	97.4	Very high	95.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	104.7	176.9	178.6	51.4	0	0	0	110.4	L56 F71 L77 L82 F95 L98 L101 S103 L104 H105	L56-L80 HydrophobicContact CB-CD1 4.13Å; L56-L80 HydrophobicContact CD2-CD1 3.99Å; L56-L80 HydrophobicContact CG-CD1 4.01Å; F71-L80 HydrophobicContact CD1-CD1 4.46Å; F71-L80 HydrophobicContact CD1-CD2 4.29Å; F71-L80 HydrophobicContact CD2-CD2 4.43Å; F71-L80 HydrophobicContact CE1-CD1 3.84Å; F71-L80 HydrophobicContact CE1-CD2 4.17Å; F71-L80 HydrophobicContact CE2-CD2 4.31Å; F71-L80 HydrophobicContact CG-CD2 4.42Å; F71-L80 HydrophobicContact CZ-CD1 4.16Å; F71-L80 HydrophobicContact CZ-CD2 4.19Å; L77-L80 HydrophobicContact CD2-CB 4.09Å; L77-L80 HydrophobicContact CD2-CD1 4.41Å; L77-L80 HydrophobicContact CD2-CD2 4.25Å; L77-L80 HydrophobicContact CD2-CG 4.48Å; L80-L82 HydrophobicContact CD1-CD1 4.09Å; L80-L82 HydrophobicContact CD1-CG 4.06Å; L80-L82 HydrophobicContact CD2-CD1 4Å; L80-L82 HydrophobicContact CG-CD1 3.87Å; L80-L82 HydrophobicContact CG-CG 4.21Å; L80-F95 HydrophobicContact CD2-CD1 4.44Å; L80-F95 HydrophobicContact CD2-CE1 4.09Å; L80-L98 HydrophobicContact CD2-CD1 4.06Å; L80-L101 HydrophobicContact CB-CD1 3.81Å; L80-L101 HydrophobicContact CB-CD2 4.35Å; L80-S103 PolarHBondContact N-O 2.95Å; L80-S103 VanDerWaalsContact N-O 3.08Å; L80-L104 HydrophobicContact CB-CD1 4.15Å; L80-L104 HydrophobicContact CD2-CD1 3.98Å; L80-L104 HydrophobicContact CG-CD1 4.02Å; L80-H105 PolarHBondContact O-N 2.87Å
81	T	97.4	Very high	95.7	Very high	20 Å²	20	37.8 Å²	37.8	12%	0.123	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	103.4	179.6	-37	0	0	0	0	111.9	L56 L58 G59 S83 H105	L56-T81 PolarHBondContact O-N 3.06Å; L58-T81 CarbonylContact C-O 3.38Å; L58-T81 WeakPolarHBondContact CA-O 3.34Å; L58-T81 PolarHBondContact N-O 3.11Å; G59-T81 PolarHBondContact N-O 2.83Å; G59-T81 VanDerWaalsContact N-O 3.16Å; T81-S83 WeakPolarHBondContact CG2-OG 3.17Å; T81-H105 HydrophobicContact CG2-CB 4.18Å
82	L	97.3	Very high	95.7	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.219	C	C	.	.			trans	-109.1	7.7	175.6	-71.4	159.1	0	0	0	113.3	L58 I63 I66 F71 L80 N85 I87 H105 L106 N109	L58-L82 HydrophobicContact CB-CD2 3.82Å; L58-L82 HydrophobicContact CD1-CD2 3.91Å; I63-L82 HydrophobicContact CD1-CD2 4.4Å; I66-L82 HydrophobicContact CD1-CD1 3.8Å; F71-L82 HydrophobicContact CE2-CD1 4.27Å; F71-L82 HydrophobicContact CZ-CD1 4.04Å; F71-L82 HydrophobicContact CZ-CD2 4.19Å; L80-L82 HydrophobicContact CD1-CD1 4.09Å; L80-L82 HydrophobicContact CD1-CG 4.06Å; L80-L82 HydrophobicContact CD2-CD1 4Å; L80-L82 HydrophobicContact CG-CD1 3.87Å; L80-L82 HydrophobicContact CG-CG 4.21Å; L82-N85 PolarHBondContact O-ND2 2.85Å; L82-I87 HydrophobicContact CB-CD1 4.06Å; L82-I87 HydrophobicContact CD2-CD1 4.26Å; L82-H105 CarbonylContact C-O 3.56Å; L82-H105 VanDerWaalsContact CA-O 3.31Å; L82-H105 WeakPolarHBondContact CA-O 3.47Å; L82-H105 WeakPolarHBondContact CB-O 3Å; L82-H105 PolarHBondContact N-O 2.86Å; L82-L106 HydrophobicContact CB-CD2 3.96Å; L82-L106 HydrophobicContact CD1-CD2 3.91Å; L82-N109 PolarHBondContact O-ND2 2.96Å; L82-N109 VanDerWaalsContact O-ND2 3.16Å
83	S	97.6	Very high	95.8	Very high	4 Å²	4	42.4 Å²	42.4	3%	0.028	22%	0.222	C	C	.	.			trans	-36.4	139.6	173	-51.9	0	0	0	0	115.8	G59 G60 T81 N85 H105 D107	G59-S83 CarbonylContact C-O 3.14Å; G59-S83 WeakPolarHBondContact CA-O 3.31Å; G60-S83 PolarHBondContact N-O 2.91Å; T81-S83 WeakPolarHBondContact CG2-OG 3.17Å; S83-N85 PolarHBondContact O-N 2.94Å; S83-N85 PolarHBondContact O-ND2 3.09Å; S83-H105 PolarHBondContact N-O 3.14Å; S83-D107 CarbonylContact C-O 3.6Å; S83-D107 WeakPolarHBondContact CA-O 3.32Å; S83-D107 WeakPolarHBondContact CA-OD1 3.38Å; S83-D107 WeakPolarHBondContact CB-OD1 3.26Å; S83-D107 WeakPolarHBondContact CB-OD2 3.39Å; S83-D107 PolarHBondContact OG-OD1 3.2Å
84	R	97.2	Very high	95.9	Very high	147 Å²	147	37 Å²	37	56%	0.555	19%	0.194	S	C	*	.	S	Bend	trans	53.1	56.5	170.7	-65.1	172.8	-64.9	-71.4	4.5	112.1	G60 N61 D107 S108	G60-R84 CarbonylContact C-O 3.57Å; G60-R84 WeakPolarHBondContact CA-O 3.47Å; G60-R84 PolarHBondContact N-O 3.32Å; G60-R84 VanDerWaalsContact N-O 3.15Å; N61-R84 PolarHBondContact N-O 3.25Å; R84-D107 PolarHBondContact N-O 3.43Å; R84-D107 IonicContact NH1-OD2 2.72Å; R84-D107 PolarHBondContact NH1-OD2 2.91Å; R84-S108 WeakPolarHBondContact CA-O 3.17Å; R84-S108 VanDerWaalsContact CG-CB 3.47Å
85	N	97.5	Very high	96	Very high	11 Å²	11	37 Å²	37	6%	0.059	19%	0.194	C	C	.	.	S	Bend	trans	-116.1	-160.9	170.3	-88.3	-83.5	0	0	0	109.2	L58 N61 F62 I63 L82 S83 I87 S108 N109	L58-N85 PolarHBondContact O-ND2 2.94Å; N61-N85 WeakPolarHBondContact CA-OD1 3.42Å; N61-N85 WeakPolarHBondContact CB-OD1 3.21Å; N61-N85 PolarHBondContact N-OD1 2.79Å; N61-N85 PolarHBondContact O-OD1 2.81Å; F62-N85 PolarHBondContact N-OD1 2.61Å; I63-N85 HydrophobicContact CB-CB 4.41Å; I63-N85 WeakPolarHBondContact CB-OD1 3.5Å; I63-N85 WeakPolarHBondContact CG1-OD1 3.29Å; I63-N85 PolarHBondContact N-OD1 3.34Å; L82-N85 PolarHBondContact O-ND2 2.85Å; S83-N85 PolarHBondContact O-N 2.94Å; S83-N85 PolarHBondContact O-ND2 3.09Å; N85-I87 HydrophobicContact CB-CD1 3.96Å; N85-I87 HydrophobicContact CB-CG1 3.89Å; N85-S108 PolarHBondContact N-O 2.73Å; N85-N109 VanDerWaalsContact CA-OD1 3.31Å; N85-N109 WeakPolarHBondContact CA-OD1 3.42Å; N85-N109 WeakPolarHBondContact CB-OD1 3.23Å; N85-N109 PolarHBondContact N-OD1 2.82Å; N85-N109 PolarHBondContact O-OD1 2.83Å
86	T	96.9	Very high	96.1	Very high	35 Å²	35	36.2 Å²	36.2	22%	0.215	19%	0.186	C	C	.	.			trans	-120.8	28.2	176.1	45.3	0	0	0	0	111.5	F62 I63 S88 N109	F62-T86 VanDerWaalsContact C-OG1 3.29Å; F62-T86 PolarHBondContact O-OG1 2.86Å; I63-T86 CarbonylContact O-C 3.21Å; I63-T86 VanDerWaalsContact O-CA 3.32Å; I63-T86 WeakPolarHBondContact O-CA 3.1Å; I63-T86 PolarHBondContact O-N 3.05Å; I63-T86 PolarHBondContact O-OG1 3.49Å; T86-S88 PolarHBondContact O-N 2.94Å; T86-S88 VanDerWaalsContact O-N 3.15Å; T86-N109 PolarHBondContact N-OD1 2.84Å
87	I	97.7	Very high	96.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.184	C	C	.	.			trans	-67.6	115.5	-168.4	-57.9	161.1	0	0	0	109.2	I63 I64 I66 L82 N85 I90 L106 N109 R110 L111	I63-I87 HydrophobicContact CB-CG1 4.25Å; I63-I87 HydrophobicContact CG2-CG1 4.11Å; I63-I87 PolarHBondContact O-N 2.7Å; I63-I87 VanDerWaalsContact O-N 3.11Å; I64-I87 CarbonylContact O-C 3.58Å; I64-I87 VanDerWaalsContact O-CA 3.3Å; I64-I87 WeakPolarHBondContact O-CA 3.26Å; I66-I87 HydrophobicContact CD1-CD1 4.19Å; I66-I87 HydrophobicContact CD1-CG2 4.36Å; I66-I87 HydrophobicContact CG1-CD1 4.48Å; I66-I87 HydrophobicContact CG1-CG2 4.32Å; L82-I87 HydrophobicContact CB-CD1 4.06Å; L82-I87 HydrophobicContact CD2-CD1 4.26Å; N85-I87 HydrophobicContact CB-CD1 3.96Å; N85-I87 HydrophobicContact CB-CG1 3.89Å; I87-I90 HydrophobicContact CG2-CG1 4.04Å; I87-L106 HydrophobicContact CD1-CD2 4.39Å; I87-N109 HydrophobicContact CB-CB 4.3Å; I87-N109 WeakPolarHBondContact CB-OD1 3.4Å; I87-N109 WeakPolarHBondContact CG1-OD1 3.44Å; I87-N109 PolarHBondContact N-OD1 2.67Å; I87-R110 CarbonylContact O-C 3.45Å; I87-R110 VanDerWaalsContact O-CA 3.3Å; I87-R110 WeakPolarHBondContact O-CA 3.37Å; I87-R110 PolarHBondContact O-N 2.81Å; I87-L111 HydrophobicContact CG2-CD2 3.93Å; I87-L111 PolarHBondContact O-N 3.14Å
88	S	96.3	Very high	96.2	Very high	50 Å²	50	37.4 Å²	37.4	35%	0.35	19%	0.185	S	C	.	.			trans	-109.7	-13.6	178.5	51.3	0	0	0	0	113.5	I64 T86	I64-S88 PolarHBondContact O-N 3.33Å; I64-S88 PolarHBondContact O-OG 3.28Å; T86-S88 PolarHBondContact O-N 2.94Å; T86-S88 VanDerWaalsContact O-N 3.15Å
89	Y	96	Very high	96.1	Very high	120 Å²	120	40.5 Å²	40.5	47%	0.471	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	136.7	179.8	-179.6	-104.1	0	0	0	111.6	N65 I66 Q91 P92	N65-Y89 WeakPolarHBondContact CA-O 3.44Å; I66-Y89 PolarHBondContact N-O 2.93Å; Y89-Q91 HydrophobicContact CE1-CB 4.08Å; Y89-P92 WeakPolarHBondContact OH-CD 3.29Å
90	I	96.9	Very high	96	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.4	171.8	-53.5	-176.1	0	0	0	106.7	I66 I87 F95 L106 L111 I118	I66-I90 HydrophobicContact CB-CB 4.48Å; I66-I90 HydrophobicContact CB-CG1 4.44Å; I66-I90 HydrophobicContact CB-CG2 4.09Å; I66-I90 HydrophobicContact CD1-CD1 4.07Å; I66-I90 HydrophobicContact CD1-CG1 4.02Å; I66-I90 HydrophobicContact CD1-CG2 4.4Å; I66-I90 HydrophobicContact CG2-CG2 4.17Å; I87-I90 HydrophobicContact CG2-CG1 4.04Å; I90-F95 HydrophobicContact CD1-CE2 4.13Å; I90-F95 HydrophobicContact CD1-CZ 4.19Å; I90-F95 HydrophobicContact CG2-CE2 4.01Å; I90-F95 HydrophobicContact CG2-CZ 4.13Å; I90-L106 HydrophobicContact CD1-CD1 4.15Å; I90-L106 HydrophobicContact CD1-CD2 4.19Å; I90-L111 HydrophobicContact CD1-CD1 4.19Å; I90-L111 HydrophobicContact CD1-CD2 3.92Å; I90-L111 HydrophobicContact CG1-CD2 3.87Å; I90-I118 HydrophobicContact CB-CG2 3.97Å; I90-I118 HydrophobicContact CD1-CG2 4.16Å; I90-I118 HydrophobicContact CG2-CG2 3.91Å
91	Q	95.4	Very high	96	Very high	79 Å²	79	41.2 Å²	41.2	37%	0.369	20%	0.204	S	C	.	.			trans	-65.6	136.5	177.2	-176	179.7	8	0	0	110.1	I66 Y89 S94	I66-Q91 WeakPolarHBondContact O-CB 3.45Å; I66-Q91 PolarHBondContact O-N 3.05Å; Y89-Q91 HydrophobicContact CE1-CB 4.08Å; Q91-S94 WeakPolarHBondContact CB-OG 3.43Å; Q91-S94 VanDerWaalsContact O-CB 3.28Å; Q91-S94 WeakPolarHBondContact O-CB 3.47Å; Q91-S94 PolarHBondContact O-N 2.7Å; Q91-S94 PolarHBondContact O-OG 2.85Å
92	P	94.9	Very high	96	Very high	47 Å²	47	46.6 Å²	46.6	31%	0.305	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.6	142.9	171.6	-33.2	38.4	0	0	0	113.1	Y89 S94 D117	Y89-P92 WeakPolarHBondContact OH-CD 3.29Å; P92-S94 VanDerWaalsContact C-N 3.26Å; P92-S94 PolarHBondContact O-N 2.96Å; P92-D117 HydrophobicContact CB-CB 3.82Å
93	Y	94.8	Very high	96	Very high	84 Å²	84	47.3 Å²	47.3	33%	0.329	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	22.7	-178.4	-48.4	-93.3	0	0	0	115.4	R68 F95 T96 D117	R68-Y93 WeakPolarHBondContact CG-O 2.97Å; R68-Y93 PolarHBondContact NE-O 3.49Å; Y93-F95 VanDerWaalsContact C-N 3.33Å; Y93-T96 VanDerWaalsContact CA-OG1 3.27Å; Y93-T96 WeakPolarHBondContact CA-OG1 3.44Å; Y93-T96 WeakPolarHBondContact CB-OG1 3.34Å; Y93-T96 PolarHBondContact O-OG1 3.02Å; Y93-D117 HydrophobicContact CD2-CB 4.27Å; Y93-D117 HydrophobicContact CE2-CB 3.85Å; Y93-D117 VanDerWaalsContact CE2-CG 3.45Å; Y93-D117 WeakPolarHBondContact CE2-OD2 3.39Å; Y93-D117 VanDerWaalsContact CZ-OD1 3.28Å; Y93-D117 PolarHBondContact N-O 2.84Å; Y93-D117 PolarHBondContact OH-OD1 2.98Å; Y93-D117 PolarHBondContact OH-OD2 3.4Å
94	S	95.4	Very high	96	Very high	4 Å²	4	47.1 Å²	47.1	3%	0.028	23%	0.225	C	C	.	.	S	Bend	trans	-73.9	-20.6	178.3	-65	0	0	0	0	114.6	R68 Q91 P92	R68-S94 PolarHBondContact N-OG 2.99Å; Q91-S94 WeakPolarHBondContact CB-OG 3.43Å; Q91-S94 VanDerWaalsContact O-CB 3.28Å; Q91-S94 WeakPolarHBondContact O-CB 3.47Å; Q91-S94 PolarHBondContact O-N 2.7Å; Q91-S94 PolarHBondContact O-OG 2.85Å; P92-S94 VanDerWaalsContact C-N 3.26Å; P92-S94 PolarHBondContact O-N 2.96Å
95	F	95.9	Very high	96.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-107	4.7	179.5	-57.1	-45.6	0	0	0	113.4	I66 F71 L80 I90 Y93 D97 L98 L104 I118 L119 L122	I66-F95 HydrophobicContact CD1-CE1 4.3Å; I66-F95 HydrophobicContact CD1-CZ 3.93Å; F71-F95 AromaticContact CD2-CD1 3.98Å; F71-F95 HydrophobicContact CD2-CD1 3.98Å; F71-F95 AromaticContact CD2-CE1 3.73Å; F71-F95 HydrophobicContact CD2-CE1 3.73Å; F71-F95 AromaticContact CE2-CE1 3.82Å; F71-F95 HydrophobicContact CE2-CE1 3.82Å; L80-F95 HydrophobicContact CD2-CD1 4.44Å; L80-F95 HydrophobicContact CD2-CE1 4.09Å; I90-F95 HydrophobicContact CD1-CE2 4.13Å; I90-F95 HydrophobicContact CD1-CZ 4.19Å; I90-F95 HydrophobicContact CG2-CE2 4.01Å; I90-F95 HydrophobicContact CG2-CZ 4.13Å; Y93-F95 VanDerWaalsContact C-N 3.33Å; F95-D97 VanDerWaalsContact C-N 3.28Å; F95-D97 PolarHBondContact O-N 2.84Å; F95-L98 HydrophobicContact CB-CD1 4.09Å; F95-L98 HydrophobicContact CD1-CD1 3.77Å; F95-L98 HydrophobicContact CG-CD1 4.34Å; F95-L98 VanDerWaalsContact O-CB 3.27Å; F95-L98 WeakPolarHBondContact O-CB 3.41Å; F95-L98 WeakPolarHBondContact O-CG 3.36Å; F95-L98 PolarHBondContact O-N 2.78Å; F95-L104 HydrophobicContact CD2-CD2 4.4Å; F95-L104 HydrophobicContact CE2-CD2 4.21Å; F95-I118 VanDerWaalsContact CD2-O 3.25Å; F95-I118 WeakPolarHBondContact CD2-O 3.4Å; F95-L119 HydrophobicContact CD2-CD2 4.28Å; F95-L119 HydrophobicContact CE2-CD2 4.29Å; F95-L122 HydrophobicContact CB-CD1 4.27Å; F95-L122 HydrophobicContact CB-CD2 3.95Å; F95-L122 HydrophobicContact CB-CG 4.11Å; F95-L122 HydrophobicContact CD2-CD1 4.33Å
96	T	94.7	Very high	96.1	Very high	40 Å²	40	42.1 Å²	42.1	25%	0.245	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-25.7	-169.8	-56.5	0	0	0	0	114.9	Y93 L98 R120	Y93-T96 VanDerWaalsContact CA-OG1 3.27Å; Y93-T96 WeakPolarHBondContact CA-OG1 3.44Å; Y93-T96 WeakPolarHBondContact CB-OG1 3.34Å; Y93-T96 PolarHBondContact O-OG1 3.02Å; T96-L98 VanDerWaalsContact C-N 3.28Å; T96-L98 PolarHBondContact O-N 3.49Å; T96-R120 WeakPolarHBondContact CA-O 3.48Å; T96-R120 WeakPolarHBondContact CB-O 3.44Å; T96-R120 PolarHBondContact N-O 2.64Å; T96-R120 PolarHBondContact OG1-O 2.86Å
97	D	93.7	Very high	96.1	Very high	58 Å²	58	41 Å²	41	31%	0.31	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	2.5	178	-57.6	-7.9	0	0	0	112.6	A72 N73 S75 F95 E99	A72-D97 WeakPolarHBondContact CA-OD2 3.4Å; N73-D97 PolarHBondContact N-OD2 2.78Å; S75-D97 WeakPolarHBondContact CA-O 3.47Å; S75-D97 WeakPolarHBondContact CB-O 3.47Å; S75-D97 PolarHBondContact N-O 3.04Å; F95-D97 VanDerWaalsContact C-N 3.28Å; F95-D97 PolarHBondContact O-N 2.84Å; D97-E99 PolarHBondContact O-N 2.97Å
98	L	95.3	Very high	96.1	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.211	C	C	.	.			trans	-95.6	45.4	-171.6	-56.4	-175.2	0	0	0	113.4	F71 M74 L77 L80 F95 T96 S100 L101 L122	F71-L98 HydrophobicContact CB-CD1 4.18Å; F71-L98 HydrophobicContact CB-CD2 4.2Å; F71-L98 HydrophobicContact CB-CG 4.49Å; M74-L98 HydrophobicContact CB-CD2 3.74Å; M74-L98 WeakPolarHBondContact O-CD2 3.48Å; L77-L98 HydrophobicContact CB-CD2 4.26Å; L77-L98 HydrophobicContact CD2-CD1 4.35Å; L77-L98 HydrophobicContact CD2-CD2 4.02Å; L80-L98 HydrophobicContact CD2-CD1 4.06Å; F95-L98 HydrophobicContact CB-CD1 4.09Å; F95-L98 HydrophobicContact CD1-CD1 3.77Å; F95-L98 HydrophobicContact CG-CD1 4.34Å; F95-L98 VanDerWaalsContact O-CB 3.27Å; F95-L98 WeakPolarHBondContact O-CB 3.41Å; F95-L98 WeakPolarHBondContact O-CG 3.36Å; F95-L98 PolarHBondContact O-N 2.78Å; T96-L98 VanDerWaalsContact C-N 3.28Å; T96-L98 PolarHBondContact O-N 3.49Å; L98-S100 PolarHBondContact O-N 2.03Å; L98-L101 HydrophobicContact CB-CB 4.11Å; L98-L101 HydrophobicContact CD1-CD2 4.25Å; L98-L101 VanDerWaalsContact O-CB 3.31Å; L98-L101 WeakPolarHBondContact O-CB 3.35Å; L98-L101 PolarHBondContact O-N 2.82Å; L98-L122 HydrophobicContact CB-CD2 4.01Å
99	E	92.5	Very high	96.2	Very high	112 Å²	112	40.6 Å²	40.6	52%	0.523	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-31.2	-173.9	-63.9	177.6	-171.3	0	0	114.5	D97 I123 N124	D97-E99 PolarHBondContact O-N 2.97Å; E99-I123 HydrophobicContact CB-CD1 4.4Å; E99-N124 PolarHBondContact O-ND2 2.94Å
100	S	95.2	Very high	96.3	Very high	48 Å²	48	41.5 Å²	41.5	34%	0.336	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-0.8	-179.1	-58.3	0	0	0	0	114.9	S75 L77 L98 R102	S75-S100 WeakPolarHBondContact O-CB 3.04Å; S75-S100 PolarHBondContact O-OG 3.12Å; L77-S100 CarbonylContact O-C 3.53Å; L98-S100 PolarHBondContact O-N 2.03Å; S100-R102 PolarHBondContact O-N 3.24Å
101	L	97.1	Very high	96.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.199	C	C	.	.			trans	-68.9	129.7	-171.8	-163.6	77.5	0	0	0	111.2	L77 L80 L98 L104 L122 N124 L125	L77-L101 HydrophobicContact CB-CD1 4.44Å; L77-L101 HydrophobicContact CD2-CD1 4.07Å; L77-L101 HydrophobicContact CG-CD1 3.89Å; L77-L101 WeakPolarHBondContact O-CA 3.2Å; L77-L101 PolarHBondContact O-N 3.18Å; L80-L101 HydrophobicContact CB-CD1 3.81Å; L80-L101 HydrophobicContact CB-CD2 4.35Å; L98-L101 HydrophobicContact CB-CB 4.11Å; L98-L101 HydrophobicContact CD1-CD2 4.25Å; L98-L101 VanDerWaalsContact O-CB 3.31Å; L98-L101 WeakPolarHBondContact O-CB 3.35Å; L98-L101 PolarHBondContact O-N 2.82Å; L101-L104 HydrophobicContact CD2-CB 4.01Å; L101-L104 HydrophobicContact CD2-CD1 4.35Å; L101-L122 HydrophobicContact CB-CD2 4.08Å; L101-L122 HydrophobicContact CD2-CD2 3.64Å; L101-L122 HydrophobicContact CG-CD2 4.48Å; L101-N124 CarbonylContact O-C 3.58Å; L101-L125 HydrophobicContact CD2-CD1 4.24Å; L101-L125 HydrophobicContact CG-CD1 4.42Å; L101-L125 WeakPolarHBondContact O-CA 3.42Å; L101-L125 PolarHBondContact O-N 2.85Å
102	R	97.3	Very high	96.4	Very high	133 Å²	133	40.3 Å²	40.3	50%	0.502	20%	0.199	S	C	.	.			trans	-113.2	-33.3	-180	-63.3	176.8	-172.4	-158.3	2.7	112.8	V78 S100 Q126 H127	V78-R102 HydrophobicContact CG1-CB 4.13Å; V78-R102 HydrophobicContact CG1-CG 4.04Å; V78-R102 PolarHBondContact O-N 3.22Å; S100-R102 PolarHBondContact O-N 3.24Å; R102-Q126 VanDerWaalsContact CD-OE1 3.3Å; R102-Q126 PolarHBondContact O-N 3.02Å; R102-H127 PolarHBondContact O-N 2.91Å
103	S	97.9	Very high	96.4	Very high	15 Å²	15	41.5 Å²	41.5	11%	0.105	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.9	175.8	-162.1	0	0	0	0	111.4	V78 L80 H105	V78-S103 PolarHBondContact O-N 3.08Å; V78-S103 VanDerWaalsContact O-N 3.08Å; L80-S103 PolarHBondContact N-O 2.95Å; L80-S103 VanDerWaalsContact N-O 3.08Å; S103-H105 PolarHBondContact OG-CD2 3.16Å; S103-H105 VanDerWaalsContact OG-CD2 3.26Å; S103-H105 PolarHBondContact OG-NE2 3.2Å
104	L	98	Very high	96.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	108.6	172.8	179.8	56.3	0	0	0	109.7	L80 F95 L101 L106 L119 L122 L125 H127 L128 I129	L80-L104 HydrophobicContact CB-CD1 4.15Å; L80-L104 HydrophobicContact CD2-CD1 3.98Å; L80-L104 HydrophobicContact CG-CD1 4.02Å; F95-L104 HydrophobicContact CD2-CD2 4.4Å; F95-L104 HydrophobicContact CE2-CD2 4.21Å; L101-L104 HydrophobicContact CD2-CB 4.01Å; L101-L104 HydrophobicContact CD2-CD1 4.35Å; L104-L106 HydrophobicContact CD1-CD1 4.31Å; L104-L106 HydrophobicContact CD1-CG 4.16Å; L104-L106 HydrophobicContact CD2-CD1 3.98Å; L104-L106 HydrophobicContact CG-CD1 4.04Å; L104-L106 HydrophobicContact CG-CG 4.2Å; L104-L119 HydrophobicContact CD2-CD2 4.1Å; L104-L122 HydrophobicContact CD2-CD1 3.73Å; L104-L125 HydrophobicContact CB-CD1 3.85Å; L104-H127 PolarHBondContact N-O 3.3Å; L104-L128 HydrophobicContact CB-CD1 4.34Å; L104-L128 HydrophobicContact CD2-CD1 4.14Å; L104-L128 HydrophobicContact CG-CD1 4.34Å; L104-I129 PolarHBondContact O-N 3.37Å
105	H	98.4	Very high	96.3	Very high	53 Å²	53	38.6 Å²	38.6	25%	0.245	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	108.7	175.1	-63.9	-100.6	0	0	0	110.7	D79 L80 T81 L82 S83 S103	D79-H105 IonicContact OD1-CD2 3.2Å; L80-H105 PolarHBondContact O-N 2.87Å; T81-H105 HydrophobicContact CG2-CB 4.18Å; L82-H105 CarbonylContact C-O 3.56Å; L82-H105 VanDerWaalsContact CA-O 3.31Å; L82-H105 WeakPolarHBondContact CA-O 3.47Å; L82-H105 WeakPolarHBondContact CB-O 3Å; L82-H105 PolarHBondContact N-O 2.86Å; S83-H105 PolarHBondContact N-O 3.14Å; S103-H105 PolarHBondContact OG-CD2 3.16Å; S103-H105 VanDerWaalsContact OG-CD2 3.26Å; S103-H105 PolarHBondContact OG-NE2 3.2Å
106	L	97.6	Very high	96.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.221	C	C	.	.			trans	-111	16.5	173	-75.4	165.1	0	0	0	111.8	I66 L82 I87 I90 L104 N109 L111 I129 L130 N133	I66-L106 HydrophobicContact CD1-CD2 4.5Å; L82-L106 HydrophobicContact CB-CD2 3.96Å; L82-L106 HydrophobicContact CD1-CD2 3.91Å; I87-L106 HydrophobicContact CD1-CD2 4.39Å; I90-L106 HydrophobicContact CD1-CD1 4.15Å; I90-L106 HydrophobicContact CD1-CD2 4.19Å; L104-L106 HydrophobicContact CD1-CD1 4.31Å; L104-L106 HydrophobicContact CD1-CG 4.16Å; L104-L106 HydrophobicContact CD2-CD1 3.98Å; L104-L106 HydrophobicContact CG-CD1 4.04Å; L104-L106 HydrophobicContact CG-CG 4.2Å; L106-N109 WeakPolarHBondContact O-CB 3.45Å; L106-N109 PolarHBondContact O-ND2 3.38Å; L106-L111 HydrophobicContact CB-CD1 4.38Å; L106-L111 HydrophobicContact CD1-CD1 4.38Å; L106-I129 PolarHBondContact N-O 3.33Å; L106-L130 HydrophobicContact CB-CD2 3.77Å; L106-L130 HydrophobicContact CD1-CD2 3.91Å; L106-L130 HydrophobicContact CG-CD2 4.5Å; L106-N133 PolarHBondContact O-ND2 3.08Å
107	D	97.8	Very high	96	Very high	13 Å²	13	42.8 Å²	42.8	7%	0.07	22%	0.216	C	C	.	.			trans	-56.7	152	-177.1	69.6	-91.4	0	0	0	114.3	S83 R84 N109 I129 N131	S83-D107 CarbonylContact C-O 3.6Å; S83-D107 WeakPolarHBondContact CA-O 3.32Å; S83-D107 WeakPolarHBondContact CA-OD1 3.38Å; S83-D107 WeakPolarHBondContact CB-OD1 3.26Å; S83-D107 WeakPolarHBondContact CB-OD2 3.39Å; S83-D107 PolarHBondContact OG-OD1 3.2Å; R84-D107 PolarHBondContact N-O 3.43Å; R84-D107 IonicContact NH1-OD2 2.72Å; R84-D107 PolarHBondContact NH1-OD2 2.91Å; D107-N109 PolarHBondContact O-N 3.25Å; D107-N109 PolarHBondContact O-ND2 3.48Å; D107-I129 HydrophobicContact CB-CG2 4.26Å; D107-I129 PolarHBondContact N-O 2.78Å; D107-N131 CarbonylContact C-O 3.58Å; D107-N131 VanDerWaalsContact CA-O 3.27Å; D107-N131 WeakPolarHBondContact CA-O 3.31Å; D107-N131 WeakPolarHBondContact CB-OD1 3.47Å
108	S	98	Very high	96	Very high	31 Å²	31	41 Å²	41	22%	0.217	21%	0.206	C	C	.	.	S	Bend	trans	55	50.9	172.9	-54.3	0	0	0	0	112.9	R84 N85 N131 N132	R84-S108 WeakPolarHBondContact CA-O 3.17Å; R84-S108 VanDerWaalsContact CG-CB 3.47Å; N85-S108 PolarHBondContact N-O 2.73Å; S108-N131 PolarHBondContact N-O 2.96Å; S108-N132 WeakPolarHBondContact CA-O 3.48Å; S108-N132 WeakPolarHBondContact CB-ND2 3.27Å; S108-N132 PolarHBondContact N-O 3.2Å; S108-N132 PolarHBondContact OG-ND2 3.44Å
109	N	98.2	Very high	96	Very high	9 Å²	9	41 Å²	41	5%	0.048	21%	0.206	C	C	.	.	S	Bend	trans	-121	-157.3	179.2	-86.7	-69.9	0	0	0	110.6	L82 N85 T86 I87 L106 D107 N132 N133	L82-N109 PolarHBondContact O-ND2 2.96Å; L82-N109 VanDerWaalsContact O-ND2 3.16Å; N85-N109 VanDerWaalsContact CA-OD1 3.31Å; N85-N109 WeakPolarHBondContact CA-OD1 3.42Å; N85-N109 WeakPolarHBondContact CB-OD1 3.23Å; N85-N109 PolarHBondContact N-OD1 2.82Å; N85-N109 PolarHBondContact O-OD1 2.83Å; T86-N109 PolarHBondContact N-OD1 2.84Å; I87-N109 HydrophobicContact CB-CB 4.3Å; I87-N109 WeakPolarHBondContact CB-OD1 3.4Å; I87-N109 WeakPolarHBondContact CG1-OD1 3.44Å; I87-N109 PolarHBondContact N-OD1 2.67Å; L106-N109 WeakPolarHBondContact O-CB 3.45Å; L106-N109 PolarHBondContact O-ND2 3.38Å; D107-N109 PolarHBondContact O-N 3.25Å; D107-N109 PolarHBondContact O-ND2 3.48Å; N109-N132 PolarHBondContact N-O 3.03Å; N109-N133 WeakPolarHBondContact CA-OD1 3.15Å; N109-N133 WeakPolarHBondContact CB-OD1 3.35Å
110	R	97.3	Very high	96	Very high	139 Å²	139	40.6 Å²	40.6	53%	0.525	20%	0.2	S	C	.	.			trans	-133.3	30.6	-175.5	-60.4	-174.9	176.6	-156.1	-2	112.2	I87 P112 N133	I87-R110 CarbonylContact O-C 3.45Å; I87-R110 VanDerWaalsContact O-CA 3.3Å; I87-R110 WeakPolarHBondContact O-CA 3.37Å; I87-R110 PolarHBondContact O-N 2.81Å; R110-P112 WeakPolarHBondContact O-CD 3.34Å; R110-N133 PolarHBondContact N-OD1 2.86Å
111	L	97.1	Very high	95.8	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.021	19%	0.19	C	C	.	.			trans	-67.4	126.1	179.6	-60.8	175.8	0	0	0	109.7	I87 I90 L106 I114 L130 N133 Q134 L135	I87-L111 HydrophobicContact CG2-CD2 3.93Å; I87-L111 PolarHBondContact O-N 3.14Å; I90-L111 HydrophobicContact CD1-CD1 4.19Å; I90-L111 HydrophobicContact CD1-CD2 3.92Å; I90-L111 HydrophobicContact CG1-CD2 3.87Å; L106-L111 HydrophobicContact CB-CD1 4.38Å; L106-L111 HydrophobicContact CD1-CD1 4.38Å; L111-I114 HydrophobicContact CD1-CD1 4.23Å; L111-L130 HydrophobicContact CD1-CD2 3.94Å; L111-N133 WeakPolarHBondContact CB-OD1 3.38Å; L111-N133 PolarHBondContact N-OD1 2.94Å; L111-N133 VanDerWaalsContact N-OD1 3.08Å; L111-Q134 CarbonylContact O-C 3.46Å; L111-Q134 VanDerWaalsContact O-CA 3.31Å; L111-Q134 WeakPolarHBondContact O-CA 3.47Å; L111-Q134 PolarHBondContact O-N 3Å; L111-L135 HydrophobicContact CB-CD2 3.71Å; L111-L135 PolarHBondContact O-N 3.39Å; L111-L135 VanDerWaalsContact O-N 3.12Å
112	P	96.2	Very high	95.7	Very high	55 Å²	55	38.9 Å²	38.9	36%	0.357	19%	0.19	S	C	.	.			trans	-89.4	-25.5	-179.3	32.5	-32.2	0	0	0	114	R110 L135 S136	R110-P112 WeakPolarHBondContact O-CD 3.34Å; P112-L135 WeakPolarHBondContact O-CA 3.14Å; P112-S136 PolarHBondContact O-N 2.85Å; P112-S136 PolarHBondContact O-OG 3.26Å
113	D	96.4	Very high	95.5	Very high	72 Å²	72	36.2 Å²	36.2	39%	0.385	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	166.3	-178.9	60.4	-95	0	0	0	110.9	S137	D113-S137 VanDerWaalsContact CA-O 3.32Å; D113-S137 WeakPolarHBondContact CA-O 3.48Å
114	I	96.2	Very high	95.4	Very high	4 Å²	4	39 Å²	39	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	108.1	167.4	-56.7	-65.5	0	0	0	109.2	L111 I118 L119 L130 L135 S137 I138 S139 A142	L111-I114 HydrophobicContact CD1-CD1 4.23Å; I114-I118 HydrophobicContact CG2-CB 4.49Å; I114-L119 HydrophobicContact CG2-CD1 3.9Å; I114-L119 HydrophobicContact CG2-CG 4.07Å; I114-L130 HydrophobicContact CD1-CD2 4.21Å; I114-L135 HydrophobicContact CD1-CD2 4.02Å; I114-L135 HydrophobicContact CG1-CD1 4.18Å; I114-L135 HydrophobicContact CG1-CD2 3.81Å; I114-S137 PolarHBondContact N-O 2.72Å; I114-I138 HydrophobicContact CB-CG1 4.28Å; I114-I138 HydrophobicContact CB-CG2 4.31Å; I114-I138 HydrophobicContact CG1-CG1 4.39Å; I114-S139 PolarHBondContact O-N 3.2Å; I114-A142 HydrophobicContact CG2-CB 3.97Å
115	G	92.3	Very high	95.4	Very high	24 Å²	24	39 Å²	39	25%	0.247	20%	0.199	C	C	.	.			trans	-81.7	164.4	171.5	0	0	0	0	0	114.1	D117 I118	G115-D117 PolarHBondContact O-N 3Å; G115-I118 PolarHBondContact O-N 3.05Å
116	E	90.7	Very high	95.3	Very high	102 Å²	102	38.8 Å²	38.8	48%	0.477	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-47.8	-177.4	64.6	-150.9	-156.6	0	0	114.5	I118 E141	E116-I118 VanDerWaalsContact C-N 3.35Å; E116-I118 PolarHBondContact O-N 3.2Å; E116-E141 HydrophobicContact CB-CB 4.47Å
117	D	92.8	Very high	95.4	Very high	26 Å²	26	41.3 Å²	41.3	14%	0.139	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	2.5	-173.2	-78.6	-26.7	0	0	0	114.6	P92 Y93 G115 R120	P92-D117 HydrophobicContact CB-CB 3.82Å; Y93-D117 HydrophobicContact CD2-CB 4.27Å; Y93-D117 HydrophobicContact CE2-CB 3.85Å; Y93-D117 VanDerWaalsContact CE2-CG 3.45Å; Y93-D117 WeakPolarHBondContact CE2-OD2 3.39Å; Y93-D117 VanDerWaalsContact CZ-OD1 3.28Å; Y93-D117 PolarHBondContact N-O 2.84Å; Y93-D117 PolarHBondContact OH-OD1 2.98Å; Y93-D117 PolarHBondContact OH-OD2 3.4Å; G115-D117 PolarHBondContact O-N 3Å; D117-R120 VanDerWaalsContact OD1-CD 3.29Å; D117-R120 WeakPolarHBondContact OD1-CD 3.36Å; D117-R120 IonicContact OD1-CZ 3.69Å; D117-R120 IonicContact OD1-NE 3.91Å; D117-R120 IonicContact OD1-NH1 2.72Å; D117-R120 PolarHBondContact OD1-NH1 3.05Å
118	I	94	Very high	95.4	Very high	20 Å²	20	40.7 Å²	40.7	10%	0.103	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-48.9	-175.6	-64	-173.8	0	0	0	111.4	I90 F95 I114 G115 E116 R120	I90-I118 HydrophobicContact CB-CG2 3.97Å; I90-I118 HydrophobicContact CD1-CG2 4.16Å; I90-I118 HydrophobicContact CG2-CG2 3.91Å; F95-I118 VanDerWaalsContact CD2-O 3.25Å; F95-I118 WeakPolarHBondContact CD2-O 3.4Å; I114-I118 HydrophobicContact CG2-CB 4.49Å; G115-I118 PolarHBondContact O-N 3.05Å; E116-I118 VanDerWaalsContact C-N 3.35Å; E116-I118 PolarHBondContact O-N 3.2Å; I118-R120 VanDerWaalsContact C-N 3.34Å
119	L	94.4	Very high	95.4	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	20%	0.202	C	C	.	.	S	Bend	trans	-94.3	11.2	-175.8	-59.1	-179.9	0	0	0	113.2	F95 L104 I114 L122 L128 F143 F146	F95-L119 HydrophobicContact CD2-CD2 4.28Å; F95-L119 HydrophobicContact CE2-CD2 4.29Å; L104-L119 HydrophobicContact CD2-CD2 4.1Å; I114-L119 HydrophobicContact CG2-CD1 3.9Å; I114-L119 HydrophobicContact CG2-CG 4.07Å; L119-L122 HydrophobicContact CB-CD1 4.18Å; L119-L122 HydrophobicContact CD2-CD1 4.17Å; L119-L122 WeakPolarHBondContact O-CB 3.41Å; L119-L122 WeakPolarHBondContact O-CD1 3.32Å; L119-L122 VanDerWaalsContact O-CG 3.3Å; L119-L122 WeakPolarHBondContact O-CG 3.42Å; L119-L128 HydrophobicContact CD1-CD2 3.91Å; L119-F143 HydrophobicContact CD1-CD1 4.44Å; L119-F143 HydrophobicContact CD1-CE1 4.34Å; L119-F146 HydrophobicContact CB-CE1 3.98Å; L119-F146 HydrophobicContact CB-CZ 4.29Å; L119-F146 HydrophobicContact CD1-CZ 3.99Å
120	R	93.6	Very high	95.4	Very high	102 Å²	102	40.1 Å²	40.1	39%	0.385	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	128.2	-169.5	-160.2	173.9	-163.1	148.3	16.4	113.2	T96 D117 I118 D145	T96-R120 WeakPolarHBondContact CA-O 3.48Å; T96-R120 WeakPolarHBondContact CB-O 3.44Å; T96-R120 PolarHBondContact N-O 2.64Å; T96-R120 PolarHBondContact OG1-O 2.86Å; D117-R120 VanDerWaalsContact OD1-CD 3.29Å; D117-R120 WeakPolarHBondContact OD1-CD 3.36Å; D117-R120 IonicContact OD1-CZ 3.69Å; D117-R120 IonicContact OD1-NE 3.91Å; D117-R120 IonicContact OD1-NH1 2.72Å; D117-R120 PolarHBondContact OD1-NH1 3.05Å; I118-R120 VanDerWaalsContact C-N 3.34Å; R120-D145 WeakPolarHBondContact CA-OD2 3.5Å; R120-D145 WeakPolarHBondContact CG-OD2 3.29Å
121	G	90.3	Very high	95.4	Very high	13 Å²	13	35.1 Å²	35.1	13%	0.134	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.9	-3.3	-175.8	0	0	0	0	0	115	I123 D145	G121-I123 PolarHBondContact O-N 2.85Å; G121-D145 PolarHBondContact N-OD2 3.07Å
122	L	94.9	Very high	95.5	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.			trans	-80.1	46.9	-175.7	-66.9	-180	0	0	0	113.9	F95 L98 L101 L104 L119 N124 L125 F146	F95-L122 HydrophobicContact CB-CD1 4.27Å; F95-L122 HydrophobicContact CB-CD2 3.95Å; F95-L122 HydrophobicContact CB-CG 4.11Å; F95-L122 HydrophobicContact CD2-CD1 4.33Å; L98-L122 HydrophobicContact CB-CD2 4.01Å; L101-L122 HydrophobicContact CB-CD2 4.08Å; L101-L122 HydrophobicContact CD2-CD2 3.64Å; L101-L122 HydrophobicContact CG-CD2 4.48Å; L104-L122 HydrophobicContact CD2-CD1 3.73Å; L119-L122 HydrophobicContact CB-CD1 4.18Å; L119-L122 HydrophobicContact CD2-CD1 4.17Å; L119-L122 WeakPolarHBondContact O-CB 3.41Å; L119-L122 WeakPolarHBondContact O-CD1 3.32Å; L119-L122 VanDerWaalsContact O-CG 3.3Å; L119-L122 WeakPolarHBondContact O-CG 3.42Å; L122-N124 VanDerWaalsContact C-N 3.29Å; L122-N124 PolarHBondContact O-N 3.34Å; L122-N124 VanDerWaalsContact O-N 3.12Å; L122-L125 HydrophobicContact CB-CB 4.22Å; L122-L125 HydrophobicContact CB-CD2 4.39Å; L122-L125 HydrophobicContact CD1-CD2 4.19Å; L122-L125 VanDerWaalsContact O-CB 3.27Å; L122-L125 WeakPolarHBondContact O-CB 3.44Å; L122-L125 PolarHBondContact O-N 3.46Å; L122-L125 VanDerWaalsContact O-N 3.13Å; L122-F146 HydrophobicContact CB-CD1 4.01Å; L122-F146 HydrophobicContact CB-CE1 4.29Å
123	I	93.4	Very high	95.6	Very high	77 Å²	77	37 Å²	37	40%	0.395	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.9	-167.6	53.8	163.5	0	0	0	115.9	E99 G121 D145 T149	E99-I123 HydrophobicContact CB-CD1 4.4Å; G121-I123 PolarHBondContact O-N 2.85Å; I123-D145 HydrophobicContact CG2-CB 4.37Å; I123-T149 WeakPolarHBondContact O-CG2 3.46Å; I123-T149 PolarHBondContact O-OG1 3.09Å
124	N	95.8	Very high	95.6	Very high	74 Å²	74	38.5 Å²	38.5	40%	0.396	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	15.3	-178.2	-71.4	-69.5	0	0	0	113.8	E99 L101 L122 Q126	E99-N124 PolarHBondContact O-ND2 2.94Å; L101-N124 CarbonylContact O-C 3.58Å; L122-N124 VanDerWaalsContact C-N 3.29Å; L122-N124 PolarHBondContact O-N 3.34Å; L122-N124 VanDerWaalsContact O-N 3.12Å; N124-Q126 PolarHBondContact O-N 3.3Å
125	L	97.4	Very high	95.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.195	C	C	.	.			trans	-67.9	125	-175.2	-165.9	72.2	0	0	0	111.7	L101 L104 L122 L128 F146 T149 L150	L101-L125 HydrophobicContact CD2-CD1 4.24Å; L101-L125 HydrophobicContact CG-CD1 4.42Å; L101-L125 WeakPolarHBondContact O-CA 3.42Å; L101-L125 PolarHBondContact O-N 2.85Å; L104-L125 HydrophobicContact CB-CD1 3.85Å; L122-L125 HydrophobicContact CB-CB 4.22Å; L122-L125 HydrophobicContact CB-CD2 4.39Å; L122-L125 HydrophobicContact CD1-CD2 4.19Å; L122-L125 VanDerWaalsContact O-CB 3.27Å; L122-L125 WeakPolarHBondContact O-CB 3.44Å; L122-L125 PolarHBondContact O-N 3.46Å; L122-L125 VanDerWaalsContact O-N 3.13Å; L125-L128 HydrophobicContact CD2-CB 3.96Å; L125-L128 HydrophobicContact CD2-CD1 4.23Å; L125-L128 HydrophobicContact CD2-CD2 4.38Å; L125-L128 HydrophobicContact CD2-CG 4.41Å; L125-F146 HydrophobicContact CB-CB 4.09Å; L125-F146 HydrophobicContact CB-CD1 4.42Å; L125-F146 HydrophobicContact CB-CG 4.21Å; L125-F146 HydrophobicContact CD2-CD1 4.25Å; L125-F146 HydrophobicContact CD2-CD2 4.4Å; L125-F146 HydrophobicContact CD2-CE1 4.24Å; L125-F146 HydrophobicContact CD2-CE2 4.38Å; L125-F146 HydrophobicContact CD2-CG 4.33Å; L125-F146 HydrophobicContact CD2-CZ 4.29Å; L125-T149 CarbonylContact O-C 3.19Å; L125-L150 HydrophobicContact CD2-CD1 4.27Å; L125-L150 HydrophobicContact CG-CD1 4.25Å; L125-L150 WeakPolarHBondContact O-CA 3.43Å; L125-L150 PolarHBondContact O-N 2.88Å
126	Q	97.6	Very high	95.9	Very high	47 Å²	47	40.3 Å²	40.3	22%	0.22	21%	0.205	C	C	.	.			trans	-106.6	-36	178.9	-63.8	-178.6	-85.6	0	0	111.8	R102 N124 E151 D152	R102-Q126 VanDerWaalsContact CD-OE1 3.3Å; R102-Q126 PolarHBondContact O-N 3.02Å; N124-Q126 PolarHBondContact O-N 3.3Å; Q126-E151 PolarHBondContact NE2-OE1 3.3Å; Q126-E151 WeakPolarHBondContact O-CA 3.13Å; Q126-E151 PolarHBondContact O-N 3.44Å; Q126-D152 PolarHBondContact O-N 2.85Å
127	H	98.3	Very high	96.1	Very high	54 Å²	54	38.6 Å²	38.6	25%	0.25	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	119.6	-178.3	-42.8	-83.7	0	0	0	110.5	R102 L104 D152	R102-H127 PolarHBondContact O-N 2.91Å; L104-H127 PolarHBondContact N-O 3.3Å; H127-D152 WeakPolarHBondContact CA-O 3.24Å; H127-D152 HydrophobicContact CB-CB 4.44Å; H127-D152 IonicContact CE1-OD2 3.07Å; H127-D152 PolarHBondContact CE1-OD2 2.89Å; H127-D152 IonicContact CG-OD2 3.86Å; H127-D152 IonicContact ND1-OD2 2.65Å; H127-D152 PolarHBondContact ND1-OD2 2.87Å
128	L	98.1	Very high	96.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	106.3	176.2	179.1	55.6	0	0	0	110	L104 L119 L125 L130 F143 F146 L150 D152 L153 D154	L104-L128 HydrophobicContact CB-CD1 4.34Å; L104-L128 HydrophobicContact CD2-CD1 4.14Å; L104-L128 HydrophobicContact CG-CD1 4.34Å; L119-L128 HydrophobicContact CD1-CD2 3.91Å; L125-L128 HydrophobicContact CD2-CB 3.96Å; L125-L128 HydrophobicContact CD2-CD1 4.23Å; L125-L128 HydrophobicContact CD2-CD2 4.38Å; L125-L128 HydrophobicContact CD2-CG 4.41Å; L128-L130 HydrophobicContact CD1-CD1 3.9Å; L128-L130 HydrophobicContact CD1-CG 4Å; L128-L130 HydrophobicContact CD2-CD1 3.96Å; L128-L130 HydrophobicContact CG-CD1 3.84Å; L128-L130 HydrophobicContact CG-CG 4.25Å; L128-F143 HydrophobicContact CD2-CE1 4.15Å; L128-F146 HydrophobicContact CD2-CE2 4Å; L128-F146 HydrophobicContact CD2-CZ 3.97Å; L128-L150 HydrophobicContact CB-CD1 3.88Å; L128-D152 PolarHBondContact N-O 2.85Å; L128-L153 HydrophobicContact CB-CD1 4.1Å; L128-L153 HydrophobicContact CD2-CD1 3.98Å; L128-L153 HydrophobicContact CG-CD1 4.06Å; L128-D154 PolarHBondContact O-N 2.68Å
129	I	98.4	Very high	96.4	Very high	27 Å²	27	39.1 Å²	39.1	14%	0.138	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	104.7	-174.1	-48.8	-58.8	0	0	0	109.2	L104 L106 D107 N131 D154	L104-I129 PolarHBondContact O-N 3.37Å; L106-I129 PolarHBondContact N-O 3.33Å; D107-I129 HydrophobicContact CB-CG2 4.26Å; D107-I129 PolarHBondContact N-O 2.78Å; I129-N131 WeakPolarHBondContact CG2-OD1 3.2Å; I129-D154 HydrophobicContact CD1-CB 3.83Å; I129-D154 HydrophobicContact CG2-CB 4.32Å
130	L	97.9	Very high	96.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.239	C	C	.	.			trans	-119.3	11.4	-172.9	-84.5	166.3	0	0	0	112.8	L106 L111 I114 L128 N133 L135 D154 L155 N158	L106-L130 HydrophobicContact CB-CD2 3.77Å; L106-L130 HydrophobicContact CD1-CD2 3.91Å; L106-L130 HydrophobicContact CG-CD2 4.5Å; L111-L130 HydrophobicContact CD1-CD2 3.94Å; I114-L130 HydrophobicContact CD1-CD2 4.21Å; L128-L130 HydrophobicContact CD1-CD1 3.9Å; L128-L130 HydrophobicContact CD1-CG 4Å; L128-L130 HydrophobicContact CD2-CD1 3.96Å; L128-L130 HydrophobicContact CG-CD1 3.84Å; L128-L130 HydrophobicContact CG-CG 4.25Å; L130-N133 PolarHBondContact O-ND2 2.69Å; L130-L135 HydrophobicContact CB-CD1 4.35Å; L130-L135 HydrophobicContact CD2-CD1 4.49Å; L130-D154 CarbonylContact C-O 3.4Å; L130-D154 WeakPolarHBondContact CA-O 3.43Å; L130-D154 PolarHBondContact N-O 3Å; L130-L155 HydrophobicContact CB-CD2 3.84Å; L130-L155 HydrophobicContact CD1-CD2 3.84Å; L130-N158 PolarHBondContact O-ND2 2.87Å
131	N	98.1	Very high	96.2	Very high	35 Å²	35	44.8 Å²	44.8	19%	0.187	24%	0.244	C	C	.	.			trans	-68.9	160.6	-172.4	64.9	-21.3	0	0	0	115.3	D107 S108 I129 N133 D154 S156	D107-N131 CarbonylContact C-O 3.58Å; D107-N131 VanDerWaalsContact CA-O 3.27Å; D107-N131 WeakPolarHBondContact CA-O 3.31Å; D107-N131 WeakPolarHBondContact CB-OD1 3.47Å; S108-N131 PolarHBondContact N-O 2.96Å; I129-N131 WeakPolarHBondContact CG2-OD1 3.2Å; N131-N133 VanDerWaalsContact C-N 3.33Å; N131-N133 PolarHBondContact O-N 3.1Å; N131-N133 PolarHBondContact O-ND2 2.83Å; N131-D154 WeakPolarHBondContact CB-OD1 3.37Å; N131-D154 PolarHBondContact N-O 2.65Å; N131-D154 PolarHBondContact ND2-OD2 3.46Å; N131-S156 CarbonylContact C-O 3.54Å; N131-S156 WeakPolarHBondContact CA-O 3.4Å; N131-S156 WeakPolarHBondContact CB-O 3.33Å; N131-S156 WeakPolarHBondContact CB-OG 3.48Å; N131-S156 PolarHBondContact ND2-OG 2.93Å
132	N	98.1	Very high	96.4	Very high	86 Å²	86	44.3 Å²	44.3	46%	0.46	24%	0.24	S	C	.	.	S	Bend	trans	54.9	48.7	-178.8	-171.8	41	0	0	0	111.7	S108 N109 S156 Y157	S108-N132 WeakPolarHBondContact CA-O 3.48Å; S108-N132 WeakPolarHBondContact CB-ND2 3.27Å; S108-N132 PolarHBondContact N-O 3.2Å; S108-N132 PolarHBondContact OG-ND2 3.44Å; N109-N132 PolarHBondContact N-O 3.03Å; N132-S156 PolarHBondContact N-O 3.21Å; N132-Y157 VanDerWaalsContact CA-O 3.24Å; N132-Y157 WeakPolarHBondContact CA-O 3.33Å; N132-Y157 PolarHBondContact N-O 2.83Å
133	N	98.1	Very high	96.4	Very high	12 Å²	12	44.3 Å²	44.3	6%	0.064	24%	0.24	C	C	.	.	S	Bend	trans	-113.4	-158.3	175.3	-92.7	-79	0	0	0	109.3	L106 N109 R110 L111 L130 N131 L135 Y157 N158	L106-N133 PolarHBondContact O-ND2 3.08Å; N109-N133 WeakPolarHBondContact CA-OD1 3.15Å; N109-N133 WeakPolarHBondContact CB-OD1 3.35Å; R110-N133 PolarHBondContact N-OD1 2.86Å; L111-N133 WeakPolarHBondContact CB-OD1 3.38Å; L111-N133 PolarHBondContact N-OD1 2.94Å; L111-N133 VanDerWaalsContact N-OD1 3.08Å; L130-N133 PolarHBondContact O-ND2 2.69Å; N131-N133 VanDerWaalsContact C-N 3.33Å; N131-N133 PolarHBondContact O-N 3.1Å; N131-N133 PolarHBondContact O-ND2 2.83Å; N133-L135 HydrophobicContact CB-CG 4.14Å; N133-Y157 PolarHBondContact N-O 2.98Å; N133-N158 VanDerWaalsContact CA-OD1 3.31Å; N133-N158 WeakPolarHBondContact CA-OD1 3.45Å; N133-N158 WeakPolarHBondContact CB-OD1 3.06Å; N133-N158 PolarHBondContact N-OD1 3.18Å
134	Q	96.9	Very high	96.3	Very high	104 Å²	104	45.5 Å²	45.5	49%	0.486	24%	0.243	S	C	.	.			trans	-122.5	17.3	178.7	-58.7	-172.6	-5.4	0	0	111.9	L111 S136 N158 N159	L111-Q134 CarbonylContact O-C 3.46Å; L111-Q134 VanDerWaalsContact O-CA 3.31Å; L111-Q134 WeakPolarHBondContact O-CA 3.47Å; L111-Q134 PolarHBondContact O-N 3Å; Q134-S136 PolarHBondContact O-N 2.94Å; Q134-N158 PolarHBondContact N-OD1 3.01Å; Q134-N159 WeakPolarHBondContact CA-ND2 3.16Å; Q134-N159 PolarHBondContact O-ND2 2.85Å
135	L	97.8	Very high	96.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.			trans	-57.8	120.5	-168.7	-62.2	176.3	0	0	0	111.5	L111 P112 I114 L130 N133 L155 N158 N159 L160	L111-L135 HydrophobicContact CB-CD2 3.71Å; L111-L135 PolarHBondContact O-N 3.39Å; L111-L135 VanDerWaalsContact O-N 3.12Å; P112-L135 WeakPolarHBondContact O-CA 3.14Å; I114-L135 HydrophobicContact CD1-CD2 4.02Å; I114-L135 HydrophobicContact CG1-CD1 4.18Å; I114-L135 HydrophobicContact CG1-CD2 3.81Å; L130-L135 HydrophobicContact CB-CD1 4.35Å; L130-L135 HydrophobicContact CD2-CD1 4.49Å; N133-L135 HydrophobicContact CB-CG 4.14Å; L135-L155 HydrophobicContact CD1-CD2 4.23Å; L135-N158 HydrophobicContact CB-CB 4.2Å; L135-N158 VanDerWaalsContact CB-OD1 3.32Å; L135-N158 WeakPolarHBondContact CB-OD1 3.25Å; L135-N158 WeakPolarHBondContact CG-OD1 3.33Å; L135-N158 PolarHBondContact N-OD1 2.92Å; L135-N159 CarbonylContact O-C 3.15Å; L135-N159 VanDerWaalsContact O-CA 3.23Å; L135-N159 WeakPolarHBondContact O-CA 3.24Å; L135-N159 WeakPolarHBondContact O-CB 3.44Å; L135-N159 PolarHBondContact O-N 2.88Å; L135-L160 HydrophobicContact CB-CD2 3.89Å; L135-L160 HydrophobicContact CB-CG 4.25Å; L135-L160 PolarHBondContact O-N 2.83Å
136	S	96.4	Very high	96	Very high	66 Å²	66	45.2 Å²	45.2	46%	0.462	24%	0.242	S	C	.	.			trans	-100.9	-29.9	178.8	59.5	0	0	0	0	112.7	P112 Q134	P112-S136 PolarHBondContact O-N 2.85Å; P112-S136 PolarHBondContact O-OG 3.26Å; Q134-S136 PolarHBondContact O-N 2.94Å
137	S	96.1	Very high	95.8	Very high	65 Å²	65	44 Å²	44	46%	0.455	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	155.4	177.5	52.9	0	0	0	0	111.9	D113 I114	D113-S137 VanDerWaalsContact CA-O 3.32Å; D113-S137 WeakPolarHBondContact CA-O 3.48Å; I114-S137 PolarHBondContact N-O 2.72Å
138	I	96.9	Very high	95.6	Very high	18 Å²	18	47.2 Å²	47.2	9%	0.092	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	134.5	174.6	-63.2	169.9	0	0	0	106.2	I114 A142 F143 L155 L160 I163 P164	I114-I138 HydrophobicContact CB-CG1 4.28Å; I114-I138 HydrophobicContact CB-CG2 4.31Å; I114-I138 HydrophobicContact CG1-CG1 4.39Å; I138-A142 HydrophobicContact CG2-CB 3.97Å; I138-F143 HydrophobicContact CD1-CZ 4.19Å; I138-F143 HydrophobicContact CG2-CE1 4.18Å; I138-F143 HydrophobicContact CG2-CE2 4.31Å; I138-F143 HydrophobicContact CG2-CZ 3.89Å; I138-L155 HydrophobicContact CD1-CD1 4.01Å; I138-L155 HydrophobicContact CD1-CD2 3.88Å; I138-L160 HydrophobicContact CD1-CD1 4.02Å; I138-L160 HydrophobicContact CD1-CD2 3.92Å; I138-L160 HydrophobicContact CG1-CD2 3.9Å; I138-I163 HydrophobicContact CD1-CG2 4.33Å; I138-P164 HydrophobicContact CG2-CG 4.28Å
139	S	95.4	Very high	95.5	Very high	39 Å²	39	49 Å²	49	27%	0.273	27%	0.266	S	S	.	.			trans	-69	147.1	177.6	-170.6	0	0	0	0	111.6	I114 E141 A142	I114-S139 PolarHBondContact O-N 3.2Å; S139-E141 VanDerWaalsContact C-N 3.26Å; S139-E141 PolarHBondContact O-N 2.81Å; S139-A142 VanDerWaalsContact O-CB 3.23Å; S139-A142 WeakPolarHBondContact O-CB 3.21Å; S139-A142 PolarHBondContact O-N 3.26Å; S139-A142 VanDerWaalsContact O-N 3.09Å
140	D	91.3	Very high	95.4	Very high	115 Å²	115	47.7 Å²	47.7	62%	0.615	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-35.3	-177.8	-68.4	-55.5	0	0	0	113.1	P164 S167	D140-P164 HydrophobicContact CB-CB 4.46Å; D140-P164 WeakPolarHBondContact OD1-CB 3.4Å; D140-S167 PolarHBondContact O-OG 3.23Å
141	E	92.6	Very high	95.4	Very high	108 Å²	108	50.2 Å²	50.2	51%	0.505	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-7.2	179.1	-62.3	-175.7	-167.7	0	0	113.5	E116 S139 F143 E144	E116-E141 HydrophobicContact CB-CB 4.47Å; S139-E141 VanDerWaalsContact C-N 3.26Å; S139-E141 PolarHBondContact O-N 2.81Å; E141-F143 PolarHBondContact O-N 2.97Å; E141-E144 HydrophobicContact CB-CG 4.36Å; E141-E144 PolarHBondContact O-N 2.86Å
142	A	94.8	Very high	95.4	Very high	4 Å²	4	50.6 Å²	50.6	3%	0.033	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-8.8	-171.7	0	0	0	0	0	115.5	I114 I138 S139	I114-A142 HydrophobicContact CG2-CB 3.97Å; I138-A142 HydrophobicContact CG2-CB 3.97Å; S139-A142 VanDerWaalsContact O-CB 3.23Å; S139-A142 WeakPolarHBondContact O-CB 3.21Å; S139-A142 PolarHBondContact O-N 3.26Å; S139-A142 VanDerWaalsContact O-N 3.09Å
143	F	94.9	Very high	95.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	1.7	-178.9	-60.8	-28.4	0	0	0	114	L119 L128 I138 E141 D145 F146 L147 L153 P164 M171	L119-F143 HydrophobicContact CD1-CD1 4.44Å; L119-F143 HydrophobicContact CD1-CE1 4.34Å; L128-F143 HydrophobicContact CD2-CE1 4.15Å; I138-F143 HydrophobicContact CD1-CZ 4.19Å; I138-F143 HydrophobicContact CG2-CE1 4.18Å; I138-F143 HydrophobicContact CG2-CE2 4.31Å; I138-F143 HydrophobicContact CG2-CZ 3.89Å; E141-F143 PolarHBondContact O-N 2.97Å; F143-D145 PolarHBondContact O-N 3.39Å; F143-F146 HydrophobicContact CB-CE2 4.05Å; F143-F146 HydrophobicContact CB-CZ 4.33Å; F143-F146 AromaticContact CD1-CE2 3.78Å; F143-F146 HydrophobicContact CD1-CE2 3.78Å; F143-F146 AromaticContact CD1-CZ 3.72Å; F143-F146 HydrophobicContact CD1-CZ 3.72Å; F143-F146 HydrophobicContact CG-CE2 4.21Å; F143-F146 HydrophobicContact CG-CZ 4.44Å; F143-F146 PolarHBondContact O-N 2.93Å; F143-L147 HydrophobicContact CB-CD2 4.14Å; F143-L147 VanDerWaalsContact O-CD2 3.32Å; F143-L147 WeakPolarHBondContact O-CD2 3.32Å; F143-L147 WeakPolarHBondContact O-CG 3.26Å; F143-L147 PolarHBondContact O-N 2.81Å; F143-L153 HydrophobicContact CE2-CD2 4.36Å; F143-L153 HydrophobicContact CZ-CD2 4.42Å; F143-P164 HydrophobicContact CD2-CG 3.7Å; F143-P164 HydrophobicContact CE2-CG 3.69Å; F143-M171 HydrophobicContact CB-CE 3.74Å; F143-M171 HydrophobicContact CD2-CE 3.64Å; F143-M171 HydrophobicContact CE2-CE 4.42Å; F143-M171 HydrophobicContact CG-CE 3.86Å
144	E	92.6	Very high	95.4	Very high	102 Å²	102	46.9 Å²	46.9	48%	0.477	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-60.2	-38.9	-168.8	-69.2	-145.5	132.4	0	0	114.5	E141 F146 L147	E141-E144 HydrophobicContact CB-CG 4.36Å; E141-E144 PolarHBondContact O-N 2.86Å; E144-F146 VanDerWaalsContact C-N 3.26Å; E144-F146 PolarHBondContact O-N 3.06Å; E144-L147 WeakPolarHBondContact O-CG 3.43Å
145	D	92.3	Very high	95.4	Very high	67 Å²	67	42 Å²	42	36%	0.358	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-65.7	-23.3	-174.1	-74.7	-24.8	0	0	0	114	R120 G121 I123 F143	R120-D145 WeakPolarHBondContact CA-OD2 3.5Å; R120-D145 WeakPolarHBondContact CG-OD2 3.29Å; G121-D145 PolarHBondContact N-OD2 3.07Å; I123-D145 HydrophobicContact CG2-CB 4.37Å; F143-D145 PolarHBondContact O-N 3.39Å
146	F	94.4	Very high	95.5	Very high	1 Å²	1	42.2 Å²	42.2	0%	0.004	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-125.1	17.3	-173.7	47.7	-95.4	0	0	0	114.9	L119 L122 L125 L128 F143 E144 L148 T149 L150	L119-F146 HydrophobicContact CB-CE1 3.98Å; L119-F146 HydrophobicContact CB-CZ 4.29Å; L119-F146 HydrophobicContact CD1-CZ 3.99Å; L122-F146 HydrophobicContact CB-CD1 4.01Å; L122-F146 HydrophobicContact CB-CE1 4.29Å; L125-F146 HydrophobicContact CB-CB 4.09Å; L125-F146 HydrophobicContact CB-CD1 4.42Å; L125-F146 HydrophobicContact CB-CG 4.21Å; L125-F146 HydrophobicContact CD2-CD1 4.25Å; L125-F146 HydrophobicContact CD2-CD2 4.4Å; L125-F146 HydrophobicContact CD2-CE1 4.24Å; L125-F146 HydrophobicContact CD2-CE2 4.38Å; L125-F146 HydrophobicContact CD2-CG 4.33Å; L125-F146 HydrophobicContact CD2-CZ 4.29Å; L128-F146 HydrophobicContact CD2-CE2 4Å; L128-F146 HydrophobicContact CD2-CZ 3.97Å; F143-F146 HydrophobicContact CB-CE2 4.05Å; F143-F146 HydrophobicContact CB-CZ 4.33Å; F143-F146 AromaticContact CD1-CE2 3.78Å; F143-F146 HydrophobicContact CD1-CE2 3.78Å; F143-F146 AromaticContact CD1-CZ 3.72Å; F143-F146 HydrophobicContact CD1-CZ 3.72Å; F143-F146 HydrophobicContact CG-CE2 4.21Å; F143-F146 HydrophobicContact CG-CZ 4.44Å; F143-F146 PolarHBondContact O-N 2.93Å; E144-F146 VanDerWaalsContact C-N 3.26Å; E144-F146 PolarHBondContact O-N 3.06Å; F146-L148 PolarHBondContact O-N 3.05Å; F146-L148 VanDerWaalsContact O-N 3.09Å; F146-T149 WeakPolarHBondContact CA-OG1 3.38Å; F146-T149 WeakPolarHBondContact CB-OG1 3.07Å; F146-T149 PolarHBondContact O-N 2.9Å; F146-T149 PolarHBondContact O-OG1 3.3Å; F146-L150 HydrophobicContact CD2-CB 4.25Å; F146-L150 HydrophobicContact CD2-CD1 4.07Å; F146-L150 HydrophobicContact CD2-CD2 4.17Å; F146-L150 HydrophobicContact CD2-CG 4.41Å; F146-L150 HydrophobicContact CE2-CD1 4.45Å; F146-L150 HydrophobicContact CE2-CD2 4.23Å; F146-L150 PolarHBondContact O-N 3.17Å
147	L	93.5	Very high	95.6	Very high	20 Å²	20	44.7 Å²	44.7	11%	0.105	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-30.1	177.1	-62.5	176.4	0	0	0	113.7	F143 E144 S167 K170 M171	F143-L147 HydrophobicContact CB-CD2 4.14Å; F143-L147 VanDerWaalsContact O-CD2 3.32Å; F143-L147 WeakPolarHBondContact O-CD2 3.32Å; F143-L147 WeakPolarHBondContact O-CG 3.26Å; F143-L147 PolarHBondContact O-N 2.81Å; E144-L147 WeakPolarHBondContact O-CG 3.43Å; L147-S167 WeakPolarHBondContact CD2-O 3.45Å; L147-K170 HydrophobicContact CB-CB 4.43Å; L147-K170 HydrophobicContact CD1-CB 4.26Å; L147-K170 HydrophobicContact CD1-CD 3.71Å; L147-M171 HydrophobicContact CD2-CE 3.98Å; L147-M171 HydrophobicContact CD2-CG 4.29Å; L147-M171 WeakPolarHBondContact O-CA 3.22Å
148	L	92.8	Very high	95.7	Very high	122 Å²	122	42 Å²	42	64%	0.639	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-5.4	-178.4	-60.8	-179.6	0	0	0	113.8	F146 I172 N173	F146-L148 PolarHBondContact O-N 3.05Å; F146-L148 VanDerWaalsContact O-N 3.09Å; L148-I172 HydrophobicContact CD2-CD1 4.24Å; L148-I172 HydrophobicContact CD2-CG1 4.34Å; L148-N173 PolarHBondContact O-ND2 2.83Å
149	T	95.7	Very high	95.7	Very high	38 Å²	38	44.9 Å²	44.9	23%	0.233	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-22.5	-171.5	34.7	0	0	0	0	113.8	I123 L125 F146	I123-T149 WeakPolarHBondContact O-CG2 3.46Å; I123-T149 PolarHBondContact O-OG1 3.09Å; L125-T149 CarbonylContact O-C 3.19Å; F146-T149 WeakPolarHBondContact CA-OG1 3.38Å; F146-T149 WeakPolarHBondContact CB-OG1 3.07Å; F146-T149 PolarHBondContact O-N 2.9Å; F146-T149 PolarHBondContact O-OG1 3.3Å
150	L	97	Very high	95.8	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.			trans	-68.1	131.6	-178.9	-156.6	71.3	0	0	0	112.9	L125 L128 F146 L153 M171 N173 L174	L125-L150 HydrophobicContact CD2-CD1 4.27Å; L125-L150 HydrophobicContact CG-CD1 4.25Å; L125-L150 WeakPolarHBondContact O-CA 3.43Å; L125-L150 PolarHBondContact O-N 2.88Å; L128-L150 HydrophobicContact CB-CD1 3.88Å; F146-L150 HydrophobicContact CD2-CB 4.25Å; F146-L150 HydrophobicContact CD2-CD1 4.07Å; F146-L150 HydrophobicContact CD2-CD2 4.17Å; F146-L150 HydrophobicContact CD2-CG 4.41Å; F146-L150 HydrophobicContact CE2-CD1 4.45Å; F146-L150 HydrophobicContact CE2-CD2 4.23Å; F146-L150 PolarHBondContact O-N 3.17Å; L150-L153 HydrophobicContact CD2-CB 3.98Å; L150-L153 HydrophobicContact CD2-CD1 4.38Å; L150-L153 HydrophobicContact CD2-CD2 4.34Å; L150-L153 HydrophobicContact CD2-CG 4.46Å; L150-M171 HydrophobicContact CD2-CE 4.03Å; L150-M171 HydrophobicContact CD2-SD 3.91Å; L150-N173 CarbonylContact O-C 3.54Å; L150-N173 VanDerWaalsContact O-C 3.3Å; L150-L174 HydrophobicContact CD2-CD1 4.29Å; L150-L174 HydrophobicContact CG-CD1 4.39Å; L150-L174 PolarHBondContact O-N 3.2Å
151	E	96.9	Very high	96.1	Very high	53 Å²	53	45.3 Å²	45.3	25%	0.248	22%	0.215	C	C	.	.			trans	-115.2	-40.7	179.1	-69.2	180	-149.3	0	0	111.4	Q126 N173 L174 H175 Q176	Q126-E151 PolarHBondContact NE2-OE1 3.3Å; Q126-E151 WeakPolarHBondContact O-CA 3.13Å; Q126-E151 PolarHBondContact O-N 3.44Å; E151-N173 HydrophobicContact CG-CB 4.42Å; E151-L174 CarbonylContact O-C 3.45Å; E151-H175 WeakPolarHBondContact O-CA 3.38Å; E151-H175 PolarHBondContact O-N 3.5Å; E151-Q176 PolarHBondContact O-N 2.89Å
152	D	98	Very high	96.2	Very high	43 Å²	43	42.6 Å²	42.6	23%	0.23	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.4	176.4	-61.6	-41.5	0	0	0	112	Q126 H127 L128 Q176	Q126-D152 PolarHBondContact O-N 2.85Å; H127-D152 WeakPolarHBondContact CA-O 3.24Å; H127-D152 HydrophobicContact CB-CB 4.44Å; H127-D152 IonicContact CE1-OD2 3.07Å; H127-D152 PolarHBondContact CE1-OD2 2.89Å; H127-D152 IonicContact CG-OD2 3.86Å; H127-D152 IonicContact ND1-OD2 2.65Å; H127-D152 PolarHBondContact ND1-OD2 2.87Å; L128-D152 PolarHBondContact N-O 2.85Å; D152-Q176 HydrophobicContact CB-CB 4.48Å; D152-Q176 VanDerWaalsContact OD1-CB 3.24Å; D152-Q176 WeakPolarHBondContact OD1-CB 3.3Å
153	L	98.1	Very high	96.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	117.7	173	-178.8	55.9	0	0	0	110.4	L128 F143 L150 L155 M171 L174 Q176 L177 S178	L128-L153 HydrophobicContact CB-CD1 4.1Å; L128-L153 HydrophobicContact CD2-CD1 3.98Å; L128-L153 HydrophobicContact CG-CD1 4.06Å; F143-L153 HydrophobicContact CE2-CD2 4.36Å; F143-L153 HydrophobicContact CZ-CD2 4.42Å; L150-L153 HydrophobicContact CD2-CB 3.98Å; L150-L153 HydrophobicContact CD2-CD1 4.38Å; L150-L153 HydrophobicContact CD2-CD2 4.34Å; L150-L153 HydrophobicContact CD2-CG 4.46Å; L153-L155 HydrophobicContact CD1-CD1 4.25Å; L153-L155 HydrophobicContact CD1-CD2 4.41Å; L153-L155 HydrophobicContact CD1-CG 4Å; L153-L155 HydrophobicContact CD2-CD1 4.1Å; L153-L155 HydrophobicContact CG-CD1 4.15Å; L153-L155 HydrophobicContact CG-CG 4.18Å; L153-M171 HydrophobicContact CD2-SD 4.49Å; L153-L174 HydrophobicContact CB-CD1 4.01Å; L153-Q176 PolarHBondContact N-O 2.98Å; L153-L177 HydrophobicContact CB-CD1 4.03Å; L153-L177 HydrophobicContact CD2-CD1 3.91Å; L153-L177 HydrophobicContact CG-CD1 4.01Å; L153-L177 WeakPolarHBondContact O-CA 3.49Å; L153-S178 PolarHBondContact O-N 2.59Å
154	D	98.5	Very high	96.4	Very high	20 Å²	20	43 Å²	43	11%	0.107	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	108.8	175.9	-175	4.8	0	0	0	110.7	L128 I129 L130 N131 S156 S178	L128-D154 PolarHBondContact O-N 2.68Å; I129-D154 HydrophobicContact CD1-CB 3.83Å; I129-D154 HydrophobicContact CG2-CB 4.32Å; L130-D154 CarbonylContact C-O 3.4Å; L130-D154 WeakPolarHBondContact CA-O 3.43Å; L130-D154 PolarHBondContact N-O 3Å; N131-D154 WeakPolarHBondContact CB-OD1 3.37Å; N131-D154 PolarHBondContact N-O 2.65Å; N131-D154 PolarHBondContact ND2-OD2 3.46Å; D154-S156 WeakPolarHBondContact OD1-CB 3.2Å; D154-S156 PolarHBondContact OD1-N 2.89Å; D154-S156 PolarHBondContact OD1-OG 3.05Å; D154-S178 WeakPolarHBondContact OD1-CB 3.22Å
155	L	98.2	Very high	96.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.188	C	C	.	.			trans	-113.3	14.5	176	-66	166.9	0	0	0	111.6	L130 L135 I138 L153 N158 L160 I163 S178 L179 N182	L130-L155 HydrophobicContact CB-CD2 3.84Å; L130-L155 HydrophobicContact CD1-CD2 3.84Å; L135-L155 HydrophobicContact CD1-CD2 4.23Å; I138-L155 HydrophobicContact CD1-CD1 4.01Å; I138-L155 HydrophobicContact CD1-CD2 3.88Å; L153-L155 HydrophobicContact CD1-CD1 4.25Å; L153-L155 HydrophobicContact CD1-CD2 4.41Å; L153-L155 HydrophobicContact CD1-CG 4Å; L153-L155 HydrophobicContact CD2-CD1 4.1Å; L153-L155 HydrophobicContact CG-CD1 4.15Å; L153-L155 HydrophobicContact CG-CG 4.18Å; L155-N158 PolarHBondContact O-ND2 2.85Å; L155-L160 HydrophobicContact CB-CD1 4Å; L155-L160 HydrophobicContact CD1-CD1 4.27Å; L155-L160 HydrophobicContact CD2-CD1 4.4Å; L155-L160 HydrophobicContact CG-CD1 4.47Å; L155-I163 HydrophobicContact CD1-CG2 4.26Å; L155-S178 PolarHBondContact N-O 3.17Å; L155-L179 HydrophobicContact CB-CD2 4.04Å; L155-L179 HydrophobicContact CD1-CD2 3.95Å; L155-N182 PolarHBondContact O-ND2 3.3Å
156	S	98.4	Very high	96.6	Very high	5 Å²	5	40 Å²	40	4%	0.035	19%	0.193	C	C	.	.			trans	-59.8	155.2	-175	60.8	0	0	0	0	113.6	N131 N132 D154 N158 D180	N131-S156 CarbonylContact C-O 3.54Å; N131-S156 WeakPolarHBondContact CA-O 3.4Å; N131-S156 WeakPolarHBondContact CB-O 3.33Å; N131-S156 WeakPolarHBondContact CB-OG 3.48Å; N131-S156 PolarHBondContact ND2-OG 2.93Å; N132-S156 PolarHBondContact N-O 3.21Å; D154-S156 WeakPolarHBondContact OD1-CB 3.2Å; D154-S156 PolarHBondContact OD1-N 2.89Å; D154-S156 PolarHBondContact OD1-OG 3.05Å; S156-N158 PolarHBondContact O-ND2 2.91Å; S156-D180 CarbonylContact C-O 3.48Å; S156-D180 WeakPolarHBondContact CA-O 3.35Å; S156-D180 VanDerWaalsContact CB-CG 3.45Å; S156-D180 WeakPolarHBondContact CB-OD1 3.44Å
157	Y	98.3	Very high	96.6	Very high	119 Å²	119	40.2 Å²	40.2	47%	0.467	20%	0.195	S	C	.	.	S	Bend	trans	53.2	63.4	-179	-62	-99.6	0	0	0	112.7	N132 N133 D180 H181	N132-Y157 VanDerWaalsContact CA-O 3.24Å; N132-Y157 WeakPolarHBondContact CA-O 3.33Å; N132-Y157 PolarHBondContact N-O 2.83Å; N133-Y157 PolarHBondContact N-O 2.98Å; Y157-D180 VanDerWaalsContact CE2-OD2 3.26Å; Y157-D180 WeakPolarHBondContact CE2-OD2 3.34Å; Y157-D180 PolarHBondContact N-O 2.67Å; Y157-H181 VanDerWaalsContact CA-O 3.31Å; Y157-H181 WeakPolarHBondContact CA-O 3.44Å; Y157-H181 HydrophobicContact CD1-CB 3.74Å; Y157-H181 AromaticContact CD1-CG 3.99Å; Y157-H181 HydrophobicContact CD2-CB 4.15Å; Y157-H181 HydrophobicContact CE1-CB 3.92Å; Y157-H181 AromaticContact CE1-CG 3.61Å; Y157-H181 AromaticContact CE1-ND1 3.86Å; Y157-H181 HydrophobicContact CE2-CB 4.28Å; Y157-H181 AromaticContact CE2-ND1 3.57Å; Y157-H181 HydrophobicContact CG-CB 3.86Å; Y157-H181 AromaticContact CZ-CE1 3.83Å; Y157-H181 AromaticContact CZ-CG 3.61Å; Y157-H181 AromaticContact CZ-ND1 3.34Å; Y157-H181 VanDerWaalsContact CZ-ND1 3.34Å; Y157-H181 PolarHBondContact OH-CE1 2.88Å; Y157-H181 PolarHBondContact OH-ND1 3.41Å
158	N	98.6	Very high	96.7	Very high	8 Å²	8	39.3 Å²	39.3	4%	0.043	19%	0.19	C	C	.	.	S	Bend	trans	-138.9	-174.9	177.3	-85.8	-71.2	0	0	0	110.4	L130 N133 Q134 L135 L155 S156 L160 H181 N182	L130-N158 PolarHBondContact O-ND2 2.87Å; N133-N158 VanDerWaalsContact CA-OD1 3.31Å; N133-N158 WeakPolarHBondContact CA-OD1 3.45Å; N133-N158 WeakPolarHBondContact CB-OD1 3.06Å; N133-N158 PolarHBondContact N-OD1 3.18Å; Q134-N158 PolarHBondContact N-OD1 3.01Å; L135-N158 HydrophobicContact CB-CB 4.2Å; L135-N158 VanDerWaalsContact CB-OD1 3.32Å; L135-N158 WeakPolarHBondContact CB-OD1 3.25Å; L135-N158 WeakPolarHBondContact CG-OD1 3.33Å; L135-N158 PolarHBondContact N-OD1 2.92Å; L155-N158 PolarHBondContact O-ND2 2.85Å; S156-N158 PolarHBondContact O-ND2 2.91Å; N158-L160 HydrophobicContact CB-CD1 4.23Å; N158-L160 HydrophobicContact CB-CG 4.17Å; N158-H181 PolarHBondContact N-O 2.77Å; N158-N182 WeakPolarHBondContact CA-OD1 3.49Å; N158-N182 WeakPolarHBondContact CB-OD1 3.27Å; N158-N182 PolarHBondContact O-OD1 2.88Å
159	N	97.9	Very high	96.8	Very high	78 Å²	78	36.2 Å²	36.2	42%	0.417	17%	0.17	S	C	.	.			trans	-108.3	19.9	-178	-58.7	-65.7	0	0	0	112.8	Q134 L135 R161 L183	Q134-N159 WeakPolarHBondContact CA-ND2 3.16Å; Q134-N159 PolarHBondContact O-ND2 2.85Å; L135-N159 CarbonylContact O-C 3.15Å; L135-N159 VanDerWaalsContact O-CA 3.23Å; L135-N159 WeakPolarHBondContact O-CA 3.24Å; L135-N159 WeakPolarHBondContact O-CB 3.44Å; L135-N159 PolarHBondContact O-N 2.88Å; N159-R161 PolarHBondContact O-N 2.9Å; N159-L183 HydrophobicContact CB-CD1 4.41Å
160	L	97.9	Very high	96.7	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.178	C	C	.	.			trans	-70.4	128	-169.7	-60.9	165.1	0	0	0	111.1	L135 I138 L155 N158 I163 N182 L183 I184	L135-L160 HydrophobicContact CB-CD2 3.89Å; L135-L160 HydrophobicContact CB-CG 4.25Å; L135-L160 PolarHBondContact O-N 2.83Å; I138-L160 HydrophobicContact CD1-CD1 4.02Å; I138-L160 HydrophobicContact CD1-CD2 3.92Å; I138-L160 HydrophobicContact CG1-CD2 3.9Å; L155-L160 HydrophobicContact CB-CD1 4Å; L155-L160 HydrophobicContact CD1-CD1 4.27Å; L155-L160 HydrophobicContact CD2-CD1 4.4Å; L155-L160 HydrophobicContact CG-CD1 4.47Å; N158-L160 HydrophobicContact CB-CD1 4.23Å; N158-L160 HydrophobicContact CB-CG 4.17Å; L160-I163 HydrophobicContact CB-CG2 4.27Å; L160-I163 HydrophobicContact CD1-CG2 3.84Å; L160-I163 HydrophobicContact CG-CG2 4.45Å; L160-N182 VanDerWaalsContact CB-OD1 3.3Å; L160-N182 WeakPolarHBondContact CB-OD1 3.24Å; L160-N182 WeakPolarHBondContact CG-OD1 3.13Å; L160-N182 PolarHBondContact N-OD1 2.9Å; L160-N182 VanDerWaalsContact N-OD1 3.1Å; L160-L183 CarbonylContact O-C 3.18Å; L160-L183 VanDerWaalsContact O-CA 3.25Å; L160-L183 WeakPolarHBondContact O-CA 3.24Å; L160-L183 PolarHBondContact O-N 3.33Å; L160-I184 WeakPolarHBondContact O-CG1 3.26Å; L160-I184 PolarHBondContact O-N 2.9Å; L160-I184 VanDerWaalsContact O-N 3.13Å
161	R	96.3	Very high	96.6	Very high	164 Å²	164	39 Å²	39	62%	0.619	18%	0.178	S	C	*	.	S	Bend	trans	-92.4	-25.6	172.2	-61.4	-170.1	-170	-167.5	3.9	113.8	N159 L183 I184 D185	N159-R161 PolarHBondContact O-N 2.9Å; R161-L183 WeakPolarHBondContact CA-O 3.48Å; R161-L183 HydrophobicContact CG-CB 4.16Å; R161-I184 WeakPolarHBondContact O-CA 3.4Å; R161-D185 PolarHBondContact O-N 3.43Å
162	S	96.2	Very high	96.4	Very high	51 Å²	51	40.6 Å²	40.6	36%	0.357	19%	0.188	S	C	.	.			trans	-154.1	164.3	173	58.1	0	0	0	0	108.4
163	I	96.2	Very high	96.2	Very high	8 Å²	8	40.7 Å²	40.7	4%	0.041	19%	0.189	C	C	.	.			trans	-136.5	161.6	175.4	58.8	-176.4	0	0	0	107.5	I138 L155 L160 W165 I168 L179 I184	I138-I163 HydrophobicContact CD1-CG2 4.33Å; L155-I163 HydrophobicContact CD1-CG2 4.26Å; L160-I163 HydrophobicContact CB-CG2 4.27Å; L160-I163 HydrophobicContact CD1-CG2 3.84Å; L160-I163 HydrophobicContact CG-CG2 4.45Å; I163-W165 VanDerWaalsContact C-N 3.32Å; I163-W165 HydrophobicContact CD1-CE3 4.05Å; I163-W165 HydrophobicContact CD1-CH2 3.64Å; I163-W165 HydrophobicContact CD1-CZ2 4.33Å; I163-W165 HydrophobicContact CD1-CZ3 3.49Å; I163-W165 VanDerWaalsContact CD1-CZ3 3.49Å; I163-W165 HydrophobicContact CG1-CD2 3.93Å; I163-W165 HydrophobicContact CG1-CE3 3.71Å; I163-W165 HydrophobicContact CG1-CH2 3.6Å; I163-W165 HydrophobicContact CG1-CZ2 3.79Å; I163-W165 HydrophobicContact CG1-CZ3 3.57Å; I163-W165 PolarHBondContact O-N 2.87Å; I163-I168 HydrophobicContact CB-CD1 4.27Å; I163-I168 HydrophobicContact CD1-CD1 3.31Å; I163-I168 HydrophobicContact CG1-CD1 3.62Å; I163-L179 HydrophobicContact CD1-CD1 3.53Å; I163-L179 HydrophobicContact CD1-CD2 3.48Å; I163-L179 VanDerWaalsContact CD1-CD2 3.48Å; I163-L179 HydrophobicContact CD1-CG 4.16Å; I163-I184 HydrophobicContact CD1-CD1 4.5Å
164	P	96	Very high	96.1	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.019	19%	0.189	C	C	.	.			trans	-72.5	85	-174.5	28.9	-36.8	0	0	0	112.3	I138 D140 F143 E166 S167 I168	I138-P164 HydrophobicContact CG2-CG 4.28Å; D140-P164 HydrophobicContact CB-CB 4.46Å; D140-P164 WeakPolarHBondContact OD1-CB 3.4Å; F143-P164 HydrophobicContact CD2-CG 3.7Å; F143-P164 HydrophobicContact CE2-CG 3.69Å; P164-E166 VanDerWaalsContact C-N 3.27Å; P164-E166 PolarHBondContact O-N 3.02Å; P164-S167 WeakPolarHBondContact O-CB 3.47Å; P164-S167 PolarHBondContact O-N 2.93Å; P164-I168 PolarHBondContact O-N 2.97Å
165	W	95.4	Very high	95.9	Very high	9 Å²	9	42.6 Å²	42.6	3%	0.034	20%	0.197	C	C	.	.	H	α-helix	trans	-58.3	-34.4	-175	-60.8	123.6	0	0	0	113.5	I163 S167 I168 R169 L179 I184 Y186 I187 T191	I163-W165 VanDerWaalsContact C-N 3.32Å; I163-W165 HydrophobicContact CD1-CE3 4.05Å; I163-W165 HydrophobicContact CD1-CH2 3.64Å; I163-W165 HydrophobicContact CD1-CZ2 4.33Å; I163-W165 HydrophobicContact CD1-CZ3 3.49Å; I163-W165 VanDerWaalsContact CD1-CZ3 3.49Å; I163-W165 HydrophobicContact CG1-CD2 3.93Å; I163-W165 HydrophobicContact CG1-CE3 3.71Å; I163-W165 HydrophobicContact CG1-CH2 3.6Å; I163-W165 HydrophobicContact CG1-CZ2 3.79Å; I163-W165 HydrophobicContact CG1-CZ3 3.57Å; I163-W165 PolarHBondContact O-N 2.87Å; W165-S167 VanDerWaalsContact C-N 3.32Å; W165-I168 HydrophobicContact CE3-CD1 4.22Å; W165-I168 HydrophobicContact CZ3-CD1 4.47Å; W165-I168 PolarHBondContact O-N 3.41Å; W165-R169 PolarHBondContact O-N 3.39Å; W165-L179 HydrophobicContact CH2-CD1 4.08Å; W165-L179 HydrophobicContact CZ3-CD1 4.18Å; W165-I184 HydrophobicContact CH2-CD1 4.45Å; W165-I184 HydrophobicContact CH2-CG2 4.22Å; W165-I184 HydrophobicContact CZ2-CG2 3.77Å; W165-Y186 VanDerWaalsContact CZ2-O 3.24Å; W165-Y186 WeakPolarHBondContact CZ2-O 3.29Å; W165-Y186 AromaticContact NE1-CE2 3.87Å; W165-I187 HydrophobicContact CD2-CG2 4.34Å; W165-I187 HydrophobicContact CE3-CG2 4.13Å; W165-I187 HydrophobicContact CH2-CB 4.27Å; W165-I187 HydrophobicContact CH2-CG1 3.74Å; W165-I187 HydrophobicContact CH2-CG2 4.04Å; W165-I187 HydrophobicContact CZ2-CB 4.21Å; W165-I187 HydrophobicContact CZ2-CG1 3.9Å; W165-I187 HydrophobicContact CZ2-CG2 4.26Å; W165-I187 HydrophobicContact CZ3-CG1 4.44Å; W165-I187 HydrophobicContact CZ3-CG2 3.95Å; W165-T191 HydrophobicContact CE3-CG2 3.86Å
166	E	93.5	Very high	95.9	Very high	99 Å²	99	45.6 Å²	45.6	46%	0.463	21%	0.211	S	C	.	.	H	α-helix	trans	-70.6	-26.5	176.2	-68.7	-58.8	144.1	0	0	113.1	P164 R169 K170	P164-E166 VanDerWaalsContact C-N 3.27Å; P164-E166 PolarHBondContact O-N 3.02Å; E166-R169 IonicContact OE1-CZ 2.77Å; E166-R169 IonicContact OE1-NH1 3.36Å; E166-R169 PolarHBondContact OE1-NH1 3.02Å; E166-R169 IonicContact OE1-NH2 3.66Å; E166-R169 IonicContact OE2-CZ 2.79Å; E166-R169 IonicContact OE2-NH1 3.19Å; E166-R169 PolarHBondContact OE2-NH1 2.91Å; E166-K170 WeakPolarHBondContact O-CD 3.39Å; E166-K170 WeakPolarHBondContact O-CE 3.04Å; E166-K170 WeakPolarHBondContact O-CG 3.17Å
167	S	94.8	Very high	95.8	Very high	5 Å²	5	45.3 Å²	45.3	4%	0.035	21%	0.209	C	C	.	.	H	α-helix	trans	-78.2	-42.6	171.3	-64.3	0	0	0	0	109.9	D140 L147 P164 W165 R169 K170	D140-S167 PolarHBondContact O-OG 3.23Å; L147-S167 WeakPolarHBondContact CD2-O 3.45Å; P164-S167 WeakPolarHBondContact O-CB 3.47Å; P164-S167 PolarHBondContact O-N 2.93Å; W165-S167 VanDerWaalsContact C-N 3.32Å; S167-R169 PolarHBondContact O-N 3.39Å; S167-K170 WeakPolarHBondContact O-CB 3.33Å; S167-K170 PolarHBondContact O-N 3.29Å; S167-K170 VanDerWaalsContact O-N 3.14Å
168	I	95.4	Very high	95.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.2	-38.8	177	-66.7	170	0	0	0	112.5	I163 P164 W165 K170 M171 L177 T191 L195	I163-I168 HydrophobicContact CB-CD1 4.27Å; I163-I168 HydrophobicContact CD1-CD1 3.31Å; I163-I168 HydrophobicContact CG1-CD1 3.62Å; P164-I168 PolarHBondContact O-N 2.97Å; W165-I168 HydrophobicContact CE3-CD1 4.22Å; W165-I168 HydrophobicContact CZ3-CD1 4.47Å; W165-I168 PolarHBondContact O-N 3.41Å; I168-K170 PolarHBondContact O-N 3.41Å; I168-K170 VanDerWaalsContact O-N 3.13Å; I168-M171 HydrophobicContact CG1-CE 4.47Å; I168-M171 HydrophobicContact CG1-SD 4.19Å; I168-M171 WeakPolarHBondContact O-CB 3.24Å; I168-M171 PolarHBondContact O-N 3.41Å; I168-L177 HydrophobicContact CG2-CD2 4.16Å; I168-T191 HydrophobicContact CG2-CG2 4.14Å; I168-L195 HydrophobicContact CG2-CD1 4.28Å
169	R	94.5	Very high	95.8	Very high	58 Å²	58	40 Å²	40	22%	0.219	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-31.6	175	-175.1	-174.7	-74.8	138.2	-0.8	112.5	W165 E166 S167 M171 E189 G190 T191	W165-R169 PolarHBondContact O-N 3.39Å; E166-R169 IonicContact OE1-CZ 2.77Å; E166-R169 IonicContact OE1-NH1 3.36Å; E166-R169 PolarHBondContact OE1-NH1 3.02Å; E166-R169 IonicContact OE1-NH2 3.66Å; E166-R169 IonicContact OE2-CZ 2.79Å; E166-R169 IonicContact OE2-NH1 3.19Å; E166-R169 PolarHBondContact OE2-NH1 2.91Å; S167-R169 PolarHBondContact O-N 3.39Å; R169-M171 VanDerWaalsContact C-N 3.33Å; R169-E189 PolarHBondContact NH2-O 3.45Å; R169-G190 PolarHBondContact NE-O 3.26Å; R169-T191 WeakPolarHBondContact CA-O 3.3Å
170	K	94.3	Very high	95.8	Very high	95 Å²	95	37 Å²	37	41%	0.413	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-10.4	-179.6	-59.1	163.5	-169.1	162.9	0	113.3	L147 E166 S167 I168 I172	L147-K170 HydrophobicContact CB-CB 4.43Å; L147-K170 HydrophobicContact CD1-CB 4.26Å; L147-K170 HydrophobicContact CD1-CD 3.71Å; E166-K170 WeakPolarHBondContact O-CD 3.39Å; E166-K170 WeakPolarHBondContact O-CE 3.04Å; E166-K170 WeakPolarHBondContact O-CG 3.17Å; S167-K170 WeakPolarHBondContact O-CB 3.33Å; S167-K170 PolarHBondContact O-N 3.29Å; S167-K170 VanDerWaalsContact O-N 3.14Å; I168-K170 PolarHBondContact O-N 3.41Å; I168-K170 VanDerWaalsContact O-N 3.13Å; K170-I172 PolarHBondContact O-N 3.07Å
171	M	94.7	Very high	95.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.188	C	C	.	.			trans	-78	58.7	-174.3	-63	178.9	173.6	0	0	113.2	F143 L147 L150 L153 I168 R169 N173 L174 L195	F143-M171 HydrophobicContact CB-CE 3.74Å; F143-M171 HydrophobicContact CD2-CE 3.64Å; F143-M171 HydrophobicContact CE2-CE 4.42Å; F143-M171 HydrophobicContact CG-CE 3.86Å; L147-M171 HydrophobicContact CD2-CE 3.98Å; L147-M171 HydrophobicContact CD2-CG 4.29Å; L147-M171 WeakPolarHBondContact O-CA 3.22Å; L150-M171 HydrophobicContact CD2-CE 4.03Å; L150-M171 HydrophobicContact CD2-SD 3.91Å; L153-M171 HydrophobicContact CD2-SD 4.49Å; I168-M171 HydrophobicContact CG1-CE 4.47Å; I168-M171 HydrophobicContact CG1-SD 4.19Å; I168-M171 WeakPolarHBondContact O-CB 3.24Å; I168-M171 PolarHBondContact O-N 3.41Å; R169-M171 VanDerWaalsContact C-N 3.33Å; M171-N173 PolarHBondContact O-N 2.77Å; M171-L174 HydrophobicContact CB-CB 4.06Å; M171-L174 HydrophobicContact CB-CD2 4.44Å; M171-L174 WeakPolarHBondContact O-CB 3.46Å; M171-L174 PolarHBondContact O-N 2.95Å; M171-L174 HydrophobicContact SD-CD2 4.5Å; M171-L195 VanDerWaalsContact O-CD2 3.3Å; M171-L195 WeakPolarHBondContact O-CD2 3.21Å
172	I	92.3	Very high	95.9	Very high	87 Å²	87	32.6 Å²	32.6	45%	0.446	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-18	-173.2	59.9	169.1	0	0	0	115.4	L148 K170 K197	L148-I172 HydrophobicContact CD2-CD1 4.24Å; L148-I172 HydrophobicContact CD2-CG1 4.34Å; K170-I172 PolarHBondContact O-N 3.07Å; I172-K197 WeakPolarHBondContact O-CD 3.35Å
173	N	94.6	Very high	96	Very high	46 Å²	46	32.8 Å²	32.8	25%	0.246	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-5.5	178.1	-79.9	-43	0	0	0	114.7	L148 L150 E151 M171 H175 K197	L148-N173 PolarHBondContact O-ND2 2.83Å; L150-N173 CarbonylContact O-C 3.54Å; L150-N173 VanDerWaalsContact O-C 3.3Å; E151-N173 HydrophobicContact CG-CB 4.42Å; M171-N173 PolarHBondContact O-N 2.77Å; N173-H175 PolarHBondContact O-CD2 3.18Å; N173-H175 VanDerWaalsContact O-CD2 3.3Å; N173-H175 PolarHBondContact O-N 3.13Å; N173-K197 HydrophobicContact CB-CD 4.49Å; N173-K197 WeakPolarHBondContact OD1-CE 3.43Å; N173-K197 PolarHBondContact OD1-NZ 2.87Å
174	L	96	Very high	96.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.155	C	C	.	.			trans	-62.6	122	-175.8	-160	70.8	0	0	0	111.7	L150 E151 L153 M171 L177 L195 K197 L198	L150-L174 HydrophobicContact CD2-CD1 4.29Å; L150-L174 HydrophobicContact CG-CD1 4.39Å; L150-L174 PolarHBondContact O-N 3.2Å; E151-L174 CarbonylContact O-C 3.45Å; L153-L174 HydrophobicContact CB-CD1 4.01Å; M171-L174 HydrophobicContact CB-CB 4.06Å; M171-L174 HydrophobicContact CB-CD2 4.44Å; M171-L174 WeakPolarHBondContact O-CB 3.46Å; M171-L174 PolarHBondContact O-N 2.95Å; M171-L174 HydrophobicContact SD-CD2 4.5Å; L174-L177 HydrophobicContact CD2-CB 4.03Å; L174-L177 HydrophobicContact CD2-CD1 4.5Å; L174-L177 HydrophobicContact CD2-CD2 4.19Å; L174-L177 HydrophobicContact CD2-CG 4.48Å; L174-L195 HydrophobicContact CD2-CD1 4.44Å; L174-K197 CarbonylContact O-C 3.57Å; L174-K197 VanDerWaalsContact O-C 3.31Å; L174-L198 HydrophobicContact CD2-CD1 4.15Å; L174-L198 HydrophobicContact CG-CD1 4.09Å; L174-L198 WeakPolarHBondContact O-CA 3.31Å; L174-L198 PolarHBondContact O-N 3.07Å
175	H	94.9	Very high	96	Very high	60 Å²	60	35.6 Å²	35.6	28%	0.278	17%	0.171	S	C	.	.			trans	-104	-36.6	178.6	-77.8	-60.4	0	0	0	112.1	E151 N173 K197 A199 R200	E151-H175 WeakPolarHBondContact O-CA 3.38Å; E151-H175 PolarHBondContact O-N 3.5Å; N173-H175 PolarHBondContact O-CD2 3.18Å; N173-H175 VanDerWaalsContact O-CD2 3.3Å; N173-H175 PolarHBondContact O-N 3.13Å; H175-K197 PolarHBondContact ND1-O 3.32Å; H175-K197 PolarHBondContact NE2-NZ 3.27Å; H175-A199 PolarHBondContact O-N 2.73Å; H175-R200 PolarHBondContact O-N 3.5Å
176	Q	96.9	Very high	96.1	Very high	62 Å²	62	41.1 Å²	41.1	29%	0.29	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	135.4	174.5	-176.3	164.9	-77.9	0	0	112.7	E151 D152 L153 R200	E151-Q176 PolarHBondContact O-N 2.89Å; D152-Q176 HydrophobicContact CB-CB 4.48Å; D152-Q176 VanDerWaalsContact OD1-CB 3.24Å; D152-Q176 WeakPolarHBondContact OD1-CB 3.3Å; L153-Q176 PolarHBondContact N-O 2.98Å; Q176-R200 HydrophobicContact CB-CB 4.5Å; Q176-R200 HydrophobicContact CG-CB 4.03Å; Q176-R200 HydrophobicContact CG-CG 4.3Å
177	L	97.9	Very high	96.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	109.7	170.9	-178.5	54.3	0	0	0	109.7	L153 I168 L174 L179 F192 L198 R200 L201 D202	L153-L177 HydrophobicContact CB-CD1 4.03Å; L153-L177 HydrophobicContact CD2-CD1 3.91Å; L153-L177 HydrophobicContact CG-CD1 4.01Å; L153-L177 WeakPolarHBondContact O-CA 3.49Å; I168-L177 HydrophobicContact CG2-CD2 4.16Å; L174-L177 HydrophobicContact CD2-CB 4.03Å; L174-L177 HydrophobicContact CD2-CD1 4.5Å; L174-L177 HydrophobicContact CD2-CD2 4.19Å; L174-L177 HydrophobicContact CD2-CG 4.48Å; L177-L179 HydrophobicContact CD1-CD1 4.36Å; L177-L179 HydrophobicContact CD1-CD2 3.85Å; L177-L179 HydrophobicContact CD1-CG 3.99Å; L177-L179 HydrophobicContact CD2-CD1 4.16Å; L177-L179 HydrophobicContact CG-CD1 4.1Å; L177-L179 HydrophobicContact CG-CD2 4.4Å; L177-L179 HydrophobicContact CG-CG 3.99Å; L177-F192 HydrophobicContact CD2-CE1 4.16Å; L177-L198 HydrophobicContact CB-CD1 4.02Å; L177-R200 PolarHBondContact N-O 3.22Å; L177-L201 HydrophobicContact CB-CD1 4.05Å; L177-L201 HydrophobicContact CD2-CD1 3.93Å; L177-L201 HydrophobicContact CG-CD1 3.97Å; L177-L201 WeakPolarHBondContact O-CA 3.33Å; L177-D202 PolarHBondContact O-N 2.97Å
178	S	98.3	Very high	96.2	Very high	14 Å²	14	39 Å²	39	10%	0.098	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.3	172.4	-129.7	0	0	0	0	110.1	L153 D154 L155 D180	L153-S178 PolarHBondContact O-N 2.59Å; D154-S178 WeakPolarHBondContact OD1-CB 3.22Å; L155-S178 PolarHBondContact N-O 3.17Å; S178-D180 PolarHBondContact OG-OD1 2.97Å
179	L	98.1	Very high	96	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.216	C	C	.	.			trans	-123.6	11.4	178.1	-58.9	176.3	0	0	0	111.3	L155 I163 W165 L177 N182 I184 D202 L203 N206	L155-L179 HydrophobicContact CB-CD2 4.04Å; L155-L179 HydrophobicContact CD1-CD2 3.95Å; I163-L179 HydrophobicContact CD1-CD1 3.53Å; I163-L179 HydrophobicContact CD1-CD2 3.48Å; I163-L179 VanDerWaalsContact CD1-CD2 3.48Å; I163-L179 HydrophobicContact CD1-CG 4.16Å; W165-L179 HydrophobicContact CH2-CD1 4.08Å; W165-L179 HydrophobicContact CZ3-CD1 4.18Å; L177-L179 HydrophobicContact CD1-CD1 4.36Å; L177-L179 HydrophobicContact CD1-CD2 3.85Å; L177-L179 HydrophobicContact CD1-CG 3.99Å; L177-L179 HydrophobicContact CD2-CD1 4.16Å; L177-L179 HydrophobicContact CG-CD1 4.1Å; L177-L179 HydrophobicContact CG-CD2 4.4Å; L177-L179 HydrophobicContact CG-CG 3.99Å; L179-N182 WeakPolarHBondContact O-CB 3.14Å; L179-N182 PolarHBondContact O-ND2 3Å; L179-I184 HydrophobicContact CB-CD1 3.94Å; L179-I184 HydrophobicContact CD1-CD1 4.03Å; L179-I184 HydrophobicContact CD2-CD1 4.44Å; L179-I184 HydrophobicContact CG-CD1 4.36Å; L179-D202 PolarHBondContact N-O 3.26Å; L179-L203 HydrophobicContact CB-CD2 4.22Å; L179-L203 HydrophobicContact CD1-CD2 3.84Å; L179-N206 PolarHBondContact O-ND2 2.71Å
180	D	97.7	Very high	95.9	Very high	15 Å²	15	43.8 Å²	43.8	8%	0.08	22%	0.218	C	C	.	.			trans	-63.8	156	-174.4	62.9	-79	0	0	0	113.2	S156 Y157 S178 N182 D202 T204	S156-D180 CarbonylContact C-O 3.48Å; S156-D180 WeakPolarHBondContact CA-O 3.35Å; S156-D180 VanDerWaalsContact CB-CG 3.45Å; S156-D180 WeakPolarHBondContact CB-OD1 3.44Å; Y157-D180 VanDerWaalsContact CE2-OD2 3.26Å; Y157-D180 WeakPolarHBondContact CE2-OD2 3.34Å; Y157-D180 PolarHBondContact N-O 2.67Å; S178-D180 PolarHBondContact OG-OD1 2.97Å; D180-N182 PolarHBondContact O-N 3.4Å; D180-N182 PolarHBondContact O-ND2 2.71Å; D180-N182 VanDerWaalsContact O-ND2 3.08Å; D180-D202 HydrophobicContact CB-CB 4.42Å; D180-T204 CarbonylContact C-O 3.59Å; D180-T204 WeakPolarHBondContact CA-O 3.45Å; D180-T204 WeakPolarHBondContact CB-OG1 3.48Å
181	H	98.1	Very high	95.9	Very high	67 Å²	67	39.3 Å²	39.3	31%	0.31	20%	0.198	S	C	.	.	S	Bend	trans	54.1	49.7	-180	-58.4	86.3	0	0	0	112.8	Y157 N158 T204 S205	Y157-H181 VanDerWaalsContact CA-O 3.31Å; Y157-H181 WeakPolarHBondContact CA-O 3.44Å; Y157-H181 HydrophobicContact CD1-CB 3.74Å; Y157-H181 AromaticContact CD1-CG 3.99Å; Y157-H181 HydrophobicContact CD2-CB 4.15Å; Y157-H181 HydrophobicContact CE1-CB 3.92Å; Y157-H181 AromaticContact CE1-CG 3.61Å; Y157-H181 AromaticContact CE1-ND1 3.86Å; Y157-H181 HydrophobicContact CE2-CB 4.28Å; Y157-H181 AromaticContact CE2-ND1 3.57Å; Y157-H181 HydrophobicContact CG-CB 3.86Å; Y157-H181 AromaticContact CZ-CE1 3.83Å; Y157-H181 AromaticContact CZ-CG 3.61Å; Y157-H181 AromaticContact CZ-ND1 3.34Å; Y157-H181 VanDerWaalsContact CZ-ND1 3.34Å; Y157-H181 PolarHBondContact OH-CE1 2.88Å; Y157-H181 PolarHBondContact OH-ND1 3.41Å; N158-H181 PolarHBondContact N-O 2.77Å; H181-T204 PolarHBondContact N-O 3.31Å; H181-S205 WeakPolarHBondContact CD2-CB 3.37Å; H181-S205 PolarHBondContact CD2-OG 2.84Å; H181-S205 WeakPolarHBondContact NE2-CB 3.25Å; H181-S205 PolarHBondContact NE2-OG 2.93Å
182	N	98.6	Very high	95.8	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.027	20%	0.198	C	C	.	.	S	Bend	trans	-122.8	-168.7	174.8	-87.9	-85.6	0	0	0	110.9	L155 N158 L160 L179 D180 I184 N206	L155-N182 PolarHBondContact O-ND2 3.3Å; N158-N182 WeakPolarHBondContact CA-OD1 3.49Å; N158-N182 WeakPolarHBondContact CB-OD1 3.27Å; N158-N182 PolarHBondContact O-OD1 2.88Å; L160-N182 VanDerWaalsContact CB-OD1 3.3Å; L160-N182 WeakPolarHBondContact CB-OD1 3.24Å; L160-N182 WeakPolarHBondContact CG-OD1 3.13Å; L160-N182 PolarHBondContact N-OD1 2.9Å; L160-N182 VanDerWaalsContact N-OD1 3.1Å; L179-N182 WeakPolarHBondContact O-CB 3.14Å; L179-N182 PolarHBondContact O-ND2 3Å; D180-N182 PolarHBondContact O-N 3.4Å; D180-N182 PolarHBondContact O-ND2 2.71Å; D180-N182 VanDerWaalsContact O-ND2 3.08Å; N182-I184 HydrophobicContact CB-CD1 4.43Å; N182-I184 HydrophobicContact CB-CG1 4.12Å; N182-N206 WeakPolarHBondContact CA-OD1 3.36Å; N182-N206 WeakPolarHBondContact CB-OD1 3.25Å; N182-N206 PolarHBondContact O-OD1 3.3Å
183	L	97.9	Very high	95.7	Very high	56 Å²	56	37.6 Å²	37.6	29%	0.293	20%	0.197	S	C	.	.			trans	-115.2	25.1	-179.9	-62.7	176.3	0	0	0	112.2	N159 L160 R161 D185 N206 R207	N159-L183 HydrophobicContact CB-CD1 4.41Å; L160-L183 CarbonylContact O-C 3.18Å; L160-L183 VanDerWaalsContact O-CA 3.25Å; L160-L183 WeakPolarHBondContact O-CA 3.24Å; L160-L183 PolarHBondContact O-N 3.33Å; R161-L183 WeakPolarHBondContact CA-O 3.48Å; R161-L183 HydrophobicContact CG-CB 4.16Å; L183-D185 PolarHBondContact O-N 2.9Å; L183-N206 PolarHBondContact N-OD1 2.94Å; L183-R207 HydrophobicContact CB-CG 4.44Å; L183-R207 HydrophobicContact CD2-CG 4.38Å
184	I	98.1	Very high	95.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.208	C	C	.	.			trans	-67.7	117.2	-169.6	-58.5	176.3	0	0	0	110.5	L160 R161 I163 W165 L179 N182 Y186 N206 R207 L208	L160-I184 WeakPolarHBondContact O-CG1 3.26Å; L160-I184 PolarHBondContact O-N 2.9Å; L160-I184 VanDerWaalsContact O-N 3.13Å; R161-I184 WeakPolarHBondContact O-CA 3.4Å; I163-I184 HydrophobicContact CD1-CD1 4.5Å; W165-I184 HydrophobicContact CH2-CD1 4.45Å; W165-I184 HydrophobicContact CH2-CG2 4.22Å; W165-I184 HydrophobicContact CZ2-CG2 3.77Å; L179-I184 HydrophobicContact CB-CD1 3.94Å; L179-I184 HydrophobicContact CD1-CD1 4.03Å; L179-I184 HydrophobicContact CD2-CD1 4.44Å; L179-I184 HydrophobicContact CG-CD1 4.36Å; N182-I184 HydrophobicContact CB-CD1 4.43Å; N182-I184 HydrophobicContact CB-CG1 4.12Å; I184-Y186 VanDerWaalsContact CG2-O 3.27Å; I184-Y186 WeakPolarHBondContact CG2-O 3.37Å; I184-N206 VanDerWaalsContact CB-OD1 3.3Å; I184-N206 WeakPolarHBondContact CB-OD1 3.29Å; I184-N206 WeakPolarHBondContact CG1-OD1 3.24Å; I184-N206 PolarHBondContact N-OD1 2.76Å; I184-R207 CarbonylContact O-C 3.5Å; I184-R207 VanDerWaalsContact O-CA 3.27Å; I184-R207 WeakPolarHBondContact O-CA 3.48Å; I184-R207 WeakPolarHBondContact O-CB 3.13Å; I184-R207 PolarHBondContact O-N 3.48Å; I184-L208 HydrophobicContact CB-CD2 4.47Å; I184-L208 HydrophobicContact CG2-CD2 3.9Å; I184-L208 WeakPolarHBondContact O-CD2 3.49Å; I184-L208 PolarHBondContact O-N 2.76Å; I184-L208 VanDerWaalsContact O-N 3.1Å
185	D	94.8	Very high	95.3	Very high	69 Å²	69	39.8 Å²	39.8	37%	0.369	21%	0.209	S	C	.	.			trans	-85.1	-32	-174.1	-68.7	-53.7	0	0	0	112.8	R161 L183 R207	R161-D185 PolarHBondContact O-N 3.43Å; L183-D185 PolarHBondContact O-N 2.9Å; D185-R207 WeakPolarHBondContact OD1-CB 3.1Å
186	Y	95.5	Very high	95	Very high	126 Å²	126	43 Å²	43	49%	0.494	22%	0.224	S	C	.	.			trans	-151.2	163.3	-177.9	73.4	-83.7	0	0	0	112.4	W165 I184	W165-Y186 VanDerWaalsContact CZ2-O 3.24Å; W165-Y186 WeakPolarHBondContact CZ2-O 3.29Å; W165-Y186 AromaticContact NE1-CE2 3.87Å; I184-Y186 VanDerWaalsContact CG2-O 3.27Å; I184-Y186 WeakPolarHBondContact CG2-O 3.37Å
187	I	96.4	Very high	94.7	Very high	14 Å²	14	43.5 Å²	43.5	7%	0.072	23%	0.225	C	C	.	.			trans	-125.7	137.2	169.6	-55.1	170.9	0	0	0	107.8	W165 F192 L203 L208 L211 P212	W165-I187 HydrophobicContact CD2-CG2 4.34Å; W165-I187 HydrophobicContact CE3-CG2 4.13Å; W165-I187 HydrophobicContact CH2-CB 4.27Å; W165-I187 HydrophobicContact CH2-CG1 3.74Å; W165-I187 HydrophobicContact CH2-CG2 4.04Å; W165-I187 HydrophobicContact CZ2-CB 4.21Å; W165-I187 HydrophobicContact CZ2-CG1 3.9Å; W165-I187 HydrophobicContact CZ2-CG2 4.26Å; W165-I187 HydrophobicContact CZ3-CG1 4.44Å; W165-I187 HydrophobicContact CZ3-CG2 3.95Å; I187-F192 HydrophobicContact CD1-CE2 4.27Å; I187-F192 HydrophobicContact CD1-CZ 4.29Å; I187-F192 HydrophobicContact CG2-CE2 3.78Å; I187-F192 HydrophobicContact CG2-CZ 3.91Å; I187-L203 HydrophobicContact CD1-CD1 3.79Å; I187-L203 HydrophobicContact CD1-CD2 4.07Å; I187-L208 HydrophobicContact CD1-CD1 4Å; I187-L208 HydrophobicContact CD1-CD2 4.16Å; I187-L208 HydrophobicContact CG1-CD2 3.82Å; I187-L211 HydrophobicContact CD1-CD2 3.91Å; I187-P212 HydrophobicContact CB-CG 4.21Å; I187-P212 HydrophobicContact CG2-CG 4.23Å
188	T	94.6	Very high	94.5	Very high	45 Å²	45	43.5 Å²	43.5	28%	0.276	23%	0.225	S	C	.	.			trans	-67.3	140.1	176.7	-59.3	0	0	0	0	111.2	T191	T188-T191 WeakPolarHBondContact O-CB 3.5Å; T188-T191 PolarHBondContact O-N 2.98Å; T188-T191 PolarHBondContact O-OG1 3.13Å
189	E	92	Very high	94.3	Very high	135 Å²	135	44.4 Å²	44.4	63%	0.631	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	139.7	177.9	-67.5	-178.1	176.5	0	0	111.8	R169 T191 P212	R169-E189 PolarHBondContact NH2-O 3.45Å; E189-T191 PolarHBondContact O-N 3.37Å; E189-P212 HydrophobicContact CB-CB 4.37Å; E189-P212 HydrophobicContact CG-CB 3.8Å
190	G	91.4	Very high	94.2	Very high	24 Å²	24	49.2 Å²	49.2	25%	0.247	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	15.1	179.9	0	0	0	0	0	114.4	R169 F192 D214	R169-G190 PolarHBondContact NE-O 3.26Å; G190-F192 PolarHBondContact O-N 2.69Å; G190-D214 WeakPolarHBondContact CA-OD1 3.27Å
191	T	94.7	Very high	94.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	-60.2	-36.9	172.8	-71.9	0	0	0	0	111.6	W165 I168 R169 T188 E189	W165-T191 HydrophobicContact CE3-CG2 3.86Å; I168-T191 HydrophobicContact CG2-CG2 4.14Å; R169-T191 WeakPolarHBondContact CA-O 3.3Å; T188-T191 WeakPolarHBondContact O-CB 3.5Å; T188-T191 PolarHBondContact O-N 2.98Å; T188-T191 PolarHBondContact O-OG1 3.13Å; E189-T191 PolarHBondContact O-N 3.37Å
192	F	93.4	Very high	94.1	Very high	1 Å²	1	46.5 Å²	46.5	0%	0.004	24%	0.239	C	C	.	.	S	Bend	trans	-98.6	-0.1	-173.3	-49.3	-65.1	0	0	0	114	L177 I187 G190 D194 L195 L198 L201 D214 I216 F217	L177-F192 HydrophobicContact CD2-CE1 4.16Å; I187-F192 HydrophobicContact CD1-CE2 4.27Å; I187-F192 HydrophobicContact CD1-CZ 4.29Å; I187-F192 HydrophobicContact CG2-CE2 3.78Å; I187-F192 HydrophobicContact CG2-CZ 3.91Å; G190-F192 PolarHBondContact O-N 2.69Å; F192-D194 PolarHBondContact O-N 2.91Å; F192-L195 HydrophobicContact CD1-CD1 4.18Å; F192-L195 PolarHBondContact O-N 2.88Å; F192-L195 VanDerWaalsContact O-N 3.17Å; F192-L198 HydrophobicContact CD1-CD2 4.36Å; F192-L201 HydrophobicContact CD1-CD2 4.22Å; F192-L201 HydrophobicContact CD2-CD2 4.43Å; F192-L201 HydrophobicContact CE1-CD1 4.32Å; F192-L201 HydrophobicContact CE1-CD2 3.83Å; F192-L201 HydrophobicContact CE2-CD2 4.03Å; F192-L201 HydrophobicContact CZ-CD1 4.43Å; F192-L201 HydrophobicContact CZ-CD2 3.72Å; F192-D214 HydrophobicContact CB-CB 4.29Å; F192-I216 HydrophobicContact CB-CB 4.43Å; F192-I216 HydrophobicContact CB-CD1 4.12Å; F192-I216 HydrophobicContact CB-CG2 3.78Å; F192-F217 HydrophobicContact CD2-CE2 4.31Å; F192-F217 AromaticContact CD2-CZ 3.75Å; F192-F217 HydrophobicContact CD2-CZ 3.75Å; F192-F217 AromaticContact CE2-CZ 3.96Å; F192-F217 HydrophobicContact CE2-CZ 3.96Å
193	A	89.8	Confident	94	Very high	50 Å²	50	46.2 Å²	46.2	41%	0.413	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-42.4	-171.8	0	0	0	0	0	113.9	D214	A193-D214 PolarHBondContact N-OD1 2.95Å
194	D	89.8	Confident	93.9	Very high	92 Å²	92	45 Å²	45	49%	0.492	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-7.5	-178.1	-64.8	-56.5	0	0	0	113.7	F192 Q196	F192-D194 PolarHBondContact O-N 2.91Å; D194-Q196 PolarHBondContact O-N 3.45Å
195	L	91.9	Very high	93.9	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.248	C	C	.	.			trans	-83.5	54.7	-171.2	-57.2	-169.3	0	0	0	113	I168 M171 L174 F192 K197 L198 I216	I168-L195 HydrophobicContact CG2-CD1 4.28Å; M171-L195 VanDerWaalsContact O-CD2 3.3Å; M171-L195 WeakPolarHBondContact O-CD2 3.21Å; L174-L195 HydrophobicContact CD2-CD1 4.44Å; F192-L195 HydrophobicContact CD1-CD1 4.18Å; F192-L195 PolarHBondContact O-N 2.88Å; F192-L195 VanDerWaalsContact O-N 3.17Å; L195-K197 PolarHBondContact O-N 2.89Å; L195-K197 VanDerWaalsContact O-N 3.09Å; L195-L198 HydrophobicContact CB-CB 4.26Å; L195-L198 WeakPolarHBondContact O-CB 3.35Å; L195-L198 PolarHBondContact O-N 3.27Å; L195-I216 HydrophobicContact CB-CD1 4.37Å; L195-I216 WeakPolarHBondContact O-CD1 3.34Å
196	Q	88	Confident	94	Very high	127 Å²	127	44.1 Å²	44.1	59%	0.593	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.6	-174.1	-59.9	-178.5	14.5	0	0	113.7	D194 R219	D194-Q196 PolarHBondContact O-N 3.45Å; Q196-R219 PolarHBondContact O-NH1 2.96Å
197	K	91.9	Very high	94.1	Very high	72 Å²	72	44.4 Å²	44.4	31%	0.313	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-18.1	178.7	-87	-179.5	150.1	-153	0	115.1	I172 N173 L174 H175 L195 A199	I172-K197 WeakPolarHBondContact O-CD 3.35Å; N173-K197 HydrophobicContact CB-CD 4.49Å; N173-K197 WeakPolarHBondContact OD1-CE 3.43Å; N173-K197 PolarHBondContact OD1-NZ 2.87Å; L174-K197 CarbonylContact O-C 3.57Å; L174-K197 VanDerWaalsContact O-C 3.31Å; H175-K197 PolarHBondContact ND1-O 3.32Å; H175-K197 PolarHBondContact NE2-NZ 3.27Å; L195-K197 PolarHBondContact O-N 2.89Å; L195-K197 VanDerWaalsContact O-N 3.09Å; K197-A199 PolarHBondContact O-N 3.39Å
198	L	94.2	Very high	94.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.228	C	C	.	.			trans	-63.9	122.1	-173.4	-169.1	71.4	0	0	0	110.2	L174 L177 F192 L195 R200 L201 I216 R219 L234	L174-L198 HydrophobicContact CD2-CD1 4.15Å; L174-L198 HydrophobicContact CG-CD1 4.09Å; L174-L198 WeakPolarHBondContact O-CA 3.31Å; L174-L198 PolarHBondContact O-N 3.07Å; L177-L198 HydrophobicContact CB-CD1 4.02Å; F192-L198 HydrophobicContact CD1-CD2 4.36Å; L195-L198 HydrophobicContact CB-CB 4.26Å; L195-L198 WeakPolarHBondContact O-CB 3.35Å; L195-L198 PolarHBondContact O-N 3.27Å; L198-R200 WeakPolarHBondContact CD1-O 3.41Å; L198-L201 HydrophobicContact CD2-CB 4.15Å; L198-L201 HydrophobicContact CD2-CD2 4.33Å; L198-I216 HydrophobicContact CB-CD1 4.03Å; L198-I216 HydrophobicContact CD2-CD1 4.02Å; L198-R219 PolarHBondContact O-NH2 2.83Å; L198-L234 HydrophobicContact CG-CD1 4.38Å
199	A	92.9	Very high	94.3	Very high	33 Å²	33	46.5 Å²	46.5	27%	0.273	24%	0.238	S	C	.	.			trans	-112.9	-25.2	-177.3	0	0	0	0	0	112.5	H175 K197 P232 S235	H175-A199 PolarHBondContact O-N 2.73Å; K197-A199 PolarHBondContact O-N 3.39Å; A199-P232 HydrophobicContact CB-CB 3.97Å; A199-P232 HydrophobicContact CB-CG 3.89Å; A199-S235 WeakPolarHBondContact O-CB 3.26Å; A199-S235 PolarHBondContact O-N 2.6Å
200	R	95.4	Very high	94.4	Very high	102 Å²	102	44 Å²	44	39%	0.385	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133	171.4	-177.8	-175.6	-49.8	-71.6	-9.5	111.3	H175 Q176 L177 L198 S235	H175-R200 PolarHBondContact O-N 3.5Å; Q176-R200 HydrophobicContact CB-CB 4.5Å; Q176-R200 HydrophobicContact CG-CB 4.03Å; Q176-R200 HydrophobicContact CG-CG 4.3Å; L177-R200 PolarHBondContact N-O 3.22Å; L198-R200 WeakPolarHBondContact CD1-O 3.41Å; R200-S235 WeakPolarHBondContact CA-O 3.31Å; R200-S235 PolarHBondContact NH1-OG 2.9Å; R200-S235 VanDerWaalsContact NH1-OG 3.08Å
201	L	96.7	Very high	94.6	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	108.5	170.5	175.4	53.7	0	0	0	108.7	L177 F192 L198 L203 F217 L234 S235 L236 S237	L177-L201 HydrophobicContact CB-CD1 4.05Å; L177-L201 HydrophobicContact CD2-CD1 3.93Å; L177-L201 HydrophobicContact CG-CD1 3.97Å; L177-L201 WeakPolarHBondContact O-CA 3.33Å; F192-L201 HydrophobicContact CD1-CD2 4.22Å; F192-L201 HydrophobicContact CD2-CD2 4.43Å; F192-L201 HydrophobicContact CE1-CD1 4.32Å; F192-L201 HydrophobicContact CE1-CD2 3.83Å; F192-L201 HydrophobicContact CE2-CD2 4.03Å; F192-L201 HydrophobicContact CZ-CD1 4.43Å; F192-L201 HydrophobicContact CZ-CD2 3.72Å; L198-L201 HydrophobicContact CD2-CB 4.15Å; L198-L201 HydrophobicContact CD2-CD2 4.33Å; L201-L203 HydrophobicContact CD1-CD2 3.94Å; L201-L203 HydrophobicContact CD1-CG 4.09Å; L201-L203 HydrophobicContact CD2-CD1 4.34Å; L201-L203 HydrophobicContact CG-CD1 4.27Å; L201-L203 HydrophobicContact CG-CD2 4.46Å; L201-L203 HydrophobicContact CG-CG 4.09Å; L201-F217 HydrophobicContact CD2-CE1 4Å; L201-F217 HydrophobicContact CD2-CZ 4.42Å; L201-L234 HydrophobicContact CB-CD1 4.31Å; L201-S235 PolarHBondContact N-O 3.49Å; L201-L236 HydrophobicContact CB-CD1 4.3Å; L201-L236 HydrophobicContact CD2-CD1 4.12Å; L201-L236 HydrophobicContact CG-CD1 4.07Å; L201-L236 WeakPolarHBondContact O-CA 3.23Å; L201-S237 PolarHBondContact O-N 2.98Å
202	D	97.1	Very high	94.6	Very high	24 Å²	24	43.5 Å²	43.5	13%	0.128	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.3	175.3	-147.5	-56.3	0	0	0	111.1	L177 L179 D180 T204 S237	L177-D202 PolarHBondContact O-N 2.97Å; L179-D202 PolarHBondContact N-O 3.26Å; D180-D202 HydrophobicContact CB-CB 4.42Å; D202-T204 VanDerWaalsContact OD1-CB 3.31Å; D202-T204 WeakPolarHBondContact OD1-CB 3.44Å; D202-T204 VanDerWaalsContact OD1-CG2 3.26Å; D202-T204 WeakPolarHBondContact OD1-CG2 3.42Å; D202-T204 PolarHBondContact OD1-N 2.95Å; D202-T204 PolarHBondContact OD1-OG1 2.77Å; D202-S237 VanDerWaalsContact CG-CB 3.47Å; D202-S237 WeakPolarHBondContact OD1-CB 3.08Å; D202-S237 WeakPolarHBondContact OD2-CB 3.18Å; D202-S237 PolarHBondContact OD2-OG 3.08Å
203	L	96.9	Very high	94.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.243	C	C	.	.			trans	-121	11.7	-179.8	-60.7	172.8	0	0	0	111.3	L179 I187 L201 N206 L208 L211 L236 S237 F238 N241	L179-L203 HydrophobicContact CB-CD2 4.22Å; L179-L203 HydrophobicContact CD1-CD2 3.84Å; I187-L203 HydrophobicContact CD1-CD1 3.79Å; I187-L203 HydrophobicContact CD1-CD2 4.07Å; L201-L203 HydrophobicContact CD1-CD2 3.94Å; L201-L203 HydrophobicContact CD1-CG 4.09Å; L201-L203 HydrophobicContact CD2-CD1 4.34Å; L201-L203 HydrophobicContact CG-CD1 4.27Å; L201-L203 HydrophobicContact CG-CD2 4.46Å; L201-L203 HydrophobicContact CG-CG 4.09Å; L203-N206 PolarHBondContact O-ND2 2.98Å; L203-L208 HydrophobicContact CB-CD1 3.98Å; L203-L208 HydrophobicContact CD1-CD1 4.11Å; L203-L208 HydrophobicContact CD2-CD1 4.4Å; L203-L208 HydrophobicContact CG-CD1 4.4Å; L203-L211 HydrophobicContact CD1-CD2 3.67Å; L203-L236 HydrophobicContact CD1-CD1 4.27Å; L203-S237 WeakPolarHBondContact CB-O 3.08Å; L203-S237 PolarHBondContact N-O 3.1Å; L203-F238 HydrophobicContact CB-CB 4.37Å; L203-N241 PolarHBondContact O-ND2 3.19Å
204	T	96.8	Very high	94.7	Very high	30 Å²	30	45.6 Å²	45.6	18%	0.184	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	153	-172.2	51.9	0	0	0	0	113.1	D180 H181 D202 N206 G239	D180-T204 CarbonylContact C-O 3.59Å; D180-T204 WeakPolarHBondContact CA-O 3.45Å; D180-T204 WeakPolarHBondContact CB-OG1 3.48Å; H181-T204 PolarHBondContact N-O 3.31Å; D202-T204 VanDerWaalsContact OD1-CB 3.31Å; D202-T204 WeakPolarHBondContact OD1-CB 3.44Å; D202-T204 VanDerWaalsContact OD1-CG2 3.26Å; D202-T204 WeakPolarHBondContact OD1-CG2 3.42Å; D202-T204 PolarHBondContact OD1-N 2.95Å; D202-T204 PolarHBondContact OD1-OG1 2.77Å; T204-N206 PolarHBondContact O-N 2.87Å; T204-N206 PolarHBondContact O-ND2 2.79Å; T204-G239 CarbonylContact C-O 3.54Å; T204-G239 WeakPolarHBondContact CA-O 3.21Å; T204-G239 WeakPolarHBondContact CB-O 3.5Å
205	S	97	Very high	94.6	Very high	47 Å²	47	46.1 Å²	46.1	33%	0.329	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	43.1	175.9	-59.3	0	0	0	0	114.8	H181 G239	H181-S205 WeakPolarHBondContact CD2-CB 3.37Å; H181-S205 PolarHBondContact CD2-OG 2.84Å; H181-S205 WeakPolarHBondContact NE2-CB 3.25Å; H181-S205 PolarHBondContact NE2-OG 2.93Å; S205-G239 PolarHBondContact N-O 2.96Å
206	N	98.4	Very high	94.5	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.021	24%	0.236	C	C	.	.	S	Bend	trans	-109.4	-164	177.5	-90.4	-81.7	0	0	0	112.5	L179 N182 L183 I184 L203 T204 L208 N241 P242	L179-N206 PolarHBondContact O-ND2 2.71Å; N182-N206 WeakPolarHBondContact CA-OD1 3.36Å; N182-N206 WeakPolarHBondContact CB-OD1 3.25Å; N182-N206 PolarHBondContact O-OD1 3.3Å; L183-N206 PolarHBondContact N-OD1 2.94Å; I184-N206 VanDerWaalsContact CB-OD1 3.3Å; I184-N206 WeakPolarHBondContact CB-OD1 3.29Å; I184-N206 WeakPolarHBondContact CG1-OD1 3.24Å; I184-N206 PolarHBondContact N-OD1 2.76Å; L203-N206 PolarHBondContact O-ND2 2.98Å; T204-N206 PolarHBondContact O-N 2.87Å; T204-N206 PolarHBondContact O-ND2 2.79Å; N206-L208 HydrophobicContact CB-CD1 4.49Å; N206-L208 HydrophobicContact CB-CG 4.21Å; N206-N241 VanDerWaalsContact CA-OD1 3.24Å; N206-N241 WeakPolarHBondContact CA-OD1 3.46Å; N206-N241 WeakPolarHBondContact CB-OD1 3.21Å; N206-N241 PolarHBondContact N-OD1 2.72Å; N206-N241 PolarHBondContact O-OD1 2.73Å; N206-P242 WeakPolarHBondContact O-CD 3.1Å
207	R	97.8	Very high	94.6	Very high	131 Å²	131	40.4 Å²	40.4	49%	0.494	21%	0.208	S	C	.	.			trans	-108.4	12.3	177.4	-62.4	-60.5	-176.5	-162	-2.4	114	L183 I184 D185 Q209 N241 P242	L183-R207 HydrophobicContact CB-CG 4.44Å; L183-R207 HydrophobicContact CD2-CG 4.38Å; I184-R207 CarbonylContact O-C 3.5Å; I184-R207 VanDerWaalsContact O-CA 3.27Å; I184-R207 WeakPolarHBondContact O-CA 3.48Å; I184-R207 WeakPolarHBondContact O-CB 3.13Å; I184-R207 PolarHBondContact O-N 3.48Å; D185-R207 WeakPolarHBondContact OD1-CB 3.1Å; R207-Q209 PolarHBondContact O-N 2.71Å; R207-N241 PolarHBondContact N-OD1 3.47Å; R207-P242 WeakPolarHBondContact O-CG 3.45Å
208	L	97.4	Very high	94.4	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	22%	0.217	C	C	.	.			trans	-62.4	118.3	-175.1	-57.8	172	0	0	0	111.1	I184 I187 L203 N206 L211 N241 P242	I184-L208 HydrophobicContact CB-CD2 4.47Å; I184-L208 HydrophobicContact CG2-CD2 3.9Å; I184-L208 WeakPolarHBondContact O-CD2 3.49Å; I184-L208 PolarHBondContact O-N 2.76Å; I184-L208 VanDerWaalsContact O-N 3.1Å; I187-L208 HydrophobicContact CD1-CD1 4Å; I187-L208 HydrophobicContact CD1-CD2 4.16Å; I187-L208 HydrophobicContact CG1-CD2 3.82Å; L203-L208 HydrophobicContact CB-CD1 3.98Å; L203-L208 HydrophobicContact CD1-CD1 4.11Å; L203-L208 HydrophobicContact CD2-CD1 4.4Å; L203-L208 HydrophobicContact CG-CD1 4.4Å; N206-L208 HydrophobicContact CB-CD1 4.49Å; N206-L208 HydrophobicContact CB-CG 4.21Å; L208-L211 HydrophobicContact CD1-CD2 3.86Å; L208-N241 HydrophobicContact CB-CB 4.34Å; L208-N241 WeakPolarHBondContact CB-OD1 3.47Å; L208-N241 PolarHBondContact N-OD1 2.92Å; L208-P242 WeakPolarHBondContact O-CD 3.4Å
209	Q	96.3	Very high	94.1	Very high	103 Å²	103	41.4 Å²	41.4	48%	0.481	22%	0.222	S	C	.	.	S	Bend	trans	-81.6	-30.1	171.3	-70.9	175.2	74.3	0	0	111.5	R207 H244	R207-Q209 PolarHBondContact O-N 2.71Å; Q209-H244 HydrophobicContact CB-CB 4.08Å; Q209-H244 WeakPolarHBondContact O-CB 3.47Å; Q209-H244 PolarHBondContact O-N 3.36Å
210	K	95.1	Very high	93.8	Very high	83 Å²	83	40.2 Å²	40.2	36%	0.361	21%	0.212	S	C	.	.			trans	-148.1	164.6	175.6	66.9	-174.6	178.6	-174.6	0	111.6	E248 L249	K210-E248 HydrophobicContact CD-CB 4.26Å; K210-E248 WeakPolarHBondContact CD-OE2 3.42Å; K210-E248 IonicContact NZ-OE1 3.34Å; K210-E248 PolarHBondContact NZ-OE1 3Å; K210-E248 IonicContact NZ-OE2 3.94Å; K210-E248 PolarHBondContact NZ-OE2 2.99Å; K210-L249 HydrophobicContact CB-CD2 4Å; K210-L249 HydrophobicContact CB-CG 4.33Å
211	L	95.3	Very high	93.3	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.016	21%	0.205	C	C	.	.			trans	-109	137.8	167.7	-66	178.7	0	0	0	109.3	I187 L203 L208 F238 W251 L252	I187-L211 HydrophobicContact CD1-CD2 3.91Å; L203-L211 HydrophobicContact CD1-CD2 3.67Å; L208-L211 HydrophobicContact CD1-CD2 3.86Å; L211-F238 HydrophobicContact CD1-CB 4.2Å; L211-F238 HydrophobicContact CD1-CD1 4.3Å; L211-F238 HydrophobicContact CD1-CD2 4.27Å; L211-F238 HydrophobicContact CD1-CG 4Å; L211-W251 HydrophobicContact CB-CH2 4.5Å; L211-W251 HydrophobicContact CB-CZ2 3.97Å; L211-W251 PolarHBondContact O-NE1 3.06Å; L211-L252 HydrophobicContact CD1-CD2 4Å
212	P	94.4	Very high	92.1	Very high	9 Å²	9	41.3 Å²	41.3	6%	0.058	23%	0.227	C	C	.	.			trans	-69	147.6	173.8	30.7	-35.3	0	0	0	110.8	I187 E189 D214 F217 W251	I187-P212 HydrophobicContact CB-CG 4.21Å; I187-P212 HydrophobicContact CG2-CG 4.23Å; E189-P212 HydrophobicContact CB-CB 4.37Å; E189-P212 HydrophobicContact CG-CB 3.8Å; P212-D214 PolarHBondContact O-N 2.9Å; P212-D214 VanDerWaalsContact O-N 3.08Å; P212-F217 VanDerWaalsContact O-CE2 3.32Å; P212-F217 WeakPolarHBondContact O-CE2 3.43Å; P212-W251 VanDerWaalsContact O-CZ2 3.26Å; P212-W251 WeakPolarHBondContact O-CZ2 3.17Å
213	P	92.8	Very high	90.6	Very high	85 Å²	85	45.7 Å²	45.7	55%	0.552	25%	0.249	S	C	*	.			trans	-77.1	91.3	177.6	30.6	-34	0	0	0	111.9	W251	P213-W251 HydrophobicContact CB-CD2 3.99Å; P213-W251 HydrophobicContact CB-CG 4.05Å
214	D	92.1	Very high	89	Confident	11 Å²	11	48.1 Å²	48.1	6%	0.059	27%	0.265	C	S	.	.			trans	-97.4	142.5	171.2	-94.6	-67.3	0	0	0	112.5	G190 F192 A193 P212 I216 F217	G190-D214 WeakPolarHBondContact CA-OD1 3.27Å; F192-D214 HydrophobicContact CB-CB 4.29Å; A193-D214 PolarHBondContact N-OD1 2.95Å; P212-D214 PolarHBondContact O-N 2.9Å; P212-D214 VanDerWaalsContact O-N 3.08Å; D214-I216 HydrophobicContact CB-CG2 3.94Å; D214-I216 PolarHBondContact O-N 2.86Å; D214-F217 HydrophobicContact CB-CD2 3.82Å; D214-F217 HydrophobicContact CB-CE2 3.67Å; D214-F217 WeakPolarHBondContact O-CD2 3.37Å; D214-F217 PolarHBondContact O-N 2.92Å
215	P	87.8	Confident	87.2	Confident	102 Å²	102	54.4 Å²	54.4	66%	0.662	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-57.2	-25.8	177.8	-24.4	33.8	0	0	0	113.9	F217 A218	P215-F217 PolarHBondContact O-N 2.99Å; P215-A218 PolarHBondContact O-N 2.91Å
216	I	90.2	Very high	85.2	Confident	9 Å²	9	55.1 Å²	55.1	5%	0.046	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-58.4	-31.9	-177.6	-152.5	176.3	0	0	0	112.8	F192 L195 L198 D214 A218 R219 L234	F192-I216 HydrophobicContact CB-CB 4.43Å; F192-I216 HydrophobicContact CB-CD1 4.12Å; F192-I216 HydrophobicContact CB-CG2 3.78Å; L195-I216 HydrophobicContact CB-CD1 4.37Å; L195-I216 WeakPolarHBondContact O-CD1 3.34Å; L198-I216 HydrophobicContact CB-CD1 4.03Å; L198-I216 HydrophobicContact CD2-CD1 4.02Å; D214-I216 HydrophobicContact CB-CG2 3.94Å; D214-I216 PolarHBondContact O-N 2.86Å; I216-A218 VanDerWaalsContact C-N 3.31Å; I216-A218 PolarHBondContact O-N 2.85Å; I216-R219 WeakPolarHBondContact O-CB 3.29Å; I216-R219 WeakPolarHBondContact O-CG 3.41Å; I216-R219 PolarHBondContact O-N 2.83Å; I216-R219 PolarHBondContact O-NE 3.02Å; I216-L234 HydrophobicContact CG1-CD2 4.26Å; I216-L234 HydrophobicContact CG2-CD2 4.13Å
217	F	90.8	Very high	83.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-74.4	-19	-175.2	-60.1	-54	0	0	0	113.1	F192 L201 P212 D214 P215 R219 S220 L234 L236 W251 L255	F192-F217 HydrophobicContact CD2-CE2 4.31Å; F192-F217 AromaticContact CD2-CZ 3.75Å; F192-F217 HydrophobicContact CD2-CZ 3.75Å; F192-F217 AromaticContact CE2-CZ 3.96Å; F192-F217 HydrophobicContact CE2-CZ 3.96Å; L201-F217 HydrophobicContact CD2-CE1 4Å; L201-F217 HydrophobicContact CD2-CZ 4.42Å; P212-F217 VanDerWaalsContact O-CE2 3.32Å; P212-F217 WeakPolarHBondContact O-CE2 3.43Å; D214-F217 HydrophobicContact CB-CD2 3.82Å; D214-F217 HydrophobicContact CB-CE2 3.67Å; D214-F217 WeakPolarHBondContact O-CD2 3.37Å; D214-F217 PolarHBondContact O-N 2.92Å; P215-F217 PolarHBondContact O-N 2.99Å; F217-R219 PolarHBondContact O-N 3.27Å; F217-R219 VanDerWaalsContact O-N 3.14Å; F217-S220 PolarHBondContact O-N 2.89Å; F217-S220 PolarHBondContact O-OG 2.79Å; F217-L234 HydrophobicContact CD1-CD2 3.81Å; F217-L234 HydrophobicContact CE1-CD2 4.33Å; F217-L236 HydrophobicContact CD1-CD1 4.34Å; F217-L236 HydrophobicContact CD1-CD2 3.78Å; F217-L236 HydrophobicContact CE1-CD1 3.89Å; F217-L236 HydrophobicContact CE1-CD2 4.06Å; F217-W251 HydrophobicContact CB-CH2 4.09Å; F217-W251 HydrophobicContact CB-CZ3 3.77Å; F217-W251 AromaticContact CD2-CH2 3.37Å; F217-W251 HydrophobicContact CD2-CH2 3.37Å; F217-W251 HydrophobicContact CD2-CZ2 4.31Å; F217-W251 AromaticContact CD2-CZ3 3.85Å; F217-W251 HydrophobicContact CD2-CZ3 3.85Å; F217-W251 AromaticContact CE2-CH2 3.99Å; F217-W251 HydrophobicContact CE2-CH2 3.99Å; F217-W251 AromaticContact CG-CH2 3.92Å; F217-W251 HydrophobicContact CG-CH2 3.92Å; F217-W251 HydrophobicContact CG-CZ3 4.13Å; F217-L255 HydrophobicContact CB-CD1 4.37Å
218	A	86.8	Confident	81.9	Confident	60 Å²	60	54.9 Å²	54.9	50%	0.496	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-61.5	-21.2	170.4	0	0	0	0	0	112.5	P215 I216 S220	P215-A218 PolarHBondContact O-N 2.91Å; I216-A218 VanDerWaalsContact C-N 3.31Å; I216-A218 PolarHBondContact O-N 2.85Å; A218-S220 VanDerWaalsContact C-N 3.31Å
219	R	88	Confident	80.3	Confident	32 Å²	32	61 Å²	61	12%	0.121	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-82.2	-1.6	176.5	-49.5	-175.3	-58.5	159	7.4	114.2	Q196 L198 I216 F217 P232 L234	Q196-R219 PolarHBondContact O-NH1 2.96Å; L198-R219 PolarHBondContact O-NH2 2.83Å; I216-R219 WeakPolarHBondContact O-CB 3.29Å; I216-R219 WeakPolarHBondContact O-CG 3.41Å; I216-R219 PolarHBondContact O-N 2.83Å; I216-R219 PolarHBondContact O-NE 3.02Å; F217-R219 PolarHBondContact O-N 3.27Å; F217-R219 VanDerWaalsContact O-N 3.14Å; R219-P232 PolarHBondContact NH1-O 2.89Å; R219-L234 HydrophobicContact CB-CB 4.15Å; R219-L234 PolarHBondContact O-N 3.1Å
220	S	86.6	Confident	78.8	Confident	9 Å²	9	64.9 Å²	64.9	6%	0.063	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-98.9	12.7	-179.1	76	0	0	0	0	114.2	F217 A218 L234 R257	F217-S220 PolarHBondContact O-N 2.89Å; F217-S220 PolarHBondContact O-OG 2.79Å; A218-S220 VanDerWaalsContact C-N 3.31Å; S220-L234 VanDerWaalsContact CA-O 3.29Å; S220-L234 WeakPolarHBondContact CA-O 3.37Å; S220-L234 WeakPolarHBondContact CB-O 3.22Å; S220-R257 WeakPolarHBondContact O-CG 3.08Å; S220-R257 PolarHBondContact O-NH1 3.43Å; S220-R257 VanDerWaalsContact O-NH1 3.09Å
221	Q	84.3	Confident	77.7	Confident	49 Å²	49	63.6 Å²	63.6	23%	0.229	38%	0.377	C	S	.	.	S	Bend	trans	-81.4	152	177.1	-64.1	-178.7	-8.3	0	0	112.3	I223 L255 D256	Q221-I223 PolarHBondContact O-N 3.24Å; Q221-I223 VanDerWaalsContact O-N 3.15Å; Q221-L255 HydrophobicContact CG-CB 4.17Å; Q221-L255 HydrophobicContact CG-CD2 4.23Å; Q221-L255 VanDerWaalsContact NE2-CD2 3.33Å; Q221-D256 CarbonylContact C-O 3.52Å; Q221-D256 WeakPolarHBondContact CA-O 3.46Å; Q221-D256 WeakPolarHBondContact CB-O 3.34Å
222	V	71.6	Confident	76.9	Confident	75 Å²	75	65 Å²	65	46%	0.455	39%	0.386	S	S	.	.	S	Bend	trans	-59.1	-27.2	-178.5	-179.9	0	0	0	0	113	P224 D256	V222-P224 WeakPolarHBondContact O-CD 3.07Å; V222-D256 PolarHBondContact N-O 3.32Å
223	I	67.1	Low	76.5	Confident	117 Å²	117	67.9 Å²	67.9	60%	0.6	41%	0.405	S	S	*	.	S	Bend	trans	-114.4	90.8	172.4	-55.7	176.3	0	0	0	109	Q221 L225	Q221-I223 PolarHBondContact O-N 3.24Å; Q221-I223 VanDerWaalsContact O-N 3.15Å; I223-L225 PolarHBondContact O-N 3.11Å
224	P	61.9	Low	76.5	Confident	51 Å²	51	64.2 Å²	64.2	33%	0.331	38%	0.38	S	S	.	.			trans	-68.2	108.6	177.2	-18.5	31.6	0	0	0	110.6	V222 A226 A227 P233	V222-P224 WeakPolarHBondContact O-CD 3.07Å; P224-A226 PolarHBondContact O-N 3.05Å; P224-A227 HydrophobicContact CB-CB 3.98Å; P224-P233 HydrophobicContact CG-CB 4.09Å
225	L	59.4	Low	76.5	Confident	162 Å²	162	66 Å²	66	85%	0.848	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-14.7	-177.3	-69.7	167.8	0	0	0	114.7	I223	I223-L225 PolarHBondContact O-N 3.11Å
226	A	55.9	Low	76.8	Confident	61 Å²	61	61.3 Å²	61.3	50%	0.504	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154	44.1	-177.9	0	0	0	0	0	114.1	P224 T228	P224-A226 PolarHBondContact O-N 3.05Å; A226-T228 PolarHBondContact O-N 2.04Å
227	A	60.5	Low	77	Confident	61 Å²	61	61.9 Å²	61.9	50%	0.504	37%	0.368	S	S	.	.			trans	-62	119.2	172.9	0	0	0	0	0	111.2	P224	P224-A227 HydrophobicContact CB-CB 3.98Å
228	T	65.8	Low	77.2	Confident	70 Å²	70	62 Å²	62	43%	0.429	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-142.5	163.8	178.3	65.3	0	0	0	0	110.7	A226 F230 L231	A226-T228 PolarHBondContact O-N 2.04Å; T228-F230 PolarHBondContact O-N 3.2Å; T228-L231 PolarHBondContact N-O 2.96Å; T228-L231 VanDerWaalsContact N-O 3.16Å; T228-L231 CarbonylContact O-C 3.57Å; T228-L231 PolarHBondContact O-N 3.3Å; T228-L231 PolarHBondContact OG1-N 2.75Å
229	P	63.4	Low	77.6	Confident	128 Å²	128	59.6 Å²	59.6	83%	0.831	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.1	176.3	-25.4	35.8	0	0	0	114.7
230	F	64.5	Low	77.9	Confident	185 Å²	185	60.6 Å²	60.6	81%	0.811	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-10.4	178.3	-54.1	-75.9	0	0	0	113.2	T228	T228-F230 PolarHBondContact O-N 3.2Å
231	L	72.9	Confident	78.4	Confident	56 Å²	56	60.4 Å²	60.4	29%	0.293	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-143.6	87.7	-179.3	-163.7	78.3	0	0	0	109	T228	T228-L231 PolarHBondContact N-O 2.96Å; T228-L231 VanDerWaalsContact N-O 3.16Å; T228-L231 CarbonylContact O-C 3.57Å; T228-L231 PolarHBondContact O-N 3.3Å; T228-L231 PolarHBondContact OG1-N 2.75Å
232	P	79.1	Confident	79	Confident	33 Å²	33	60 Å²	60	21%	0.214	37%	0.37	C	S	.	.			trans	-67.6	155.3	-178.9	28	-34.5	0	0	0	111.8	A199 R219	A199-P232 HydrophobicContact CB-CB 3.97Å; A199-P232 HydrophobicContact CB-CG 3.89Å; R219-P232 PolarHBondContact NH1-O 2.89Å
233	P	86.1	Confident	80.3	Confident	70 Å²	70	56.5 Å²	56.5	46%	0.455	35%	0.349	S	S	.	.			trans	-64.4	147.8	165	30.7	-34.9	0	0	0	110	P224	P224-P233 HydrophobicContact CG-CB 4.09Å
234	L	90.8	Very high	81.7	Confident	7 Å²	7	52.4 Å²	52.4	4%	0.037	33%	0.327	C	S	.	.			trans	-97	110.2	-177.8	179.7	66.8	0	0	0	111.3	L198 L201 I216 F217 R219 S220 L236	L198-L234 HydrophobicContact CG-CD1 4.38Å; L201-L234 HydrophobicContact CB-CD1 4.31Å; I216-L234 HydrophobicContact CG1-CD2 4.26Å; I216-L234 HydrophobicContact CG2-CD2 4.13Å; F217-L234 HydrophobicContact CD1-CD2 3.81Å; F217-L234 HydrophobicContact CE1-CD2 4.33Å; R219-L234 HydrophobicContact CB-CB 4.15Å; R219-L234 PolarHBondContact O-N 3.1Å; S220-L234 VanDerWaalsContact CA-O 3.29Å; S220-L234 WeakPolarHBondContact CA-O 3.37Å; S220-L234 WeakPolarHBondContact CB-O 3.22Å; L234-L236 VanDerWaalsContact C-N 3.33Å; L234-L236 HydrophobicContact CD2-CB 4.42Å; L234-L236 HydrophobicContact CG-CB 4.37Å; L234-L236 PolarHBondContact O-N 3.2Å
235	S	92.5	Very high	83.4	Confident	49 Å²	49	50 Å²	50	34%	0.343	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	86.3	164.5	-177.2	0	0	0	0	109.5	A199 R200 L201	A199-S235 WeakPolarHBondContact O-CB 3.26Å; A199-S235 PolarHBondContact O-N 2.6Å; R200-S235 WeakPolarHBondContact CA-O 3.31Å; R200-S235 PolarHBondContact NH1-OG 2.9Å; R200-S235 VanDerWaalsContact NH1-OG 3.08Å; L201-S235 PolarHBondContact N-O 3.49Å
236	L	93.6	Very high	85.2	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.016	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	132.4	169.8	177.2	67.6	0	0	0	110.4	L201 L203 F217 L234 F238 R257	L201-L236 HydrophobicContact CB-CD1 4.3Å; L201-L236 HydrophobicContact CD2-CD1 4.12Å; L201-L236 HydrophobicContact CG-CD1 4.07Å; L201-L236 WeakPolarHBondContact O-CA 3.23Å; L203-L236 HydrophobicContact CD1-CD1 4.27Å; F217-L236 HydrophobicContact CD1-CD1 4.34Å; F217-L236 HydrophobicContact CD1-CD2 3.78Å; F217-L236 HydrophobicContact CE1-CD1 3.89Å; F217-L236 HydrophobicContact CE1-CD2 4.06Å; L234-L236 VanDerWaalsContact C-N 3.33Å; L234-L236 HydrophobicContact CD2-CB 4.42Å; L234-L236 HydrophobicContact CG-CB 4.37Å; L234-L236 PolarHBondContact O-N 3.2Å; L236-F238 HydrophobicContact CD2-CD1 3.96Å; L236-F238 HydrophobicContact CD2-CE1 4.29Å; L236-F238 HydrophobicContact CG-CD1 4.08Å; L236-R257 PolarHBondContact O-NH1 3.33Å; L236-R257 PolarHBondContact O-NH2 3.48Å
237	S	94.8	Very high	87.1	Confident	22 Å²	22	41 Å²	41	15%	0.154	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	131.9	168.7	-30.6	0	0	0	0	109.8	L201 D202 L203	L201-S237 PolarHBondContact O-N 2.98Å; D202-S237 VanDerWaalsContact CG-CB 3.47Å; D202-S237 WeakPolarHBondContact OD1-CB 3.08Å; D202-S237 WeakPolarHBondContact OD2-CB 3.18Å; D202-S237 PolarHBondContact OD2-OG 3.08Å; L203-S237 WeakPolarHBondContact CB-O 3.08Å; L203-S237 PolarHBondContact N-O 3.1Å
238	F	95.4	Very high	88.8	Confident	1 Å²	1	40.3 Å²	40.3	0%	0.004	25%	0.245	C	C	.	.			trans	-144.3	12.2	178.3	67.8	-84	0	0	0	115.5	L203 L211 L236 N241 L243 L252 E262 W276	L203-F238 HydrophobicContact CB-CB 4.37Å; L211-F238 HydrophobicContact CD1-CB 4.2Å; L211-F238 HydrophobicContact CD1-CD1 4.3Å; L211-F238 HydrophobicContact CD1-CD2 4.27Å; L211-F238 HydrophobicContact CD1-CG 4Å; L236-F238 HydrophobicContact CD2-CD1 3.96Å; L236-F238 HydrophobicContact CD2-CE1 4.29Å; L236-F238 HydrophobicContact CG-CD1 4.08Å; F238-N241 PolarHBondContact O-ND2 2.93Å; F238-L243 HydrophobicContact CD2-CD1 4.09Å; F238-L243 HydrophobicContact CD2-CD2 4.41Å; F238-L243 HydrophobicContact CE2-CD1 3.84Å; F238-L252 HydrophobicContact CD2-CD2 4.5Å; F238-L252 HydrophobicContact CE1-CD1 4.27Å; F238-L252 HydrophobicContact CE1-CD2 4.39Å; F238-L252 HydrophobicContact CE2-CD2 3.78Å; F238-L252 HydrophobicContact CZ-CD1 4.25Å; F238-L252 HydrophobicContact CZ-CD2 3.73Å; F238-L252 HydrophobicContact CZ-CG 4.19Å; F238-E262 HydrophobicContact CD2-CG 4.07Å; F238-E262 WeakPolarHBondContact CE1-OE1 3.38Å; F238-E262 HydrophobicContact CE2-CB 4.09Å; F238-E262 HydrophobicContact CE2-CG 3.76Å; F238-E262 HydrophobicContact CZ-CG 4Å; F238-E262 WeakPolarHBondContact CZ-OE1 3.31Å; F238-W276 HydrophobicContact CE1-CZ2 4.2Å; F238-W276 AromaticContact CZ-CZ2 3.83Å; F238-W276 HydrophobicContact CZ-CZ2 3.83Å
239	G	94.6	Very high	90.2	Very high	10 Å²	10	37 Å²	37	10%	0.103	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	159.9	174.4	0	0	0	0	0	114.4	T204 S205 N241	T204-G239 CarbonylContact C-O 3.54Å; T204-G239 WeakPolarHBondContact CA-O 3.21Å; T204-G239 WeakPolarHBondContact CB-O 3.5Å; S205-G239 PolarHBondContact N-O 2.96Å; G239-N241 PolarHBondContact O-N 2.9Å
240	G	94.9	Very high	91.8	Very high	54 Å²	54	32.3 Å²	32.3	56%	0.557	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.4	-1.5	-178.3	0	0	0	0	0	116
241	N	97.6	Very high	93.2	Very high	5 Å²	5	26.3 Å²	26.3	3%	0.027	16%	0.164	C	C	.	.	S	Bend	trans	-80.9	150.1	175.5	-81	-77.1	0	0	0	113.1	L203 N206 R207 L208 F238 G239 L243	L203-N241 PolarHBondContact O-ND2 3.19Å; N206-N241 VanDerWaalsContact CA-OD1 3.24Å; N206-N241 WeakPolarHBondContact CA-OD1 3.46Å; N206-N241 WeakPolarHBondContact CB-OD1 3.21Å; N206-N241 PolarHBondContact N-OD1 2.72Å; N206-N241 PolarHBondContact O-OD1 2.73Å; R207-N241 PolarHBondContact N-OD1 3.47Å; L208-N241 HydrophobicContact CB-CB 4.34Å; L208-N241 WeakPolarHBondContact CB-OD1 3.47Å; L208-N241 PolarHBondContact N-OD1 2.92Å; F238-N241 PolarHBondContact O-ND2 2.93Å; G239-N241 PolarHBondContact O-N 2.9Å; N241-L243 HydrophobicContact CB-CD2 3.99Å; N241-L243 HydrophobicContact CB-CG 4.25Å; N241-L243 PolarHBondContact O-N 3.04Å
242	P	97.1	Very high	94.2	Very high	40 Å²	40	23.7 Å²	23.7	26%	0.26	15%	0.15	S	C	.	.			trans	-81	61.5	179	36.3	-38.4	0	0	0	112.2	N206 R207 L208 A265	N206-P242 WeakPolarHBondContact O-CD 3.1Å; R207-P242 WeakPolarHBondContact O-CG 3.45Å; L208-P242 WeakPolarHBondContact O-CD 3.4Å; P242-A265 HydrophobicContact CB-CB 3.92Å
243	L	97.4	Very high	94.9	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.01	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	136.3	-169.4	-60.3	174.6	0	0	0	113.5	F238 N241 L249 E262 C264 A265 S266 F275	F238-L243 HydrophobicContact CD2-CD1 4.09Å; F238-L243 HydrophobicContact CD2-CD2 4.41Å; F238-L243 HydrophobicContact CE2-CD1 3.84Å; N241-L243 HydrophobicContact CB-CD2 3.99Å; N241-L243 HydrophobicContact CB-CG 4.25Å; N241-L243 PolarHBondContact O-N 3.04Å; L243-L249 HydrophobicContact CB-CD1 4.15Å; L243-L249 HydrophobicContact CD2-CD1 4.31Å; L243-E262 HydrophobicContact CD1-CB 4.2Å; L243-C264 CarbonylContact O-C 3.09Å; L243-A265 PolarHBondContact O-N 2.82Å; L243-S266 PolarHBondContact O-N 2.9Å; L243-F275 HydrophobicContact CD1-CD2 4.05Å
244	H	97.3	Very high	95.3	Very high	30 Å²	30	28.5 Å²	28.5	14%	0.139	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	93.6	174.8	-175.6	20.7	0	0	0	108.9	Q209 N246 L249 S266 D314	Q209-H244 HydrophobicContact CB-CB 4.08Å; Q209-H244 WeakPolarHBondContact O-CB 3.47Å; Q209-H244 PolarHBondContact O-N 3.36Å; H244-N246 VanDerWaalsContact C-N 3.27Å; H244-N246 PolarHBondContact NE2-ND2 2.79Å; H244-N246 PolarHBondContact O-N 2.77Å; H244-L249 WeakPolarHBondContact O-CD1 3.44Å; H244-S266 WeakPolarHBondContact CA-OG 3.41Å; H244-S266 WeakPolarHBondContact CB-OG 3.25Å; H244-S266 PolarHBondContact ND1-OG 2.62Å; H244-S266 VanDerWaalsContact ND1-OG 3.11Å; H244-D314 IonicContact CE1-OD1 3.15Å; H244-D314 PolarHBondContact CE1-OD1 2.88Å; H244-D314 IonicContact CE1-OD2 3.51Å; H244-D314 PolarHBondContact CE1-OD2 3.34Å; H244-D314 VanDerWaalsContact CE1-OD2 3.32Å; H244-D314 IonicContact NE2-OD1 2.64Å; H244-D314 PolarHBondContact NE2-OD1 3.48Å
245	C	97.4	Very high	95.3	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.158	C	C	.	.			trans	-84.6	66	-168.5	-63.7	0	0	0	0	112.3	C264 S266 P267 L270 F283	C245-C264 HydrophobicContact CB-CB 3.76Å; C245-C264 WeakPolarHBondContact CB-SG 3.49Å; C245-C264 WeakPolarHBondContact SG-CB 3.48Å; C245-C264 CovalentContact SG-SG 2.02Å; C245-C264 PolarHBondContact SG-SG 2.87Å; C245-S266 PolarHBondContact N-O 3.23Å; C245-P267 WeakPolarHBondContact O-CD 3.41Å; C245-L270 HydrophobicContact CB-CD1 4.05Å; C245-L270 WeakPolarHBondContact O-CD1 3.47Å; C245-F283 HydrophobicContact CB-CD1 4.06Å; C245-F283 HydrophobicContact CB-CE1 3.64Å; C245-F283 HydrophobicContact CB-CZ 4.47Å
246	N	96.6	Very high	95.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	-102.5	-171.3	170.5	68.6	13.4	0	0	0	110.4	H244 E248 L249 F283 L284 D314	H244-N246 VanDerWaalsContact C-N 3.27Å; H244-N246 PolarHBondContact NE2-ND2 2.79Å; H244-N246 PolarHBondContact O-N 2.77Å; N246-E248 PolarHBondContact O-N 2.94Å; N246-E248 VanDerWaalsContact O-N 3.1Å; N246-E248 WeakPolarHBondContact OD1-CB 3.49Å; N246-E248 WeakPolarHBondContact OD1-CG 3.45Å; N246-E248 PolarHBondContact OD1-N 3.35Å; N246-L249 PolarHBondContact O-N 2.91Å; N246-L249 VanDerWaalsContact O-N 3.14Å; N246-F283 WeakPolarHBondContact O-CD1 3.27Å; N246-L284 CarbonylContact C-O 3.53Å; N246-L284 WeakPolarHBondContact CA-O 3.3Å; N246-L284 WeakPolarHBondContact CB-O 3.42Å; N246-D314 VanDerWaalsContact CB-OD1 3.22Å; N246-D314 WeakPolarHBondContact CB-OD1 3.5Å; N246-D314 PolarHBondContact ND2-OD1 2.8Å
247	C	96.2	Very high	94.8	Very high	36 Å²	36	33 Å²	33	24%	0.243	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-59.7	-18.1	179	74.8	0	0	0	0	115.1	L249 L250 F283 L284 C285	C247-L249 PolarHBondContact O-N 3.02Å; C247-L250 VanDerWaalsContact O-CB 3.22Å; C247-L250 WeakPolarHBondContact O-CB 3.35Å; C247-L250 PolarHBondContact O-N 2.94Å; C247-F283 WeakPolarHBondContact CA-O 3.43Å; C247-F283 PolarHBondContact N-O 2.84Å; C247-L284 PolarHBondContact N-O 3.18Å; C247-L284 VanDerWaalsContact N-O 3.15Å; C247-C285 VanDerWaalsContact CA-SG 3.53Å; C247-C285 HydrophobicContact CB-CB 3.87Å; C247-C285 WeakPolarHBondContact CB-SG 3.39Å; C247-C285 PolarHBondContact N-SG 2.78Å; C247-C285 WeakPolarHBondContact SG-CB 3.09Å; C247-C285 CovalentContact SG-SG 2.03Å; C247-C285 PolarHBondContact SG-SG 3.01Å
248	E	96.2	Very high	94.2	Very high	45 Å²	45	37.4 Å²	37.4	21%	0.21	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-68.3	-23.6	176.6	-55.2	-166	101.3	0	0	112.6	K210 N246 W251 P315 A363	K210-E248 HydrophobicContact CD-CB 4.26Å; K210-E248 WeakPolarHBondContact CD-OE2 3.42Å; K210-E248 IonicContact NZ-OE1 3.34Å; K210-E248 PolarHBondContact NZ-OE1 3Å; K210-E248 IonicContact NZ-OE2 3.94Å; K210-E248 PolarHBondContact NZ-OE2 2.99Å; N246-E248 PolarHBondContact O-N 2.94Å; N246-E248 VanDerWaalsContact O-N 3.1Å; N246-E248 WeakPolarHBondContact OD1-CB 3.49Å; N246-E248 WeakPolarHBondContact OD1-CG 3.45Å; N246-E248 PolarHBondContact OD1-N 3.35Å; E248-W251 PolarHBondContact O-NE1 3.14Å; E248-W251 VanDerWaalsContact O-NE1 3.13Å; E248-P315 HydrophobicContact CG-CG 3.61Å; E248-P315 WeakPolarHBondContact OE2-CG 3.47Å; E248-A363 HydrophobicContact CG-CB 4.08Å
249	L	96.4	Very high	93.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-96.5	3.2	174	-69	-176.4	0	0	0	113.7	K210 L243 H244 N246 C247 W251 L252 R253 F275 F283	K210-L249 HydrophobicContact CB-CD2 4Å; K210-L249 HydrophobicContact CB-CG 4.33Å; L243-L249 HydrophobicContact CB-CD1 4.15Å; L243-L249 HydrophobicContact CD2-CD1 4.31Å; H244-L249 WeakPolarHBondContact O-CD1 3.44Å; N246-L249 PolarHBondContact O-N 2.91Å; N246-L249 VanDerWaalsContact O-N 3.14Å; C247-L249 PolarHBondContact O-N 3.02Å; L249-W251 VanDerWaalsContact C-N 3.26Å; L249-W251 PolarHBondContact O-N 2.74Å; L249-L252 HydrophobicContact CD2-CD2 3.98Å; L249-L252 WeakPolarHBondContact O-CB 3.46Å; L249-L252 PolarHBondContact O-N 2.77Å; L249-L252 VanDerWaalsContact O-N 3.11Å; L249-R253 PolarHBondContact O-N 2.98Å; L249-F275 HydrophobicContact CB-CE2 3.99Å; L249-F275 HydrophobicContact CB-CZ 4.23Å; L249-F275 HydrophobicContact CD1-CE2 3.97Å; L249-F283 HydrophobicContact CB-CD1 4.41Å; L249-F283 HydrophobicContact CB-CE1 4.33Å
250	L	95.6	Very high	93	Very high	31 Å²	31	43.4 Å²	43.4	16%	0.162	22%	0.224	C	C	.	.	H	α-helix	trans	-64.7	-28.4	179.4	-179.7	58.3	0	0	0	112.9	C247 R254 E280 F283	C247-L250 VanDerWaalsContact O-CB 3.22Å; C247-L250 WeakPolarHBondContact O-CB 3.35Å; C247-L250 PolarHBondContact O-N 2.94Å; L250-R254 WeakPolarHBondContact O-CG 3.39Å; L250-R254 PolarHBondContact O-N 2.87Å; L250-E280 HydrophobicContact CD1-CB 3.77Å; L250-E280 HydrophobicContact CD1-CG 3.78Å; L250-F283 HydrophobicContact CB-CB 4.32Å; L250-F283 HydrophobicContact CD1-CB 4.24Å
251	W	94.1	Very high	92.7	Very high	59 Å²	59	47 Å²	47	22%	0.223	23%	0.228	C	C	.	.	H	α-helix	trans	-68.3	-39.1	173.3	73.2	-94.8	0	0	0	111.5	L211 P212 P213 F217 E248 L249 R254 L255	L211-W251 HydrophobicContact CB-CH2 4.5Å; L211-W251 HydrophobicContact CB-CZ2 3.97Å; L211-W251 PolarHBondContact O-NE1 3.06Å; P212-W251 VanDerWaalsContact O-CZ2 3.26Å; P212-W251 WeakPolarHBondContact O-CZ2 3.17Å; P213-W251 HydrophobicContact CB-CD2 3.99Å; P213-W251 HydrophobicContact CB-CG 4.05Å; F217-W251 HydrophobicContact CB-CH2 4.09Å; F217-W251 HydrophobicContact CB-CZ3 3.77Å; F217-W251 AromaticContact CD2-CH2 3.37Å; F217-W251 HydrophobicContact CD2-CH2 3.37Å; F217-W251 HydrophobicContact CD2-CZ2 4.31Å; F217-W251 AromaticContact CD2-CZ3 3.85Å; F217-W251 HydrophobicContact CD2-CZ3 3.85Å; F217-W251 AromaticContact CE2-CH2 3.99Å; F217-W251 HydrophobicContact CE2-CH2 3.99Å; F217-W251 AromaticContact CG-CH2 3.92Å; F217-W251 HydrophobicContact CG-CH2 3.92Å; F217-W251 HydrophobicContact CG-CZ3 4.13Å; E248-W251 PolarHBondContact O-NE1 3.14Å; E248-W251 VanDerWaalsContact O-NE1 3.13Å; L249-W251 VanDerWaalsContact C-N 3.26Å; L249-W251 PolarHBondContact O-N 2.74Å; W251-R254 PolarHBondContact O-N 2.78Å; W251-L255 HydrophobicContact CZ3-CD1 4.28Å
252	L	94.4	Very high	92.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-69.9	-42.2	179.3	-179.9	65.1	0	0	0	110.3	L211 F238 L249 R254 L255 F275 W276	L211-L252 HydrophobicContact CD1-CD2 4Å; F238-L252 HydrophobicContact CD2-CD2 4.5Å; F238-L252 HydrophobicContact CE1-CD1 4.27Å; F238-L252 HydrophobicContact CE1-CD2 4.39Å; F238-L252 HydrophobicContact CE2-CD2 3.78Å; F238-L252 HydrophobicContact CZ-CD1 4.25Å; F238-L252 HydrophobicContact CZ-CD2 3.73Å; F238-L252 HydrophobicContact CZ-CG 4.19Å; L249-L252 HydrophobicContact CD2-CD2 3.98Å; L249-L252 WeakPolarHBondContact O-CB 3.46Å; L249-L252 PolarHBondContact O-N 2.77Å; L249-L252 VanDerWaalsContact O-N 3.11Å; L252-R254 PolarHBondContact O-N 3.29Å; L252-R254 VanDerWaalsContact O-N 3.15Å; L252-L255 HydrophobicContact CD1-CD1 3.93Å; L252-L255 WeakPolarHBondContact O-CB 3.5Å; L252-L255 WeakPolarHBondContact O-CG 3.37Å; L252-L255 PolarHBondContact O-N 3.21Å; L252-L255 VanDerWaalsContact O-N 3.09Å; L252-F275 HydrophobicContact CB-CZ 4.12Å; L252-F275 HydrophobicContact CD2-CE1 4.21Å; L252-F275 HydrophobicContact CD2-CZ 3.84Å; L252-F275 HydrophobicContact CG-CE1 4.01Å; L252-F275 HydrophobicContact CG-CZ 3.89Å; L252-W276 WeakPolarHBondContact O-CH2 3.34Å; L252-W276 WeakPolarHBondContact O-CZ3 3.15Å
253	R	94.3	Very high	92.5	Very high	59 Å²	59	47.3 Å²	47.3	22%	0.223	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-23.5	174.6	179.5	58.9	-169.9	87.9	-9.7	113.1	L249 L255 F275 W276 I278 E280 F283	L249-R253 PolarHBondContact O-N 2.98Å; R253-L255 VanDerWaalsContact C-N 3.34Å; R253-F275 HydrophobicContact CB-CE1 4.14Å; R253-F275 HydrophobicContact CB-CZ 4.03Å; R253-W276 VanDerWaalsContact CZ-O 3.22Å; R253-W276 PolarHBondContact NE-O 3.35Å; R253-W276 PolarHBondContact NH2-O 3.45Å; R253-I278 PolarHBondContact NE-O 2.92Å; R253-E280 HydrophobicContact CG-CG 4.31Å; R253-F283 HydrophobicContact CB-CD2 4.44Å; R253-F283 HydrophobicContact CB-CE2 4.01Å; R253-F283 HydrophobicContact CB-CZ 4.06Å; R253-F283 HydrophobicContact CG-CD2 4.09Å; R253-F283 HydrophobicContact CG-CE2 3.54Å; R253-F283 HydrophobicContact CG-CZ 3.99Å
254	R	93.4	Very high	92.5	Very high	146 Å²	146	47.3 Å²	47.3	55%	0.551	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-3.5	177.7	-77	172.6	174.8	148.4	11.4	114.8	L250 W251 L252 E280	L250-R254 WeakPolarHBondContact O-CG 3.39Å; L250-R254 PolarHBondContact O-N 2.87Å; W251-R254 PolarHBondContact O-N 2.78Å; L252-R254 PolarHBondContact O-N 3.29Å; L252-R254 VanDerWaalsContact O-N 3.15Å; R254-E280 HydrophobicContact CG-CG 4.49Å; R254-E280 IonicContact CZ-OE2 2.67Å; R254-E280 IonicContact NE-OE2 2.99Å; R254-E280 PolarHBondContact NE-OE2 3.24Å; R254-E280 IonicContact NH2-OE2 2.7Å; R254-E280 PolarHBondContact NH2-OE2 2.86Å
255	L	91.1	Very high	92.5	Very high	17 Å²	17	47.7 Å²	47.7	9%	0.089	24%	0.238	C	C	.	.	S	Bend	trans	-75.6	139.9	171.1	-54.4	-174.8	0	0	0	110.1	F217 Q221 W251 L252 R253 R257 W276	F217-L255 HydrophobicContact CB-CD1 4.37Å; Q221-L255 HydrophobicContact CG-CB 4.17Å; Q221-L255 HydrophobicContact CG-CD2 4.23Å; Q221-L255 VanDerWaalsContact NE2-CD2 3.33Å; W251-L255 HydrophobicContact CZ3-CD1 4.28Å; L252-L255 HydrophobicContact CD1-CD1 3.93Å; L252-L255 WeakPolarHBondContact O-CB 3.5Å; L252-L255 WeakPolarHBondContact O-CG 3.37Å; L252-L255 PolarHBondContact O-N 3.21Å; L252-L255 VanDerWaalsContact O-N 3.09Å; R253-L255 VanDerWaalsContact C-N 3.34Å; L255-R257 HydrophobicContact CB-CG 4.17Å; L255-R257 PolarHBondContact O-N 2.92Å; L255-W276 HydrophobicContact CB-CH2 4.47Å; L255-W276 WeakPolarHBondContact O-CZ3 3.47Å
256	D	87.9	Confident	92.5	Very high	98 Å²	98	49.1 Å²	49.1	52%	0.524	25%	0.248	S	C	.	.			trans	-85.1	106.3	170.1	-170.2	30.6	0	0	0	108.8	Q221 V222	Q221-D256 CarbonylContact C-O 3.52Å; Q221-D256 WeakPolarHBondContact CA-O 3.46Å; Q221-D256 WeakPolarHBondContact CB-O 3.34Å; V222-D256 PolarHBondContact N-O 3.32Å
257	R	87.8	Confident	92.5	Very high	38 Å²	38	50.7 Å²	50.7	14%	0.143	26%	0.258	C	S	.	.			trans	-142.1	153	-168.7	-84.8	-168.8	58.8	89.2	-2.2	111.7	S220 L236 L255 D260 W276	S220-R257 WeakPolarHBondContact O-CG 3.08Å; S220-R257 PolarHBondContact O-NH1 3.43Å; S220-R257 VanDerWaalsContact O-NH1 3.09Å; L236-R257 PolarHBondContact O-NH1 3.33Å; L236-R257 PolarHBondContact O-NH2 3.48Å; L255-R257 HydrophobicContact CB-CG 4.17Å; L255-R257 PolarHBondContact O-N 2.92Å; R257-D260 IonicContact NH2-OD2 2.68Å; R257-D260 PolarHBondContact NH2-OD2 2.8Å; R257-W276 HydrophobicContact CB-CH2 3.95Å; R257-W276 HydrophobicContact CB-CZ2 3.92Å; R257-W276 HydrophobicContact CB-CZ3 4.4Å; R257-W276 HydrophobicContact CG-CH2 4.31Å; R257-W276 HydrophobicContact CG-CZ2 4.47Å
258	D	83.4	Confident	92.4	Very high	115 Å²	115	54.8 Å²	54.8	62%	0.615	28%	0.284	S	S	*	.			trans	-66.6	154.7	166.2	-63.5	-63.8	0	0	0	111.5	D260	D258-D260 PolarHBondContact O-N 3.06Å
259	D	81.8	Confident	92.3	Very high	60 Å²	60	55.6 Å²	55.6	32%	0.321	30%	0.304	S	S	.	.			trans	-89.3	95.3	-175.7	175.2	30.4	0	0	0	111.1	M261 Y277	D259-M261 PolarHBondContact O-N 2.74Å; D259-M261 PolarHBondContact OD1-N 2.9Å; D259-Y277 WeakPolarHBondContact OD2-CE2 3.18Å; D259-Y277 PolarHBondContact OD2-OH 2.89Å
260	D	82.8	Confident	92.3	Very high	76 Å²	76	56.1 Å²	56.1	41%	0.406	31%	0.307	S	S	.	.			trans	-81.5	18.2	176.5	-68.6	-51	0	0	0	112.3	R257 D258 E262	R257-D260 IonicContact NH2-OD2 2.68Å; R257-D260 PolarHBondContact NH2-OD2 2.8Å; D258-D260 PolarHBondContact O-N 3.06Å; D260-E262 VanDerWaalsContact C-N 3.28Å; D260-E262 HydrophobicContact CB-CG 4.33Å; D260-E262 PolarHBondContact N-OE2 2.84Å; D260-E262 VanDerWaalsContact N-OE2 3.13Å; D260-E262 PolarHBondContact O-N 3.46Å
261	M	88.9	Confident	92.3	Very high	129 Å²	129	61.8 Å²	61.8	64%	0.635	33%	0.33	S	S	*	.			trans	59	31.4	-178.8	-60.4	173.1	-77.5	0	0	114.1	D259 Y274	D259-M261 PolarHBondContact O-N 2.74Å; D259-M261 PolarHBondContact OD1-N 2.9Å; M261-Y274 HydrophobicContact CB-CD1 4.33Å; M261-Y274 HydrophobicContact CB-CE1 4.07Å; M261-Y274 HydrophobicContact CG-CE1 4.43Å
262	E	94.4	Very high	92.4	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.005	35%	0.349	C	S	.	.			trans	-63.9	142.7	175.3	-46.1	97.3	122.4	0	0	110.5	F238 L243 D260 Y274 F275 W276	F238-E262 HydrophobicContact CD2-CG 4.07Å; F238-E262 WeakPolarHBondContact CE1-OE1 3.38Å; F238-E262 HydrophobicContact CE2-CB 4.09Å; F238-E262 HydrophobicContact CE2-CG 3.76Å; F238-E262 HydrophobicContact CZ-CG 4Å; F238-E262 WeakPolarHBondContact CZ-OE1 3.31Å; L243-E262 HydrophobicContact CD1-CB 4.2Å; D260-E262 VanDerWaalsContact C-N 3.28Å; D260-E262 HydrophobicContact CB-CG 4.33Å; D260-E262 PolarHBondContact N-OE2 2.84Å; D260-E262 VanDerWaalsContact N-OE2 3.13Å; D260-E262 PolarHBondContact O-N 3.46Å; E262-Y274 CarbonylContact O-C 3.59Å; E262-Y274 VanDerWaalsContact O-CA 3.29Å; E262-Y274 WeakPolarHBondContact O-CA 3.18Å; E262-F275 HydrophobicContact CB-CB 4.08Å; E262-F275 PolarHBondContact O-N 3.24Å; E262-W276 PolarHBondContact OE1-NE1 3.29Å; E262-W276 VanDerWaalsContact OE2-CD1 3.25Å; E262-W276 PolarHBondContact OE2-NE1 2.82Å
263	T	95.8	Very high	92.4	Very high	51 Å²	51	67.2 Å²	67.2	31%	0.313	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-131.7	145.5	-174	52.8	0	0	0	0	113	R273 Y274	T263-R273 WeakPolarHBondContact CA-O 3.33Å; T263-Y274 HydrophobicContact CG2-CD1 3.64Å; T263-Y274 HydrophobicContact CG2-CE1 3.94Å; T263-Y274 HydrophobicContact CG2-CG 4.45Å
264	C	97.6	Very high	92.5	Very high	2 Å²	2	70 Å²	70	1%	0.014	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	128.2	175	-60.6	0	0	0	0	110.6	L243 C245 L270 K271 G272 R273 I278	L243-C264 CarbonylContact O-C 3.09Å; C245-C264 HydrophobicContact CB-CB 3.76Å; C245-C264 WeakPolarHBondContact CB-SG 3.49Å; C245-C264 WeakPolarHBondContact SG-CB 3.48Å; C245-C264 CovalentContact SG-SG 2.02Å; C245-C264 PolarHBondContact SG-SG 2.87Å; C264-L270 HydrophobicContact CB-CB 4.28Å; C264-K271 CarbonylContact O-C 3.53Å; C264-K271 WeakPolarHBondContact O-CA 3.19Å; C264-G272 PolarHBondContact O-N 2.8Å; C264-R273 PolarHBondContact N-O 3.43Å; C264-I278 HydrophobicContact CB-CD1 4.29Å; C264-I278 WeakPolarHBondContact SG-CD1 3.24Å
265	A	97.6	Very high	92.6	Very high	38 Å²	38	63 Å²	63	31%	0.314	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-26.8	171.6	0	0	0	0	0	112.6	P242 L243 K271	P242-A265 HydrophobicContact CB-CB 3.92Å; L243-A265 PolarHBondContact O-N 2.82Å; A265-K271 VanDerWaalsContact O-CD 3.31Å; A265-K271 WeakPolarHBondContact O-CD 3.13Å; A265-K271 VanDerWaalsContact O-CG 3.28Å; A265-K271 WeakPolarHBondContact O-CG 3.18Å
266	S	96.4	Very high	92.8	Very high	31 Å²	31	63.4 Å²	63.4	22%	0.217	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	165.8	179	55.7	0	0	0	0	109.9	L243 H244 C245	L243-S266 PolarHBondContact O-N 2.9Å; H244-S266 WeakPolarHBondContact CA-OG 3.41Å; H244-S266 WeakPolarHBondContact CB-OG 3.25Å; H244-S266 PolarHBondContact ND1-OG 2.62Å; H244-S266 VanDerWaalsContact ND1-OG 3.11Å; C245-S266 PolarHBondContact N-O 3.23Å
267	P	96.4	Very high	93	Very high	32 Å²	32	66.5 Å²	66.5	21%	0.208	36%	0.36	C	S	.	.	S	Bend	cis	-63.9	167.1	-10.2	29	-36.3	0	0	0	112.7	C245 G269 L270 K271	C245-P267 WeakPolarHBondContact O-CD 3.41Å; P267-G269 PolarHBondContact O-N 3.2Å; P267-L270 HydrophobicContact CG-CD1 4.38Å; P267-L270 PolarHBondContact O-N 2.95Å; P267-K271 PolarHBondContact O-N 2.74Å; P267-K271 VanDerWaalsContact O-N 3.14Å
268	P	94.7	Very high	93.4	Very high	123 Å²	123	64.8 Å²	64.8	80%	0.799	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-24.3	-172.1	-28.6	36.5	0	0	0	116.2
269	G	94.6	Very high	94	Very high	61 Å²	61	66.7 Å²	66.7	63%	0.629	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-21.6	176.1	0	0	0	0	0	115	P267	P267-G269 PolarHBondContact O-N 3.2Å
270	L	95.9	Very high	94.6	Very high	11 Å²	11	67.9 Å²	67.9	6%	0.058	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-7.9	178.9	-62.5	179.6	0	0	0	113	C245 C264 P267 G272 R273 I278 E282	C245-L270 HydrophobicContact CB-CD1 4.05Å; C245-L270 WeakPolarHBondContact O-CD1 3.47Å; C264-L270 HydrophobicContact CB-CB 4.28Å; P267-L270 HydrophobicContact CG-CD1 4.38Å; P267-L270 PolarHBondContact O-N 2.95Å; L270-G272 PolarHBondContact O-N 3.3Å; L270-R273 WeakPolarHBondContact O-CB 3.31Å; L270-R273 PolarHBondContact O-N 3.15Å; L270-I278 HydrophobicContact CB-CD1 4.27Å; L270-I278 HydrophobicContact CD1-CD1 4.41Å; L270-I278 HydrophobicContact CD1-CG2 4.13Å; L270-I278 HydrophobicContact CD2-CD1 4.23Å; L270-I278 HydrophobicContact CD2-CG1 4.27Å; L270-I278 HydrophobicContact CD2-CG2 3.87Å; L270-E282 HydrophobicContact CD2-CB 4.2Å
271	K	96.1	Very high	95.3	Very high	150 Å²	150	70.4 Å²	70.4	65%	0.652	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	125.2	-178.6	-179.5	168.4	-173.3	165.9	0	112.5	C264 A265 P267 R273	C264-K271 CarbonylContact O-C 3.53Å; C264-K271 WeakPolarHBondContact O-CA 3.19Å; A265-K271 VanDerWaalsContact O-CD 3.31Å; A265-K271 WeakPolarHBondContact O-CD 3.13Å; A265-K271 VanDerWaalsContact O-CG 3.28Å; A265-K271 WeakPolarHBondContact O-CG 3.18Å; P267-K271 PolarHBondContact O-N 2.74Å; P267-K271 VanDerWaalsContact O-N 3.14Å; K271-R273 VanDerWaalsContact C-N 3.32Å
272	G	94.9	Very high	95.6	Very high	60 Å²	60	67 Å²	67	62%	0.619	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	4.4	179.1	0	0	0	0	0	114.9	C264 L270	C264-G272 PolarHBondContact O-N 2.8Å; L270-G272 PolarHBondContact O-N 3.3Å
273	R	95.8	Very high	95.7	Very high	113 Å²	113	67.2 Å²	67.2	43%	0.426	35%	0.349	S	S	.	.	S	Bend	trans	-86.1	148.8	168.8	-63.5	-171.3	-174.3	-177.1	11.2	111	T263 C264 L270 K271 I278 E282	T263-R273 WeakPolarHBondContact CA-O 3.33Å; C264-R273 PolarHBondContact N-O 3.43Å; L270-R273 WeakPolarHBondContact O-CB 3.31Å; L270-R273 PolarHBondContact O-N 3.15Å; K271-R273 VanDerWaalsContact C-N 3.32Å; R273-I278 HydrophobicContact CB-CD1 3.91Å; R273-I278 HydrophobicContact CB-CG1 3.96Å; R273-E282 IonicContact CZ-OE2 3.64Å; R273-E282 IonicContact NH1-OE1 3.8Å; R273-E282 IonicContact NH1-OE2 3.63Å; R273-E282 PolarHBondContact NH1-OE2 3.46Å; R273-E282 IonicContact NH2-OE2 2.73Å
274	Y	95.4	Very high	95.8	Very high	118 Å²	118	70.5 Å²	70.5	46%	0.463	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-69.9	133.7	171.1	-63	-69.5	0	0	0	111.2	M261 E262 T263 W276 Y277 I278	M261-Y274 HydrophobicContact CB-CD1 4.33Å; M261-Y274 HydrophobicContact CB-CE1 4.07Å; M261-Y274 HydrophobicContact CG-CE1 4.43Å; E262-Y274 CarbonylContact O-C 3.59Å; E262-Y274 VanDerWaalsContact O-CA 3.29Å; E262-Y274 WeakPolarHBondContact O-CA 3.18Å; T263-Y274 HydrophobicContact CG2-CD1 3.64Å; T263-Y274 HydrophobicContact CG2-CE1 3.94Å; T263-Y274 HydrophobicContact CG2-CG 4.45Å; Y274-W276 PolarHBondContact O-N 3.01Å; Y274-Y277 VanDerWaalsContact CB-CD2 3.48Å; Y274-Y277 HydrophobicContact CD2-CD2 4.49Å; Y274-Y277 HydrophobicContact CG-CD2 4.31Å; Y274-Y277 HydrophobicContact CG-CE2 4.47Å; Y274-Y277 PolarHBondContact O-N 2.98Å; Y274-I278 WeakPolarHBondContact O-CG1 3.43Å
275	F	96.2	Very high	95.7	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-56.5	-49.6	-169.8	-178.1	-97.9	0	0	0	112.8	L243 L249 L252 R253 E262 Y277 I278 F283	L243-F275 HydrophobicContact CD1-CD2 4.05Å; L249-F275 HydrophobicContact CB-CE2 3.99Å; L249-F275 HydrophobicContact CB-CZ 4.23Å; L249-F275 HydrophobicContact CD1-CE2 3.97Å; L252-F275 HydrophobicContact CB-CZ 4.12Å; L252-F275 HydrophobicContact CD2-CE1 4.21Å; L252-F275 HydrophobicContact CD2-CZ 3.84Å; L252-F275 HydrophobicContact CG-CE1 4.01Å; L252-F275 HydrophobicContact CG-CZ 3.89Å; R253-F275 HydrophobicContact CB-CE1 4.14Å; R253-F275 HydrophobicContact CB-CZ 4.03Å; E262-F275 HydrophobicContact CB-CB 4.08Å; E262-F275 PolarHBondContact O-N 3.24Å; F275-Y277 VanDerWaalsContact C-N 3.34Å; F275-Y277 PolarHBondContact O-N 3.35Å; F275-I278 PolarHBondContact O-N 3.4Å; F275-F283 HydrophobicContact CD2-CE1 4.11Å; F275-F283 HydrophobicContact CD2-CZ 4.06Å; F275-F283 AromaticContact CE2-CE1 3.58Å; F275-F283 HydrophobicContact CE2-CE1 3.58Å; F275-F283 AromaticContact CE2-CZ 3.81Å; F275-F283 HydrophobicContact CE2-CZ 3.81Å; F275-F283 HydrophobicContact CZ-CE1 4.16Å; F275-F283 HydrophobicContact CZ-CZ 4.21Å
276	W	94	Very high	95.7	Very high	24 Å²	24	76.2 Å²	76.2	9%	0.091	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-72.1	-21.3	-175.7	-56.8	108.5	0	0	0	114.3	F238 L252 R253 L255 R257 E262 Y274	F238-W276 HydrophobicContact CE1-CZ2 4.2Å; F238-W276 AromaticContact CZ-CZ2 3.83Å; F238-W276 HydrophobicContact CZ-CZ2 3.83Å; L252-W276 WeakPolarHBondContact O-CH2 3.34Å; L252-W276 WeakPolarHBondContact O-CZ3 3.15Å; R253-W276 VanDerWaalsContact CZ-O 3.22Å; R253-W276 PolarHBondContact NE-O 3.35Å; R253-W276 PolarHBondContact NH2-O 3.45Å; L255-W276 HydrophobicContact CB-CH2 4.47Å; L255-W276 WeakPolarHBondContact O-CZ3 3.47Å; R257-W276 HydrophobicContact CB-CH2 3.95Å; R257-W276 HydrophobicContact CB-CZ2 3.92Å; R257-W276 HydrophobicContact CB-CZ3 4.4Å; R257-W276 HydrophobicContact CG-CH2 4.31Å; R257-W276 HydrophobicContact CG-CZ2 4.47Å; E262-W276 PolarHBondContact OE1-NE1 3.29Å; E262-W276 VanDerWaalsContact OE2-CD1 3.25Å; E262-W276 PolarHBondContact OE2-NE1 2.82Å; Y274-W276 PolarHBondContact O-N 3.01Å
277	Y	93.6	Very high	95.7	Very high	164 Å²	164	78.7 Å²	78.7	64%	0.643	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-84.2	-15.7	178.2	-63.1	-100.1	0	0	0	113.2	D259 Y274 F275	D259-Y277 WeakPolarHBondContact OD2-CE2 3.18Å; D259-Y277 PolarHBondContact OD2-OH 2.89Å; Y274-Y277 VanDerWaalsContact CB-CD2 3.48Å; Y274-Y277 HydrophobicContact CD2-CD2 4.49Å; Y274-Y277 HydrophobicContact CG-CD2 4.31Å; Y274-Y277 HydrophobicContact CG-CE2 4.47Å; Y274-Y277 PolarHBondContact O-N 2.98Å; F275-Y277 VanDerWaalsContact C-N 3.34Å; F275-Y277 PolarHBondContact O-N 3.35Å
278	I	95.2	Very high	95.8	Very high	1 Å²	1	77.7 Å²	77.7	1%	0.005	40%	0.396	C	S	.	.	S	Bend	trans	-72.2	138.7	173.2	-60.2	162.3	0	0	0	108.3	R253 C264 L270 R273 Y274 F275 E282 F283	R253-I278 PolarHBondContact NE-O 2.92Å; C264-I278 HydrophobicContact CB-CD1 4.29Å; C264-I278 WeakPolarHBondContact SG-CD1 3.24Å; L270-I278 HydrophobicContact CB-CD1 4.27Å; L270-I278 HydrophobicContact CD1-CD1 4.41Å; L270-I278 HydrophobicContact CD1-CG2 4.13Å; L270-I278 HydrophobicContact CD2-CD1 4.23Å; L270-I278 HydrophobicContact CD2-CG1 4.27Å; L270-I278 HydrophobicContact CD2-CG2 3.87Å; R273-I278 HydrophobicContact CB-CD1 3.91Å; R273-I278 HydrophobicContact CB-CG1 3.96Å; Y274-I278 WeakPolarHBondContact O-CG1 3.43Å; F275-I278 PolarHBondContact O-N 3.4Å; I278-E282 HydrophobicContact CG2-CB 3.64Å; I278-E282 HydrophobicContact CG2-CG 4.44Å; I278-F283 HydrophobicContact CB-CE2 3.73Å; I278-F283 HydrophobicContact CB-CZ 4.08Å; I278-F283 HydrophobicContact CD1-CZ 4.49Å; I278-F283 HydrophobicContact CG2-CD2 3.91Å; I278-F283 HydrophobicContact CG2-CE2 3.43Å; I278-F283 VanDerWaalsContact CG2-CE2 3.43Å; I278-F283 HydrophobicContact CG2-CZ 4.02Å
279	R	95.7	Very high	95.9	Very high	156 Å²	156	76.8 Å²	76.8	59%	0.589	38%	0.383	S	S	*	.			trans	-79.8	150.1	179.7	-56.4	-179.6	180	-176.1	0	111	E281 E282 F283	R279-E281 HydrophobicContact CB-CG 3.76Å; R279-E281 WeakPolarHBondContact CD-OE1 3.39Å; R279-E281 IonicContact CZ-OE1 2.63Å; R279-E281 IonicContact NE-OE1 3.75Å; R279-E281 IonicContact NH1-OE1 2.61Å; R279-E281 PolarHBondContact NH1-OE1 3.03Å; R279-E281 PolarHBondContact O-N 3.12Å; R279-E281 VanDerWaalsContact O-N 3.09Å; R279-E282 HydrophobicContact CB-CG 4.45Å; R279-E282 PolarHBondContact N-OE1 3.01Å; R279-E282 VanDerWaalsContact N-OE1 3.12Å; R279-E282 WeakPolarHBondContact O-CB 3.02Å; R279-E282 PolarHBondContact O-N 3.21Å; R279-F283 VanDerWaalsContact O-CD2 3.32Å; R279-F283 WeakPolarHBondContact O-CD2 3.49Å
280	E	95.8	Very high	96	Very high	85 Å²	85	75 Å²	75	40%	0.397	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-50.8	-35.3	173.2	-74.7	-170.5	-128.5	0	0	113.5	L250 R253 R254 E282 F283	L250-E280 HydrophobicContact CD1-CB 3.77Å; L250-E280 HydrophobicContact CD1-CG 3.78Å; R253-E280 HydrophobicContact CG-CG 4.31Å; R254-E280 HydrophobicContact CG-CG 4.49Å; R254-E280 IonicContact CZ-OE2 2.67Å; R254-E280 IonicContact NE-OE2 2.99Å; R254-E280 PolarHBondContact NE-OE2 3.24Å; R254-E280 IonicContact NH2-OE2 2.7Å; R254-E280 PolarHBondContact NH2-OE2 2.86Å; E280-E282 PolarHBondContact O-N 2.95Å; E280-F283 PolarHBondContact O-N 2.83Å
281	E	95.6	Very high	95.9	Very high	129 Å²	129	77.7 Å²	77.7	60%	0.603	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-69.1	-11.9	178.6	63.9	-171.1	-178.7	0	0	114.6	R279	R279-E281 HydrophobicContact CB-CG 3.76Å; R279-E281 WeakPolarHBondContact CD-OE1 3.39Å; R279-E281 IonicContact CZ-OE1 2.63Å; R279-E281 IonicContact NE-OE1 3.75Å; R279-E281 IonicContact NH1-OE1 2.61Å; R279-E281 PolarHBondContact NH1-OE1 3.03Å; R279-E281 PolarHBondContact O-N 3.12Å; R279-E281 VanDerWaalsContact O-N 3.09Å
282	E	96.4	Very high	95.8	Very high	58 Å²	58	76.4 Å²	76.4	27%	0.271	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-94.2	-15.3	175.5	-65.5	177.3	-83.8	0	0	113	L270 R273 I278 R279 E280 L284	L270-E282 HydrophobicContact CD2-CB 4.2Å; R273-E282 IonicContact CZ-OE2 3.64Å; R273-E282 IonicContact NH1-OE1 3.8Å; R273-E282 IonicContact NH1-OE2 3.63Å; R273-E282 PolarHBondContact NH1-OE2 3.46Å; R273-E282 IonicContact NH2-OE2 2.73Å; I278-E282 HydrophobicContact CG2-CB 3.64Å; I278-E282 HydrophobicContact CG2-CG 4.44Å; R279-E282 HydrophobicContact CB-CG 4.45Å; R279-E282 PolarHBondContact N-OE1 3.01Å; R279-E282 VanDerWaalsContact N-OE1 3.12Å; R279-E282 WeakPolarHBondContact O-CB 3.02Å; R279-E282 PolarHBondContact O-N 3.21Å; E280-E282 PolarHBondContact O-N 2.95Å; E282-L284 VanDerWaalsContact C-N 3.27Å; E282-L284 PolarHBondContact O-N 2.8Å
283	F	96.9	Very high	95.8	Very high	4 Å²	4	76.3 Å²	76.3	2%	0.018	36%	0.356	C	S	.	.			trans	-80.3	70.6	176.7	-72.6	-95.2	0	0	0	111.1	C245 N246 C247 L249 L250 R253 F275 I278 R279 E280	C245-F283 HydrophobicContact CB-CD1 4.06Å; C245-F283 HydrophobicContact CB-CE1 3.64Å; C245-F283 HydrophobicContact CB-CZ 4.47Å; N246-F283 WeakPolarHBondContact O-CD1 3.27Å; C247-F283 WeakPolarHBondContact CA-O 3.43Å; C247-F283 PolarHBondContact N-O 2.84Å; L249-F283 HydrophobicContact CB-CD1 4.41Å; L249-F283 HydrophobicContact CB-CE1 4.33Å; L250-F283 HydrophobicContact CB-CB 4.32Å; L250-F283 HydrophobicContact CD1-CB 4.24Å; R253-F283 HydrophobicContact CB-CD2 4.44Å; R253-F283 HydrophobicContact CB-CE2 4.01Å; R253-F283 HydrophobicContact CB-CZ 4.06Å; R253-F283 HydrophobicContact CG-CD2 4.09Å; R253-F283 HydrophobicContact CG-CE2 3.54Å; R253-F283 HydrophobicContact CG-CZ 3.99Å; F275-F283 HydrophobicContact CD2-CE1 4.11Å; F275-F283 HydrophobicContact CD2-CZ 4.06Å; F275-F283 AromaticContact CE2-CE1 3.58Å; F275-F283 HydrophobicContact CE2-CE1 3.58Å; F275-F283 AromaticContact CE2-CZ 3.81Å; F275-F283 HydrophobicContact CE2-CZ 3.81Å; F275-F283 HydrophobicContact CZ-CE1 4.16Å; F275-F283 HydrophobicContact CZ-CZ 4.21Å; I278-F283 HydrophobicContact CB-CE2 3.73Å; I278-F283 HydrophobicContact CB-CZ 4.08Å; I278-F283 HydrophobicContact CD1-CZ 4.49Å; I278-F283 HydrophobicContact CG2-CD2 3.91Å; I278-F283 HydrophobicContact CG2-CE2 3.43Å; I278-F283 VanDerWaalsContact CG2-CE2 3.43Å; I278-F283 HydrophobicContact CG2-CZ 4.02Å; R279-F283 VanDerWaalsContact O-CD2 3.32Å; R279-F283 WeakPolarHBondContact O-CD2 3.49Å; E280-F283 PolarHBondContact O-N 2.83Å
284	L	96.2	Very high	95.7	Very high	121 Å²	121	72.3 Å²	72.3	63%	0.634	34%	0.344	S	S	*	.			trans	-91.3	163.1	-177.6	-58.6	178.4	0	0	0	112.3	N246 C247 E282	N246-L284 CarbonylContact C-O 3.53Å; N246-L284 WeakPolarHBondContact CA-O 3.3Å; N246-L284 WeakPolarHBondContact CB-O 3.42Å; C247-L284 PolarHBondContact N-O 3.18Å; C247-L284 VanDerWaalsContact N-O 3.15Å; E282-L284 VanDerWaalsContact C-N 3.27Å; E282-L284 PolarHBondContact O-N 2.8Å
285	C	96.8	Very high	95.6	Very high	27 Å²	27	73.2 Å²	73.2	18%	0.182	35%	0.352	C	S	.	.			trans	-131.6	149.7	169.3	-78.5	0	0	0	0	108.9	C247 D314 A364	C247-C285 VanDerWaalsContact CA-SG 3.53Å; C247-C285 HydrophobicContact CB-CB 3.87Å; C247-C285 WeakPolarHBondContact CB-SG 3.39Å; C247-C285 PolarHBondContact N-SG 2.78Å; C247-C285 WeakPolarHBondContact SG-CB 3.09Å; C247-C285 CovalentContact SG-SG 2.03Å; C247-C285 PolarHBondContact SG-SG 3.01Å; C285-D314 CarbonylContact C-O 3.58Å; C285-D314 VanDerWaalsContact CA-O 3.26Å; C285-D314 WeakPolarHBondContact CA-O 3.39Å; C285-D314 WeakPolarHBondContact CB-O 3.23Å; C285-A364 HydrophobicContact CB-CB 3.74Å
286	E	96.6	Very high	95.5	Very high	132 Å²	132	79 Å²	79	62%	0.617	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.6	177.2	-61.1	-170.6	165.2	0	0	110.2	D314 N362	E286-D314 HydrophobicContact CB-CB 4.01Å; E286-D314 HydrophobicContact CG-CB 4.18Å; E286-D314 PolarHBondContact N-O 2.87Å; E286-D314 PolarHBondContact O-N 3.27Å; E286-D314 VanDerWaalsContact O-N 3.13Å; E286-N362 PolarHBondContact O-ND2 3.09Å
287	P	97	Very high	95.5	Very high	84 Å²	84	79.8 Å²	79.8	55%	0.545	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	155.3	179.9	29.2	-35.7	0	0	0	111.6	A364	P287-A364 HydrophobicContact CB-CB 4.19Å
288	P	97.6	Very high	95.5	Very high	11 Å²	11	77.6 Å²	77.6	7%	0.071	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	141.7	-173	26.2	-33	0	0	0	112.4	I312 P317 A360 N362 G365 S367	P288-I312 CarbonylContact C-O 3.55Å; P288-I312 WeakPolarHBondContact CA-O 3.19Å; P288-P317 HydrophobicContact CB-CB 3.86Å; P288-P317 HydrophobicContact CB-CG 4.11Å; P288-A360 HydrophobicContact CB-CB 4.08Å; P288-A360 VanDerWaalsContact CG-O 3.27Å; P288-A360 WeakPolarHBondContact CG-O 3.32Å; P288-N362 WeakPolarHBondContact CD-OD1 3.46Å; P288-G365 WeakPolarHBondContact CD-O 3.46Å; P288-G365 WeakPolarHBondContact CG-O 3.42Å; P288-S367 WeakPolarHBondContact O-CB 3.31Å
289	L	96.9	Very high	95.5	Very high	103 Å²	103	78.2 Å²	78.2	54%	0.539	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	113.3	173.4	178.3	63.2	0	0	0	109.4	T291 A311 I312	L289-T291 PolarHBondContact O-N 3.29Å; L289-A311 CarbonylContact O-C 3.57Å; L289-A311 WeakPolarHBondContact O-CA 3.32Å; L289-A311 WeakPolarHBondContact O-CB 3.23Å; L289-I312 HydrophobicContact CB-CG1 4.13Å; L289-I312 PolarHBondContact N-O 2.83Å; L289-I312 PolarHBondContact O-N 3.42Å
290	I	96.4	Very high	95.3	Very high	25 Å²	25	73.9 Å²	73.9	13%	0.128	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	116.4	173.2	-62.6	171.9	0	0	0	108.8	H293 A311 A360 A369	I290-H293 HydrophobicContact CG2-CB 4.18Å; I290-A311 HydrophobicContact CG1-CB 4.09Å; I290-A360 HydrophobicContact CD1-CB 4.27Å; I290-A360 HydrophobicContact CG1-CB 3.91Å; I290-A369 HydrophobicContact CD1-CB 3.59Å; I290-A369 HydrophobicContact CG2-CB 4.17Å
291	T	95	Very high	95.1	Very high	66 Å²	66	72.9 Å²	72.9	41%	0.405	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-30.5	-174.9	58.8	0	0	0	0	113.4	L289 K310 I312	L289-T291 PolarHBondContact O-N 3.29Å; T291-K310 PolarHBondContact N-O 3.39Å; T291-K310 PolarHBondContact OG1-O 3.25Å; T291-I312 HydrophobicContact CG2-CB 4.41Å; T291-I312 HydrophobicContact CG2-CD1 3.84Å; T291-I312 HydrophobicContact CG2-CG1 3.77Å; T291-I312 HydrophobicContact CG2-CG2 3.94Å
292	Q	93.6	Very high	94.8	Very high	123 Å²	123	69 Å²	69	58%	0.575	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.3	132.3	179.6	-57.7	-179.5	-50.2	0	0	108.5	C309 K310	Q292-C309 CarbonylContact O-C 3.51Å; Q292-C309 WeakPolarHBondContact O-CA 3.45Å; Q292-K310 HydrophobicContact CB-CB 4.3Å; Q292-K310 PolarHBondContact N-O 2.88Å; Q292-K310 PolarHBondContact O-N 2.9Å
293	H	95.2	Very high	94.6	Very high	58 Å²	58	71.1 Å²	71.1	27%	0.269	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	154.8	169.5	59.4	-84.4	0	0	0	111	I290 H295 K308	I290-H293 HydrophobicContact CG2-CB 4.18Å; H293-H295 AromaticContact CD2-CE1 3.9Å; H293-H295 AromaticContact CD2-ND1 3.54Å; H293-H295 AromaticContact CE1-CE1 3.55Å; H293-H295 AromaticContact CE1-ND1 3.88Å; H293-H295 AromaticContact NE2-CE1 3.18Å; H293-H295 PolarHBondContact NE2-CE1 3.06Å; H293-H295 AromaticContact NE2-ND1 3.04Å; H293-H295 PolarHBondContact NE2-ND1 3.24Å; H293-H295 PolarHBondContact O-N 3.38Å; H293-K308 CarbonylContact C-O 3.58Å; H293-K308 WeakPolarHBondContact CA-O 3.32Å
294	T	93.9	Very high	94.5	Very high	29 Å²	29	74.4 Å²	74.4	18%	0.178	39%	0.394	C	S	.	.			trans	-67.5	118.1	169.5	-57.5	0	0	0	0	108.9	L297 K308 I371	T294-L297 HydrophobicContact CG2-CB 4.03Å; T294-K308 PolarHBondContact N-O 3.46Å; T294-K308 PolarHBondContact OG1-N 2.85Å; T294-K308 VanDerWaalsContact OG1-N 3.12Å; T294-I371 HydrophobicContact CG2-CG2 4.19Å; T294-I371 WeakPolarHBondContact O-CB 3.01Å; T294-I371 WeakPolarHBondContact O-CG1 3.34Å; T294-I371 WeakPolarHBondContact O-CG2 3.5Å
295	H	93.1	Very high	94.4	Very high	137 Å²	137	68.6 Å²	68.6	63%	0.634	36%	0.364	S	S	*	.			trans	-76.1	-45.5	178	-68.5	-59.6	0	0	0	113	H293 E372	H293-H295 AromaticContact CD2-CE1 3.9Å; H293-H295 AromaticContact CD2-ND1 3.54Å; H293-H295 AromaticContact CE1-CE1 3.55Å; H293-H295 AromaticContact CE1-ND1 3.88Å; H293-H295 AromaticContact NE2-CE1 3.18Å; H293-H295 PolarHBondContact NE2-CE1 3.06Å; H293-H295 AromaticContact NE2-ND1 3.04Å; H293-H295 PolarHBondContact NE2-ND1 3.24Å; H293-H295 PolarHBondContact O-N 3.38Å; H295-E372 PolarHBondContact O-N 3.42Å; H295-E372 VanDerWaalsContact O-N 3.09Å
296	K	94.6	Very high	94.4	Very high	121 Å²	121	69.9 Å²	69.9	53%	0.526	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	138.8	-179.3	-175.1	175.5	-172.6	69.5	0	109.2	E372 S374	K296-E372 CarbonylContact C-O 3.36Å; K296-E372 WeakPolarHBondContact CA-O 3.5Å; K296-E372 HydrophobicContact CB-CB 4.32Å; K296-E372 HydrophobicContact CG-CB 4.01Å; K296-E372 IonicContact NZ-OE2 3.64Å; K296-E372 PolarHBondContact NZ-OE2 3.03Å; K296-S374 PolarHBondContact NZ-OG 3.2Å
297	L	93.9	Very high	94.3	Very high	41 Å²	41	63.6 Å²	63.6	22%	0.215	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	141.7	177.9	-177	58.9	0	0	0	110.3	T294 V299 A305 L307 E372 L373 S374	T294-L297 HydrophobicContact CG2-CB 4.03Å; L297-V299 HydrophobicContact CD1-CG2 4.05Å; L297-V299 HydrophobicContact CD2-CG2 3.98Å; L297-V299 HydrophobicContact CG-CG2 3.79Å; L297-A305 HydrophobicContact CD2-CB 3.91Å; L297-L307 HydrophobicContact CB-CD2 4.33Å; L297-L307 HydrophobicContact CD2-CD2 3.62Å; L297-E372 PolarHBondContact N-O 3.42Å; L297-L373 HydrophobicContact CB-CD1 3.97Å; L297-L373 HydrophobicContact CD2-CD1 4.01Å; L297-L373 HydrophobicContact CG-CD1 3.97Å; L297-S374 PolarHBondContact O-N 3.29Å
298	L	94.1	Very high	94.3	Very high	119 Å²	119	65.6 Å²	65.6	62%	0.623	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	115.6	178.2	-172.1	72.4	0	0	0	108.7	S374 V376	L298-S374 WeakPolarHBondContact CA-O 3.35Å; L298-V376 HydrophobicContact CD1-CG2 3.53Å; L298-V376 HydrophobicContact CD2-CG2 4.25Å; L298-V376 HydrophobicContact CG-CG2 3.85Å
299	V	93.7	Very high	94.2	Very high	14 Å²	14	65.1 Å²	65.1	9%	0.085	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	148.3	-173.6	168.6	0	0	0	0	110.2	L297 Q303 A305 T348 S374 I375 V376	L297-V299 HydrophobicContact CD1-CG2 4.05Å; L297-V299 HydrophobicContact CD2-CG2 3.98Å; L297-V299 HydrophobicContact CG-CG2 3.79Å; V299-Q303 HydrophobicContact CG1-CB 3.73Å; V299-A305 HydrophobicContact CB-CB 4.39Å; V299-A305 HydrophobicContact CG1-CB 4.33Å; V299-A305 HydrophobicContact CG2-CB 3.97Å; V299-T348 HydrophobicContact CG1-CG2 3.96Å; V299-S374 PolarHBondContact N-O 3.47Å; V299-S374 VanDerWaalsContact N-O 3.07Å; V299-I375 CarbonylContact O-C 3.53Å; V299-I375 WeakPolarHBondContact O-CA 3.39Å; V299-V376 PolarHBondContact O-N 2.89Å
300	L	91.6	Very high	94.1	Very high	65 Å²	65	65.5 Å²	65.5	34%	0.34	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	140.1	175.6	-65	158.1	0	0	0	110.3	G302 Q303 T348 V376 L378	L300-G302 PolarHBondContact O-N 2.84Å; L300-Q303 HydrophobicContact CB-CG 4.18Å; L300-Q303 WeakPolarHBondContact O-CB 3.32Å; L300-Q303 PolarHBondContact O-N 3.38Å; L300-T348 PolarHBondContact O-OG1 2.91Å; L300-V376 WeakPolarHBondContact CA-O 3.35Å; L300-V376 HydrophobicContact CD2-CB 3.84Å; L300-V376 HydrophobicContact CD2-CG1 3.75Å; L300-L378 HydrophobicContact CB-CD1 4Å; L300-L378 HydrophobicContact CD1-CD1 4.49Å; L300-L378 HydrophobicContact CD2-CD1 3.75Å; L300-L378 HydrophobicContact CD2-CG 4.41Å; L300-L378 HydrophobicContact CG-CD1 4.3Å
301	E	92.2	Very high	94.1	Very high	64 Å²	64	65 Å²	65	30%	0.299	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	127.7	179.2	-171.9	166.5	-146.1	0	0	111.1	S350 I375 V376 Q377	E301-S350 VanDerWaalsContact OE1-CB 3.25Å; E301-S350 WeakPolarHBondContact OE1-CB 3.44Å; E301-S350 PolarHBondContact OE1-N 3.32Å; E301-S350 PolarHBondContact OE1-OG 2.95Å; E301-I375 HydrophobicContact CB-CG2 3.92Å; E301-I375 HydrophobicContact CG-CG2 4.49Å; E301-V376 PolarHBondContact N-O 3.23Å; E301-Q377 WeakPolarHBondContact OE2-CG 3.48Å; E301-Q377 PolarHBondContact OE2-NE2 3.32Å
302	G	88.9	Confident	94.2	Very high	47 Å²	47	66.3 Å²	66.3	49%	0.485	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.3	-7	-174.2	0	0	0	0	0	115.8	L300 T348	L300-G302 PolarHBondContact O-N 2.84Å; G302-T348 PolarHBondContact N-O 3.06Å; G302-T348 PolarHBondContact N-OG1 3.3Å
303	Q	91.9	Very high	94.3	Very high	102 Å²	102	61.4 Å²	61.4	48%	0.477	32%	0.322	S	S	.	.	S	Bend	trans	-89.8	163.3	171.2	-67.8	-175.4	-35.1	0	0	112.4	V299 L300 T348	V299-Q303 HydrophobicContact CG1-CB 3.73Å; L300-Q303 HydrophobicContact CB-CG 4.18Å; L300-Q303 WeakPolarHBondContact O-CB 3.32Å; L300-Q303 PolarHBondContact O-N 3.38Å; Q303-T348 PolarHBondContact N-OG1 2.96Å; Q303-T348 WeakPolarHBondContact O-CB 3.29Å; Q303-T348 WeakPolarHBondContact O-CG2 3.49Å; Q303-T348 PolarHBondContact O-N 2.96Å; Q303-T348 PolarHBondContact O-OG1 3.46Å
304	T	94.4	Very high	94.3	Very high	73 Å²	73	59.8 Å²	59.8	45%	0.448	32%	0.315	S	S	.	.			trans	-69	140	170.9	-50.8	0	0	0	0	111.2	D344 I345 L346	T304-D344 HydrophobicContact CG2-CB 4.4Å; T304-I345 CarbonylContact C-O 3.53Å; T304-I345 VanDerWaalsContact CA-O 3.26Å; T304-I345 WeakPolarHBondContact CA-O 3.46Å; T304-L346 PolarHBondContact OG1-O 3.09Å
305	A	95	Very high	94.5	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.3	169.8	0	0	0	0	0	111.6	L297 V299 D344 I345 T348 L373	L297-A305 HydrophobicContact CD2-CB 3.91Å; V299-A305 HydrophobicContact CB-CB 4.39Å; V299-A305 HydrophobicContact CG1-CB 4.33Å; V299-A305 HydrophobicContact CG2-CB 3.97Å; A305-D344 WeakPolarHBondContact O-CA 3.34Å; A305-I345 HydrophobicContact CB-CB 4.39Å; A305-I345 PolarHBondContact N-O 3.23Å; A305-I345 PolarHBondContact O-N 3.44Å; A305-T348 HydrophobicContact CB-CG2 3.46Å; A305-T348 VanDerWaalsContact CB-CG2 3.46Å; A305-L373 HydrophobicContact CB-CD1 4.12Å; A305-L373 HydrophobicContact CB-CD2 4.31Å
306	T	96.1	Very high	94.5	Very high	53 Å²	53	59.5 Å²	59.5	33%	0.325	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	108.2	-178.5	-57.7	0	0	0	0	111.2	K308 T342 D344	T306-K308 HydrophobicContact CG2-CG 4.09Å; T306-T342 HydrophobicContact CG2-CG2 3.63Å; T306-D344 WeakPolarHBondContact CA-OD1 3.28Å; T306-D344 WeakPolarHBondContact CB-OD1 3.43Å; T306-D344 VanDerWaalsContact CG2-OD1 3.24Å; T306-D344 WeakPolarHBondContact CG2-OD1 3.27Å; T306-D344 PolarHBondContact OG1-OD1 3.14Å
307	L	95.9	Very high	94.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	110	176.6	-50.7	-176.2	0	0	0	109	L297 W321 T342 L343 I345 F356 I371	L297-L307 HydrophobicContact CB-CD2 4.33Å; L297-L307 HydrophobicContact CD2-CD2 3.62Å; L307-W321 HydrophobicContact CB-CH2 3.41Å; L307-W321 VanDerWaalsContact CB-CH2 3.41Å; L307-W321 HydrophobicContact CB-CZ2 4.12Å; L307-W321 HydrophobicContact CB-CZ3 3.65Å; L307-W321 HydrophobicContact CD1-CE3 4.42Å; L307-W321 HydrophobicContact CD1-CZ3 3.9Å; L307-W321 HydrophobicContact CG-CZ3 4.44Å; L307-W321 VanDerWaalsContact O-CZ2 3.26Å; L307-W321 WeakPolarHBondContact O-CZ2 3.48Å; L307-T342 WeakPolarHBondContact O-CA 3.42Å; L307-L343 HydrophobicContact CB-CB 4.44Å; L307-L343 HydrophobicContact CD1-CD2 4.24Å; L307-L343 PolarHBondContact N-O 3.32Å; L307-L343 PolarHBondContact O-N 2.91Å; L307-I345 HydrophobicContact CD1-CD1 4.46Å; L307-F356 HydrophobicContact CD1-CB 4Å; L307-F356 HydrophobicContact CD1-CD1 3.9Å; L307-F356 HydrophobicContact CD1-CD2 3.99Å; L307-F356 HydrophobicContact CD1-CE1 4.4Å; L307-F356 HydrophobicContact CD1-CG 3.68Å; L307-I371 HydrophobicContact CD2-CG2 3.97Å
308	K	95.6	Very high	94.7	Very high	126 Å²	126	56.6 Å²	56.6	55%	0.548	31%	0.31	S	S	.	.			trans	-92.4	136.3	179.7	-63.8	179.2	-178.3	174.6	0	109.2	H293 T294 T306 T342	H293-K308 CarbonylContact C-O 3.58Å; H293-K308 WeakPolarHBondContact CA-O 3.32Å; T294-K308 PolarHBondContact N-O 3.46Å; T294-K308 PolarHBondContact OG1-N 2.85Å; T294-K308 VanDerWaalsContact OG1-N 3.12Å; T306-K308 HydrophobicContact CG2-CG 4.09Å; K308-T342 HydrophobicContact CG-CG2 4.04Å
309	C	96.1	Very high	94.7	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.014	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	132.5	169.2	-170.8	0	0	0	0	109.5	Q292 I319 W321 G341 C358	Q292-C309 CarbonylContact O-C 3.51Å; Q292-C309 WeakPolarHBondContact O-CA 3.45Å; C309-I319 HydrophobicContact CB-CG2 4.37Å; C309-W321 HydrophobicContact CB-CH2 3.86Å; C309-W321 HydrophobicContact CB-CZ2 3.43Å; C309-W321 VanDerWaalsContact CB-CZ2 3.43Å; C309-G341 CarbonylContact O-C 3.54Å; C309-G341 WeakPolarHBondContact O-CA 3.27Å; C309-C358 HydrophobicContact CB-CB 3.67Å; C309-C358 WeakPolarHBondContact CB-SG 3.26Å; C309-C358 WeakPolarHBondContact SG-CB 3.38Å; C309-C358 CovalentContact SG-SG 2.03Å; C309-C358 PolarHBondContact SG-SG 2.89Å
310	K	95.8	Very high	94.8	Very high	110 Å²	110	55.7 Å²	55.7	48%	0.478	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	119.1	-176.3	-175	179.7	-176.8	174.5	0	111.1	T291 Q292	T291-K310 PolarHBondContact N-O 3.39Å; T291-K310 PolarHBondContact OG1-O 3.25Å; Q292-K310 HydrophobicContact CB-CB 4.3Å; Q292-K310 PolarHBondContact N-O 2.88Å; Q292-K310 PolarHBondContact O-N 2.9Å
311	A	96.1	Very high	95.1	Very high	16 Å²	16	52.6 Å²	52.6	13%	0.132	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	163.6	175.8	0	0	0	0	0	112.5	L289 I290 P317 I319 A360	L289-A311 CarbonylContact O-C 3.57Å; L289-A311 WeakPolarHBondContact O-CA 3.32Å; L289-A311 WeakPolarHBondContact O-CB 3.23Å; I290-A311 HydrophobicContact CG1-CB 4.09Å; A311-P317 HydrophobicContact CB-CG 3.59Å; A311-I319 HydrophobicContact CB-CD1 4.01Å; A311-A360 HydrophobicContact CB-CB 3.48Å; A311-A360 VanDerWaalsContact CB-CB 3.48Å
312	I	95.9	Very high	95.3	Very high	93 Å²	93	50.4 Å²	50.4	48%	0.477	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	159	166.7	65.9	177.4	0	0	0	108.9	P288 L289 T291	P288-I312 CarbonylContact C-O 3.55Å; P288-I312 WeakPolarHBondContact CA-O 3.19Å; L289-I312 HydrophobicContact CB-CG1 4.13Å; L289-I312 PolarHBondContact N-O 2.83Å; L289-I312 PolarHBondContact O-N 3.42Å; T291-I312 HydrophobicContact CG2-CB 4.41Å; T291-I312 HydrophobicContact CG2-CD1 3.84Å; T291-I312 HydrophobicContact CG2-CG1 3.77Å; T291-I312 HydrophobicContact CG2-CG2 3.94Å
313	G	95.9	Very high	95.5	Very high	20 Å²	20	49 Å²	49	21%	0.206	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.9	173.7	178.2	0	0	0	0	0	110.4	P315	G313-P315 CarbonylContact C-O 3.55Å; G313-P315 CarbonylContact O-C 3.41Å
314	D	96.7	Very high	95.5	Very high	24 Å²	24	46.7 Å²	46.7	13%	0.128	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	105.7	173	-172.5	-24.9	0	0	0	107.4	H244 N246 C285 E286	H244-D314 IonicContact CE1-OD1 3.15Å; H244-D314 PolarHBondContact CE1-OD1 2.88Å; H244-D314 IonicContact CE1-OD2 3.51Å; H244-D314 PolarHBondContact CE1-OD2 3.34Å; H244-D314 VanDerWaalsContact CE1-OD2 3.32Å; H244-D314 IonicContact NE2-OD1 2.64Å; H244-D314 PolarHBondContact NE2-OD1 3.48Å; N246-D314 VanDerWaalsContact CB-OD1 3.22Å; N246-D314 WeakPolarHBondContact CB-OD1 3.5Å; N246-D314 PolarHBondContact ND2-OD1 2.8Å; C285-D314 CarbonylContact C-O 3.58Å; C285-D314 VanDerWaalsContact CA-O 3.26Å; C285-D314 WeakPolarHBondContact CA-O 3.39Å; C285-D314 WeakPolarHBondContact CB-O 3.23Å; E286-D314 HydrophobicContact CB-CB 4.01Å; E286-D314 HydrophobicContact CG-CB 4.18Å; E286-D314 PolarHBondContact N-O 2.87Å; E286-D314 PolarHBondContact O-N 3.27Å; E286-D314 VanDerWaalsContact O-N 3.13Å
315	P	96.4	Very high	95.4	Very high	12 Å²	12	47.2 Å²	47.2	8%	0.078	25%	0.254	C	S	.	.	S	Bend	cis	-68.4	166.6	3.6	-14	28.4	0	0	0	113.2	E248 G313 P317 N362 A363	E248-P315 HydrophobicContact CG-CG 3.61Å; E248-P315 WeakPolarHBondContact OE2-CG 3.47Å; G313-P315 CarbonylContact C-O 3.55Å; G313-P315 CarbonylContact O-C 3.41Å; P315-P317 WeakPolarHBondContact O-CD 3.5Å; P315-N362 PolarHBondContact O-ND2 3.46Å; P315-A363 HydrophobicContact CG-CB 4.04Å
316	I	94.1	Very high	95.2	Very high	148 Å²	148	54.3 Å²	54.3	76%	0.759	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-55.6	121.6	171.4	-59.5	175.2	0	0	0	108.8
317	P	96.3	Very high	95	Very high	13 Å²	13	59.8 Å²	59.8	8%	0.084	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-77	141.2	-173.3	29.3	-35.4	0	0	0	113.2	P288 A311 P315 A360 A361 N362	P288-P317 HydrophobicContact CB-CB 3.86Å; P288-P317 HydrophobicContact CB-CG 4.11Å; A311-P317 HydrophobicContact CB-CG 3.59Å; P315-P317 WeakPolarHBondContact O-CD 3.5Å; P317-A360 HydrophobicContact CB-CB 4.33Å; P317-A361 CarbonylContact C-O 3.58Å; P317-A361 VanDerWaalsContact CA-O 3.23Å; P317-A361 WeakPolarHBondContact CA-O 3.42Å; P317-A361 WeakPolarHBondContact CB-O 3.33Å; P317-N362 HydrophobicContact CB-CB 4.13Å
318	V	95.1	Very high	94.9	Very high	87 Å²	87	66 Å²	66	53%	0.527	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	139.8	171	-176.6	0	0	0	0	108.8	A360 A361	V318-A360 WeakPolarHBondContact O-CA 3.39Å; V318-A361 PolarHBondContact N-O 3.08Å; V318-A361 PolarHBondContact O-N 3.13Å
319	I	95.9	Very high	94.8	Very high	25 Å²	25	61.5 Å²	61.5	13%	0.128	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	123.7	178.3	-56	-56.9	0	0	0	109.9	C309 A311 A360	C309-I319 HydrophobicContact CB-CG2 4.37Å; A311-I319 HydrophobicContact CB-CD1 4.01Å; I319-A360 HydrophobicContact CD1-CB 3.54Å
320	H	95.6	Very high	94.5	Very high	89 Å²	89	63.4 Å²	63.4	41%	0.412	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	149.8	170.2	-58.8	-59.8	0	0	0	110.2	L328 I359	H320-L328 HydrophobicContact CB-CD2 4.23Å; H320-I359 HydrophobicContact CB-CB 4.49Å; H320-I359 PolarHBondContact N-O 2.94Å; H320-I359 PolarHBondContact O-N 3.34Å
321	W	96.4	Very high	94.3	Very high	1 Å²	1	64 Å²	64	0%	0.004	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	135.4	-178.5	-76.2	91.9	0	0	0	110.5	L307 C309 L328 I329 G341 L343 F356 C358 I371	L307-W321 HydrophobicContact CB-CH2 3.41Å; L307-W321 VanDerWaalsContact CB-CH2 3.41Å; L307-W321 HydrophobicContact CB-CZ2 4.12Å; L307-W321 HydrophobicContact CB-CZ3 3.65Å; L307-W321 HydrophobicContact CD1-CE3 4.42Å; L307-W321 HydrophobicContact CD1-CZ3 3.9Å; L307-W321 HydrophobicContact CG-CZ3 4.44Å; L307-W321 VanDerWaalsContact O-CZ2 3.26Å; L307-W321 WeakPolarHBondContact O-CZ2 3.48Å; C309-W321 HydrophobicContact CB-CH2 3.86Å; C309-W321 HydrophobicContact CB-CZ2 3.43Å; C309-W321 VanDerWaalsContact CB-CZ2 3.43Å; W321-L328 CarbonylContact O-C 3.12Å; W321-L328 WeakPolarHBondContact O-CA 3.32Å; W321-I329 HydrophobicContact CB-CB 4.06Å; W321-I329 HydrophobicContact CB-CD1 4.26Å; W321-I329 HydrophobicContact CB-CG1 4.48Å; W321-I329 PolarHBondContact O-N 2.88Å; W321-G341 WeakPolarHBondContact CZ2-O 3.4Å; W321-G341 PolarHBondContact NE1-O 3.46Å; W321-L343 HydrophobicContact CB-CD2 3.86Å; W321-L343 HydrophobicContact CD2-CB 3.72Å; W321-L343 HydrophobicContact CD2-CD2 3.75Å; W321-L343 HydrophobicContact CD2-CG 4.4Å; W321-L343 HydrophobicContact CE3-CB 4.32Å; W321-L343 HydrophobicContact CE3-CD2 3.82Å; W321-L343 HydrophobicContact CG-CB 3.88Å; W321-L343 HydrophobicContact CG-CD2 3.78Å; W321-L343 HydrophobicContact CG-CG 4.45Å; W321-L343 HydrophobicContact CZ2-CB 4.13Å; W321-F356 HydrophobicContact CE3-CB 4.41Å; W321-F356 HydrophobicContact CZ3-CB 4.36Å; W321-C358 HydrophobicContact CE3-CB 4.41Å; W321-C358 HydrophobicContact CH2-CB 4.19Å; W321-C358 HydrophobicContact CZ2-CB 4.38Å; W321-C358 HydrophobicContact CZ3-CB 4.23Å; W321-I371 HydrophobicContact CH2-CD1 4.07Å; W321-I371 HydrophobicContact CZ3-CD1 3.76Å; W321-I371 HydrophobicContact CZ3-CG1 4.39Å
322	V	96.4	Very high	94.1	Very high	18 Å²	18	67 Å²	67	11%	0.109	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.4	176.3	-176.9	0	0	0	0	109.3	R327 L328 F356 T357 I359	V322-R327 CarbonylContact C-O 3.58Å; V322-R327 WeakPolarHBondContact CA-O 3.2Å; V322-L328 HydrophobicContact CG2-CD2 3.96Å; V322-F356 WeakPolarHBondContact O-CA 3.28Å; V322-T357 PolarHBondContact N-O 2.78Å; V322-T357 PolarHBondContact O-N 2.87Å; V322-I359 HydrophobicContact CG2-CD1 3.7Å; V322-I359 HydrophobicContact CG2-CG1 4.3Å
323	A	93.9	Very high	93.8	Very high	16 Å²	16	68.3 Å²	68.3	13%	0.132	39%	0.387	C	S	.	.			trans	-76.1	164.6	177.9	0	0	0	0	0	112.3	D325 D326 R327 I329 F356	A323-D325 WeakPolarHBondContact CB-OD1 3.26Å; A323-D325 PolarHBondContact O-N 3.47Å; A323-D326 PolarHBondContact O-N 2.81Å; A323-R327 PolarHBondContact N-O 3.48Å; A323-I329 HydrophobicContact CB-CD1 3.88Å; A323-I329 HydrophobicContact CB-CG1 3.94Å; A323-F356 HydrophobicContact CB-CE1 4.47Å
324	P	92.8	Very high	93.6	Very high	54 Å²	54	71.2 Å²	71.2	35%	0.351	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-5	175.4	-22.7	33.3	0	0	0	116	F356	P324-F356 HydrophobicContact CG-CD2 3.98Å; P324-F356 HydrophobicContact CG-CE2 3.74Å; P324-F356 HydrophobicContact CG-CZ 4.13Å
325	D	90.9	Very high	93.4	Very high	84 Å²	84	70.8 Å²	70.8	45%	0.449	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	26.1	173.3	73.9	-21.2	0	0	0	113.4	A323 R327	A323-D325 WeakPolarHBondContact CB-OD1 3.26Å; A323-D325 PolarHBondContact O-N 3.47Å; D325-R327 PolarHBondContact O-N 3.31Å; D325-R327 WeakPolarHBondContact OD1-CB 3.41Å; D325-R327 WeakPolarHBondContact OD1-CG 3.33Å; D325-R327 WeakPolarHBondContact OD2-CD 3.26Å; D325-R327 IonicContact OD2-CZ 3.15Å; D325-R327 IonicContact OD2-NE 2.69Å; D325-R327 IonicContact OD2-NH1 3Å; D325-R327 PolarHBondContact OD2-NH1 2.81Å; D325-R327 IonicContact OD2-NH2 2.67Å
326	D	91.1	Very high	93.3	Very high	150 Å²	150	71.2 Å²	71.2	80%	0.802	40%	0.395	S	S	*	.	S	Bend	trans	59.5	19.8	179.4	-64	-43.6	0	0	0	115	A323	A323-D326 PolarHBondContact O-N 2.81Å
327	R	92.1	Very high	93.3	Very high	168 Å²	168	65.8 Å²	65.8	63%	0.634	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-95.4	136.5	178.1	-65.9	-176	178.1	134.3	8.6	112.8	V322 A323 D325	V322-R327 CarbonylContact C-O 3.58Å; V322-R327 WeakPolarHBondContact CA-O 3.2Å; A323-R327 PolarHBondContact N-O 3.48Å; D325-R327 PolarHBondContact O-N 3.31Å; D325-R327 WeakPolarHBondContact OD1-CB 3.41Å; D325-R327 WeakPolarHBondContact OD1-CG 3.33Å; D325-R327 WeakPolarHBondContact OD2-CD 3.26Å; D325-R327 IonicContact OD2-CZ 3.15Å; D325-R327 IonicContact OD2-NE 2.69Å; D325-R327 IonicContact OD2-NH1 3Å; D325-R327 PolarHBondContact OD2-NH1 2.81Å; D325-R327 IonicContact OD2-NH2 2.67Å
328	L	93.5	Very high	93.2	Very high	130 Å²	130	70 Å²	70	68%	0.681	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.9	133.1	167.1	-75.8	164.8	0	0	0	110.8	H320 W321 V322	H320-L328 HydrophobicContact CB-CD2 4.23Å; W321-L328 CarbonylContact O-C 3.12Å; W321-L328 WeakPolarHBondContact O-CA 3.32Å; V322-L328 HydrophobicContact CG2-CD2 3.96Å
329	I	93.6	Very high	92.9	Very high	32 Å²	32	74.6 Å²	74.6	16%	0.164	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	131.7	178	-54.6	175.6	0	0	0	108.5	W321 A323 T335 V337 L343 F356	W321-I329 HydrophobicContact CB-CB 4.06Å; W321-I329 HydrophobicContact CB-CD1 4.26Å; W321-I329 HydrophobicContact CB-CG1 4.48Å; W321-I329 PolarHBondContact O-N 2.88Å; A323-I329 HydrophobicContact CB-CD1 3.88Å; A323-I329 HydrophobicContact CB-CG1 3.94Å; I329-T335 HydrophobicContact CG2-CG2 4.07Å; I329-V337 HydrophobicContact CG2-CG2 4.46Å; I329-L343 HydrophobicContact CD1-CD2 3.6Å; I329-L343 HydrophobicContact CG2-CD1 3.91Å; I329-L343 HydrophobicContact CG2-CD2 4.19Å; I329-F356 HydrophobicContact CD1-CD1 3.65Å; I329-F356 HydrophobicContact CD1-CE1 3.56Å
330	G	90.5	Very high	92.6	Very high	41 Å²	41	78.4 Å²	78.4	42%	0.423	43%	0.425	S	S	.	.			trans	-130.5	-172.7	170.6	0	0	0	0	0	111.7	S332 T335	G330-S332 PolarHBondContact O-N 2.88Å; G330-T335 PolarHBondContact O-OG1 3.26Å
331	N	91.8	Very high	92.4	Very high	124 Å²	124	74.2 Å²	74.2	66%	0.663	41%	0.406	S	S	*	.	S	Bend	trans	-68.1	129	179	-69.2	-13	0	0	0	110.9	T335 V337	N331-T335 WeakPolarHBondContact CA-O 3.48Å; N331-V337 PolarHBondContact OD1-N 3.45Å; N331-V337 PolarHBondContact OD1-O 2.92Å
332	S	91	Very high	92.3	Very high	78 Å²	78	75 Å²	75	55%	0.545	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-155.5	173.1	-174.1	-170.2	0	0	0	0	110	G330 R334 T335	G330-S332 PolarHBondContact O-N 2.88Å; S332-R334 PolarHBondContact O-N 3.3Å; S332-T335 WeakPolarHBondContact CB-OG1 3.36Å; S332-T335 PolarHBondContact N-O 2.88Å; S332-T335 PolarHBondContact O-N 3.33Å; S332-T335 VanDerWaalsContact O-O 3.08Å
333	S	89.9	Confident	92.3	Very high	121 Å²	121	74.1 Å²	74.1	85%	0.846	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-5.8	178.9	57.8	0	0	0	0	115
334	R	91.6	Very high	92.4	Very high	80 Å²	80	74.5 Å²	74.5	30%	0.302	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.8	-11.4	-178.6	-159.5	-177.8	69.5	97.3	-2.9	114	S332 I345 L346 I347 D352	S332-R334 PolarHBondContact O-N 3.3Å; R334-I345 CarbonylContact O-C 3.59Å; R334-L346 PolarHBondContact O-N 2.85Å; R334-I347 HydrophobicContact CG-CB 4.36Å; R334-I347 PolarHBondContact NH1-O 3.47Å; R334-D352 IonicContact CZ-OD1 2.69Å; R334-D352 VanDerWaalsContact CZ-OD1 3.28Å; R334-D352 IonicContact CZ-OD2 3.99Å; R334-D352 IonicContact NH1-OD1 2.72Å; R334-D352 PolarHBondContact NH1-OD1 2.98Å; R334-D352 IonicContact NH1-OD2 3.01Å; R334-D352 PolarHBondContact NH1-OD2 3.4Å; R334-D352 IonicContact NH2-OD1 3.51Å; R334-D352 PolarHBondContact NH2-OD1 3.49Å; R334-D352 IonicContact NH2-OD2 2.87Å
335	T	92.9	Very high	92.5	Very high	16 Å²	16	72 Å²	72	10%	0.098	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	130.2	-174.8	48.8	0	0	0	0	110.8	I329 G330 N331 S332 L343 D344 I345	I329-T335 HydrophobicContact CG2-CG2 4.07Å; G330-T335 PolarHBondContact O-OG1 3.26Å; N331-T335 WeakPolarHBondContact CA-O 3.48Å; S332-T335 WeakPolarHBondContact CB-OG1 3.36Å; S332-T335 PolarHBondContact N-O 2.88Å; S332-T335 PolarHBondContact O-N 3.33Å; S332-T335 VanDerWaalsContact O-O 3.08Å; T335-L343 HydrophobicContact CG2-CD1 4.31Å; T335-D344 CarbonylContact C-O 3.6Å; T335-D344 VanDerWaalsContact CA-O 3.31Å; T335-D344 WeakPolarHBondContact CA-O 3.31Å; T335-I345 HydrophobicContact CG2-CG1 4.34Å
336	A	94.5	Very high	92.6	Very high	21 Å²	21	71.6 Å²	71.6	17%	0.174	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122.2	175.1	0	0	0	0	0	109.6	Y338 L343 D344	A336-Y338 HydrophobicContact CB-CE2 4.02Å; A336-L343 CarbonylContact O-C 3.49Å; A336-L343 WeakPolarHBondContact O-CA 3.24Å; A336-D344 PolarHBondContact N-O 2.89Å; A336-D344 PolarHBondContact O-N 3.26Å
337	V	94.5	Very high	92.7	Very high	33 Å²	33	69 Å²	69	20%	0.2	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	130	171.4	-177.5	0	0	0	0	107.7	I329 N331 T342 L343	I329-V337 HydrophobicContact CG2-CG2 4.46Å; N331-V337 PolarHBondContact OD1-N 3.45Å; N331-V337 PolarHBondContact OD1-O 2.92Å; V337-T342 WeakPolarHBondContact CA-O 3.38Å; V337-L343 HydrophobicContact CG2-CD1 3.96Å
338	Y	93.4	Very high	92.7	Very high	101 Å²	101	61.1 Å²	61.1	40%	0.396	34%	0.342	S	S	.	.			trans	-108.8	152.2	-176.7	-59.6	-88	0	0	0	111.4	A336 N340 G341 T342 D344	A336-Y338 HydrophobicContact CB-CE2 4.02Å; Y338-N340 PolarHBondContact O-N 3.49Å; Y338-G341 PolarHBondContact O-N 3.38Å; Y338-T342 HydrophobicContact CD2-CG2 4.45Å; Y338-T342 PolarHBondContact N-O 3.29Å; Y338-D344 HydrophobicContact CE2-CB 4.1Å; Y338-D344 WeakPolarHBondContact CE2-OD2 3.31Å; Y338-D344 PolarHBondContact OH-OD2 2.85Å
339	D	88.1	Confident	92.5	Very high	184 Å²	184	57 Å²	57	98%	0.984	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.8	178.7	-47.9	-48.3	0	0	0	113.6	G341	D339-G341 PolarHBondContact O-N 2.89Å
340	N	90	Very high	92.3	Very high	105 Å²	105	58.6 Å²	58.6	56%	0.561	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-0.4	174.1	71.6	23.9	0	0	0	114	Y338 T342	Y338-N340 PolarHBondContact O-N 3.49Å; N340-T342 WeakPolarHBondContact OD1-CB 3.32Å; N340-T342 PolarHBondContact OD1-N 3.44Å; N340-T342 PolarHBondContact OD1-OG1 3.37Å
341	G	91.5	Very high	92.1	Very high	1 Å²	1	65.6 Å²	65.6	1%	0.01	36%	0.355	C	S	.	.	S	Bend	trans	89.8	-0.4	179.6	0	0	0	0	0	115.9	C309 W321 Y338 D339	C309-G341 CarbonylContact O-C 3.54Å; C309-G341 WeakPolarHBondContact O-CA 3.27Å; W321-G341 WeakPolarHBondContact CZ2-O 3.4Å; W321-G341 PolarHBondContact NE1-O 3.46Å; Y338-G341 PolarHBondContact O-N 3.38Å; D339-G341 PolarHBondContact O-N 2.89Å
342	T	94.9	Very high	92	Very high	17 Å²	17	60.3 Å²	60.3	10%	0.104	33%	0.327	C	S	.	.			trans	-78.2	144.7	178.4	-52.5	0	0	0	0	111.6	T306 L307 K308 V337 Y338 N340	T306-T342 HydrophobicContact CG2-CG2 3.63Å; L307-T342 WeakPolarHBondContact O-CA 3.42Å; K308-T342 HydrophobicContact CG-CG2 4.04Å; V337-T342 WeakPolarHBondContact CA-O 3.38Å; Y338-T342 HydrophobicContact CD2-CG2 4.45Å; Y338-T342 PolarHBondContact N-O 3.29Å; N340-T342 WeakPolarHBondContact OD1-CB 3.32Å; N340-T342 PolarHBondContact OD1-N 3.44Å; N340-T342 PolarHBondContact OD1-OG1 3.37Å
343	L	96.2	Very high	92.1	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119.7	167.2	162.2	61.3	0	0	0	109.5	L307 W321 I329 T335 A336 V337 I345 F356	L307-L343 HydrophobicContact CB-CB 4.44Å; L307-L343 HydrophobicContact CD1-CD2 4.24Å; L307-L343 PolarHBondContact N-O 3.32Å; L307-L343 PolarHBondContact O-N 2.91Å; W321-L343 HydrophobicContact CB-CD2 3.86Å; W321-L343 HydrophobicContact CD2-CB 3.72Å; W321-L343 HydrophobicContact CD2-CD2 3.75Å; W321-L343 HydrophobicContact CD2-CG 4.4Å; W321-L343 HydrophobicContact CE3-CB 4.32Å; W321-L343 HydrophobicContact CE3-CD2 3.82Å; W321-L343 HydrophobicContact CG-CB 3.88Å; W321-L343 HydrophobicContact CG-CD2 3.78Å; W321-L343 HydrophobicContact CG-CG 4.45Å; W321-L343 HydrophobicContact CZ2-CB 4.13Å; I329-L343 HydrophobicContact CD1-CD2 3.6Å; I329-L343 HydrophobicContact CG2-CD1 3.91Å; I329-L343 HydrophobicContact CG2-CD2 4.19Å; T335-L343 HydrophobicContact CG2-CD1 4.31Å; A336-L343 CarbonylContact O-C 3.49Å; A336-L343 WeakPolarHBondContact O-CA 3.24Å; V337-L343 HydrophobicContact CG2-CD1 3.96Å; L343-I345 HydrophobicContact CD1-CG1 4.45Å; L343-I345 HydrophobicContact CG-CG1 4.36Å; L343-F356 HydrophobicContact CD2-CD1 4.35Å
344	D	95.6	Very high	92.3	Very high	25 Å²	25	59 Å²	59	13%	0.134	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.1	166.4	-79.2	-27.8	0	0	0	111	T304 A305 T306 T335 A336 Y338 L346	T304-D344 HydrophobicContact CG2-CB 4.4Å; A305-D344 WeakPolarHBondContact O-CA 3.34Å; T306-D344 WeakPolarHBondContact CA-OD1 3.28Å; T306-D344 WeakPolarHBondContact CB-OD1 3.43Å; T306-D344 VanDerWaalsContact CG2-OD1 3.24Å; T306-D344 WeakPolarHBondContact CG2-OD1 3.27Å; T306-D344 PolarHBondContact OG1-OD1 3.14Å; T335-D344 CarbonylContact C-O 3.6Å; T335-D344 VanDerWaalsContact CA-O 3.31Å; T335-D344 WeakPolarHBondContact CA-O 3.31Å; A336-D344 PolarHBondContact N-O 2.89Å; A336-D344 PolarHBondContact O-N 3.26Å; Y338-D344 HydrophobicContact CE2-CB 4.1Å; Y338-D344 WeakPolarHBondContact CE2-OD2 3.31Å; Y338-D344 PolarHBondContact OH-OD2 2.85Å; D344-L346 HydrophobicContact CB-CD2 4.41Å
345	I	95.3	Very high	92.5	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	99.3	167.2	-52.5	175.9	0	0	0	106.7	T304 A305 L307 R334 T335 L343 I347 T348 F356 L373	T304-I345 CarbonylContact C-O 3.53Å; T304-I345 VanDerWaalsContact CA-O 3.26Å; T304-I345 WeakPolarHBondContact CA-O 3.46Å; A305-I345 HydrophobicContact CB-CB 4.39Å; A305-I345 PolarHBondContact N-O 3.23Å; A305-I345 PolarHBondContact O-N 3.44Å; L307-I345 HydrophobicContact CD1-CD1 4.46Å; R334-I345 CarbonylContact O-C 3.59Å; T335-I345 HydrophobicContact CG2-CG1 4.34Å; L343-I345 HydrophobicContact CD1-CG1 4.45Å; L343-I345 HydrophobicContact CG-CG1 4.36Å; I345-I347 VanDerWaalsContact C-N 3.28Å; I345-I347 PolarHBondContact O-N 2.91Å; I345-T348 HydrophobicContact CB-CG2 4.49Å; I345-T348 HydrophobicContact CG2-CG2 4.28Å; I345-F356 HydrophobicContact CD1-CE1 3.78Å; I345-F356 HydrophobicContact CD1-CE2 4.36Å; I345-F356 HydrophobicContact CD1-CZ 3.56Å; I345-L373 HydrophobicContact CD1-CD2 3.91Å
346	L	93.4	Very high	92.7	Very high	75 Å²	75	57.8 Å²	57.8	39%	0.393	30%	0.3	S	S	.	.	S	Bend	trans	-61.8	-33.2	-169.3	-59.8	177.9	0	0	0	113.6	T304 R334 D344	T304-L346 PolarHBondContact OG1-O 3.09Å; R334-L346 PolarHBondContact O-N 2.85Å; D344-L346 HydrophobicContact CB-CD2 4.41Å
347	I	91.5	Very high	92.8	Very high	97 Å²	97	58.6 Å²	58.6	50%	0.497	30%	0.302	S	S	.	.	S	Bend	trans	-136.4	104.4	175.1	-53.6	178.7	0	0	0	107.2	R334 I345	R334-I347 HydrophobicContact CG-CB 4.36Å; R334-I347 PolarHBondContact NH1-O 3.47Å; I345-I347 VanDerWaalsContact C-N 3.28Å; I345-I347 PolarHBondContact O-N 2.91Å
348	T	92.1	Very high	92.9	Very high	1 Å²	1	57 Å²	57	1%	0.006	29%	0.293	C	S	.	.			trans	-70.4	143.8	171.8	51.5	0	0	0	0	111.6	V299 L300 G302 Q303 A305 I345	V299-T348 HydrophobicContact CG1-CG2 3.96Å; L300-T348 PolarHBondContact O-OG1 2.91Å; G302-T348 PolarHBondContact N-O 3.06Å; G302-T348 PolarHBondContact N-OG1 3.3Å; Q303-T348 PolarHBondContact N-OG1 2.96Å; Q303-T348 WeakPolarHBondContact O-CB 3.29Å; Q303-T348 WeakPolarHBondContact O-CG2 3.49Å; Q303-T348 PolarHBondContact O-N 2.96Å; Q303-T348 PolarHBondContact O-OG1 3.46Å; A305-T348 HydrophobicContact CB-CG2 3.46Å; A305-T348 VanDerWaalsContact CB-CG2 3.46Å; I345-T348 HydrophobicContact CB-CG2 4.49Å; I345-T348 HydrophobicContact CG2-CG2 4.28Å
349	T	90.9	Very high	93.1	Very high	45 Å²	45	54.1 Å²	54.1	28%	0.276	28%	0.284	S	S	.	.			trans	-131.9	157	175.1	69.9	0	0	0	0	109	K351 D352 I375	T349-K351 PolarHBondContact O-N 2.87Å; T349-K351 PolarHBondContact OG1-N 2.86Å; T349-D352 WeakPolarHBondContact CA-OD2 3.2Å; T349-D352 WeakPolarHBondContact CB-OD2 3.48Å; T349-D352 PolarHBondContact N-OD2 3Å; T349-D352 WeakPolarHBondContact O-CB 3.5Å; T349-D352 PolarHBondContact O-N 3.49Å; T349-D352 VanDerWaalsContact O-OD2 3.12Å; T349-D352 PolarHBondContact OG1-OD2 3.46Å; T349-I375 WeakPolarHBondContact O-CD1 3.27Å
350	S	88.4	Confident	93.5	Very high	64 Å²	64	45.3 Å²	45.3	45%	0.448	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-11.4	173.9	36.1	0	0	0	0	115.3	E301	E301-S350 VanDerWaalsContact OE1-CB 3.25Å; E301-S350 WeakPolarHBondContact OE1-CB 3.44Å; E301-S350 PolarHBondContact OE1-N 3.32Å; E301-S350 PolarHBondContact OE1-OG 2.95Å
351	K	87.5	Confident	93.8	Very high	188 Å²	188	41.7 Å²	41.7	82%	0.817	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-19.8	170.8	-64.1	-177.3	179.3	179.1	0	114.4	T349 Y353	T349-K351 PolarHBondContact O-N 2.87Å; T349-K351 PolarHBondContact OG1-N 2.86Å; K351-Y353 PolarHBondContact O-N 3.13Å
352	D	89.3	Confident	94.1	Very high	13 Å²	13	43 Å²	43	7%	0.07	23%	0.228	C	C	.	.	S	Bend	trans	-84.3	3	178.5	-52.3	-74.4	0	0	0	112.2	R334 T349 G354 F356 L373 I375	R334-D352 IonicContact CZ-OD1 2.69Å; R334-D352 VanDerWaalsContact CZ-OD1 3.28Å; R334-D352 IonicContact CZ-OD2 3.99Å; R334-D352 IonicContact NH1-OD1 2.72Å; R334-D352 PolarHBondContact NH1-OD1 2.98Å; R334-D352 IonicContact NH1-OD2 3.01Å; R334-D352 PolarHBondContact NH1-OD2 3.4Å; R334-D352 IonicContact NH2-OD1 3.51Å; R334-D352 PolarHBondContact NH2-OD1 3.49Å; R334-D352 IonicContact NH2-OD2 2.87Å; T349-D352 WeakPolarHBondContact CA-OD2 3.2Å; T349-D352 WeakPolarHBondContact CB-OD2 3.48Å; T349-D352 PolarHBondContact N-OD2 3Å; T349-D352 WeakPolarHBondContact O-CB 3.5Å; T349-D352 PolarHBondContact O-N 3.49Å; T349-D352 VanDerWaalsContact O-OD2 3.12Å; T349-D352 PolarHBondContact OG1-OD2 3.46Å; D352-G354 PolarHBondContact O-N 3.3Å; D352-F356 HydrophobicContact CB-CZ 4.39Å; D352-F356 WeakPolarHBondContact O-CE2 3.49Å; D352-L373 HydrophobicContact CB-CD2 4.28Å; D352-I375 HydrophobicContact CB-CD1 3.72Å
353	Y	93.1	Very high	94.1	Very high	155 Å²	155	45.2 Å²	45.2	61%	0.608	25%	0.248	S	C	*	.			trans	-67.5	123.4	172.9	173.9	-91.3	0	0	0	110.4	K351	K351-Y353 PolarHBondContact O-N 3.13Å
354	G	93.9	Very high	94	Very high	18 Å²	18	47.3 Å²	47.3	19%	0.186	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.3	-161	176.2	0	0	0	0	0	113.6	D352 L373	D352-G354 PolarHBondContact O-N 3.3Å; G354-L373 PolarHBondContact N-O 3.31Å; G354-L373 VanDerWaalsContact N-O 3.14Å; G354-L373 PolarHBondContact O-N 2.88Å
355	T	96.4	Very high	94	Very high	67 Å²	67	47.7 Å²	47.7	41%	0.411	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.9	179.1	-53.7	0	0	0	0	110.1	T370 I371	T355-T370 HydrophobicContact CG2-CG2 4.03Å; T355-I371 CarbonylContact C-O 3.6Å; T355-I371 WeakPolarHBondContact CA-O 3.41Å
356	F	96.4	Very high	94.1	Very high	3 Å²	3	54.6 Å²	54.6	1%	0.013	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	148	167.7	-70.9	-104.9	0	0	0	109.1	L307 W321 V322 A323 P324 I329 L343 I345 D352 T370 I371 L373	L307-F356 HydrophobicContact CD1-CB 4Å; L307-F356 HydrophobicContact CD1-CD1 3.9Å; L307-F356 HydrophobicContact CD1-CD2 3.99Å; L307-F356 HydrophobicContact CD1-CE1 4.4Å; L307-F356 HydrophobicContact CD1-CG 3.68Å; W321-F356 HydrophobicContact CE3-CB 4.41Å; W321-F356 HydrophobicContact CZ3-CB 4.36Å; V322-F356 WeakPolarHBondContact O-CA 3.28Å; A323-F356 HydrophobicContact CB-CE1 4.47Å; P324-F356 HydrophobicContact CG-CD2 3.98Å; P324-F356 HydrophobicContact CG-CE2 3.74Å; P324-F356 HydrophobicContact CG-CZ 4.13Å; I329-F356 HydrophobicContact CD1-CD1 3.65Å; I329-F356 HydrophobicContact CD1-CE1 3.56Å; L343-F356 HydrophobicContact CD2-CD1 4.35Å; I345-F356 HydrophobicContact CD1-CE1 3.78Å; I345-F356 HydrophobicContact CD1-CE2 4.36Å; I345-F356 HydrophobicContact CD1-CZ 3.56Å; D352-F356 HydrophobicContact CB-CZ 4.39Å; D352-F356 WeakPolarHBondContact O-CE2 3.49Å; F356-T370 CarbonylContact O-C 3.3Å; F356-T370 WeakPolarHBondContact O-CA 3.39Å; F356-I371 HydrophobicContact CB-CB 4.45Å; F356-I371 PolarHBondContact N-O 3.01Å; F356-I371 PolarHBondContact O-N 3.31Å; F356-L373 HydrophobicContact CD2-CB 3.89Å; F356-L373 HydrophobicContact CD2-CD2 4.42Å; F356-L373 HydrophobicContact CE2-CB 3.74Å; F356-L373 HydrophobicContact CE2-CD2 3.63Å; F356-L373 HydrophobicContact CE2-CG 4.31Å; F356-L373 HydrophobicContact CZ-CD2 4.12Å
357	T	96.7	Very high	94.3	Very high	38 Å²	38	52.5 Å²	52.5	23%	0.233	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121.6	173.3	-55.6	0	0	0	0	109.8	V322 I359 A369	V322-T357 PolarHBondContact N-O 2.78Å; V322-T357 PolarHBondContact O-N 2.87Å; T357-I359 HydrophobicContact CG2-CG1 4.11Å; T357-A369 WeakPolarHBondContact CA-O 3.16Å
358	C	96.6	Very high	94.6	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	131.4	163.5	171.5	0	0	0	0	108.7	C309 W321 T368 A369 I371	C309-C358 HydrophobicContact CB-CB 3.67Å; C309-C358 WeakPolarHBondContact CB-SG 3.26Å; C309-C358 WeakPolarHBondContact SG-CB 3.38Å; C309-C358 CovalentContact SG-SG 2.03Å; C309-C358 PolarHBondContact SG-SG 2.89Å; W321-C358 HydrophobicContact CE3-CB 4.41Å; W321-C358 HydrophobicContact CH2-CB 4.19Å; W321-C358 HydrophobicContact CZ2-CB 4.38Å; W321-C358 HydrophobicContact CZ3-CB 4.23Å; C358-T368 VanDerWaalsContact O-CA 3.3Å; C358-T368 WeakPolarHBondContact O-CA 3.3Å; C358-A369 PolarHBondContact N-O 3.11Å; C358-A369 PolarHBondContact O-N 2.81Å; C358-I371 HydrophobicContact CB-CD1 3.9Å
359	I	96.8	Very high	94.8	Very high	39 Å²	39	52.4 Å²	52.4	20%	0.2	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	115.1	173.9	-53.1	-176	0	0	0	107.4	H320 V322 T357 T368	H320-I359 HydrophobicContact CB-CB 4.49Å; H320-I359 PolarHBondContact N-O 2.94Å; H320-I359 PolarHBondContact O-N 3.34Å; V322-I359 HydrophobicContact CG2-CD1 3.7Å; V322-I359 HydrophobicContact CG2-CG1 4.3Å; T357-I359 HydrophobicContact CG2-CG1 4.11Å; I359-T368 HydrophobicContact CB-CG2 4.39Å; I359-T368 HydrophobicContact CG1-CG2 3.98Å; I359-T368 HydrophobicContact CG2-CG2 4.17Å
360	A	97.3	Very high	95	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.1	170.9	0	0	0	0	0	109.1	P288 I290 A311 P317 V318 I319 E366 S367	P288-A360 HydrophobicContact CB-CB 4.08Å; P288-A360 VanDerWaalsContact CG-O 3.27Å; P288-A360 WeakPolarHBondContact CG-O 3.32Å; I290-A360 HydrophobicContact CD1-CB 4.27Å; I290-A360 HydrophobicContact CG1-CB 3.91Å; A311-A360 HydrophobicContact CB-CB 3.48Å; A311-A360 VanDerWaalsContact CB-CB 3.48Å; P317-A360 HydrophobicContact CB-CB 4.33Å; V318-A360 WeakPolarHBondContact O-CA 3.39Å; I319-A360 HydrophobicContact CD1-CB 3.54Å; A360-E366 CarbonylContact O-C 3.53Å; A360-E366 VanDerWaalsContact O-CA 3.31Å; A360-E366 WeakPolarHBondContact O-CA 3.31Å; A360-S367 PolarHBondContact N-O 3Å; A360-S367 PolarHBondContact O-N 2.82Å
361	A	96.6	Very high	95.4	Very high	29 Å²	29	51.5 Å²	51.5	24%	0.24	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	141.1	-175.4	0	0	0	0	0	112.5	P317 V318	P317-A361 CarbonylContact C-O 3.58Å; P317-A361 VanDerWaalsContact CA-O 3.23Å; P317-A361 WeakPolarHBondContact CA-O 3.42Å; P317-A361 WeakPolarHBondContact CB-O 3.33Å; V318-A361 PolarHBondContact N-O 3.08Å; V318-A361 PolarHBondContact O-N 3.13Å
362	N	96.4	Very high	95.8	Very high	29 Å²	29	47.1 Å²	47.1	16%	0.155	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	-176.9	170.2	78.3	6.3	0	0	0	111.4	E286 P288 P315 P317 A364 G365	E286-N362 PolarHBondContact O-ND2 3.09Å; P288-N362 WeakPolarHBondContact CD-OD1 3.46Å; P315-N362 PolarHBondContact O-ND2 3.46Å; P317-N362 HydrophobicContact CB-CB 4.13Å; N362-A364 PolarHBondContact O-N 3.02Å; N362-A364 VanDerWaalsContact O-N 3.09Å; N362-A364 WeakPolarHBondContact OD1-CA 3.33Å; N362-A364 WeakPolarHBondContact OD1-CB 3.35Å; N362-A364 PolarHBondContact OD1-N 3.11Å; N362-G365 PolarHBondContact N-O 3.04Å; N362-G365 PolarHBondContact O-N 3.35Å; N362-G365 VanDerWaalsContact O-N 3.11Å; N362-G365 PolarHBondContact OD1-N 3.11Å
363	A	94.7	Very high	96.2	Very high	63 Å²	63	46.5 Å²	46.5	52%	0.521	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-17.1	-178.4	0	0	0	0	0	115.4	E248 P315	E248-A363 HydrophobicContact CG-CB 4.08Å; P315-A363 HydrophobicContact CG-CB 4.04Å
364	A	95.7	Very high	96.2	Very high	44 Å²	44	40 Å²	40	36%	0.364	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-14	176.5	0	0	0	0	0	114.3	C285 P287 N362	C285-A364 HydrophobicContact CB-CB 3.74Å; P287-A364 HydrophobicContact CB-CB 4.19Å; N362-A364 PolarHBondContact O-N 3.02Å; N362-A364 VanDerWaalsContact O-N 3.09Å; N362-A364 WeakPolarHBondContact OD1-CA 3.33Å; N362-A364 WeakPolarHBondContact OD1-CB 3.35Å; N362-A364 PolarHBondContact OD1-N 3.11Å
365	G	95.8	Very high	96.2	Very high	32 Å²	32	40.3 Å²	40.3	33%	0.33	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	153	-161.1	175.7	0	0	0	0	0	114.7	P288 N362	P288-G365 WeakPolarHBondContact CD-O 3.46Å; P288-G365 WeakPolarHBondContact CG-O 3.42Å; N362-G365 PolarHBondContact N-O 3.04Å; N362-G365 PolarHBondContact O-N 3.35Å; N362-G365 VanDerWaalsContact O-N 3.11Å; N362-G365 PolarHBondContact OD1-N 3.11Å
366	E	96.7	Very high	95.8	Very high	147 Å²	147	40 Å²	40	69%	0.687	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-127.7	155.6	-178.3	64.6	-178.8	-176	0	0	112.4	A360	A360-E366 CarbonylContact O-C 3.53Å; A360-E366 VanDerWaalsContact O-CA 3.31Å; A360-E366 WeakPolarHBondContact O-CA 3.31Å
367	S	97.3	Very high	95.2	Very high	30 Å²	30	45.5 Å²	45.5	21%	0.21	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	137.7	176.5	-174.3	0	0	0	0	109	P288 A360	P288-S367 WeakPolarHBondContact O-CB 3.31Å; A360-S367 PolarHBondContact N-O 3Å; A360-S367 PolarHBondContact O-N 2.82Å
368	T	97.2	Very high	93.8	Very high	87 Å²	87	48.9 Å²	48.9	53%	0.534	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	144.9	-172.6	61.1	0	0	0	0	112.3	C358 I359	C358-T368 VanDerWaalsContact O-CA 3.3Å; C358-T368 WeakPolarHBondContact O-CA 3.3Å; I359-T368 HydrophobicContact CB-CG2 4.39Å; I359-T368 HydrophobicContact CG1-CG2 3.98Å; I359-T368 HydrophobicContact CG2-CG2 4.17Å
369	A	96.4	Very high	92.1	Very high	10 Å²	10	54.7 Å²	54.7	8%	0.083	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	139.6	174.1	0	0	0	0	0	110.2	I290 T357 C358 I371	I290-A369 HydrophobicContact CD1-CB 3.59Å; I290-A369 HydrophobicContact CG2-CB 4.17Å; T357-A369 WeakPolarHBondContact CA-O 3.16Å; C358-A369 PolarHBondContact N-O 3.11Å; C358-A369 PolarHBondContact O-N 2.81Å; A369-I371 VanDerWaalsContact O-CD1 3.29Å; A369-I371 WeakPolarHBondContact O-CD1 3.11Å
370	T	96.7	Very high	89.8	Confident	90 Å²	90	61.5 Å²	61.5	55%	0.552	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	137.9	-178.1	51.6	0	0	0	0	111.6	T355 F356	T355-T370 HydrophobicContact CG2-CG2 4.03Å; F356-T370 CarbonylContact O-C 3.3Å; F356-T370 WeakPolarHBondContact O-CA 3.39Å
371	I	96.4	Very high	87.4	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	118.6	-173.4	-58.5	93.1	0	0	0	109.1	T294 L307 W321 T355 F356 C358 A369 L373	T294-I371 HydrophobicContact CG2-CG2 4.19Å; T294-I371 WeakPolarHBondContact O-CB 3.01Å; T294-I371 WeakPolarHBondContact O-CG1 3.34Å; T294-I371 WeakPolarHBondContact O-CG2 3.5Å; L307-I371 HydrophobicContact CD2-CG2 3.97Å; W321-I371 HydrophobicContact CH2-CD1 4.07Å; W321-I371 HydrophobicContact CZ3-CD1 3.76Å; W321-I371 HydrophobicContact CZ3-CG1 4.39Å; T355-I371 CarbonylContact C-O 3.6Å; T355-I371 WeakPolarHBondContact CA-O 3.41Å; F356-I371 HydrophobicContact CB-CB 4.45Å; F356-I371 PolarHBondContact N-O 3.01Å; F356-I371 PolarHBondContact O-N 3.31Å; C358-I371 HydrophobicContact CB-CD1 3.9Å; A369-I371 VanDerWaalsContact O-CD1 3.29Å; A369-I371 WeakPolarHBondContact O-CD1 3.11Å; I371-L373 PolarHBondContact O-N 2.82Å
372	E	96.4	Very high	84.6	Confident	95 Å²	95	73 Å²	73	44%	0.444	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	112.2	178	-70.2	-175.7	176.6	0	0	111.6	H295 K296 L297	H295-E372 PolarHBondContact O-N 3.42Å; H295-E372 VanDerWaalsContact O-N 3.09Å; K296-E372 CarbonylContact C-O 3.36Å; K296-E372 WeakPolarHBondContact CA-O 3.5Å; K296-E372 HydrophobicContact CB-CB 4.32Å; K296-E372 HydrophobicContact CG-CB 4.01Å; K296-E372 IonicContact NZ-OE2 3.64Å; K296-E372 PolarHBondContact NZ-OE2 3.03Å; L297-E372 PolarHBondContact N-O 3.42Å
373	L	95.7	Very high	82.3	Confident	1 Å²	1	79.7 Å²	79.7	1%	0.005	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	116.9	170.2	-175.3	57.6	0	0	0	110.6	L297 A305 I345 D352 G354 F356 I371 I375	L297-L373 HydrophobicContact CB-CD1 3.97Å; L297-L373 HydrophobicContact CD2-CD1 4.01Å; L297-L373 HydrophobicContact CG-CD1 3.97Å; A305-L373 HydrophobicContact CB-CD1 4.12Å; A305-L373 HydrophobicContact CB-CD2 4.31Å; I345-L373 HydrophobicContact CD1-CD2 3.91Å; D352-L373 HydrophobicContact CB-CD2 4.28Å; G354-L373 PolarHBondContact N-O 3.31Å; G354-L373 VanDerWaalsContact N-O 3.14Å; G354-L373 PolarHBondContact O-N 2.88Å; F356-L373 HydrophobicContact CD2-CB 3.89Å; F356-L373 HydrophobicContact CD2-CD2 4.42Å; F356-L373 HydrophobicContact CE2-CB 3.74Å; F356-L373 HydrophobicContact CE2-CD2 3.63Å; F356-L373 HydrophobicContact CE2-CG 4.31Å; F356-L373 HydrophobicContact CZ-CD2 4.12Å; I371-L373 PolarHBondContact O-N 2.82Å; L373-I375 HydrophobicContact CD2-CD1 4.35Å; L373-I375 HydrophobicContact CG-CD1 4.4Å; L373-I375 HydrophobicContact CG-CG1 4.22Å
374	S	93.9	Very high	79.5	Confident	18 Å²	18	79.5 Å²	79.5	13%	0.126	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	135.4	176.2	-61.1	0	0	0	0	110.1	K296 L297 L298 V299	K296-S374 PolarHBondContact NZ-OG 3.2Å; L297-S374 PolarHBondContact O-N 3.29Å; L298-S374 WeakPolarHBondContact CA-O 3.35Å; V299-S374 PolarHBondContact N-O 3.47Å; V299-S374 VanDerWaalsContact N-O 3.07Å
375	I	93.3	Very high	77	Confident	25 Å²	25	84.4 Å²	84.4	13%	0.128	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.2	-171.4	-61.3	177.3	0	0	0	109.9	V299 E301 T349 D352 L373	V299-I375 CarbonylContact O-C 3.53Å; V299-I375 WeakPolarHBondContact O-CA 3.39Å; E301-I375 HydrophobicContact CB-CG2 3.92Å; E301-I375 HydrophobicContact CG-CG2 4.49Å; T349-I375 WeakPolarHBondContact O-CD1 3.27Å; D352-I375 HydrophobicContact CB-CD1 3.72Å; L373-I375 HydrophobicContact CD2-CD1 4.35Å; L373-I375 HydrophobicContact CG-CD1 4.4Å; L373-I375 HydrophobicContact CG-CG1 4.22Å
376	V	88.9	Confident	74.3	Confident	59 Å²	59	88.4 Å²	88.4	36%	0.358	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	116.4	-177.2	-179.3	0	0	0	0	109.2	L298 V299 L300 E301	L298-V376 HydrophobicContact CD1-CG2 3.53Å; L298-V376 HydrophobicContact CD2-CG2 4.25Å; L298-V376 HydrophobicContact CG-CG2 3.85Å; V299-V376 PolarHBondContact O-N 2.89Å; L300-V376 WeakPolarHBondContact CA-O 3.35Å; L300-V376 HydrophobicContact CD2-CB 3.84Å; L300-V376 HydrophobicContact CD2-CG1 3.75Å; E301-V376 PolarHBondContact N-O 3.23Å
377	Q	83.1	Confident	71.6	Confident	120 Å²	120	93.8 Å²	93.8	56%	0.561	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-78.9	133.8	172.1	-52.4	-165.9	-63.9	0	0	109.4	E301	E301-Q377 WeakPolarHBondContact OE2-CG 3.48Å; E301-Q377 PolarHBondContact OE2-NE2 3.32Å
378	L	68.1	Low	68.5	Low	109 Å²	109	97.4 Å²	97.4	57%	0.571	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-69.3	135.7	168.6	-77.5	81.6	0	0	0	108.8	L300 H380	L300-L378 HydrophobicContact CB-CD1 4Å; L300-L378 HydrophobicContact CD1-CD1 4.49Å; L300-L378 HydrophobicContact CD2-CD1 3.75Å; L300-L378 HydrophobicContact CD2-CG 4.41Å; L300-L378 HydrophobicContact CG-CD1 4.3Å; L378-H380 PolarHBondContact O-N 2.52Å
379	P	60.1	Low	65.4	Low	122 Å²	122	97.8 Å²	97.8	79%	0.792	57%	0.568	S	S	*	*			trans	-65.9	112.7	176.8	26.7	-33.3	0	0	0	109.9	L381	P379-L381 PolarHBondContact O-N 3.39Å
380	H	49.5	Very low	63.3	Low	182 Å²	182	102.9 Å²	102.9	84%	0.843	60%	0.6	S	S	*	*			trans	-59.2	108.7	172.7	-69.6	-67	0	0	0	109.9	L378 S382	L378-H380 PolarHBondContact O-N 2.52Å; H380-S382 VanDerWaalsContact C-N 3.3Å; H380-S382 PolarHBondContact O-N 3.06Å
381	L	47.2	Very low	61.1	Low	167 Å²	167	103.4 Å²	103.4	87%	0.874	61%	0.606	S	S	*	*			trans	-71.9	87.3	177.5	-160	79.8	0	0	0	109.2	P379 N383	P379-L381 PolarHBondContact O-N 3.39Å; L381-N383 PolarHBondContact O-N 2.94Å
382	S	38.1	Very low	57.9	Low	103 Å²	103	113.1 Å²	113.1	72%	0.72	65%	0.648	S	S	*	*			trans	-65.8	130	-178.8	55.5	0	0	0	0	110.6	H380 G384	H380-S382 VanDerWaalsContact C-N 3.3Å; H380-S382 PolarHBondContact O-N 3.06Å; S382-G384 PolarHBondContact O-N 2.95Å
383	N	46.4	Very low	54.7	Low	169 Å²	169	113.2 Å²	113.2	90%	0.904	66%	0.659	S	S	*	*			trans	-73.1	66.8	174.9	-85.9	-33.6	0	0	0	110.9	L381	L381-N383 PolarHBondContact O-N 2.94Å
384	G	36.1	Very low	51.6	Low	60 Å²	60	123.7 Å²	123.7	62%	0.619	70%	0.698	S	S	*	*			trans	-92.6	93	178.2	0	0	0	0	0	112.1	S382 S386	S382-G384 PolarHBondContact O-N 2.95Å; G384-S386 PolarHBondContact O-N 3.08Å; G384-S386 VanDerWaalsContact O-N 3.14Å
385	T	44.6	Very low	48.8	Very low	146 Å²	146	128.8 Å²	128.8	90%	0.896	72%	0.724	S	S	*	*			trans	-75.7	97.4	175.1	50.1	0	0	0	0	112.2
386	S	37.2	Very low	46.1	Very low	117 Å²	117	131.2 Å²	131.2	82%	0.818	74%	0.743	S	S	*	*			trans	-146.5	141.8	162.3	57.9	0	0	0	0	111.7	G384	G384-S386 PolarHBondContact O-N 3.08Å; G384-S386 VanDerWaalsContact O-N 3.14Å
387	R	40.9	Very low	43.4	Very low	259 Å²	259	135.6 Å²	135.6	98%	0.977	76%	0.764	S	S	*	*			trans	-102.6	136	-174.8	-68.3	172.4	170.8	165.3	-4.9	111.1
388	A	32.8	Very low	41.1	Very low	106 Å²	106	136.9 Å²	136.9	88%	0.876	77%	0.774	S	S	*	*			trans	-145.9	151.4	156.1	0	0	0	0	0	109.8
389	A	32.1	Very low	39.3	Very low	95 Å²	95	137.2 Å²	137.2	79%	0.785	78%	0.78	S	S	*	*			trans	-89.6	157.9	-157.6	0	0	0	0	0	116.2
390	P	51	Low	37.7	Very low	117 Å²	117	136 Å²	136	76%	0.76	77%	0.774	S	S	*	*			trans	-85.7	-154.7	162.3	43.4	-39.7	0	0	0	109
391	P	50.7	Low	36.7	Very low	102 Å²	102	132.5 Å²	132.5	66%	0.662	77%	0.77	S	S	*	*			cis	-137.8	172.9	-9.5	42.4	-26.2	0	0	0	116.1
392	K	29	Very low	36	Very low	203 Å²	203	130 Å²	130	88%	0.883	77%	0.767	S	S	*	*			trans	-148	115.2	136.3	-64.6	-170.4	-176.6	173.9	0	107.3
393	S	29.1	Very low	35.6	Very low	97 Å²	97	134.7 Å²	134.7	68%	0.678	77%	0.774	S	S	*	*			cis	95.7	139.2	30	86.3	0	0	0	0	114.5
394	R	30.5	Very low	34.8	Very low	221 Å²	221	131.6 Å²	131.6	83%	0.834	77%	0.766	S	S	*	*			trans	90.4	129.1	-173.8	-58.5	-137.3	159.6	-170.7	-6.5	116.6
395	L	37.1	Very low	34.4	Very low	126 Å²	126	135 Å²	135	66%	0.66	77%	0.77	S	S	*	*			cis	-163	141.2	-17.5	-144.8	72.7	0	0	0	110.2
396	S	36	Very low	33.7	Very low	76 Å²	76	139.1 Å²	139.1	53%	0.531	77%	0.769	S	S	.	*			trans	45.6	149.2	130.8	66.5	0	0	0	0	123.3
397	D	31.1	Very low	33.3	Very low	150 Å²	150	137.2 Å²	137.2	80%	0.802	77%	0.768	S	S	*	*			cis	-171.7	-167.9	-10.5	-101.9	-32.9	0	0	0	110
398	I	34.5	Very low	32.7	Very low	148 Å²	148	133.1 Å²	133.1	76%	0.759	76%	0.76	S	S	*	*			trans	113.6	63.1	156.7	-53.1	176.4	0	0	0	115.4
399	T	31.1	Very low	32.9	Very low	116 Å²	116	135 Å²	135	71%	0.712	76%	0.761	S	S	*	*				56.7	152.8	116.8	59	0	0	0	0	124.4
400	S	26.5	Very low	32.8	Very low	96 Å²	96	139.1 Å²	139.1	67%	0.671	76%	0.761	S	S	*	*			trans	83	79.5	142.6	51.3	0	0	0	0	121.9
401	S	29.2	Very low	31.9	Very low	108 Å²	108	136.9 Å²	136.9	76%	0.755	76%	0.759	S	S	*	*				66.8	149.4	108	69.1	0	0	0	0	124
402	S	31.2	Very low	31.1	Very low	114 Å²	114	137.7 Å²	137.7	80%	0.797	76%	0.764	S	S	*	*			trans	101.2	106.6	147.2	73.5	0	0	0	0	120.6
403	K	29.7	Very low	31.6	Very low	202 Å²	202	134 Å²	134	88%	0.878	76%	0.76	S	S	*	*			trans	-10.1	141.1	151.9	-66.1	175.2	173.4	178.9	0	119.3
404	S	30.8	Very low	32.4	Very low	105 Å²	105	137.3 Å²	137.3	73%	0.734	77%	0.765	S	S	*	*			trans	55.6	123.8	132.1	-167.9	0	0	0	0	118.2
405	N	26.5	Very low	33.7	Very low	132 Å²	132	136.1 Å²	136.1	71%	0.706	76%	0.761	S	S	*	*				-163.5	167.5	61.2	-150.8	-11.3	0	0	0	113.9
406	R	30.8	Very low	35.3	Very low	232 Å²	232	131.7 Å²	131.7	88%	0.875	74%	0.743	S	S	*	*			trans	0.4	129.7	165.1	-72.1	163.7	179.7	-162.6	-1.9	119.7
407	G	29.1	Very low	37.6	Very low	76 Å²	76	128.3 Å²	128.3	78%	0.784	72%	0.719	S	S	*	*				126.7	79	114.7	0	0	0	0	0	119
408	E	27.3	Very low	40.2	Very low	173 Å²	173	125.8 Å²	125.8	81%	0.808	71%	0.705	S	S	*	*			trans	-165.2	144.7	136.1	-119.7	178.7	-159	0	0	111.3	K410	E408-K410 PolarHBondContact O-N 3.27Å
409	T	38.7	Very low	42.6	Very low	147 Å²	147	120.1 Å²	120.1	90%	0.902	68%	0.677	S	S	*	*			trans	-83.5	110.8	-178.9	1.5	0	0	0	0	111
410	K	30	Very low	45.1	Very low	181 Å²	181	115.6 Å²	115.6	79%	0.787	65%	0.65	S	S	*	*			trans	-123.6	151.9	163.3	-71.4	-178	-179.4	168.7	0	109.7	E408	E408-K410 PolarHBondContact O-N 3.27Å
411	G	30.6	Very low	47.8	Very low	69 Å²	69	116.1 Å²	116.1	71%	0.711	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-67	173.9	-164.2	0	0	0	0	0	115.3
412	P	33.4	Very low	50.5	Low	120 Å²	120	112.3 Å²	112.3	78%	0.779	62%	0.618	S	S	*	*	S	Bend	trans	-58.7	155.6	174.3	27.4	-35.3	0	0	0	111.3	E414	P412-E414 PolarHBondContact O-N 2.95Å
413	P	40.5	Very low	53.1	Low	124 Å²	124	109.2 Å²	109.2	81%	0.805	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-57.6	130.4	179.8	24.3	-34.2	0	0	0	110.9	R415	P413-R415 PolarHBondContact O-N 2.65Å; P413-R415 VanDerWaalsContact O-N 3.11Å
414	E	45.6	Very low	55.7	Low	167 Å²	167	101.3 Å²	101.3	78%	0.78	56%	0.563	S	S	*	*			trans	-62.4	110.7	-178.5	-170	172.6	-146.4	0	0	109.6	P412 A416	P412-E414 PolarHBondContact O-N 2.95Å; E414-A416 PolarHBondContact O-N 2.8Å
415	R	58.7	Low	58.3	Low	196 Å²	196	99.7 Å²	99.7	74%	0.74	55%	0.548	S	S	*	.			trans	-65.9	117.8	176.7	-70.2	-174.5	176	-174.9	-2.2	108.5	P413 V417	P413-R415 PolarHBondContact O-N 2.65Å; P413-R415 VanDerWaalsContact O-N 3.11Å; R415-V417 WeakPolarHBondContact CB-O 3.41Å; R415-V417 PolarHBondContact O-N 3.26Å; R415-V417 VanDerWaalsContact O-N 3.08Å
416	A	71.1	Confident	61.3	Low	34 Å²	34	94.4 Å²	94.4	28%	0.281	52%	0.522	S	S	.	.	S	Bend	trans	-60.9	-19.3	-177.9	0	0	0	0	0	113.9	E414 W431 T432 V499	E414-A416 PolarHBondContact O-N 2.8Å; A416-W431 CarbonylContact O-C 3.5Å; A416-W431 WeakPolarHBondContact O-CA 3.13Å; A416-W431 VanDerWaalsContact O-CB 3.27Å; A416-W431 WeakPolarHBondContact O-CB 3.3Å; A416-T432 PolarHBondContact O-N 3.03Å; A416-V499 HydrophobicContact CB-CG1 4.47Å; A416-V499 VanDerWaalsContact CB-O 3.29Å; A416-V499 WeakPolarHBondContact CB-O 3.39Å
417	V	82.7	Confident	64.1	Low	4 Å²	4	83.3 Å²	83.3	2%	0.024	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	131.3	166.4	-178.7	0	0	0	0	108.7	R415 V429 W431 L480 V482 V499 A502	R415-V417 WeakPolarHBondContact CB-O 3.41Å; R415-V417 PolarHBondContact O-N 3.26Å; R415-V417 VanDerWaalsContact O-N 3.08Å; V417-V429 HydrophobicContact CG1-CG1 3.81Å; V417-W431 HydrophobicContact CG2-CB 4.05Å; V417-L480 HydrophobicContact CG1-CD2 4.33Å; V417-V482 HydrophobicContact CG1-CG2 3.91Å; V417-V482 HydrophobicContact CG2-CB 3.86Å; V417-V482 HydrophobicContact CG2-CG2 3.76Å; V417-V499 HydrophobicContact CG2-CG1 4.43Å; V417-A502 HydrophobicContact CG1-CB 4.19Å
418	L	85.4	Confident	67	Low	98 Å²	98	81.5 Å²	81.5	51%	0.513	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	125.5	179.6	178.9	68.7	0	0	0	109.1	K430	L418-K430 PolarHBondContact N-O 2.87Å; L418-K430 PolarHBondContact O-N 2.74Å
419	V	85.4	Confident	70	Confident	28 Å²	28	73.3 Å²	73.3	17%	0.17	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	139.9	168.7	-170.6	0	0	0	0	108.7	V422 A427 V429 A502 F504	V419-V422 HydrophobicContact CG1-CG2 3.83Å; V419-A427 HydrophobicContact CG1-CB 3.95Å; V419-V429 HydrophobicContact CG2-CG2 4.47Å; V419-A502 HydrophobicContact CG2-CB 3.79Å; V419-F504 HydrophobicContact CB-CB 4.4Å; V419-F504 HydrophobicContact CB-CD1 4.43Å; V419-F504 HydrophobicContact CB-CG 4.45Å; V419-F504 HydrophobicContact CG1-CB 4.19Å; V419-F504 HydrophobicContact CG1-CD1 4.02Å; V419-F504 HydrophobicContact CG1-CD2 4.2Å; V419-F504 HydrophobicContact CG1-CE1 4.46Å; V419-F504 HydrophobicContact CG1-CG 3.87Å; V419-F504 HydrophobicContact CG2-CD1 3.96Å; V419-F504 HydrophobicContact CG2-CG 4.45Å
420	S	83.5	Confident	72.3	Confident	21 Å²	21	69.6 Å²	69.6	15%	0.147	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	166.7	-173.3	48.9	0	0	0	0	110.3	V422 L428 K430	S420-V422 PolarHBondContact O-N 3.24Å; S420-V422 VanDerWaalsContact O-N 3.13Å; S420-L428 PolarHBondContact N-O 2.92Å; S420-L428 PolarHBondContact O-N 2.79Å; S420-L428 PolarHBondContact OG-O 3.08Å; S420-K430 WeakPolarHBondContact OG-CD 3.27Å; S420-K430 WeakPolarHBondContact OG-CE 3.38Å; S420-K430 PolarHBondContact OG-NZ 3.48Å
421	D	83.6	Confident	75.1	Confident	108 Å²	108	61.4 Å²	61.4	58%	0.578	35%	0.349	S	S	*	.	S	Bend	trans	55.6	36	168.9	-45.5	-47.3	0	0	0	113.8	L428 K430	D421-L428 HydrophobicContact CB-CB 4.12Å; D421-L428 WeakPolarHBondContact OD2-CD2 3.5Å; D421-K430 IonicContact OD2-NZ 2.68Å; D421-K430 PolarHBondContact OD2-NZ 3.08Å
422	V	85.6	Confident	77.4	Confident	28 Å²	28	61.4 Å²	61.4	17%	0.17	34%	0.335	C	S	.	.			trans	-71.6	133.8	-176.8	-172.8	0	0	0	0	111.4	V419 S420 S426 A427 F504 F505 K507	V419-V422 HydrophobicContact CG1-CG2 3.83Å; S420-V422 PolarHBondContact O-N 3.24Å; S420-V422 VanDerWaalsContact O-N 3.13Å; V422-S426 WeakPolarHBondContact CA-O 3.37Å; V422-A427 HydrophobicContact CG1-CB 4.34Å; V422-A427 HydrophobicContact CG2-CB 3.99Å; V422-F504 HydrophobicContact CG1-CD2 4.11Å; V422-F504 HydrophobicContact CG1-CE2 4.43Å; V422-F504 HydrophobicContact CG2-CD2 4.17Å; V422-F505 WeakPolarHBondContact CG1-O 3.21Å; V422-K507 VanDerWaalsContact O-CE 3.28Å; V422-K507 WeakPolarHBondContact O-CE 3.3Å; V422-K507 PolarHBondContact O-NZ 3.46Å
423	T	86.4	Confident	79.2	Confident	49 Å²	49	58.3 Å²	58.3	30%	0.301	31%	0.314	S	S	.	.			trans	-114.7	-161	178.9	74.6	0	0	0	0	110.7	T425 S426 K507	T423-T425 PolarHBondContact OG1-N 3.31Å; T423-T425 VanDerWaalsContact OG1-N 3.13Å; T423-S426 WeakPolarHBondContact CG2-OG 3.49Å; T423-S426 PolarHBondContact N-O 3.13Å; T423-S426 PolarHBondContact OG1-N 3.44Å; T423-S426 PolarHBondContact OG1-O 2.86Å; T423-S426 PolarHBondContact OG1-OG 3.12Å; T423-K507 PolarHBondContact O-N 3.33Å
424	T	85.1	Confident	80.3	Confident	36 Å²	36	56 Å²	56	22%	0.221	30%	0.301	C	S	.	.	S	Bend	trans	-76.4	-24.3	169.3	49.5	0	0	0	0	112.5	S474 K507 D509	T424-S474 VanDerWaalsContact O-CA 3.25Å; T424-S474 WeakPolarHBondContact O-CA 3.23Å; T424-S474 WeakPolarHBondContact O-CB 3.44Å; T424-S474 PolarHBondContact O-N 3.22Å; T424-K507 HydrophobicContact CG2-CB 3.99Å; T424-D509 HydrophobicContact CG2-CB 3.68Å
425	T	84.4	Confident	80.8	Confident	70 Å²	70	58.7 Å²	58.7	43%	0.429	31%	0.31	S	S	.	.	S	Bend	trans	-135.9	4	-172.9	60	0	0	0	0	115.2	T423 N470 N471 L472	T423-T425 PolarHBondContact OG1-N 3.31Å; T423-T425 VanDerWaalsContact OG1-N 3.13Å; T425-N470 CarbonylContact O-C 3.15Å; T425-N471 PolarHBondContact O-N 3.4Å; T425-L472 WeakPolarHBondContact CA-O 3.32Å; T425-L472 PolarHBondContact O-N 3.46Å
426	S	89.2	Confident	80.6	Confident	21 Å²	21	54.4 Å²	54.4	15%	0.147	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	159.4	-178.6	65.5	0	0	0	0	114.2	V422 T423 V469 N470	V422-S426 WeakPolarHBondContact CA-O 3.37Å; T423-S426 WeakPolarHBondContact CG2-OG 3.49Å; T423-S426 PolarHBondContact N-O 3.13Å; T423-S426 PolarHBondContact OG1-N 3.44Å; T423-S426 PolarHBondContact OG1-O 2.86Å; T423-S426 PolarHBondContact OG1-OG 3.12Å; S426-V469 CarbonylContact C-O 3.53Å; S426-V469 WeakPolarHBondContact CA-O 3.41Å; S426-V469 WeakPolarHBondContact CB-O 3.34Å; S426-N470 VanDerWaalsContact CB-OD1 3.24Å; S426-N470 WeakPolarHBondContact CB-OD1 3.5Å
427	A	89.5	Confident	80	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	138.8	177	0	0	0	0	0	111.7	V419 V422 V468 V469 L472 F504	V419-A427 HydrophobicContact CG1-CB 3.95Å; V422-A427 HydrophobicContact CG1-CB 4.34Å; V422-A427 HydrophobicContact CG2-CB 3.99Å; A427-V468 WeakPolarHBondContact O-CA 3.48Å; A427-V469 PolarHBondContact N-O 2.99Å; A427-V469 PolarHBondContact O-N 3.15Å; A427-L472 HydrophobicContact CB-CD1 3.98Å; A427-F504 HydrophobicContact CB-CD2 4.14Å; A427-F504 HydrophobicContact CB-CE2 3.49Å; A427-F504 VanDerWaalsContact CB-CE2 3.49Å; A427-F504 HydrophobicContact CB-CZ 3.81Å
428	L	89.5	Confident	78.9	Confident	38 Å²	38	57.6 Å²	57.6	20%	0.199	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	107.2	178.2	175.4	48.5	0	0	0	110.9	S420 D421 K430 A466 V468	S420-L428 PolarHBondContact N-O 2.92Å; S420-L428 PolarHBondContact O-N 2.79Å; S420-L428 PolarHBondContact OG-O 3.08Å; D421-L428 HydrophobicContact CB-CB 4.12Å; D421-L428 WeakPolarHBondContact OD2-CD2 3.5Å; L428-K430 HydrophobicContact CD1-CG 4.45Å; L428-K430 VanDerWaalsContact CD2-CE 3.48Å; L428-K430 HydrophobicContact CG-CD 4.46Å; L428-K430 HydrophobicContact CG-CG 4.35Å; L428-A466 HydrophobicContact CD1-CB 4.14Å; L428-V468 HydrophobicContact CB-CG2 4.47Å; L428-V468 HydrophobicContact CD1-CG2 3.89Å
429	V	90.3	Very high	78.1	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	134.5	175	-169.7	0	0	0	0	109.3	V417 V419 W431 L445 A466 F467 V469 L480 V482	V417-V429 HydrophobicContact CG1-CG1 3.81Å; V419-V429 HydrophobicContact CG2-CG2 4.47Å; V429-W431 HydrophobicContact CB-CZ3 4.5Å; V429-W431 HydrophobicContact CG1-CE3 4.1Å; V429-W431 HydrophobicContact CG1-CZ3 4.37Å; V429-L445 HydrophobicContact CG1-CD1 4.41Å; V429-A466 CarbonylContact O-C 3.16Å; V429-A466 WeakPolarHBondContact O-CA 3.27Å; V429-F467 PolarHBondContact N-O 2.94Å; V429-F467 PolarHBondContact O-N 3.11Å; V429-V469 HydrophobicContact CG2-CG2 4.01Å; V429-L480 HydrophobicContact CG1-CD2 3.85Å; V429-L480 HydrophobicContact CG2-CD1 3.66Å; V429-L480 HydrophobicContact CG2-CD2 4.12Å; V429-V482 HydrophobicContact CG1-CG2 4.22Å
430	K	87.3	Confident	77.5	Confident	70 Å²	70	64.4 Å²	64.4	30%	0.304	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	140.4	176.8	-67.8	160.6	-178.5	140	0	108.1	L418 S420 D421 L428 A466	L418-K430 PolarHBondContact N-O 2.87Å; L418-K430 PolarHBondContact O-N 2.74Å; S420-K430 WeakPolarHBondContact OG-CD 3.27Å; S420-K430 WeakPolarHBondContact OG-CE 3.38Å; S420-K430 PolarHBondContact OG-NZ 3.48Å; D421-K430 IonicContact OD2-NZ 2.68Å; D421-K430 PolarHBondContact OD2-NZ 3.08Å; L428-K430 HydrophobicContact CD1-CG 4.45Å; L428-K430 VanDerWaalsContact CD2-CE 3.48Å; L428-K430 HydrophobicContact CG-CD 4.46Å; L428-K430 HydrophobicContact CG-CG 4.35Å; K430-A466 HydrophobicContact CG-CB 3.82Å
431	W	88.8	Confident	77.1	Confident	9 Å²	9	69 Å²	69	3%	0.034	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	148.9	178.8	59.4	100.3	0	0	0	113.8	A416 V417 V429 Y443 I460 N464 K465 F467 V482 V499	A416-W431 CarbonylContact O-C 3.5Å; A416-W431 WeakPolarHBondContact O-CA 3.13Å; A416-W431 VanDerWaalsContact O-CB 3.27Å; A416-W431 WeakPolarHBondContact O-CB 3.3Å; V417-W431 HydrophobicContact CG2-CB 4.05Å; V429-W431 HydrophobicContact CB-CZ3 4.5Å; V429-W431 HydrophobicContact CG1-CE3 4.1Å; V429-W431 HydrophobicContact CG1-CZ3 4.37Å; W431-Y443 AromaticContact CD1-CE1 3.89Å; W431-Y443 AromaticContact CE2-CD2 3.94Å; W431-Y443 AromaticContact CE2-CG 3.99Å; W431-Y443 AromaticContact CZ2-CD2 3.75Å; W431-Y443 HydrophobicContact CZ2-CD2 3.75Å; W431-Y443 HydrophobicContact CZ2-CE2 4.31Å; W431-Y443 HydrophobicContact CZ2-CG 4.01Å; W431-Y443 AromaticContact NE1-CD1 3.41Å; W431-Y443 AromaticContact NE1-CD2 3.52Å; W431-Y443 AromaticContact NE1-CE1 3.38Å; W431-Y443 AromaticContact NE1-CE2 3.48Å; W431-Y443 AromaticContact NE1-CG 3.49Å; W431-Y443 AromaticContact NE1-CZ 3.44Å; W431-I460 HydrophobicContact CH2-CD1 3.88Å; W431-I460 HydrophobicContact CH2-CG2 4.08Å; W431-I460 HydrophobicContact CZ2-CD1 4.5Å; W431-I460 HydrophobicContact CZ2-CG2 4.12Å; W431-N464 VanDerWaalsContact CZ2-O 3.25Å; W431-N464 WeakPolarHBondContact CZ2-O 3.34Å; W431-K465 PolarHBondContact N-O 3.48Å; W431-F467 HydrophobicContact CH2-CB 3.93Å; W431-F467 HydrophobicContact CZ3-CB 3.96Å; W431-V482 HydrophobicContact CD2-CG1 4.05Å; W431-V482 HydrophobicContact CD2-CG2 4.41Å; W431-V482 HydrophobicContact CE3-CG2 4.28Å; W431-V482 HydrophobicContact CG-CG1 4.01Å; W431-V499 HydrophobicContact CB-CG1 4.35Å
432	T	79.4	Confident	77	Confident	69 Å²	69	66.5 Å²	66.5	42%	0.423	35%	0.353	S	S	.	.			trans	-114.3	137.3	176.7	56.9	0	0	0	0	109.8	A416	A416-T432 PolarHBondContact O-N 3.03Å
433	V	71.8	Confident	77	Confident	54 Å²	54	65.6 Å²	65.6	33%	0.327	35%	0.347	S	S	.	.			trans	-118.2	131.3	-180	-179	0	0	0	0	108.5	A437 Y443 V499	V433-A437 HydrophobicContact CG1-CB 3.78Å; V433-Y443 HydrophobicContact CG2-CE1 3.81Å; V433-V499 HydrophobicContact CG2-CG1 4.18Å
434	S	63.1	Low	77	Confident	77 Å²	77	64.6 Å²	64.6	54%	0.538	34%	0.339	S	S	.	.			trans	-57.7	141.1	178.9	180	0	0	0	0	111.5	S436 A437	S434-S436 PolarHBondContact O-N 2.88Å; S434-S436 PolarHBondContact OG-N 2.87Å; S434-S436 PolarHBondContact OG-OG 2.92Å; S434-A437 WeakPolarHBondContact O-CB 3.31Å; S434-A437 PolarHBondContact O-N 3.2Å; S434-A437 VanDerWaalsContact O-N 3.1Å
435	K	56.5	Low	77.1	Confident	222 Å²	222	62.9 Å²	62.9	97%	0.965	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-6	173.9	-65	-178	179.8	177.3	0	113.8
436	S	54.8	Low	77.3	Confident	106 Å²	106	61.9 Å²	61.9	74%	0.741	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-0.2	175.1	65	0	0	0	0	114.5	S434	S434-S436 PolarHBondContact O-N 2.88Å; S434-S436 PolarHBondContact OG-N 2.87Å; S434-S436 PolarHBondContact OG-OG 2.92Å
437	A	57.9	Low	77.2	Confident	41 Å²	41	61.3 Å²	61.3	34%	0.339	31%	0.313	S	S	.	.	S	Bend	trans	-79.1	150.2	179.6	0	0	0	0	0	112.3	V433 S434	V433-A437 HydrophobicContact CG1-CB 3.78Å; S434-A437 WeakPolarHBondContact O-CB 3.31Å; S434-A437 PolarHBondContact O-N 3.2Å; S434-A437 VanDerWaalsContact O-N 3.1Å
438	P	60.1	Low	77	Confident	64 Å²	64	63.1 Å²	63.1	42%	0.416	32%	0.323	S	S	.	.			trans	-64.5	171.7	170.6	29.6	-36.3	0	0	0	111.8	V440 W486	P438-V440 PolarHBondContact O-N 3.38Å; P438-W486 HydrophobicContact CB-CG 4.29Å; P438-W486 HydrophobicContact CG-CB 4.22Å; P438-W486 HydrophobicContact CG-CD2 3.39Å; P438-W486 HydrophobicContact CG-CE3 3.81Å; P438-W486 HydrophobicContact CG-CG 3.58Å; P438-W486 HydrophobicContact CG-CH2 4.39Å; P438-W486 HydrophobicContact CG-CZ2 4.06Å; P438-W486 HydrophobicContact CG-CZ3 4.28Å
439	R	68.3	Low	76.5	Confident	243 Å²	243	62.1 Å²	62.1	92%	0.917	32%	0.319	S	S	*	.			trans	-62.8	98.2	179.6	-80.3	-175.4	168.2	-171.5	-3.5	111.2	K441	R439-K441 PolarHBondContact O-N 2.99Å
440	V	72.7	Confident	75.6	Confident	27 Å²	27	66 Å²	66	16%	0.164	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	131.3	171.7	-175.2	0	0	0	0	109.7	P438 M442 Y443 A462 A484	P438-V440 PolarHBondContact O-N 3.38Å; V440-M442 VanDerWaalsContact CG1-O 3.32Å; V440-M442 WeakPolarHBondContact CG1-O 3.44Å; V440-Y443 HydrophobicContact CG1-CD1 4.1Å; V440-Y443 HydrophobicContact CG1-CE1 3.72Å; V440-Y443 HydrophobicContact CG1-CE2 4.36Å; V440-Y443 HydrophobicContact CG2-CE1 4.46Å; V440-A462 HydrophobicContact CG1-CB 4.33Å; V440-A462 VanDerWaalsContact O-CB 3.29Å; V440-A462 WeakPolarHBondContact O-CB 3.09Å; V440-A484 HydrophobicContact CG1-CB 3.99Å; V440-A484 HydrophobicContact CG2-CB 3.98Å
441	K	75.1	Confident	74.3	Confident	116 Å²	116	69.1 Å²	69.1	50%	0.504	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-36	-177.5	-172	168.4	-178.9	166.8	0	111.6	R439 A462 M485 D487	R439-K441 PolarHBondContact O-N 2.99Å; K441-A462 WeakPolarHBondContact O-CB 3.32Å; K441-M485 PolarHBondContact N-O 2.92Å; K441-D487 WeakPolarHBondContact CD-OD1 3.33Å; K441-D487 WeakPolarHBondContact CD-OD2 3.49Å; K441-D487 IonicContact NZ-OD1 3.28Å; K441-D487 PolarHBondContact NZ-OD1 3.31Å; K441-D487 IonicContact NZ-OD2 3.83Å; K441-D487 PolarHBondContact NZ-OD2 3.48Å
442	M	80.9	Confident	72.9	Confident	56 Å²	56	73.5 Å²	73.5	28%	0.276	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	159.4	178.7	52.8	-164.1	-74.3	0	0	109.7	V440 M459 M485	V440-M442 VanDerWaalsContact CG1-O 3.32Å; V440-M442 WeakPolarHBondContact CG1-O 3.44Å; M442-M459 HydrophobicContact CE-CB 3.87Å; M442-M459 HydrophobicContact CE-CE 3.85Å; M442-M459 HydrophobicContact CE-CG 3.68Å; M442-M459 HydrophobicContact CE-SD 3.41Å; M442-M459 WeakPolarHBondContact CE-SD 2.99Å; M442-M485 HydrophobicContact CE-SD 3.8Å; M442-M485 HydrophobicContact CG-CB 3.79Å; M442-M485 HydrophobicContact CG-CG 4.02Å; M442-M485 HydrophobicContact CG-SD 3.68Å; M442-M485 PolarHBondContact O-N 2.78Å; M442-M485 HydrophobicContact SD-SD 3.9Å
443	Y	84.9	Confident	72	Confident	9 Å²	9	79.2 Å²	79.2	4%	0.035	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	143	168	-57.9	-79	0	0	0	109.7	W431 V433 V440 I460 A462 N464 V482 L483 A484 V499	W431-Y443 AromaticContact CD1-CE1 3.89Å; W431-Y443 AromaticContact CE2-CD2 3.94Å; W431-Y443 AromaticContact CE2-CG 3.99Å; W431-Y443 AromaticContact CZ2-CD2 3.75Å; W431-Y443 HydrophobicContact CZ2-CD2 3.75Å; W431-Y443 HydrophobicContact CZ2-CE2 4.31Å; W431-Y443 HydrophobicContact CZ2-CG 4.01Å; W431-Y443 AromaticContact NE1-CD1 3.41Å; W431-Y443 AromaticContact NE1-CD2 3.52Å; W431-Y443 AromaticContact NE1-CE1 3.38Å; W431-Y443 AromaticContact NE1-CE2 3.48Å; W431-Y443 AromaticContact NE1-CG 3.49Å; W431-Y443 AromaticContact NE1-CZ 3.44Å; V433-Y443 HydrophobicContact CG2-CE1 3.81Å; V440-Y443 HydrophobicContact CG1-CD1 4.1Å; V440-Y443 HydrophobicContact CG1-CE1 3.72Å; V440-Y443 HydrophobicContact CG1-CE2 4.36Å; V440-Y443 HydrophobicContact CG2-CE1 4.46Å; Y443-I460 PolarHBondContact N-O 3.47Å; Y443-I460 PolarHBondContact O-N 3.47Å; Y443-A462 HydrophobicContact CE2-CB 4.45Å; Y443-N464 WeakPolarHBondContact CE2-O 3.31Å; Y443-V482 HydrophobicContact CD1-CG1 4.29Å; Y443-L483 CarbonylContact C-O 3.47Å; Y443-L483 VanDerWaalsContact CA-O 3.24Å; Y443-L483 WeakPolarHBondContact CA-O 3.09Å; Y443-A484 HydrophobicContact CD1-CB 4.04Å; Y443-A484 HydrophobicContact CE1-CB 4.03Å; Y443-V499 HydrophobicContact CD1-CG2 4.48Å; Y443-V499 HydrophobicContact CE1-CG2 4.5Å
444	Q	86.4	Confident	71.7	Confident	28 Å²	28	80.1 Å²	80.1	13%	0.131	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	115.8	167.5	-176.4	177.2	-1.6	0	0	108	Q446 M459 L483 M485	Q444-Q446 HydrophobicContact CG-CG 4.12Å; Q444-Q446 VanDerWaalsContact NE2-NE2 3.13Å; Q444-M459 HydrophobicContact CB-CE 4.27Å; Q444-M459 HydrophobicContact CB-SD 3.67Å; Q444-M459 HydrophobicContact CG-CE 4.01Å; Q444-M459 HydrophobicContact CG-SD 3.69Å; Q444-L483 HydrophobicContact CB-CB 4.42Å; Q444-L483 PolarHBondContact N-O 2.77Å; Q444-L483 PolarHBondContact O-N 2.87Å; Q444-M485 HydrophobicContact CB-SD 4.49Å
445	L	88.1	Confident	72.3	Confident	1 Å²	1	81 Å²	81	1%	0.005	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.9	165.7	-165.5	69.4	0	0	0	108	V429 Y447 Y457 R458 I460 F467 V469 L480 V482	V429-L445 HydrophobicContact CG1-CD1 4.41Å; L445-Y447 HydrophobicContact CD2-CD1 4.27Å; L445-Y447 HydrophobicContact CD2-CE1 4.4Å; L445-Y447 HydrophobicContact CG-CD1 4.37Å; L445-Y457 CarbonylContact O-C 3.47Å; L445-Y457 WeakPolarHBondContact O-CA 3.46Å; L445-Y457 WeakPolarHBondContact O-CB 3.48Å; L445-R458 HydrophobicContact CB-CB 4.38Å; L445-R458 PolarHBondContact N-O 3.15Å; L445-R458 PolarHBondContact O-N 3.15Å; L445-I460 HydrophobicContact CB-CD1 3.86Å; L445-I460 HydrophobicContact CD2-CD1 4.32Å; L445-F467 HydrophobicContact CD2-CD1 3.79Å; L445-F467 HydrophobicContact CD2-CE1 4.18Å; L445-V469 HydrophobicContact CD2-CG2 3.67Å; L445-L480 HydrophobicContact CD1-CD1 4.05Å; L445-L480 HydrophobicContact CD1-CD2 3.85Å; L445-L480 HydrophobicContact CD1-CG 4.03Å; L445-L480 HydrophobicContact CD2-CD1 4.43Å; L445-L480 HydrophobicContact CG-CD1 4.37Å; L445-V482 HydrophobicContact CD1-CG2 3.76Å
446	Q	88.1	Confident	73.4	Confident	48 Å²	48	73.1 Å²	73.1	22%	0.224	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.3	171.5	-66.1	179	-9.8	0	0	108.2	Q444 L455 I456 L480 C481 L483	Q444-Q446 HydrophobicContact CG-CG 4.12Å; Q444-Q446 VanDerWaalsContact NE2-NE2 3.13Å; Q446-L455 HydrophobicContact CB-CD1 4.42Å; Q446-L455 HydrophobicContact CB-CD2 4.39Å; Q446-L455 HydrophobicContact CB-CG 4.46Å; Q446-L455 HydrophobicContact CG-CD2 4.34Å; Q446-I456 CarbonylContact C-O 3.58Å; Q446-I456 WeakPolarHBondContact CA-O 3.3Å; Q446-L480 CarbonylContact O-C 3.41Å; Q446-L480 WeakPolarHBondContact O-CA 3.31Å; Q446-C481 PolarHBondContact N-O 3.13Å; Q446-C481 PolarHBondContact O-N 2.79Å; Q446-L483 HydrophobicContact CB-CD1 4.43Å; Q446-L483 VanDerWaalsContact CD-CD1 3.49Å; Q446-L483 HydrophobicContact CG-CD1 3.86Å
447	Y	86.9	Confident	74.7	Confident	10 Å²	10	70.9 Å²	70.9	4%	0.039	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	151	173.8	62.2	-83.2	0	0	0	112.4	L445 I456 V469 L472 Y478 D479 L480	L445-Y447 HydrophobicContact CD2-CD1 4.27Å; L445-Y447 HydrophobicContact CD2-CE1 4.4Å; L445-Y447 HydrophobicContact CG-CD1 4.37Å; Y447-I456 HydrophobicContact CD2-CB 4.42Å; Y447-I456 HydrophobicContact CE1-CB 4.19Å; Y447-I456 HydrophobicContact CE1-CG2 3.85Å; Y447-I456 HydrophobicContact CE2-CB 4.06Å; Y447-I456 HydrophobicContact CE2-CD1 3.94Å; Y447-I456 HydrophobicContact CE2-CG2 4.23Å; Y447-I456 PolarHBondContact N-O 2.87Å; Y447-I456 PolarHBondContact O-N 2.8Å; Y447-V469 HydrophobicContact CE1-CG1 3.89Å; Y447-V469 HydrophobicContact CE2-CG1 3.9Å; Y447-L472 HydrophobicContact CD2-CD2 4.4Å; Y447-L472 HydrophobicContact CE2-CD2 4.03Å; Y447-Y478 HydrophobicContact CD2-CD1 4.25Å; Y447-Y478 HydrophobicContact CD2-CE1 4.48Å; Y447-D479 VanDerWaalsContact CA-O 3.22Å; Y447-D479 WeakPolarHBondContact CA-O 3.41Å; Y447-L480 HydrophobicContact CG-CD1 4.48Å
448	N	85.6	Confident	75.9	Confident	37 Å²	37	70.2 Å²	70.2	20%	0.198	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.6	173.8	-171.1	28.3	0	0	0	110.6	D452 V454 L455 Y478 D479	N448-D452 PolarHBondContact ND2-O 2.72Å; N448-D452 PolarHBondContact OD1-O 2.82Å; N448-V454 PolarHBondContact OD1-O 2.75Å; N448-L455 HydrophobicContact CB-CD1 4.31Å; N448-Y478 WeakPolarHBondContact O-CA 3.34Å; N448-Y478 WeakPolarHBondContact O-CD1 3.45Å; N448-D479 PolarHBondContact N-O 3.16Å; N448-D479 PolarHBondContact O-N 2.82Å; N448-D479 VanDerWaalsContact O-N 3.11Å
449	C	79.5	Confident	76.9	Confident	18 Å²	18	70.1 Å²	70.1	12%	0.122	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	160.3	168.9	-162.3	0	0	0	0	110	D451 D452 G477 Y478	C449-D451 VanDerWaalsContact C-N 3.3Å; C449-D452 HydrophobicContact CB-CB 4.08Å; C449-G477 CarbonylContact C-O 3.16Å; C449-G477 WeakPolarHBondContact CA-O 3.34Å; C449-Y478 HydrophobicContact CB-CD1 4.41Å; C449-Y478 HydrophobicContact CB-CE1 3.85Å
450	S	71.7	Confident	77.7	Confident	80 Å²	80	58.8 Å²	58.8	56%	0.559	30%	0.3	S	S	*	.	S	Bend	trans	-71.2	-22	172.2	-58.5	0	0	0	0	114.2	G477	S450-G477 PolarHBondContact N-O 2.89Å; S450-G477 PolarHBondContact OG-O 3.04Å
451	D	60.3	Low	78.1	Confident	137 Å²	137	59.9 Å²	59.9	73%	0.733	31%	0.308	S	S	*	.	S	Bend	trans	-107.1	1.4	-174.1	-54.5	-59.2	0	0	0	114.2	C449	C449-D451 VanDerWaalsContact C-N 3.3Å
452	D	58.9	Low	78.1	Confident	101 Å²	101	55.9 Å²	55.9	54%	0.54	30%	0.296	S	S	.	.			trans	-124.1	156.5	178.4	-119.8	-41.5	0	0	0	109	N448 C449	N448-D452 PolarHBondContact ND2-O 2.72Å; N448-D452 PolarHBondContact OD1-O 2.82Å; C449-D452 HydrophobicContact CB-CB 4.08Å
453	E	59.6	Low	77.9	Confident	189 Å²	189	58.4 Å²	58.4	88%	0.883	32%	0.315	S	S	*	.			trans	-104.1	4.5	174.1	-67	-168.2	142.9	0	0	113.1	L455	E453-L455 PolarHBondContact O-N 2.89Å
454	V	66.6	Low	77.7	Confident	73 Å²	73	60.2 Å²	60.2	44%	0.442	33%	0.325	S	S	.	.			trans	-88.5	96.7	-170.8	-174.2	0	0	0	0	111.4	N448 I456	N448-V454 PolarHBondContact OD1-O 2.75Å; V454-I456 PolarHBondContact O-N 3.07Å
455	L	75	Confident	77.4	Confident	94 Å²	94	65.4 Å²	65.4	49%	0.492	35%	0.348	S	S	.	.			trans	-67.7	99	177.8	-168.6	87.6	0	0	0	112.2	Q446 N448 E453	Q446-L455 HydrophobicContact CB-CD1 4.42Å; Q446-L455 HydrophobicContact CB-CD2 4.39Å; Q446-L455 HydrophobicContact CB-CG 4.46Å; Q446-L455 HydrophobicContact CG-CD2 4.34Å; N448-L455 HydrophobicContact CB-CD1 4.31Å; E453-L455 PolarHBondContact O-N 2.89Å
456	I	79.8	Confident	77.2	Confident	58 Å²	58	67.5 Å²	67.5	30%	0.297	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	131.8	175.6	-57.9	172.7	0	0	0	109.3	Q446 Y447 V454	Q446-I456 CarbonylContact C-O 3.58Å; Q446-I456 WeakPolarHBondContact CA-O 3.3Å; Y447-I456 HydrophobicContact CD2-CB 4.42Å; Y447-I456 HydrophobicContact CE1-CB 4.19Å; Y447-I456 HydrophobicContact CE1-CG2 3.85Å; Y447-I456 HydrophobicContact CE2-CB 4.06Å; Y447-I456 HydrophobicContact CE2-CD1 3.94Å; Y447-I456 HydrophobicContact CE2-CG2 4.23Å; Y447-I456 PolarHBondContact N-O 2.87Å; Y447-I456 PolarHBondContact O-N 2.8Å; V454-I456 PolarHBondContact O-N 3.07Å
457	Y	83.2	Confident	77.1	Confident	59 Å²	59	67.1 Å²	67.1	23%	0.231	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	145.9	173.6	63	-91.3	0	0	0	112.9	L445 S762 V764	L445-Y457 CarbonylContact O-C 3.47Å; L445-Y457 WeakPolarHBondContact O-CA 3.46Å; L445-Y457 WeakPolarHBondContact O-CB 3.48Å; Y457-S762 PolarHBondContact OH-OG 3.49Å; Y457-V764 HydrophobicContact CE1-CG2 3.8Å; Y457-V764 WeakPolarHBondContact OH-CG2 3.25Å
458	R	81.5	Confident	77.2	Confident	27 Å²	27	69.7 Å²	69.7	10%	0.102	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	131.9	177.7	-72.2	-176.4	165.9	-169.7	-2.3	110.8	L445 E761	L445-R458 HydrophobicContact CB-CB 4.38Å; L445-R458 PolarHBondContact N-O 3.15Å; L445-R458 PolarHBondContact O-N 3.15Å; R458-E761 IonicContact CZ-OE1 3.68Å; R458-E761 IonicContact NE-OE1 2.73Å; R458-E761 PolarHBondContact NE-OE1 3.16Å; R458-E761 IonicContact NH2-OE1 3.82Å; R458-E761 PolarHBondContact NH2-OE1 3.03Å; R458-E761 IonicContact NH2-OE2 2.83Å; R458-E761 PolarHBondContact NH2-OE2 3.35Å
459	M	81.9	Confident	77.2	Confident	61 Å²	61	67.9 Å²	67.9	30%	0.3	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	127.8	179	-65.3	-53.1	-161.2	0	0	110.8	M442 Q444 M485	M442-M459 HydrophobicContact CE-CB 3.87Å; M442-M459 HydrophobicContact CE-CE 3.85Å; M442-M459 HydrophobicContact CE-CG 3.68Å; M442-M459 HydrophobicContact CE-SD 3.41Å; M442-M459 WeakPolarHBondContact CE-SD 2.99Å; Q444-M459 HydrophobicContact CB-CE 4.27Å; Q444-M459 HydrophobicContact CB-SD 3.67Å; Q444-M459 HydrophobicContact CG-CE 4.01Å; Q444-M459 HydrophobicContact CG-SD 3.69Å; M459-M485 HydrophobicContact CE-SD 4.04Å; M459-M485 HydrophobicContact SD-SD 4.38Å
460	I	83.9	Confident	77.5	Confident	5 Å²	5	70.7 Å²	70.7	3%	0.026	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.9	-170.9	-60.7	167.2	0	0	0	109.2	W431 Y443 L445 N464 F467	W431-I460 HydrophobicContact CH2-CD1 3.88Å; W431-I460 HydrophobicContact CH2-CG2 4.08Å; W431-I460 HydrophobicContact CZ2-CD1 4.5Å; W431-I460 HydrophobicContact CZ2-CG2 4.12Å; Y443-I460 PolarHBondContact N-O 3.47Å; Y443-I460 PolarHBondContact O-N 3.47Å; L445-I460 HydrophobicContact CB-CD1 3.86Å; L445-I460 HydrophobicContact CD2-CD1 4.32Å; I460-N464 HydrophobicContact CG2-CB 3.84Å; I460-F467 HydrophobicContact CD1-CB 3.73Å; I460-F467 HydrophobicContact CD1-CD1 4.11Å; I460-F467 HydrophobicContact CD1-CD2 3.89Å; I460-F467 HydrophobicContact CD1-CG 3.64Å; I460-F467 HydrophobicContact CG1-CD2 3.95Å; I460-F467 HydrophobicContact CG1-CE2 4.3Å; I460-F467 HydrophobicContact CG1-CG 4.23Å
461	P	81.7	Confident	77.9	Confident	51 Å²	51	73.9 Å²	73.9	33%	0.331	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	143.2	177	-27.9	37.2	0	0	0	113.3	T463 N464	P461-T463 PolarHBondContact O-N 3.42Å; P461-N464 PolarHBondContact O-N 3.42Å
462	A	76.4	Confident	79	Confident	31 Å²	31	67.7 Å²	67.7	26%	0.256	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-11.9	-178.4	0	0	0	0	0	115.1	V440 K441 Y443 N464	V440-A462 HydrophobicContact CG1-CB 4.33Å; V440-A462 VanDerWaalsContact O-CB 3.29Å; V440-A462 WeakPolarHBondContact O-CB 3.09Å; K441-A462 WeakPolarHBondContact O-CB 3.32Å; Y443-A462 HydrophobicContact CE2-CB 4.45Å; A462-N464 VanDerWaalsContact C-N 3.27Å
463	T	76.1	Confident	80.1	Confident	110 Å²	110	66.9 Å²	66.9	68%	0.675	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-32.1	168.4	45.6	0	0	0	0	112.4	P461	P461-T463 PolarHBondContact O-N 3.42Å
464	N	80.4	Confident	81.3	Confident	46 Å²	46	60.2 Å²	60.2	25%	0.246	33%	0.334	C	S	.	.			trans	-95.2	131.7	-168	-56.2	-6.3	0	0	0	108.7	W431 Y443 I460 P461 A462 E757	W431-N464 VanDerWaalsContact CZ2-O 3.25Å; W431-N464 WeakPolarHBondContact CZ2-O 3.34Å; Y443-N464 WeakPolarHBondContact CE2-O 3.31Å; I460-N464 HydrophobicContact CG2-CB 3.84Å; P461-N464 PolarHBondContact O-N 3.42Å; A462-N464 VanDerWaalsContact C-N 3.27Å; N464-E757 PolarHBondContact ND2-OE1 2.92Å
465	K	79.3	Confident	82	Confident	137 Å²	137	58.5 Å²	58.5	60%	0.596	33%	0.331	S	S	*	.	S	Bend	trans	-118.2	8.3	-179.3	-60.7	179.9	-177.3	176	0	112.7	W431	W431-K465 PolarHBondContact N-O 3.48Å
466	A	83.9	Confident	82.4	Confident	46 Å²	46	54.9 Å²	54.9	38%	0.38	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	149.9	178.3	0	0	0	0	0	108.5	L428 V429 K430	L428-A466 HydrophobicContact CD1-CB 4.14Å; V429-A466 CarbonylContact O-C 3.16Å; V429-A466 WeakPolarHBondContact O-CA 3.27Å; K430-A466 HydrophobicContact CG-CB 3.82Å
467	F	87.6	Confident	82.8	Confident	40 Å²	40	52.3 Å²	52.3	18%	0.175	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	137.2	-179.4	-174.7	-96.9	0	0	0	110	V429 W431 L445 I460 V469	V429-F467 PolarHBondContact N-O 2.94Å; V429-F467 PolarHBondContact O-N 3.11Å; W431-F467 HydrophobicContact CH2-CB 3.93Å; W431-F467 HydrophobicContact CZ3-CB 3.96Å; L445-F467 HydrophobicContact CD2-CD1 3.79Å; L445-F467 HydrophobicContact CD2-CE1 4.18Å; I460-F467 HydrophobicContact CD1-CB 3.73Å; I460-F467 HydrophobicContact CD1-CD1 4.11Å; I460-F467 HydrophobicContact CD1-CD2 3.89Å; I460-F467 HydrophobicContact CD1-CG 3.64Å; I460-F467 HydrophobicContact CG1-CD2 3.95Å; I460-F467 HydrophobicContact CG1-CE2 4.3Å; I460-F467 HydrophobicContact CG1-CG 4.23Å; F467-V469 HydrophobicContact CD1-CG2 4.16Å; F467-V469 HydrophobicContact CE1-CG2 4.41Å
468	V	87.8	Confident	83	Confident	63 Å²	63	50.2 Å²	50.2	38%	0.382	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	116.6	173.7	-172.4	0	0	0	0	108.4	A427 L428 N470	A427-V468 WeakPolarHBondContact O-CA 3.48Å; L428-V468 HydrophobicContact CB-CG2 4.47Å; L428-V468 HydrophobicContact CD1-CG2 3.89Å; V468-N470 VanDerWaalsContact CG1-OD1 3.29Å; V468-N470 WeakPolarHBondContact CG1-OD1 3.16Å
469	V	86.6	Confident	83.3	Confident	0 Å²	0	53 Å²	53	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.3	166	-168.8	0	0	0	0	107.5	S426 A427 V429 L445 Y447 F467 L472 L480	S426-V469 CarbonylContact C-O 3.53Å; S426-V469 WeakPolarHBondContact CA-O 3.41Å; S426-V469 WeakPolarHBondContact CB-O 3.34Å; A427-V469 PolarHBondContact N-O 2.99Å; A427-V469 PolarHBondContact O-N 3.15Å; V429-V469 HydrophobicContact CG2-CG2 4.01Å; L445-V469 HydrophobicContact CD2-CG2 3.67Å; Y447-V469 HydrophobicContact CE1-CG1 3.89Å; Y447-V469 HydrophobicContact CE2-CG1 3.9Å; F467-V469 HydrophobicContact CD1-CG2 4.16Å; F467-V469 HydrophobicContact CE1-CG2 4.41Å; V469-L472 HydrophobicContact CG1-CD1 4.45Å; V469-L472 HydrophobicContact CG1-CD2 3.67Å; V469-L472 HydrophobicContact CG1-CG 4.13Å; V469-L480 HydrophobicContact CG2-CD1 4.21Å
470	N	84.8	Confident	83.7	Confident	76 Å²	76	50.2 Å²	50.2	41%	0.406	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	165.9	-179.3	-71.1	-32.6	0	0	0	109.1	T425 S426 V468 L472	T425-N470 CarbonylContact O-C 3.15Å; S426-N470 VanDerWaalsContact CB-OD1 3.24Å; S426-N470 WeakPolarHBondContact CB-OD1 3.5Å; V468-N470 VanDerWaalsContact CG1-OD1 3.29Å; V468-N470 WeakPolarHBondContact CG1-OD1 3.16Å; N470-L472 VanDerWaalsContact C-N 3.29Å
471	N	80.7	Confident	83.8	Confident	147 Å²	147	51.6 Å²	51.6	79%	0.786	31%	0.306	S	S	*	.	S	Bend	trans	63	34	-178	-50.4	-14.5	0	0	0	112.9	T425	T425-N471 PolarHBondContact O-N 3.4Å
472	L	83.5	Confident	84.1	Confident	8 Å²	8	49.2 Å²	49.2	4%	0.042	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-73.9	153.8	166.9	-57.7	176.7	0	0	0	110.2	T425 A427 Y447 V469 N470 Y478 F504 T506	T425-L472 WeakPolarHBondContact CA-O 3.32Å; T425-L472 PolarHBondContact O-N 3.46Å; A427-L472 HydrophobicContact CB-CD1 3.98Å; Y447-L472 HydrophobicContact CD2-CD2 4.4Å; Y447-L472 HydrophobicContact CE2-CD2 4.03Å; V469-L472 HydrophobicContact CG1-CD1 4.45Å; V469-L472 HydrophobicContact CG1-CD2 3.67Å; V469-L472 HydrophobicContact CG1-CG 4.13Å; N470-L472 VanDerWaalsContact C-N 3.29Å; L472-Y478 HydrophobicContact CB-CE2 3.9Å; L472-Y478 HydrophobicContact CD2-CD1 4.2Å; L472-Y478 HydrophobicContact CD2-CD2 4.33Å; L472-Y478 HydrophobicContact CD2-CE1 3.87Å; L472-Y478 HydrophobicContact CD2-CE2 3.97Å; L472-Y478 HydrophobicContact CD2-CG 4.43Å; L472-Y478 HydrophobicContact CG-CE2 4.35Å; L472-F504 HydrophobicContact CD1-CE2 3.7Å; L472-F504 HydrophobicContact CD1-CZ 3.79Å; L472-T506 HydrophobicContact CB-CG2 3.78Å; L472-T506 HydrophobicContact CD1-CG2 3.81Å; L472-T506 HydrophobicContact CG-CG2 4.45Å
473	V	81.5	Confident	84.5	Confident	83 Å²	83	48.6 Å²	48.6	50%	0.503	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-78.4	147.7	171.1	-177.3	0	0	0	0	108.9	T476 Y478 T506	V473-T476 HydrophobicContact CB-CG2 4.11Å; V473-T476 HydrophobicContact CG1-CG2 3.76Å; V473-T476 PolarHBondContact O-OG1 3.38Å; V473-Y478 PolarHBondContact N-OH 3.28Å; V473-T506 VanDerWaalsContact O-CB 3.31Å; V473-T506 WeakPolarHBondContact O-CB 3.29Å; V473-T506 WeakPolarHBondContact O-CG2 3.14Å; V473-T506 PolarHBondContact O-OG1 3.16Å
474	S	84.1	Confident	84.8	Confident	50 Å²	50	43.5 Å²	43.5	35%	0.35	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	139.7	179.4	52.4	0	0	0	0	112.3	T424 T476 K507	T424-S474 VanDerWaalsContact O-CA 3.25Å; T424-S474 WeakPolarHBondContact O-CA 3.23Å; T424-S474 WeakPolarHBondContact O-CB 3.44Å; T424-S474 PolarHBondContact O-N 3.22Å; S474-T476 VanDerWaalsContact C-N 3.33Å; S474-T476 PolarHBondContact O-N 2.79Å; S474-K507 WeakPolarHBondContact CB-O 3.37Å
475	G	82.4	Confident	84.7	Confident	36 Å²	36	42.4 Å²	42.4	37%	0.371	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	12	179.8	0	0	0	0	0	116	T506 K507	G475-T506 PolarHBondContact N-OG1 3.01Å; G475-K507 PolarHBondContact N-O 3.07Å; G475-K507 VanDerWaalsContact N-O 3.11Å
476	T	83.1	Confident	84.5	Confident	19 Å²	19	38.3 Å²	38.3	12%	0.117	23%	0.226	C	C	.	.			trans	-107.1	155.2	-177.3	56.9	0	0	0	0	113.1	V473 S474 Y478 F505 T506	V473-T476 HydrophobicContact CB-CG2 4.11Å; V473-T476 HydrophobicContact CG1-CG2 3.76Å; V473-T476 PolarHBondContact O-OG1 3.38Å; S474-T476 VanDerWaalsContact C-N 3.33Å; S474-T476 PolarHBondContact O-N 2.79Å; T476-Y478 WeakPolarHBondContact OG1-CE2 3.08Å; T476-F505 WeakPolarHBondContact O-CA 3.33Å; T476-T506 PolarHBondContact N-OG1 2.72Å; T476-T506 VanDerWaalsContact N-OG1 3.11Å; T476-T506 PolarHBondContact O-N 2.9Å; T476-T506 PolarHBondContact O-OG1 2.67Å
477	G	88.5	Confident	83.6	Confident	4 Å²	4	40.1 Å²	40.1	4%	0.041	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	140.8	172.6	0	0	0	0	0	112	C449 S450 F505	C449-G477 CarbonylContact C-O 3.16Å; C449-G477 WeakPolarHBondContact CA-O 3.34Å; S450-G477 PolarHBondContact N-O 2.89Å; S450-G477 PolarHBondContact OG-O 3.04Å; G477-F505 VanDerWaalsContact CA-CD1 3.44Å
478	Y	87.4	Confident	82.4	Confident	15 Å²	15	40.7 Å²	40.7	6%	0.059	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	123.7	176.6	-76.4	-78.5	0	0	0	111.6	Y447 N448 C449 L472 V473 T476 Q503 F504 T506	Y447-Y478 HydrophobicContact CD2-CD1 4.25Å; Y447-Y478 HydrophobicContact CD2-CE1 4.48Å; N448-Y478 WeakPolarHBondContact O-CA 3.34Å; N448-Y478 WeakPolarHBondContact O-CD1 3.45Å; C449-Y478 HydrophobicContact CB-CD1 4.41Å; C449-Y478 HydrophobicContact CB-CE1 3.85Å; L472-Y478 HydrophobicContact CB-CE2 3.9Å; L472-Y478 HydrophobicContact CD2-CD1 4.2Å; L472-Y478 HydrophobicContact CD2-CD2 4.33Å; L472-Y478 HydrophobicContact CD2-CE1 3.87Å; L472-Y478 HydrophobicContact CD2-CE2 3.97Å; L472-Y478 HydrophobicContact CD2-CG 4.43Å; L472-Y478 HydrophobicContact CG-CE2 4.35Å; V473-Y478 PolarHBondContact N-OH 3.28Å; T476-Y478 WeakPolarHBondContact OG1-CE2 3.08Å; Y478-Q503 WeakPolarHBondContact O-CA 3.19Å; Y478-F504 HydrophobicContact CD2-CE2 4.2Å; Y478-F504 HydrophobicContact CD2-CZ 4.24Å; Y478-F504 HydrophobicContact CG-CE1 4.46Å; Y478-F504 HydrophobicContact CG-CE2 4.44Å; Y478-F504 HydrophobicContact CG-CZ 4.05Å; Y478-F504 PolarHBondContact N-O 3.41Å; Y478-F504 PolarHBondContact O-N 2.85Å; Y478-T506 HydrophobicContact CD2-CG2 4.03Å; Y478-T506 HydrophobicContact CE2-CG2 3.88Å
479	D	87.7	Confident	80.9	Confident	85 Å²	85	44.8 Å²	44.8	46%	0.455	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.2	168.1	-82	-10.7	0	0	0	109	Y447 N448 Q503	Y447-D479 VanDerWaalsContact CA-O 3.22Å; Y447-D479 WeakPolarHBondContact CA-O 3.41Å; N448-D479 PolarHBondContact N-O 3.16Å; N448-D479 PolarHBondContact O-N 2.82Å; N448-D479 VanDerWaalsContact O-N 3.11Å; D479-Q503 WeakPolarHBondContact OD1-CG 3.4Å; D479-Q503 PolarHBondContact OD1-NE2 2.88Å
480	L	89.5	Confident	79.5	Confident	2 Å²	2	49 Å²	49	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	134	-173.2	179.1	148.7	0	0	0	111.8	V417 V429 L445 Q446 Y447 V469 V482 C501 A502 F504	V417-L480 HydrophobicContact CG1-CD2 4.33Å; V429-L480 HydrophobicContact CG1-CD2 3.85Å; V429-L480 HydrophobicContact CG2-CD1 3.66Å; V429-L480 HydrophobicContact CG2-CD2 4.12Å; L445-L480 HydrophobicContact CD1-CD1 4.05Å; L445-L480 HydrophobicContact CD1-CD2 3.85Å; L445-L480 HydrophobicContact CD1-CG 4.03Å; L445-L480 HydrophobicContact CD2-CD1 4.43Å; L445-L480 HydrophobicContact CG-CD1 4.37Å; Q446-L480 CarbonylContact O-C 3.41Å; Q446-L480 WeakPolarHBondContact O-CA 3.31Å; Y447-L480 HydrophobicContact CG-CD1 4.48Å; V469-L480 HydrophobicContact CG2-CD1 4.21Å; L480-V482 HydrophobicContact CD2-CG2 4.39Å; L480-C501 CarbonylContact O-C 3.06Å; L480-C501 WeakPolarHBondContact O-CA 3.04Å; L480-C501 WeakPolarHBondContact O-CB 3.04Å; L480-A502 PolarHBondContact N-O 2.68Å; L480-A502 VanDerWaalsContact N-O 3.15Å; L480-A502 PolarHBondContact O-N 3.04Å; L480-F504 HydrophobicContact CB-CE1 4.1Å; L480-F504 HydrophobicContact CD1-CE1 4Å
481	C	87.9	Confident	78.2	Confident	35 Å²	35	48.8 Å²	48.8	24%	0.236	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.4	176.3	-68.5	0	0	0	0	111.6	Q446 L483 C501	Q446-C481 PolarHBondContact N-O 3.13Å; Q446-C481 PolarHBondContact O-N 2.79Å; C481-L483 HydrophobicContact CB-CD1 4.46Å; C481-C501 HydrophobicContact CB-CB 4.07Å; C481-C501 WeakPolarHBondContact CB-SG 3.33Å; C481-C501 WeakPolarHBondContact SG-CB 3.16Å; C481-C501 CovalentContact SG-SG 2.04Å; C481-C501 PolarHBondContact SG-SG 3.21Å
482	V	86.6	Confident	77.1	Confident	1 Å²	1	49 Å²	49	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	125.8	170.7	-177.8	0	0	0	0	108.4	V417 V429 W431 Y443 L445 L480 V499 G500	V417-V482 HydrophobicContact CG1-CG2 3.91Å; V417-V482 HydrophobicContact CG2-CB 3.86Å; V417-V482 HydrophobicContact CG2-CG2 3.76Å; V429-V482 HydrophobicContact CG1-CG2 4.22Å; W431-V482 HydrophobicContact CD2-CG1 4.05Å; W431-V482 HydrophobicContact CD2-CG2 4.41Å; W431-V482 HydrophobicContact CE3-CG2 4.28Å; W431-V482 HydrophobicContact CG-CG1 4.01Å; Y443-V482 HydrophobicContact CD1-CG1 4.29Å; L445-V482 HydrophobicContact CD1-CG2 3.76Å; L480-V482 HydrophobicContact CD2-CG2 4.39Å; V482-V499 HydrophobicContact CB-CB 4.27Å; V482-V499 HydrophobicContact CG1-CB 4.17Å; V482-V499 HydrophobicContact CG1-CG2 4.2Å; V482-V499 WeakPolarHBondContact O-CB 3.32Å; V482-V499 PolarHBondContact O-N 3.05Å; V482-G500 PolarHBondContact N-O 2.92Å; V482-G500 PolarHBondContact O-N 3.06Å
483	L	85.6	Confident	75.8	Confident	17 Å²	17	54.6 Å²	54.6	9%	0.089	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	142.5	172.6	-57.9	90.9	0	0	0	110	Y443 Q444 Q446 C481 N497 I498	Y443-L483 CarbonylContact C-O 3.47Å; Y443-L483 VanDerWaalsContact CA-O 3.24Å; Y443-L483 WeakPolarHBondContact CA-O 3.09Å; Q444-L483 HydrophobicContact CB-CB 4.42Å; Q444-L483 PolarHBondContact N-O 2.77Å; Q444-L483 PolarHBondContact O-N 2.87Å; Q446-L483 HydrophobicContact CB-CD1 4.43Å; Q446-L483 VanDerWaalsContact CD-CD1 3.49Å; Q446-L483 HydrophobicContact CG-CD1 3.86Å; C481-L483 HydrophobicContact CB-CD1 4.46Å; L483-N497 CarbonylContact C-O 3.5Å; L483-N497 VanDerWaalsContact CA-O 3.29Å; L483-N497 WeakPolarHBondContact CA-O 3.39Å; L483-I498 HydrophobicContact CD2-CG1 4.07Å; L483-I498 HydrophobicContact CG-CG1 4.19Å
484	A	82.3	Confident	74.9	Confident	4 Å²	4	54.3 Å²	54.3	3%	0.033	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	132.7	170.2	0	0	0	0	0	109.3	V440 Y443 W486 T496 N497 V499	V440-A484 HydrophobicContact CG1-CB 3.99Å; V440-A484 HydrophobicContact CG2-CB 3.98Å; Y443-A484 HydrophobicContact CD1-CB 4.04Å; Y443-A484 HydrophobicContact CE1-CB 4.03Å; A484-W486 HydrophobicContact CB-CE3 4.38Å; A484-W486 HydrophobicContact CB-CZ3 4.36Å; A484-T496 WeakPolarHBondContact O-CA 3.41Å; A484-N497 PolarHBondContact N-O 3.37Å; A484-N497 PolarHBondContact O-N 2.69Å; A484-V499 HydrophobicContact CB-CG2 3.64Å
485	M	77.6	Confident	74.2	Confident	22 Å²	22	53.7 Å²	53.7	11%	0.108	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	132.7	174.7	-50.8	-173.1	73	0	0	109.9	K441 M442 Q444 M459 A495 T496	K441-M485 PolarHBondContact N-O 2.92Å; M442-M485 HydrophobicContact CE-SD 3.8Å; M442-M485 HydrophobicContact CG-CB 3.79Å; M442-M485 HydrophobicContact CG-CG 4.02Å; M442-M485 HydrophobicContact CG-SD 3.68Å; M442-M485 PolarHBondContact O-N 2.78Å; M442-M485 HydrophobicContact SD-SD 3.9Å; Q444-M485 HydrophobicContact CB-SD 4.49Å; M459-M485 HydrophobicContact CE-SD 4.04Å; M459-M485 HydrophobicContact SD-SD 4.38Å; M485-A495 WeakPolarHBondContact CA-O 3.41Å; M485-T496 HydrophobicContact CE-CG2 3.88Å; M485-T496 HydrophobicContact CG-CG2 4.07Å
486	W	76.2	Confident	73.8	Confident	51 Å²	51	55.7 Å²	55.7	19%	0.193	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	156.1	173	61.3	78.4	0	0	0	111.5	P438 A484 T494 A495 N497	P438-W486 HydrophobicContact CB-CG 4.29Å; P438-W486 HydrophobicContact CG-CB 4.22Å; P438-W486 HydrophobicContact CG-CD2 3.39Å; P438-W486 HydrophobicContact CG-CE3 3.81Å; P438-W486 HydrophobicContact CG-CG 3.58Å; P438-W486 HydrophobicContact CG-CH2 4.39Å; P438-W486 HydrophobicContact CG-CZ2 4.06Å; P438-W486 HydrophobicContact CG-CZ3 4.28Å; A484-W486 HydrophobicContact CB-CE3 4.38Å; A484-W486 HydrophobicContact CB-CZ3 4.36Å; W486-T494 WeakPolarHBondContact O-CA 3.39Å; W486-A495 PolarHBondContact N-O 3.18Å; W486-A495 PolarHBondContact O-N 3.18Å; W486-N497 HydrophobicContact CH2-CB 3.34Å; W486-N497 HydrophobicContact CZ2-CB 4.26Å; W486-N497 HydrophobicContact CZ3-CB 3.65Å
487	D	63.5	Low	73.5	Confident	84 Å²	84	59.2 Å²	59.2	45%	0.449	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	123.6	168.9	-60.1	-31.4	0	0	0	108	K441	K441-D487 WeakPolarHBondContact CD-OD1 3.33Å; K441-D487 WeakPolarHBondContact CD-OD2 3.49Å; K441-D487 IonicContact NZ-OD1 3.28Å; K441-D487 PolarHBondContact NZ-OD1 3.31Å; K441-D487 IonicContact NZ-OD2 3.83Å; K441-D487 PolarHBondContact NZ-OD2 3.48Å
488	D	62.2	Low	73.1	Confident	53 Å²	53	63.8 Å²	63.8	28%	0.283	37%	0.374	S	S	.	.			trans	-73.9	144.2	170.9	172.8	34.1	0	0	0	110.3	A490 T491	D488-A490 PolarHBondContact OD1-N 2.94Å; D488-A490 PolarHBondContact OD2-N 3.31Å; D488-T491 CarbonylContact C-O 3.56Å; D488-T491 WeakPolarHBondContact CB-O 3.49Å; D488-T491 VanDerWaalsContact O-O 3.06Å; D488-T491 WeakPolarHBondContact OD2-CB 3.29Å; D488-T491 PolarHBondContact OD2-N 3.4Å; D488-T491 PolarHBondContact OD2-OG1 3.33Å
489	T	57.9	Low	72.8	Confident	149 Å²	149	64.5 Å²	64.5	91%	0.914	38%	0.38	S	S	*	.	S	Bend	trans	-89	-12.1	177.7	51.6	0	0	0	0	113
490	A	57.3	Low	72.6	Confident	87 Å²	87	61.3 Å²	61.3	72%	0.719	37%	0.367	S	S	*	.	S	Bend	trans	-94.5	-34.7	175.4	0	0	0	0	0	113.2	D488	D488-A490 PolarHBondContact OD1-N 2.94Å; D488-A490 PolarHBondContact OD2-N 3.31Å
491	T	56.8	Low	72.4	Confident	73 Å²	73	64.6 Å²	64.6	45%	0.448	39%	0.39	S	S	.	.	S	Bend	trans	-128.7	137.3	177.3	63.1	0	0	0	0	110.6	D488 L493	D488-T491 CarbonylContact C-O 3.56Å; D488-T491 WeakPolarHBondContact CB-O 3.49Å; D488-T491 VanDerWaalsContact O-O 3.06Å; D488-T491 WeakPolarHBondContact OD2-CB 3.29Å; D488-T491 PolarHBondContact OD2-N 3.4Å; D488-T491 PolarHBondContact OD2-OG1 3.33Å; T491-L493 PolarHBondContact O-N 3.21Å
492	T	57	Low	72.3	Confident	152 Å²	152	63.5 Å²	63.5	93%	0.933	38%	0.383	S	S	*	.	S	Bend	trans	-78.9	41.9	-177	59.4	0	0	0	0	112.8
493	L	56.2	Low	72.4	Confident	124 Å²	124	70.7 Å²	70.7	65%	0.649	42%	0.416	S	S	*	.	S	Bend	trans	-120.2	145.7	-179.2	-64.4	173.1	0	0	0	108.9	T491 A495	T491-L493 PolarHBondContact O-N 3.21Å; L493-A495 PolarHBondContact O-N 2.82Å
494	T	63.4	Low	72.4	Confident	78 Å²	78	70.6 Å²	70.6	48%	0.479	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	111.1	175.7	50.3	0	0	0	0	109.7	W486	W486-T494 WeakPolarHBondContact O-CA 3.39Å
495	A	68.8	Low	72.7	Confident	36 Å²	36	77.5 Å²	77.5	30%	0.298	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	139.8	173.6	0	0	0	0	0	110.3	M485 W486 L493	M485-A495 WeakPolarHBondContact CA-O 3.41Å; W486-A495 PolarHBondContact N-O 3.18Å; W486-A495 PolarHBondContact O-N 3.18Å; L493-A495 PolarHBondContact O-N 2.82Å
496	T	74.6	Confident	73.2	Confident	79 Å²	79	76.8 Å²	76.8	49%	0.485	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.2	177.9	60.5	0	0	0	0	110	A484 M485	A484-T496 WeakPolarHBondContact O-CA 3.41Å; M485-T496 HydrophobicContact CE-CG2 3.88Å; M485-T496 HydrophobicContact CG-CG2 4.07Å
497	N	76.4	Confident	73.6	Confident	93 Å²	93	80.5 Å²	80.5	50%	0.497	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	146.5	172.3	-170.6	23.7	0	0	0	111.2	L483 A484 W486 V499	L483-N497 CarbonylContact C-O 3.5Å; L483-N497 VanDerWaalsContact CA-O 3.29Å; L483-N497 WeakPolarHBondContact CA-O 3.39Å; A484-N497 PolarHBondContact N-O 3.37Å; A484-N497 PolarHBondContact O-N 2.69Å; W486-N497 HydrophobicContact CH2-CB 3.34Å; W486-N497 HydrophobicContact CZ2-CB 4.26Å; W486-N497 HydrophobicContact CZ3-CB 3.65Å; N497-V499 PolarHBondContact O-N 3Å
498	I	79.8	Confident	74.3	Confident	100 Å²	100	82.8 Å²	82.8	51%	0.513	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	121.1	-179.9	-59.7	169.9	0	0	0	108.6	L483	L483-I498 HydrophobicContact CD2-CG1 4.07Å; L483-I498 HydrophobicContact CG-CG1 4.19Å
499	V	81.4	Confident	74.4	Confident	29 Å²	29	85.2 Å²	85.2	18%	0.176	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	-38.4	171.5	-178.7	0	0	0	0	109.7	A416 V417 W431 V433 Y443 V482 A484 N497	A416-V499 HydrophobicContact CB-CG1 4.47Å; A416-V499 VanDerWaalsContact CB-O 3.29Å; A416-V499 WeakPolarHBondContact CB-O 3.39Å; V417-V499 HydrophobicContact CG2-CG1 4.43Å; W431-V499 HydrophobicContact CB-CG1 4.35Å; V433-V499 HydrophobicContact CG2-CG1 4.18Å; Y443-V499 HydrophobicContact CD1-CG2 4.48Å; Y443-V499 HydrophobicContact CE1-CG2 4.5Å; V482-V499 HydrophobicContact CB-CB 4.27Å; V482-V499 HydrophobicContact CG1-CB 4.17Å; V482-V499 HydrophobicContact CG1-CG2 4.2Å; V482-V499 WeakPolarHBondContact O-CB 3.32Å; V482-V499 PolarHBondContact O-N 3.05Å; A484-V499 HydrophobicContact CB-CG2 3.64Å; N497-V499 PolarHBondContact O-N 3Å
500	G	83.6	Confident	74	Confident	18 Å²	18	86.6 Å²	86.6	19%	0.186	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.2	174.3	172.2	0	0	0	0	0	111.2	V482	V482-G500 PolarHBondContact N-O 2.92Å; V482-G500 PolarHBondContact O-N 3.06Å
501	C	86	Confident	73.7	Confident	72 Å²	72	87.8 Å²	87.8	49%	0.486	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	154.2	172.7	-53.9	0	0	0	0	110.1	L480 C481	L480-C501 CarbonylContact O-C 3.06Å; L480-C501 WeakPolarHBondContact O-CA 3.04Å; L480-C501 WeakPolarHBondContact O-CB 3.04Å; C481-C501 HydrophobicContact CB-CB 4.07Å; C481-C501 WeakPolarHBondContact CB-SG 3.33Å; C481-C501 WeakPolarHBondContact SG-CB 3.16Å; C481-C501 CovalentContact SG-SG 2.04Å; C481-C501 PolarHBondContact SG-SG 3.21Å
502	A	85.4	Confident	73.1	Confident	12 Å²	12	91.6 Å²	91.6	10%	0.099	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	132.3	178.7	0	0	0	0	0	109.6	V417 V419 L480	V417-A502 HydrophobicContact CG1-CB 4.19Å; V419-A502 HydrophobicContact CG2-CB 3.79Å; L480-A502 PolarHBondContact N-O 2.68Å; L480-A502 VanDerWaalsContact N-O 3.15Å; L480-A502 PolarHBondContact O-N 3.04Å
503	Q	88	Confident	72.4	Confident	151 Å²	151	90.6 Å²	90.6	71%	0.706	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	140.2	172.7	-44.1	-173.4	-83.9	0	0	108.6	Y478 D479	Y478-Q503 WeakPolarHBondContact O-CA 3.19Å; D479-Q503 WeakPolarHBondContact OD1-CG 3.4Å; D479-Q503 PolarHBondContact OD1-NE2 2.88Å
504	F	86.6	Confident	71.5	Confident	16 Å²	16	91.6 Å²	91.6	7%	0.07	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	159.7	174.5	71.7	-80.9	0	0	0	111.3	V419 V422 A427 L472 Y478 L480 T506	V419-F504 HydrophobicContact CB-CB 4.4Å; V419-F504 HydrophobicContact CB-CD1 4.43Å; V419-F504 HydrophobicContact CB-CG 4.45Å; V419-F504 HydrophobicContact CG1-CB 4.19Å; V419-F504 HydrophobicContact CG1-CD1 4.02Å; V419-F504 HydrophobicContact CG1-CD2 4.2Å; V419-F504 HydrophobicContact CG1-CE1 4.46Å; V419-F504 HydrophobicContact CG1-CG 3.87Å; V419-F504 HydrophobicContact CG2-CD1 3.96Å; V419-F504 HydrophobicContact CG2-CG 4.45Å; V422-F504 HydrophobicContact CG1-CD2 4.11Å; V422-F504 HydrophobicContact CG1-CE2 4.43Å; V422-F504 HydrophobicContact CG2-CD2 4.17Å; A427-F504 HydrophobicContact CB-CD2 4.14Å; A427-F504 HydrophobicContact CB-CE2 3.49Å; A427-F504 VanDerWaalsContact CB-CE2 3.49Å; A427-F504 HydrophobicContact CB-CZ 3.81Å; L472-F504 HydrophobicContact CD1-CE2 3.7Å; L472-F504 HydrophobicContact CD1-CZ 3.79Å; Y478-F504 HydrophobicContact CD2-CE2 4.2Å; Y478-F504 HydrophobicContact CD2-CZ 4.24Å; Y478-F504 HydrophobicContact CG-CE1 4.46Å; Y478-F504 HydrophobicContact CG-CE2 4.44Å; Y478-F504 HydrophobicContact CG-CZ 4.05Å; Y478-F504 PolarHBondContact N-O 3.41Å; Y478-F504 PolarHBondContact O-N 2.85Å; L480-F504 HydrophobicContact CB-CE1 4.1Å; L480-F504 HydrophobicContact CD1-CE1 4Å; F504-T506 HydrophobicContact CE2-CG2 4.35Å
505	F	88.4	Confident	70.2	Confident	148 Å²	148	93 Å²	93	65%	0.649	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.7	175	-70.1	-96	0	0	0	108.9	V422 T476 G477	V422-F505 WeakPolarHBondContact CG1-O 3.21Å; T476-F505 WeakPolarHBondContact O-CA 3.33Å; G477-F505 VanDerWaalsContact CA-CD1 3.44Å
506	T	86.8	Confident	68.4	Low	8 Å²	8	99.6 Å²	99.6	5%	0.049	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-71.1	158.2	168.4	51.9	0	0	0	0	110.2	L472 V473 G475 T476 Y478 F504	L472-T506 HydrophobicContact CB-CG2 3.78Å; L472-T506 HydrophobicContact CD1-CG2 3.81Å; L472-T506 HydrophobicContact CG-CG2 4.45Å; V473-T506 VanDerWaalsContact O-CB 3.31Å; V473-T506 WeakPolarHBondContact O-CB 3.29Å; V473-T506 WeakPolarHBondContact O-CG2 3.14Å; V473-T506 PolarHBondContact O-OG1 3.16Å; G475-T506 PolarHBondContact N-OG1 3.01Å; T476-T506 PolarHBondContact N-OG1 2.72Å; T476-T506 VanDerWaalsContact N-OG1 3.11Å; T476-T506 PolarHBondContact O-N 2.9Å; T476-T506 PolarHBondContact O-OG1 2.67Å; Y478-T506 HydrophobicContact CD2-CG2 4.03Å; Y478-T506 HydrophobicContact CE2-CG2 3.88Å; F504-T506 HydrophobicContact CE2-CG2 4.35Å
507	K	84.5	Confident	66.7	Low	128 Å²	128	103.7 Å²	103.7	56%	0.557	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-70.1	138.7	174.6	-71.4	168.9	178.5	153.2	0	109.5	V422 T423 T424 S474 G475 D509	V422-K507 VanDerWaalsContact O-CE 3.28Å; V422-K507 WeakPolarHBondContact O-CE 3.3Å; V422-K507 PolarHBondContact O-NZ 3.46Å; T423-K507 PolarHBondContact O-N 3.33Å; T424-K507 HydrophobicContact CG2-CB 3.99Å; S474-K507 WeakPolarHBondContact CB-O 3.37Å; G475-K507 PolarHBondContact N-O 3.07Å; G475-K507 VanDerWaalsContact N-O 3.11Å; K507-D509 PolarHBondContact O-N 3.24Å
508	E	78.6	Confident	65	Low	132 Å²	132	103.1 Å²	103.1	62%	0.617	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-61.4	123.1	166.9	-67.8	172.3	-177.1	0	0	108.8	Y510	E508-Y510 HydrophobicContact CB-CD2 4.23Å; E508-Y510 PolarHBondContact O-N 3.28Å; E508-Y510 VanDerWaalsContact OE2-CE2 3.27Å; E508-Y510 WeakPolarHBondContact OE2-CE2 3.48Å
509	D	64.1	Low	63.6	Low	104 Å²	104	106.6 Å²	106.6	56%	0.556	55%	0.553	S	S	*	*			trans	-85.3	73.9	173.7	-159	14.7	0	0	0	108.6	T424 K507 P511	T424-D509 HydrophobicContact CG2-CB 3.68Å; K507-D509 PolarHBondContact O-N 3.24Å; D509-P511 WeakPolarHBondContact O-CD 3.39Å; D509-P511 VanDerWaalsContact O-N 3.16Å
510	Y	50.5	Low	61.9	Low	178 Å²	178	112.3 Å²	112.3	70%	0.698	58%	0.576	S	S	*	*			trans	-58	117.5	169.5	-101.6	-86.5	0	0	0	108	E508 Q512	E508-Y510 HydrophobicContact CB-CD2 4.23Å; E508-Y510 PolarHBondContact O-N 3.28Å; E508-Y510 VanDerWaalsContact OE2-CE2 3.27Å; E508-Y510 WeakPolarHBondContact OE2-CE2 3.48Å; Y510-Q512 VanDerWaalsContact C-N 3.3Å; Y510-Q512 PolarHBondContact O-N 2.88Å
511	P	50.4	Low	60.3	Low	113 Å²	113	117 Å²	117	73%	0.734	60%	0.596	S	S	*	*			trans	-65	99.9	167.6	27.8	-32.1	0	0	0	106.7	D509 C513	D509-P511 WeakPolarHBondContact O-CD 3.39Å; D509-P511 VanDerWaalsContact O-N 3.16Å; P511-C513 PolarHBondContact O-N 3.04Å
512	Q	43.6	Very low	58.6	Low	153 Å²	153	115.6 Å²	115.6	72%	0.715	59%	0.594	S	S	*	*			trans	-56	110.5	164.3	-79.9	-162.4	-5.9	0	0	105.9	Y510 Q514	Y510-Q512 VanDerWaalsContact C-N 3.3Å; Y510-Q512 PolarHBondContact O-N 2.88Å; Q512-Q514 HydrophobicContact CB-CG 4.31Å; Q512-Q514 PolarHBondContact O-N 2.86Å
513	C	43.1	Very low	57.2	Low	131 Å²	131	116.9 Å²	116.9	89%	0.885	61%	0.608	S	S	*	*			trans	-74.4	61	175	-159.3	0	0	0	0	108.8	P511 S515	P511-C513 PolarHBondContact O-N 3.04Å; C513-S515 PolarHBondContact O-N 3.05Å
514	Q	37.4	Very low	55.8	Low	145 Å²	145	112.3 Å²	112.3	68%	0.678	59%	0.591	S	S	*	*			trans	-58.4	112.3	160.5	-69.1	-168.2	7.4	0	0	105.5	Q512 M516	Q512-Q514 HydrophobicContact CB-CG 4.31Å; Q512-Q514 PolarHBondContact O-N 2.86Å; Q514-M516 VanDerWaalsContact C-N 3.33Å; Q514-M516 PolarHBondContact O-N 3.36Å
515	S	36.5	Very low	54.5	Low	108 Å²	108	116.2 Å²	116.2	76%	0.755	61%	0.61	S	S	*	*			trans	-50.2	103.1	167	177.6	0	0	0	0	107.8	C513 H517	C513-S515 PolarHBondContact O-N 3.05Å; S515-H517 VanDerWaalsContact C-N 3.27Å; S515-H517 PolarHBondContact O-N 3.31Å
516	M	31.5	Very low	53.5	Low	173 Å²	173	115.1 Å²	115.1	85%	0.852	61%	0.61	S	S	*	*			trans	-60.5	98.3	170.5	-87.5	-71.8	-75.7	0	0	106	Q514 S518	Q514-M516 VanDerWaalsContact C-N 3.33Å; Q514-M516 PolarHBondContact O-N 3.36Å; M516-S518 VanDerWaalsContact C-N 3.31Å; M516-S518 PolarHBondContact O-N 3.25Å
517	H	37.7	Very low	52.8	Low	165 Å²	165	121.1 Å²	121.1	76%	0.764	64%	0.641	S	S	*	*			trans	-60.7	98.3	-179	-170.6	85.7	0	0	0	107.2	S515 Q519	S515-H517 VanDerWaalsContact C-N 3.27Å; S515-H517 PolarHBondContact O-N 3.31Å; H517-Q519 PolarHBondContact O-N 2.85Å; H517-Q519 VanDerWaalsContact O-N 3.13Å
518	S	41.6	Very low	52.5	Low	82 Å²	82	119.3 Å²	119.3	57%	0.573	64%	0.636	S	S	*	*			trans	-58.8	121.7	-162.6	52.2	0	0	0	0	109	M516 F520	M516-S518 VanDerWaalsContact C-N 3.31Å; M516-S518 PolarHBondContact O-N 3.25Å; S518-F520 PolarHBondContact O-N 2.89Å
519	Q	50.5	Low	52.6	Low	173 Å²	173	117.6 Å²	117.6	81%	0.808	63%	0.631	S	S	*	*			trans	-57.9	111.3	-176.3	-75.1	-170.8	-12.6	0	0	108.6	H517 L521	H517-Q519 PolarHBondContact O-N 2.85Å; H517-Q519 VanDerWaalsContact O-N 3.13Å; Q519-L521 PolarHBondContact O-N 3.3Å
520	F	45.6	Very low	53.3	Low	148 Å²	148	114.1 Å²	114.1	65%	0.649	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	24.9	-158	-137.9	-94	0	0	0	113.7	S518 T524	S518-F520 PolarHBondContact O-N 2.89Å; F520-T524 HydrophobicContact CD1-CG2 4.47Å; F520-T524 WeakPolarHBondContact O-CG2 3.5Å; F520-T524 PolarHBondContact O-OG1 2.78Å
521	L	50.1	Low	55	Low	117 Å²	117	107.6 Å²	107.6	61%	0.613	61%	0.606	S	S	*	*	H	α-helix	trans	-87.2	-27.9	176.2	-70.8	92.6	0	0	0	112.4	Q519 T524 M525	Q519-L521 PolarHBondContact O-N 3.3Å; L521-T524 WeakPolarHBondContact CA-OG1 3.41Å; L521-T524 PolarHBondContact O-OG1 2.82Å; L521-M525 VanDerWaalsContact O-CB 3.31Å; L521-M525 WeakPolarHBondContact O-CB 3.37Å; L521-M525 WeakPolarHBondContact O-CG 3.08Å; L521-M525 PolarHBondContact O-N 2.82Å
522	G	50.1	Low	56.9	Low	43 Å²	43	106.9 Å²	106.9	44%	0.443	60%	0.595	S	S	.	*	H	α-helix	trans	-63.1	-53.3	176.6	0	0	0	0	0	112.4	T524 M525 I526	G522-T524 PolarHBondContact O-N 3.45Å; G522-M525 PolarHBondContact O-N 2.86Å; G522-I526 VanDerWaalsContact O-CG1 3.29Å; G522-I526 WeakPolarHBondContact O-CG1 3.42Å; G522-I526 PolarHBondContact O-N 2.92Å
523	G	56.2	Low	59.1	Low	39 Å²	39	103.8 Å²	103.8	40%	0.402	58%	0.582	S	S	.	*	H	α-helix	trans	-65.4	-36.4	-179.5	0	0	0	0	0	113.8	I526 L527	G523-I526 PolarHBondContact O-N 2.89Å; G523-L527 WeakPolarHBondContact O-CB 3.31Å; G523-L527 WeakPolarHBondContact O-CG 3.26Å; G523-L527 PolarHBondContact O-N 2.83Å
524	T	58.9	Low	61.3	Low	55 Å²	55	101.6 Å²	101.6	34%	0.337	57%	0.565	S	S	.	*	H	α-helix	trans	-71.2	-40.2	176.6	46.3	0	0	0	0	112	F520 L521 G522 L527 I528	F520-T524 HydrophobicContact CD1-CG2 4.47Å; F520-T524 WeakPolarHBondContact O-CG2 3.5Å; F520-T524 PolarHBondContact O-OG1 2.78Å; L521-T524 WeakPolarHBondContact CA-OG1 3.41Å; L521-T524 PolarHBondContact O-OG1 2.82Å; G522-T524 PolarHBondContact O-N 3.45Å; T524-L527 PolarHBondContact O-N 3.03Å; T524-I528 WeakPolarHBondContact O-CB 3.37Å; T524-I528 WeakPolarHBondContact O-CD1 3.28Å; T524-I528 VanDerWaalsContact O-CG1 3.23Å; T524-I528 WeakPolarHBondContact O-CG1 3.4Å; T524-I528 PolarHBondContact O-N 3.47Å
525	M	57.8	Low	63.8	Low	97 Å²	97	97.1 Å²	97.1	48%	0.478	55%	0.553	S	S	.	*	H	α-helix	trans	-62.3	-42.4	171.6	-72.9	-65.2	120.1	0	0	112.2	L521 G522 L527 I528 I529	L521-M525 VanDerWaalsContact O-CB 3.31Å; L521-M525 WeakPolarHBondContact O-CB 3.37Å; L521-M525 WeakPolarHBondContact O-CG 3.08Å; L521-M525 PolarHBondContact O-N 2.82Å; G522-M525 PolarHBondContact O-N 2.86Å; M525-L527 PolarHBondContact O-N 2.03Å; M525-I528 HydrophobicContact CE-CD1 4.07Å; M525-I528 PolarHBondContact O-N 3.03Å; M525-I529 WeakPolarHBondContact O-CB 3.23Å; M525-I529 VanDerWaalsContact O-CG1 3.24Å; M525-I529 WeakPolarHBondContact O-CG1 3.49Å; M525-I529 PolarHBondContact O-N 3.22Å
526	I	69	Low	66.3	Low	125 Å²	125	96 Å²	96	64%	0.641	54%	0.541	S	S	*	.	H	α-helix	trans	-62.5	-42.9	176.7	-70.5	165.6	0	0	0	111.4	G522 G523 G530	G522-I526 VanDerWaalsContact O-CG1 3.29Å; G522-I526 WeakPolarHBondContact O-CG1 3.42Å; G522-I526 PolarHBondContact O-N 2.92Å; G523-I526 PolarHBondContact O-N 2.89Å; I526-G530 PolarHBondContact O-N 2.71Å
527	L	72.2	Confident	69	Low	135 Å²	135	92.3 Å²	92.3	71%	0.707	52%	0.524	S	S	*	.	H	α-helix	trans	-67	-37.9	176.1	-74.8	170.2	0	0	0	112.9	G523 T524 M525 G531	G523-L527 WeakPolarHBondContact O-CB 3.31Å; G523-L527 WeakPolarHBondContact O-CG 3.26Å; G523-L527 PolarHBondContact O-N 2.83Å; T524-L527 PolarHBondContact O-N 3.03Å; M525-L527 PolarHBondContact O-N 2.03Å; L527-G531 PolarHBondContact O-N 2.78Å
528	I	76.5	Confident	71.4	Confident	89 Å²	89	89.2 Å²	89.2	46%	0.456	51%	0.513	S	S	.	.	H	α-helix	trans	-68.7	-48.6	177.1	-71.1	164.5	0	0	0	110.6	T524 M525 G531 I532	T524-I528 WeakPolarHBondContact O-CB 3.37Å; T524-I528 WeakPolarHBondContact O-CD1 3.28Å; T524-I528 VanDerWaalsContact O-CG1 3.23Å; T524-I528 WeakPolarHBondContact O-CG1 3.4Å; T524-I528 PolarHBondContact O-N 3.47Å; M525-I528 HydrophobicContact CE-CD1 4.07Å; M525-I528 PolarHBondContact O-N 3.03Å; I528-G531 PolarHBondContact O-N 2.89Å; I528-I532 HydrophobicContact CG2-CD1 3.82Å; I528-I532 VanDerWaalsContact O-CG1 3.26Å; I528-I532 WeakPolarHBondContact O-CG1 3.45Å; I528-I532 PolarHBondContact O-N 3.33Å
529	I	80.6	Confident	73.7	Confident	97 Å²	97	89.4 Å²	89.4	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-64.3	-46.2	179.1	-67.4	165.6	0	0	0	110.4	M525 G531 I532 I533	M525-I529 WeakPolarHBondContact O-CB 3.23Å; M525-I529 VanDerWaalsContact O-CG1 3.24Å; M525-I529 WeakPolarHBondContact O-CG1 3.49Å; M525-I529 PolarHBondContact O-N 3.22Å; I529-G531 PolarHBondContact O-N 2.92Å; I529-I532 PolarHBondContact O-N 3.25Å; I529-I533 HydrophobicContact CG2-CD1 3.86Å; I529-I533 VanDerWaalsContact O-CG1 3.31Å; I529-I533 WeakPolarHBondContact O-CG1 3.45Å; I529-I533 PolarHBondContact O-N 2.97Å
530	G	80.3	Confident	75.5	Confident	31 Å²	31	87.1 Å²	87.1	32%	0.32	50%	0.498	S	S	.	.	H	α-helix	trans	-60.2	-42.7	174.4	0	0	0	0	0	112.6	I526 I533 V534	I526-G530 PolarHBondContact O-N 2.71Å; G530-I533 PolarHBondContact O-N 3.01Å; G530-V534 WeakPolarHBondContact O-CG2 3.42Å; G530-V534 PolarHBondContact O-N 3.48Å
531	G	85.8	Confident	77.5	Confident	40 Å²	40	84.2 Å²	84.2	41%	0.412	49%	0.489	S	S	.	.	H	α-helix	trans	-61.7	-41.8	175.2	0	0	0	0	0	113.2	L527 I528 I529 V534 A535	L527-G531 PolarHBondContact O-N 2.78Å; I528-G531 PolarHBondContact O-N 2.89Å; I529-G531 PolarHBondContact O-N 2.92Å; G531-V534 PolarHBondContact O-N 2.61Å; G531-A535 WeakPolarHBondContact O-CB 3.09Å; G531-A535 PolarHBondContact O-N 3.35Å
532	I	90.4	Very high	79.3	Confident	99 Å²	99	82.7 Å²	82.7	51%	0.508	48%	0.484	S	S	.	.	H	α-helix	trans	-64.7	-42.8	175.3	-69.5	163.5	0	0	0	110.8	I528 I529 A535 T536	I528-I532 HydrophobicContact CG2-CD1 3.82Å; I528-I532 VanDerWaalsContact O-CG1 3.26Å; I528-I532 WeakPolarHBondContact O-CG1 3.45Å; I528-I532 PolarHBondContact O-N 3.33Å; I529-I532 PolarHBondContact O-N 3.25Å; I532-A535 PolarHBondContact O-N 3.39Å; I532-T536 HydrophobicContact CG2-CG2 4.44Å; I532-T536 WeakPolarHBondContact O-CB 3.41Å; I532-T536 WeakPolarHBondContact O-CG2 3.17Å; I532-T536 PolarHBondContact O-N 3.42Å; I532-T536 PolarHBondContact O-OG1 2.67Å
533	I	89.3	Confident	80.9	Confident	88 Å²	88	84.8 Å²	84.8	45%	0.451	48%	0.484	S	S	.	.	H	α-helix	trans	-63	-46.8	177.2	-68.6	165.5	0	0	0	110.8	I529 G530 T536 L537	I529-I533 HydrophobicContact CG2-CD1 3.86Å; I529-I533 VanDerWaalsContact O-CG1 3.31Å; I529-I533 WeakPolarHBondContact O-CG1 3.45Å; I529-I533 PolarHBondContact O-N 2.97Å; G530-I533 PolarHBondContact O-N 3.01Å; I533-T536 PolarHBondContact O-N 3.31Å; I533-T536 PolarHBondContact O-OG1 3.39Å; I533-T536 VanDerWaalsContact O-OG1 3.06Å; I533-L537 HydrophobicContact CG2-CD1 3.93Å; I533-L537 WeakPolarHBondContact O-CB 3.03Å; I533-L537 VanDerWaalsContact O-CG 3.31Å; I533-L537 WeakPolarHBondContact O-CG 3.32Å; I533-L537 PolarHBondContact O-N 2.89Å
534	V	90.1	Very high	82	Confident	85 Å²	85	87.3 Å²	87.3	52%	0.515	49%	0.488	S	S	.	.	H	α-helix	trans	-65	-42.3	177.3	172.7	0	0	0	0	111.7	G530 G531 L537 L538	G530-V534 WeakPolarHBondContact O-CG2 3.42Å; G530-V534 PolarHBondContact O-N 3.48Å; G531-V534 PolarHBondContact O-N 2.61Å; V534-L537 PolarHBondContact O-N 2.89Å; V534-L538 HydrophobicContact CG1-CD1 3.95Å; V534-L538 HydrophobicContact CG1-CG 4.45Å; V534-L538 WeakPolarHBondContact O-CB 3.27Å; V534-L538 WeakPolarHBondContact O-CG 3.49Å; V534-L538 PolarHBondContact O-N 3.33Å
535	A	88.8	Confident	82.9	Confident	51 Å²	51	90.9 Å²	90.9	42%	0.421	50%	0.502	S	S	.	.	H	α-helix	trans	-64.9	-43.3	178.2	0	0	0	0	0	112.3	G531 I532 L538 V539	G531-A535 WeakPolarHBondContact O-CB 3.09Å; G531-A535 PolarHBondContact O-N 3.35Å; I532-A535 PolarHBondContact O-N 3.39Å; A535-L538 PolarHBondContact O-N 3.44Å; A535-V539 WeakPolarHBondContact O-CB 3.41Å; A535-V539 WeakPolarHBondContact O-CG2 3.26Å; A535-V539 PolarHBondContact O-N 3.41Å
536	T	89.2	Confident	83.9	Confident	84 Å²	84	90.2 Å²	90.2	52%	0.515	50%	0.504	S	S	.	.	H	α-helix	trans	-68	-38.5	177.3	49.2	0	0	0	0	112.4	I532 I533 V539 F540	I532-T536 HydrophobicContact CG2-CG2 4.44Å; I532-T536 WeakPolarHBondContact O-CB 3.41Å; I532-T536 WeakPolarHBondContact O-CG2 3.17Å; I532-T536 PolarHBondContact O-N 3.42Å; I532-T536 PolarHBondContact O-OG1 2.67Å; I533-T536 PolarHBondContact O-N 3.31Å; I533-T536 PolarHBondContact O-OG1 3.39Å; I533-T536 VanDerWaalsContact O-OG1 3.06Å; T536-V539 PolarHBondContact O-N 3.41Å; T536-F540 WeakPolarHBondContact O-CB 3.34Å; T536-F540 PolarHBondContact O-N 2.84Å
537	L	88.3	Confident	83.9	Confident	95 Å²	95	93 Å²	93	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-62.1	-45	170.8	-77.1	168.9	0	0	0	112.2	I533 V534 F540 I541	I533-L537 HydrophobicContact CG2-CD1 3.93Å; I533-L537 WeakPolarHBondContact O-CB 3.03Å; I533-L537 VanDerWaalsContact O-CG 3.31Å; I533-L537 WeakPolarHBondContact O-CG 3.32Å; I533-L537 PolarHBondContact O-N 2.89Å; V534-L537 PolarHBondContact O-N 2.89Å; L537-F540 PolarHBondContact O-N 2.57Å; L537-I541 WeakPolarHBondContact O-CB 3.33Å; L537-I541 VanDerWaalsContact O-CG1 3.26Å; L537-I541 WeakPolarHBondContact O-CG1 3.3Å; L537-I541 PolarHBondContact O-N 3.15Å
538	L	87.8	Confident	83.6	Confident	101 Å²	101	94.7 Å²	94.7	53%	0.529	50%	0.504	S	S	.	.	H	α-helix	trans	-63.2	-42.4	176.8	-75.7	170.6	0	0	0	112	V534 A535 I541 V542	V534-L538 HydrophobicContact CG1-CD1 3.95Å; V534-L538 HydrophobicContact CG1-CG 4.45Å; V534-L538 WeakPolarHBondContact O-CB 3.27Å; V534-L538 WeakPolarHBondContact O-CG 3.49Å; V534-L538 PolarHBondContact O-N 3.33Å; A535-L538 PolarHBondContact O-N 3.44Å; L538-I541 PolarHBondContact O-N 2.04Å; L538-V542 WeakPolarHBondContact O-CB 3.38Å; L538-V542 VanDerWaalsContact O-CG2 3.32Å; L538-V542 WeakPolarHBondContact O-CG2 2.99Å; L538-V542 PolarHBondContact O-N 3.03Å
539	V	90.8	Very high	82.9	Confident	86 Å²	86	97.9 Å²	97.9	52%	0.521	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-41.7	174.1	168.9	0	0	0	0	111.1	A535 T536 V542 I543	A535-V539 WeakPolarHBondContact O-CB 3.41Å; A535-V539 WeakPolarHBondContact O-CG2 3.26Å; A535-V539 PolarHBondContact O-N 3.41Å; T536-V539 PolarHBondContact O-N 3.41Å; V539-V542 PolarHBondContact O-N 3.12Å; V539-I543 HydrophobicContact CG1-CD1 3.76Å; V539-I543 HydrophobicContact CG1-CG1 4.43Å; V539-I543 WeakPolarHBondContact O-CB 3.42Å; V539-I543 VanDerWaalsContact O-CG1 3.26Å; V539-I543 WeakPolarHBondContact O-CG1 3.32Å; V539-I543 PolarHBondContact O-N 3.01Å
540	F	88.1	Confident	81.8	Confident	124 Å²	124	98 Å²	98	54%	0.544	52%	0.519	S	S	.	.	H	α-helix	trans	-63.9	-43.4	176.1	-174.4	-107.5	0	0	0	112.2	T536 L537 I543 L544	T536-F540 WeakPolarHBondContact O-CB 3.34Å; T536-F540 PolarHBondContact O-N 2.84Å; L537-F540 PolarHBondContact O-N 2.57Å; F540-I543 PolarHBondContact O-N 3.31Å; F540-L544 HydrophobicContact CD1-CD1 3.88Å; F540-L544 HydrophobicContact CD1-CG 4.49Å; F540-L544 HydrophobicContact CE1-CD1 3.52Å; F540-L544 HydrophobicContact CE1-CG 4.25Å; F540-L544 HydrophobicContact CZ-CD1 4.05Å; F540-L544 HydrophobicContact CZ-CG 4.4Å; F540-L544 WeakPolarHBondContact O-CG 3.36Å; F540-L544 PolarHBondContact O-N 2.8Å
541	I	88.2	Confident	80.3	Confident	88 Å²	88	100.9 Å²	100.9	45%	0.451	53%	0.534	S	S	.	.	H	α-helix	trans	-61.5	-44.1	173.9	-69.5	163.1	0	0	0	110.7	L537 L538 L544 M545	L537-I541 WeakPolarHBondContact O-CB 3.33Å; L537-I541 VanDerWaalsContact O-CG1 3.26Å; L537-I541 WeakPolarHBondContact O-CG1 3.3Å; L537-I541 PolarHBondContact O-N 3.15Å; L538-I541 PolarHBondContact O-N 2.04Å; I541-L544 PolarHBondContact O-N 3.12Å; I541-M545 HydrophobicContact CG2-CG 4.4Å; I541-M545 WeakPolarHBondContact O-CG 3.47Å; I541-M545 PolarHBondContact O-N 3.09Å
542	V	86.3	Confident	78.6	Confident	85 Å²	85	104.6 Å²	104.6	52%	0.515	54%	0.544	S	S	.	.	H	α-helix	trans	-64.3	-40.9	176.3	169.9	0	0	0	0	111.4	L538 V539 L544 M545 V546	L538-V542 WeakPolarHBondContact O-CB 3.38Å; L538-V542 VanDerWaalsContact O-CG2 3.32Å; L538-V542 WeakPolarHBondContact O-CG2 2.99Å; L538-V542 PolarHBondContact O-N 3.03Å; V539-V542 PolarHBondContact O-N 3.12Å; V542-L544 VanDerWaalsContact C-N 3.34Å; V542-L544 PolarHBondContact O-N 3.05Å; V542-M545 PolarHBondContact O-N 2.93Å; V542-V546 HydrophobicContact CG1-CG2 4.3Å; V542-V546 WeakPolarHBondContact O-CB 3.29Å; V542-V546 VanDerWaalsContact O-CG2 3.27Å; V542-V546 WeakPolarHBondContact O-CG2 3.43Å; V542-V546 PolarHBondContact O-N 3.31Å
543	I	84.4	Confident	76.4	Confident	86 Å²	86	106.9 Å²	106.9	44%	0.441	56%	0.558	S	S	.	*	H	α-helix	trans	-62.4	-41.4	174.4	-71.5	166.1	0	0	0	111	V539 F540 V546 R547	V539-I543 HydrophobicContact CG1-CD1 3.76Å; V539-I543 HydrophobicContact CG1-CG1 4.43Å; V539-I543 WeakPolarHBondContact O-CB 3.42Å; V539-I543 VanDerWaalsContact O-CG1 3.26Å; V539-I543 WeakPolarHBondContact O-CG1 3.32Å; V539-I543 PolarHBondContact O-N 3.01Å; F540-I543 PolarHBondContact O-N 3.31Å; I543-V546 PolarHBondContact O-N 2.77Å; I543-R547 WeakPolarHBondContact O-CB 3.36Å; I543-R547 WeakPolarHBondContact O-CG 3.39Å; I543-R547 PolarHBondContact O-N 2.95Å
544	L	79.8	Confident	74.5	Confident	92 Å²	92	106.6 Å²	106.6	48%	0.482	57%	0.568	S	S	.	*	H	α-helix	trans	-64.5	-45.4	174	-74.9	176	0	0	0	111.8	F540 I541 V542 V546 R547 Y548	F540-L544 HydrophobicContact CD1-CD1 3.88Å; F540-L544 HydrophobicContact CD1-CG 4.49Å; F540-L544 HydrophobicContact CE1-CD1 3.52Å; F540-L544 HydrophobicContact CE1-CG 4.25Å; F540-L544 HydrophobicContact CZ-CD1 4.05Å; F540-L544 HydrophobicContact CZ-CG 4.4Å; F540-L544 WeakPolarHBondContact O-CG 3.36Å; F540-L544 PolarHBondContact O-N 2.8Å; I541-L544 PolarHBondContact O-N 3.12Å; V542-L544 VanDerWaalsContact C-N 3.34Å; V542-L544 PolarHBondContact O-N 3.05Å; L544-V546 VanDerWaalsContact C-N 3.34Å; L544-V546 PolarHBondContact O-N 2.91Å; L544-R547 PolarHBondContact O-N 3.18Å; L544-Y548 VanDerWaalsContact O-CB 3.23Å; L544-Y548 WeakPolarHBondContact O-CB 3.49Å; L544-Y548 PolarHBondContact O-N 3.08Å
545	M	76.7	Confident	72.2	Confident	130 Å²	130	110.8 Å²	110.8	64%	0.64	58%	0.583	S	S	*	*	H	α-helix	trans	-65	-36.2	176.7	-67.7	-148.1	84.2	0	0	112.4	I541 V542 K549	I541-M545 HydrophobicContact CG2-CG 4.4Å; I541-M545 WeakPolarHBondContact O-CG 3.47Å; I541-M545 PolarHBondContact O-N 3.09Å; V542-M545 PolarHBondContact O-N 2.93Å; M545-K549 WeakPolarHBondContact O-CB 3.36Å; M545-K549 PolarHBondContact O-N 3.43Å
546	V	78.7	Confident	69.9	Low	84 Å²	84	112.4 Å²	112.4	51%	0.509	60%	0.604	S	S	.	*	H	α-helix	trans	-67.4	-46.5	173.8	168.6	0	0	0	0	110.6	V542 I543 L544 Y548 K549 V550	V542-V546 HydrophobicContact CG1-CG2 4.3Å; V542-V546 WeakPolarHBondContact O-CB 3.29Å; V542-V546 VanDerWaalsContact O-CG2 3.27Å; V542-V546 WeakPolarHBondContact O-CG2 3.43Å; V542-V546 PolarHBondContact O-N 3.31Å; I543-V546 PolarHBondContact O-N 2.77Å; L544-V546 VanDerWaalsContact C-N 3.34Å; L544-V546 PolarHBondContact O-N 2.91Å; V546-Y548 PolarHBondContact O-N 3.01Å; V546-K549 PolarHBondContact O-N 3.26Å; V546-V550 HydrophobicContact CG1-CG2 4.39Å; V546-V550 WeakPolarHBondContact O-CB 3.36Å; V546-V550 VanDerWaalsContact O-CG2 3.28Å; V546-V550 WeakPolarHBondContact O-CG2 3.36Å; V546-V550 PolarHBondContact O-N 3.43Å
547	R	69.5	Low	67.1	Low	182 Å²	182	118 Å²	118	69%	0.687	62%	0.621	S	S	*	*	H	α-helix	trans	-62.7	-41.9	175.2	-77.3	-169.1	171.9	-146.8	-1.9	112	I543 L544 K549 V550 C551	I543-R547 WeakPolarHBondContact O-CB 3.36Å; I543-R547 WeakPolarHBondContact O-CG 3.39Å; I543-R547 PolarHBondContact O-N 2.95Å; L544-R547 PolarHBondContact O-N 3.18Å; R547-K549 PolarHBondContact O-N 3.46Å; R547-V550 PolarHBondContact O-N 3.4Å; R547-C551 PolarHBondContact O-N 3.17Å; R547-C551 PolarHBondContact O-SG 3.43Å
548	Y	66.9	Low	64.4	Low	171 Å²	171	122.4 Å²	122.4	67%	0.671	64%	0.641	S	S	*	*	H	α-helix	trans	-60.4	-44.3	174.6	-168.7	-98.5	0	0	0	111.4	L544 V546 C551 N552	L544-Y548 VanDerWaalsContact O-CB 3.23Å; L544-Y548 WeakPolarHBondContact O-CB 3.49Å; L544-Y548 PolarHBondContact O-N 3.08Å; V546-Y548 PolarHBondContact O-N 3.01Å; Y548-C551 PolarHBondContact O-N 2.88Å; Y548-N552 VanDerWaalsContact O-CB 3.27Å; Y548-N552 WeakPolarHBondContact O-CB 3.46Å; Y548-N552 PolarHBondContact O-N 3.29Å
549	K	61.8	Low	61.7	Low	156 Å²	156	123.1 Å²	123.1	68%	0.678	66%	0.655	S	S	*	*	H	α-helix	trans	-70.1	-32.1	177.8	-167.3	168.7	-174.8	173.8	0	113.4	M545 V546 R547 N553	M545-K549 WeakPolarHBondContact O-CB 3.36Å; M545-K549 PolarHBondContact O-N 3.43Å; V546-K549 PolarHBondContact O-N 3.26Å; R547-K549 PolarHBondContact O-N 3.46Å; K549-N553 PolarHBondContact O-N 3.33Å
550	V	56.3	Low	58.9	Low	99 Å²	99	123.8 Å²	123.8	60%	0.6	66%	0.663	S	S	*	*	H	α-helix	trans	-68.9	-44.7	172.4	167.5	0	0	0	0	110.9	V546 R547 N553	V546-V550 HydrophobicContact CG1-CG2 4.39Å; V546-V550 WeakPolarHBondContact O-CB 3.36Å; V546-V550 VanDerWaalsContact O-CG2 3.28Å; V546-V550 WeakPolarHBondContact O-CG2 3.36Å; V546-V550 PolarHBondContact O-N 3.43Å; R547-V550 PolarHBondContact O-N 3.4Å; V550-N553 PolarHBondContact O-N 3.39Å
551	C	50	Low	56.3	Low	93 Å²	93	124.5 Å²	124.5	63%	0.628	68%	0.678	S	S	*	*	H	α-helix	trans	-64.7	-41.6	174.6	-67.2	0	0	0	0	112.3	R547 Y548 N553 A554	R547-C551 PolarHBondContact O-N 3.17Å; R547-C551 PolarHBondContact O-SG 3.43Å; Y548-C551 PolarHBondContact O-N 2.88Å; C551-N553 PolarHBondContact O-N 2.88Å; C551-A554 PolarHBondContact O-N 3.02Å
552	N	48.4	Very low	53.6	Low	117 Å²	117	124.2 Å²	124.2	63%	0.626	68%	0.684	S	S	*	*	H	α-helix	trans	-73.3	-13.2	-177.3	-156.5	33.5	0	0	0	113.7	Y548 A554	Y548-N552 VanDerWaalsContact O-CB 3.27Å; Y548-N552 WeakPolarHBondContact O-CB 3.46Å; Y548-N552 PolarHBondContact O-N 3.29Å; N552-A554 PolarHBondContact O-N 2.89Å
553	N	44.9	Very low	51.1	Low	147 Å²	147	127.6 Å²	127.6	79%	0.786	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-3.1	172.2	-109.8	24	0	0	0	113.5	K549 V550 C551	K549-N553 PolarHBondContact O-N 3.33Å; V550-N553 PolarHBondContact O-N 3.39Å; C551-N553 PolarHBondContact O-N 2.88Å
554	A	50.6	Low	48.6	Very low	82 Å²	82	129.7 Å²	129.7	68%	0.678	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	13.2	-170.2	0	0	0	0	0	115.5	C551 N552	C551-A554 PolarHBondContact O-N 3.02Å; N552-A554 PolarHBondContact O-N 2.89Å
555	Q	41	Very low	46.3	Very low	174 Å²	174	135.8 Å²	135.8	81%	0.813	73%	0.733	S	S	*	*			trans	-142.9	56.7	178.1	-138	164.4	18.8	0	0	115.8	K557	Q555-K557 PolarHBondContact O-N 3.15Å
556	G	39.3	Very low	44.2	Very low	85 Å²	85	134 Å²	134	88%	0.876	73%	0.734	S	S	*	*			trans	-71.8	57.2	171	0	0	0	0	0	115.1
557	K	31.6	Very low	41.9	Very low	202 Å²	202	139.1 Å²	139.1	88%	0.878	75%	0.752	S	S	*	*			trans	-161.5	122.3	158.1	-119.5	169.6	-174.5	176.8	0	112.2	Q555	Q555-K557 PolarHBondContact O-N 3.15Å
558	M	31.5	Very low	40.2	Very low	186 Å²	186	136.1 Å²	136.1	92%	0.916	75%	0.754	S	S	*	*			trans	-105.4	128.7	-176.5	179.3	173.4	166.9	0	0	110.1
559	S	31.7	Very low	38.6	Very low	117 Å²	117	136 Å²	136	82%	0.818	77%	0.765	S	S	*	*			trans	-130.2	105.8	168.8	56.4	0	0	0	0	109.2
560	S	31.3	Very low	37.1	Very low	99 Å²	99	132.3 Å²	132.3	69%	0.692	77%	0.772	S	S	*	*			trans	-65.6	136.1	176.6	178.1	0	0	0	0	111.6
561	V	32.8	Very low	35.9	Very low	140 Å²	140	132.7 Å²	132.7	85%	0.848	79%	0.785	S	S	*	*			trans	-138.7	129.5	138	175.6	0	0	0	0	107.6
562	S	33.2	Very low	35.1	Very low	82 Å²	82	137.1 Å²	137.1	57%	0.573	80%	0.797	S	S	*	*			trans	-81.5	148.2	168.7	55.7	0	0	0	0	110.7
563	N	32.7	Very low	34.8	Very low	155 Å²	155	136.7 Å²	136.7	83%	0.829	80%	0.8	S	S	*	*				179.1	119.7	119.5	-85.9	-9.1	0	0	0	110.6
564	V	32.6	Very low	34.1	Very low	130 Å²	130	135.5 Å²	135.5	79%	0.788	80%	0.798	S	S	*	*			trans	-105	128.2	158.6	170.9	0	0	0	0	106.2
565	Y	30.8	Very low	33.1	Very low	220 Å²	220	139.3 Å²	139.3	86%	0.863	80%	0.802	S	S	*	*			trans	-159.7	146.9	134.5	-112.8	-71.9	0	0	0	110.7
566	S	32.8	Very low	32.5	Very low	93 Å²	93	138.4 Å²	138.4	65%	0.65	80%	0.802	S	S	*	*			trans	-85.7	159.7	172.6	50	0	0	0	0	111.2
567	Q	31	Very low	32	Very low	192 Å²	192	138.2 Å²	138.2	90%	0.897	80%	0.801	S	S	*	*				-168.4	167	123.3	-106.2	172.7	25.2	0	0	112.4
568	T	33.4	Very low	31.8	Very low	119 Å²	119	135.8 Å²	135.8	73%	0.73	80%	0.802	S	S	*	*			trans	-111.8	151.4	-172	47.7	0	0	0	0	112.4
569	N	33	Very low	31.7	Very low	167 Å²	167	134 Å²	134	89%	0.893	80%	0.796	S	S	*	*			trans	63.5	118.6	158.6	-61.1	-6.9	0	0	0	118.5
570	G	30.3	Very low	32.3	Very low	80 Å²	80	133.9 Å²	133.9	83%	0.825	79%	0.792	S	S	*	*			trans	-163	141.7	165.4	0	0	0	0	0	109.6
571	A	30.5	Very low	32.1	Very low	106 Å²	106	137.1 Å²	137.1	88%	0.876	80%	0.797	S	S	*	*			trans	-90.5	164.3	-170.5	0	0	0	0	0	114.4
572	Q	33.9	Very low	31.9	Very low	187 Å²	187	137 Å²	137	87%	0.874	80%	0.795	S	S	*	*			trans	-56.7	161.7	166.6	-88.3	-174.6	5.1	0	0	112.7
573	P	42.9	Very low	31.5	Very low	107 Å²	107	140.1 Å²	140.1	70%	0.695	81%	0.806	S	S	*	*			cis	-152.3	167.9	46.7	42.1	-21.1	0	0	0	120.6
574	V	28.6	Very low	31.9	Very low	122 Å²	122	138.7 Å²	138.7	74%	0.739	81%	0.805	S	S	*	*			trans	56	125	143.7	169.9	0	0	0	0	118
575	Q	30.7	Very low	31.5	Very low	162 Å²	162	141.5 Å²	141.5	76%	0.757	81%	0.807	S	S	*	*				-171.8	150	64.1	-153.7	157.6	46.5	0	0	114.6
576	N	27.8	Very low	31.3	Very low	155 Å²	155	137.8 Å²	137.8	83%	0.829	81%	0.807	S	S	*	*			trans	30.5	127.6	154.9	-58.6	-6.3	0	0	0	123.3
577	G	28.5	Very low	30.9	Very low	82 Å²	82	139 Å²	139	85%	0.845	81%	0.81	S	S	*	*			trans	-174.1	109.3	165.6	0	0	0	0	0	116.3
578	V	27.6	Very low	30.6	Very low	150 Å²	150	136.7 Å²	136.7	91%	0.909	81%	0.808	S	S	*	*			trans	-63.1	153.9	-168.8	177.2	0	0	0	0	117.6
579	L	29.3	Very low	30.1	Very low	149 Å²	149	140.8 Å²	140.8	78%	0.78	81%	0.81	S	S	*	*			trans	-61.4	166.5	172.1	-94.6	159.1	0	0	0	114.6
580	P	44.3	Very low	29.8	Very low	114 Å²	114	137.7 Å²	137.7	74%	0.74	79%	0.794	S	S	*	*			cis	-151.4	145.7	48.5	40.2	-17.5	0	0	0	121.6
581	Q	27.7	Very low	29.7	Very low	168 Å²	168	141 Å²	141	79%	0.785	79%	0.788	S	S	*	*			trans	25.3	119.9	131.1	-171.4	-174.4	28.3	0	0	122.4
582	V	27.7	Very low	29.3	Very low	136 Å²	136	143.8 Å²	143.8	82%	0.824	79%	0.787	S	S	*	*			trans	-145.4	147.2	140.7	-178.8	0	0	0	0	109.6
583	N	26.6	Very low	28.9	Very low	148 Å²	148	142 Å²	142	79%	0.791	78%	0.781	S	S	*	*			trans	-134.2	151.6	171.3	-101.9	-28.3	0	0	0	109.3
584	P	40.4	Very low	28	Very low	125 Å²	125	142.7 Å²	142.7	81%	0.812	78%	0.775	S	S	*	*				-145.5	167.1	113.4	36.9	-21.6	0	0	0	116
585	K	24.8	Very low	27.7	Very low	189 Å²	189	145.4 Å²	145.4	82%	0.822	78%	0.777	S	S	*	*			trans	-83.4	158.3	179.1	-57.4	169.6	177.3	175	0	113
586	V	25.2	Very low	27.4	Very low	143 Å²	143	143 Å²	143	87%	0.867	77%	0.769	S	S	*	*			trans	-132.9	152.1	141.9	-179.5	0	0	0	0	108.7
587	V	24.2	Very low	27.3	Very low	118 Å²	118	140.4 Å²	140.4	72%	0.715	76%	0.762	S	S	*	*			trans	-127	144.3	-175.1	173.6	0	0	0	0	109.7
588	V	25.5	Very low	27.2	Very low	143 Å²	143	143 Å²	143	87%	0.867	75%	0.752	S	S	*	*			trans	-138.1	135.5	160.3	-177.3	0	0	0	0	108.8
589	R	21.8	Very low	27.5	Very low	205 Å²	205	140.1 Å²	140.1	77%	0.774	74%	0.739	S	S	*	*			trans	-157.6	142.8	168.1	-155.8	-148.1	161.6	123.1	4.5	110.3
590	N	27.3	Very low	27.3	Very low	102 Å²	102	138.8 Å²	138.8	55%	0.545	74%	0.737	S	S	.	*			trans	65.4	160.1	163.4	-82.6	38.2	0	0	0	117.6
591	E	27.8	Very low	26.6	Very low	151 Å²	151	143 Å²	143	71%	0.706	74%	0.738	S	S	*	*			cis	-178.6	150.9	-36.6	-115.4	169.6	-175.9	0	0	107
592	L	23.3	Very low	26.7	Very low	163 Å²	163	139.8 Å²	139.8	85%	0.853	73%	0.734	S	S	*	*			trans	-172.4	120.8	151.8	-119.7	70.2	0	0	0	106.9
593	M	25.9	Very low	26.8	Very low	150 Å²	150	137.7 Å²	137.7	74%	0.739	73%	0.725	S	S	*	*				71.6	141.5	86.7	-67.3	-48	-153.5	0	0	115.4
594	E	23.1	Very low	26.9	Very low	122 Å²	122	138 Å²	138	57%	0.57	73%	0.725	S	S	*	*			cis	-168.8	-178.8	-9	179.6	165.1	-160.8	0	0	110.3
595	F	22	Very low	26.2	Very low	178 Å²	178	136.9 Å²	136.9	78%	0.781	72%	0.72	S	S	*	*			trans	96.1	137.4	162.5	-68.3	-97.4	0	0	0	117.4
596	N	25.5	Very low	26.3	Very low	111 Å²	111	132.6 Å²	132.6	59%	0.594	71%	0.714	S	S	*	*			cis	147.3	146.1	-17.4	-97.9	-33.6	0	0	0	107.4
597	C	25.5	Very low	26.4	Very low	102 Å²	102	131.5 Å²	131.5	69%	0.689	71%	0.713	S	S	*	*			cis	-162.7	172.8	-13.5	-150.3	0	0	0	0	112.3
598	E	26.9	Very low	26.7	Very low	135 Å²	135	131.6 Å²	131.6	63%	0.631	72%	0.719	S	S	*	*			trans	63.3	152.8	170.8	-74.7	-64.7	70.7	0	0	117.3
599	S	32.3	Very low	26.7	Very low	90 Å²	90	130.7 Å²	130.7	63%	0.629	72%	0.719	S	S	*	*			cis	-159	179.9	-9.7	52.1	0	0	0	0	107.9
600	V	26.7	Very low	27	Very low	122 Å²	122	126.1 Å²	126.1	74%	0.739	72%	0.718	S	S	*	*			cis	-138.8	120	5.6	-165.2	0	0	0	0	105.2
601	R	29.5	Very low	27	Very low	203 Å²	203	127 Å²	127	77%	0.766	73%	0.727	S	S	*	*				46.1	136.5	92.8	-73.7	-177.4	172.8	154.3	0.2	116.6
602	S	29.5	Very low	26.8	Very low	99 Å²	99	127.6 Å²	127.6	69%	0.692	74%	0.735	S	S	*	*			cis	-157.8	174.9	-7.6	52.4	0	0	0	0	108
603	S	28.7	Very low	27	Very low	93 Å²	93	124.5 Å²	124.5	65%	0.65	73%	0.727	S	S	*	*			cis	-150.5	175.6	33.5	-65.3	0	0	0	0	109.1
604	I	28.7	Very low	26.9	Very low	154 Å²	154	128.2 Å²	128.2	79%	0.79	73%	0.733	S	S	*	*			cis	65.7	124.7	38	-42.8	167	0	0	0	110.6
605	S	26.4	Very low	27	Very low	101 Å²	101	129.1 Å²	129.1	71%	0.706	74%	0.742	S	S	*	*			cis	-163.2	173	9.9	32.7	0	0	0	0	109.9
606	S	27.3	Very low	26.9	Very low	99 Å²	99	125.6 Å²	125.6	69%	0.692	74%	0.738	S	S	*	*			cis	165.6	141.5	-40.9	58.3	0	0	0	0	110.6
607	S	26.1	Very low	26.9	Very low	120 Å²	120	127 Å²	127	84%	0.839	75%	0.745	S	S	*	*			trans	61.6	151.7	152.8	56.9	0	0	0	0	122.3
608	S	31.2	Very low	26.8	Very low	121 Å²	121	128.3 Å²	128.3	85%	0.846	75%	0.746	S	S	*	*			trans	-94.9	164.7	174.8	50.8	0	0	0	0	113.4
609	S	26.3	Very low	26.7	Very low	124 Å²	124	131 Å²	131	87%	0.867	75%	0.752	S	S	*	*			trans	-153.1	163.3	162.7	59.5	0	0	0	0	110.9
610	S	26.6	Very low	26.2	Very low	109 Å²	109	130.9 Å²	130.9	76%	0.762	75%	0.751	S	S	*	*			trans	-142.4	-170.8	-176	61.6	0	0	0	0	111.1
611	V	27.3	Very low	26.1	Very low	121 Å²	121	131.7 Å²	131.7	73%	0.733	75%	0.75	S	S	*	*			trans	87.7	106.7	172	-172.2	0	0	0	0	117.1
612	N	24	Very low	25.9	Very low	162 Å²	162	130 Å²	130	87%	0.866	75%	0.751	S	S	*	*				-161.5	161.7	112.9	-108.5	-35.8	0	0	0	111.1
613	S	26.8	Very low	25.7	Very low	99 Å²	99	129.2 Å²	129.2	69%	0.692	75%	0.745	S	S	*	*			trans	-138.1	158.8	-175.4	59.5	0	0	0	0	112.9
614	R	24.4	Very low	25.7	Very low	227 Å²	227	132.3 Å²	132.3	86%	0.857	75%	0.749	S	S	*	*			trans	177.9	114.4	144.7	-101	157.9	-177.9	165.6	2.2	113.2
615	D	24.7	Very low	25.6	Very low	141 Å²	141	132.5 Å²	132.5	75%	0.754	75%	0.747	S	S	*	*				38.1	143	126.3	-42.1	-36	0	0	0	123.6
616	C	21.2	Very low	25.6	Very low	104 Å²	104	130.3 Å²	130.3	70%	0.703	74%	0.74	S	S	*	*			trans	86.5	117.3	148.5	-76.7	0	0	0	0	123
617	D	24.8	Very low	25.6	Very low	140 Å²	140	131.9 Å²	131.9	75%	0.749	75%	0.746	S	S	*	*				80.1	101.4	121.7	-53.9	-15.1	0	0	0	123.7
618	D	23.4	Very low	25.7	Very low	131 Å²	131	133.5 Å²	133.5	70%	0.701	74%	0.744	S	S	*	*				91.5	158.1	112.2	-141.6	1.6	0	0	0	123.3
619	Y	24.2	Very low	25.5	Very low	192 Å²	192	132.5 Å²	132.5	75%	0.753	74%	0.738	S	S	*	*			trans	49.1	94.4	166	-74.4	-64.1	0	0	0	123.6
620	S	23.3	Very low	25.7	Very low	87 Å²	87	131.3 Å²	131.3	61%	0.608	73%	0.729	S	S	*	*				60.4	146.8	110.1	80.4	0	0	0	0	125.5
621	L	24.5	Very low	25.7	Very low	138 Å²	138	134.3 Å²	134.3	72%	0.723	73%	0.729	S	S	*	*			trans	80.7	131	142.9	-76.8	161.7	0	0	0	122.3
622	Q	24.5	Very low	25.7	Very low	168 Å²	168	139.7 Å²	139.7	79%	0.785	74%	0.736	S	S	*	*			trans	67.9	160.6	142.8	-76.9	172.1	-23.4	0	0	120.5
623	S	25.4	Very low	25.7	Very low	82 Å²	82	143 Å²	143	57%	0.573	74%	0.736	S	S	*	*			cis	-177.9	167.2	-42.5	53.8	0	0	0	0	109.6
624	E	27.8	Very low	26.5	Very low	158 Å²	158	143.6 Å²	143.6	74%	0.738	74%	0.738	S	S	*	*			trans	67.3	164.5	161.9	-60.9	-160.6	135.9	0	0	115.7
625	Q	27.4	Very low	27.4	Very low	158 Å²	158	137.5 Å²	137.5	74%	0.738	73%	0.728	S	S	*	*			cis	-158	165.1	-22.1	-105.8	172.9	31	0	0	104.6
626	G	26.7	Very low	27.7	Very low	55 Å²	55	136.1 Å²	136.1	57%	0.567	73%	0.729	S	S	*	*			cis	158.5	-173.7	3.9	0	0	0	0	0	109.8
627	T	27.5	Very low	28	Very low	132 Å²	132	141.8 Å²	141.8	81%	0.81	74%	0.736	S	S	*	*			trans	72.5	152.9	162.6	79.9	0	0	0	0	119.1
628	L	27.1	Very low	28.2	Very low	154 Å²	154	139.9 Å²	139.9	81%	0.806	73%	0.734	S	S	*	*			cis	-167.4	166.4	-22.6	-111.9	168.8	0	0	0	111.9
629	S	27.6	Very low	28.4	Very low	101 Å²	101	142 Å²	142	71%	0.706	74%	0.736	S	S	*	*			trans	67.5	161.1	162.6	-87.5	0	0	0	0	118.2
630	S	29.8	Very low	28.7	Very low	99 Å²	99	141.4 Å²	141.4	69%	0.692	74%	0.74	S	S	*	*			cis	-176.3	165.3	-10.5	51	0	0	0	0	109.7
631	K	28.2	Very low	29.1	Very low	171 Å²	171	142.7 Å²	142.7	74%	0.743	74%	0.74	S	S	*	*			cis	-170.9	142.8	-13.7	-102.7	169.4	-174.3	174	0	110
632	W	26.4	Very low	29.4	Very low	234 Å²	234	144.4 Å²	144.4	89%	0.886	75%	0.748	S	S	*	*			trans	70.3	133.9	155	-63.5	26.2	0	0	0	117.3
633	R	24.8	Very low	29.7	Very low	231 Å²	231	142.2 Å²	142.2	87%	0.872	74%	0.742	S	S	*	*				79.2	148.6	50.8	-87.6	-163.4	-178.6	-161.9	4.3	114.8
634	P	41.8	Very low	29.9	Very low	112 Å²	112	149.7 Å²	149.7	73%	0.727	76%	0.758	S	S	*	*			cis	-130.9	-126.8	-19.5	38	-15.2	0	0	0	110.4
635	P	44.4	Very low	30	Very low	99 Å²	99	148.9 Å²	148.9	64%	0.643	76%	0.757	S	S	*	*			cis	-134.8	142.1	-40.2	34.9	-15.2	0	0	0	117.7
636	S	30.6	Very low	30	Very low	113 Å²	113	149.5 Å²	149.5	79%	0.79	76%	0.762	S	S	*	*			trans	67.9	163.5	146.4	78	0	0	0	0	120.5
637	R	28.4	Very low	30	Very low	223 Å²	223	150 Å²	150	84%	0.842	77%	0.768	S	S	*	*			cis	-138.8	134.6	10	-85.6	-173.6	175.1	164.2	-2.7	109.6
638	S	29.2	Very low	30	Very low	100 Å²	100	147.7 Å²	147.7	70%	0.699	76%	0.762	S	S	*	*				63	138.6	74	83.1	0	0	0	0	115.6
639	K	27.4	Very low	29.9	Very low	175 Å²	175	150.3 Å²	150.3	76%	0.761	77%	0.767	S	S	*	*			cis	-179.2	156.7	-5.5	-123.5	-169.5	179.2	-171	0	108.3
640	H	30.1	Very low	30	Very low	180 Å²	180	149.5 Å²	149.5	83%	0.833	77%	0.766	S	S	*	*				166.8	155	124.4	-98.7	-80.5	0	0	0	114.7
641	N	30.9	Very low	29.9	Very low	113 Å²	113	150.5 Å²	150.5	60%	0.604	77%	0.773	S	S	*	*			trans	-106.4	170.1	-176.2	-66	31.8	0	0	0	112.9	D643	N641-D643 PolarHBondContact ND2-OD2 3.08Å
642	I	32.1	Very low	29.7	Very low	174 Å²	174	150.9 Å²	150.9	89%	0.892	78%	0.783	S	S	*	*				-151.5	149.2	118.8	-101.1	155.7	0	0	0	109.1
643	D	30.6	Very low	29.6	Very low	123 Å²	123	148.9 Å²	148.9	66%	0.658	78%	0.783	S	S	*	*			trans	-119.2	139.5	-160.8	-57.3	-90.7	0	0	0	114.9	N641	N641-D643 PolarHBondContact ND2-OD2 3.08Å
644	R	29.7	Very low	29.5	Very low	239 Å²	239	145.3 Å²	145.3	90%	0.902	78%	0.781	S	S	*	*			trans	172	150.3	140.7	-99.3	170.1	172.8	177.7	-3.4	109.5
645	L	29.2	Very low	28.5	Very low	140 Å²	140	149.9 Å²	149.9	73%	0.733	79%	0.789	S	S	*	*			cis	-149.3	166.8	27.3	-128.1	156.2	0	0	0	112.2
646	M	27.6	Very low	27.4	Very low	171 Å²	171	150.7 Å²	150.7	84%	0.842	80%	0.796	S	S	*	*			trans	71.3	135.7	168.1	-59.4	-54.4	-75.2	0	0	120.5
647	G	25.8	Very low	27	Very low	66 Å²	66	153.9 Å²	153.9	68%	0.68	80%	0.798	S	S	*	*			trans	176.3	140.7	167.2	0	0	0	0	0	111.4
648	A	27.4	Very low	26.7	Very low	83 Å²	83	152 Å²	152	69%	0.686	80%	0.796	S	S	*	*			trans	64.6	151.4	-179.3	0	0	0	0	0	114.9
649	F	26.3	Very low	26.6	Very low	210 Å²	210	156.9 Å²	156.9	92%	0.921	81%	0.805	S	S	*	*			cis	-136.1	178.9	35.8	-87.8	-87.6	0	0	0	115.3
650	A	29	Very low	26.4	Very low	83 Å²	83	156.4 Å²	156.4	69%	0.686	81%	0.805	S	S	*	*			trans	-117.5	172.8	-175.1	0	0	0	0	0	112.5
651	S	27	Very low	26.1	Very low	120 Å²	120	154.9 Å²	154.9	84%	0.839	80%	0.803	S	S	*	*			trans	60.9	115.1	159	-58.2	0	0	0	0	118.3
652	L	25.9	Very low	25.8	Very low	179 Å²	179	155.1 Å²	155.1	94%	0.937	81%	0.809	S	S	*	*			trans	-127.5	129.5	163.9	-86.8	165.5	0	0	0	109.8
653	E	23.2	Very low	25.5	Very low	193 Å²	193	152.9 Å²	152.9	90%	0.902	80%	0.803	S	S	*	*			trans	-132.5	141.6	161.5	-169.7	175.1	-132.5	0	0	107.4
654	L	23.5	Very low	25.3	Very low	156 Å²	156	153.9 Å²	153.9	82%	0.817	81%	0.809	S	S	*	*			trans	-85.7	140.5	-164.1	-72.1	94	0	0	0	113.9
655	K	21.3	Very low	25.2	Very low	207 Å²	207	146.9 Å²	146.9	90%	0.9	80%	0.796	S	S	*	*			trans	-148.1	120.4	137.7	-141.1	159.6	-168.4	163.4	0	112.7
656	C	20.6	Very low	25.1	Very low	116 Å²	116	150.9 Å²	150.9	78%	0.784	80%	0.802	S	S	*	*			trans	-70.9	148.6	175.2	-62.7	0	0	0	0	111.8
657	Q	22.5	Very low	25.1	Very low	181 Å²	181	148.6 Å²	148.6	85%	0.846	80%	0.797	S	S	*	*			trans	-147.7	117.3	155.6	-145	175.5	26.2	0	0	113.5
658	K	21.5	Very low	25.2	Very low	182 Å²	182	150.5 Å²	150.5	79%	0.791	80%	0.8	S	S	*	*			trans	52.3	158.3	153.5	-78.1	-168.4	165.6	-162.6	0	121.5
659	K	26.7	Very low	25.2	Very low	203 Å²	203	152.5 Å²	152.5	88%	0.883	80%	0.804	S	S	*	*			trans	-144.4	126.1	-177.2	-179.8	-172.8	-176.7	-175	0	107.6
660	E	24.3	Very low	25.3	Very low	166 Å²	166	149.1 Å²	149.1	78%	0.776	80%	0.8	S	S	*	*			trans	-150.3	159.1	173.6	-72.2	176.2	-175.6	0	0	107.7
661	D	23.9	Very low	25.2	Very low	148 Å²	148	149.6 Å²	149.6	79%	0.791	81%	0.805	S	S	*	*			cis	-164.2	150.4	-45.6	-165	9.9	0	0	0	107.8
662	T	24.1	Very low	25.2	Very low	117 Å²	117	154.6 Å²	154.6	72%	0.718	81%	0.805	S	S	*	*			trans	171.1	123.4	155.9	19.7	0	0	0	0	115.1
663	T	25.7	Very low	25.4	Very low	127 Å²	127	153.6 Å²	153.6	78%	0.779	80%	0.795	S	S	*	*			trans	63.3	142.9	148.3	57.2	0	0	0	0	119.8
664	D	26.4	Very low	25.7	Very low	145 Å²	145	148.8 Å²	148.8	78%	0.775	78%	0.783	S	S	*	*			cis	-152.6	150.9	4.8	-149.1	-11.3	0	0	0	115.7
665	S	26.9	Very low	25.9	Very low	91 Å²	91	146.9 Å²	146.9	64%	0.636	77%	0.773	S	S	*	*			trans	79.7	138.1	146.4	89	0	0	0	0	123.9
666	R	27.6	Very low	26.2	Very low	225 Å²	225	145.6 Å²	145.6	85%	0.849	77%	0.768	S	S	*	*			trans	88.9	91.2	147.4	-71.2	176.9	-176.7	-160.8	0.4	123.6
667	T	27.3	Very low	26.5	Very low	122 Å²	122	148.6 Å²	148.6	75%	0.748	77%	0.77	S	S	*	*				78.1	128.4	123	50.5	0	0	0	0	123.7
668	S	27.1	Very low	27.6	Very low	106 Å²	106	144.2 Å²	144.2	74%	0.741	76%	0.758	S	S	*	*			trans	66.3	137.4	148.9	48.1	0	0	0	0	120
669	T	27.6	Very low	28	Very low	126 Å²	126	142.6 Å²	142.6	77%	0.773	76%	0.757	S	S	*	*			cis	-162.9	147.2	-4.9	11.4	0	0	0	0	112.2
670	V	29.1	Very low	28	Very low	138 Å²	138	140.6 Å²	140.6	84%	0.836	76%	0.755	S	S	*	*			trans	55.7	112.2	148.6	-178.8	0	0	0	0	120.1
671	A	27	Very low	28.1	Very low	94 Å²	94	136.7 Å²	136.7	78%	0.777	76%	0.76	S	S	*	*				175.6	93.7	118.5	0	0	0	0	0	116.2
672	R	27	Very low	28.1	Very low	224 Å²	224	138.8 Å²	138.8	85%	0.845	77%	0.765	S	S	*	*			trans	34.6	124.5	140.3	-74	-174.3	154.4	163.5	-1.9	124.3
673	H	30.2	Very low	28.2	Very low	159 Å²	159	138 Å²	138	74%	0.736	77%	0.77	S	S	*	*				67.4	147.5	128.8	-68.7	-50.4	0	0	0	121.2
674	S	28.8	Very low	28.2	Very low	91 Å²	91	139.2 Å²	139.2	64%	0.636	77%	0.767	S	S	*	*			cis	-160.3	145.9	-3.9	53	0	0	0	0	114.5
675	D	27.8	Very low	28.2	Very low	116 Å²	116	138.1 Å²	138.1	62%	0.62	77%	0.771	S	S	*	*				71.3	141.3	129.3	-73.5	23.6	0	0	0	125.2
676	K	28.1	Very low	28.3	Very low	181 Å²	181	141.1 Å²	141.1	79%	0.787	77%	0.772	S	S	*	*			trans	86.3	91.3	141.7	-74.8	158.4	-172.8	126.1	0	121.8
677	E	26.3	Very low	28.1	Very low	178 Å²	178	139.5 Å²	139.5	83%	0.832	77%	0.772	S	S	*	*				-45	-178.3	124.2	-111.3	-168	159.3	0	0	114.4
678	P	46.8	Very low	27.9	Very low	89 Å²	89	144.7 Å²	144.7	58%	0.578	78%	0.777	S	S	*	*			cis	-139.4	-173.2	-4.7	23.7	2.5	0	0	0	115.5
679	L	29.3	Very low	27.9	Very low	148 Å²	148	144.2 Å²	144.2	78%	0.775	77%	0.774	S	S	*	*				144	132.4	122.3	-71.7	176.4	0	0	0	117.8
680	L	27.1	Very low	27.8	Very low	161 Å²	161	145.1 Å²	145.1	84%	0.843	77%	0.773	S	S	*	*			trans	16.1	141.7	154.5	-78.7	82.4	0	0	0	123.6
681	G	25	Very low	27.6	Very low	85 Å²	85	145.6 Å²	145.6	88%	0.876	77%	0.771	S	S	*	*			trans	-164.7	94.7	161.5	0	0	0	0	0	113.7
682	Q	25.7	Very low	27.5	Very low	191 Å²	191	147.9 Å²	147.9	89%	0.893	78%	0.775	S	S	*	*			trans	-96.5	137.1	-169.8	173	-170.5	9	0	0	113.9
683	A	25.7	Very low	27.4	Very low	101 Å²	101	145 Å²	145	84%	0.835	78%	0.776	S	S	*	*			trans	-162.5	149.5	155.5	0	0	0	0	0	112.8
684	E	25.9	Very low	27.8	Very low	153 Å²	153	142.3 Å²	142.3	72%	0.715	77%	0.772	S	S	*	*			trans	-115.1	158.4	173.3	-67	-166.5	101.8	0	0	112.1	K686	E684-K686 IonicContact OE1-NZ 2.61Å; E684-K686 PolarHBondContact OE1-NZ 2.89Å; E684-K686 IonicContact OE2-NZ 3.57Å
685	S	26.6	Very low	27.7	Very low	122 Å²	122	144.8 Å²	144.8	85%	0.853	78%	0.778	S	S	*	*			trans	-162.8	158.5	132.6	37.4	0	0	0	0	111.4
686	K	27.4	Very low	27.6	Very low	153 Å²	153	147.9 Å²	147.9	67%	0.665	79%	0.788	S	S	*	*			trans	-128.8	155.8	-170.2	-60.7	173.7	174.6	85.2	0	110.3	E684	E684-K686 IonicContact OE1-NZ 2.61Å; E684-K686 PolarHBondContact OE1-NZ 2.89Å; E684-K686 IonicContact OE2-NZ 3.57Å
687	F	24.6	Very low	27.5	Very low	191 Å²	191	142.4 Å²	142.4	84%	0.838	78%	0.784	S	S	*	*			trans	169	113.9	135.3	-99.3	-81.8	0	0	0	106.7
688	R	24	Very low	27.5	Very low	231 Å²	231	143.5 Å²	143.5	87%	0.872	79%	0.785	S	S	*	*				56.1	141.1	76.5	-83.6	-167.8	168.8	-164.6	-1.6	114.3
689	S	25.4	Very low	26.5	Very low	96 Å²	96	144.7 Å²	144.7	67%	0.671	79%	0.792	S	S	*	*			cis	-177.6	179.8	-16.8	-164	0	0	0	0	109.8
690	L	25.3	Very low	26.4	Very low	145 Å²	145	146.4 Å²	146.4	76%	0.759	79%	0.793	S	S	*	*			trans	73.8	119.6	169.4	-47.2	177.2	0	0	0	115
691	L	25.1	Very low	26.3	Very low	149 Å²	149	149.1 Å²	149.1	78%	0.78	79%	0.792	S	S	*	*				87.9	111.2	51.7	-78.2	177.3	0	0	0	114.4
692	T	25.8	Very low	26.4	Very low	142 Å²	142	149 Å²	149	87%	0.871	78%	0.777	S	S	*	*				-175	146.2	107.6	25.6	0	0	0	0	113.2
693	L	24.4	Very low	26.3	Very low	163 Å²	163	148.1 Å²	148.1	85%	0.853	77%	0.773	S	S	*	*			trans	-93.4	-176.9	164.7	-77.3	167	0	0	0	108.2
694	P	38.7	Very low	26.2	Very low	102 Å²	102	147.6 Å²	147.6	66%	0.662	76%	0.763	S	S	*	*			cis	-154.4	-174.8	21.3	46.7	-25.6	0	0	0	119.6
695	L	27.3	Very low	26	Very low	144 Å²	144	149.4 Å²	149.4	75%	0.754	77%	0.769	S	S	*	*			trans	54.4	152.2	148.9	-93.9	86	0	0	0	120.4
696	E	25.3	Very low	25.9	Very low	180 Å²	180	150 Å²	150	84%	0.841	76%	0.763	S	S	*	*			cis	-170.1	177.8	-21.4	-138.6	179.8	-158.8	0	0	109.6
697	G	25.9	Very low	25.7	Very low	67 Å²	67	150.9 Å²	150.9	69%	0.691	77%	0.771	S	S	*	*			trans	126.8	130	155.9	0	0	0	0	0	118.6
698	K	25.5	Very low	25.5	Very low	200 Å²	200	145.5 Å²	145.5	87%	0.87	77%	0.77	S	S	*	*			trans	-154.2	154.8	-172.6	-68.4	-178.5	179.6	171	0	110.7
699	T	27.3	Very low	25.5	Very low	115 Å²	115	141.8 Å²	141.8	71%	0.706	77%	0.767	S	S	*	*			cis	-172	172.8	-11.6	30.7	0	0	0	0	109.6
700	K	26.5	Very low	25.4	Very low	184 Å²	184	146.4 Å²	146.4	80%	0.8	78%	0.776	S	S	*	*			trans	88.1	129.8	144	-86.9	169.6	177.6	178	0	123.4
701	R	25.1	Very low	25.4	Very low	218 Å²	218	143.2 Å²	143.2	82%	0.823	77%	0.77	S	S	*	*			trans	73.2	124.7	133	-93.7	-173	176.9	171.9	-2.1	124.7
702	S	26.8	Very low	25.4	Very low	82 Å²	82	142 Å²	142	57%	0.573	77%	0.769	S	S	*	*			trans	46.3	159.2	130.5	59.3	0	0	0	0	121.7
703	H	24.5	Very low	25.4	Very low	172 Å²	172	140.7 Å²	140.7	80%	0.796	77%	0.766	S	S	*	*			cis	-148.8	166.6	24.2	-77.7	-96	0	0	0	114.5
704	S	23.7	Very low	25.5	Very low	91 Å²	91	141.7 Å²	141.7	64%	0.636	77%	0.766	S	S	*	*			trans	12	135.6	143.2	-168.8	0	0	0	0	122.2
705	F	21.7	Very low	24.7	Very low	190 Å²	190	141.9 Å²	141.9	83%	0.833	77%	0.768	S	S	*	*				178.3	119.2	107.5	-107.8	-81.5	0	0	0	115.2
706	D	23.4	Very low	24.6	Very low	136 Å²	136	140.6 Å²	140.6	73%	0.727	77%	0.77	S	S	*	*			trans	37.9	161.6	136.1	-140.2	-0.6	0	0	0	126.6
707	M	22.5	Very low	24.5	Very low	171 Å²	171	137.6 Å²	137.6	84%	0.842	76%	0.764	S	S	*	*			trans	82	124.4	160.7	-116.6	78	-174.6	0	0	122.3
708	G	22.1	Very low	24.4	Very low	78 Å²	78	142.3 Å²	142.3	80%	0.804	76%	0.762	S	S	*	*			trans	157	125.4	161.8	0	0	0	0	0	115.9
709	D	23.9	Very low	24.9	Very low	153 Å²	153	138.6 Å²	138.6	82%	0.818	76%	0.759	S	S	*	*			trans	-115.4	179.7	-165.9	-105.9	-53.9	0	0	0	116.2
710	F	23.5	Very low	24.8	Very low	193 Å²	193	140.3 Å²	140.3	85%	0.846	76%	0.757	S	S	*	*			trans	90.4	138.1	164.9	-68.9	-82.5	0	0	0	119.2
711	A	24.5	Very low	24.8	Very low	77 Å²	77	141.9 Å²	141.9	64%	0.636	76%	0.763	S	S	*	*			cis	-156.2	133.8	-1	0	0	0	0	0	117.3
712	T	24.7	Very low	24.8	Very low	124 Å²	124	138 Å²	138	76%	0.761	76%	0.757	S	S	*	*			trans	47.1	124.1	130.2	65.6	0	0	0	0	126.5
713	S	25.3	Very low	24.8	Very low	115 Å²	115	141 Å²	141	80%	0.804	77%	0.772	S	S	*	*				-173.6	125.6	120.3	39.6	0	0	0	0	108
714	Q	27.1	Very low	24.7	Very low	183 Å²	183	139.3 Å²	139.3	86%	0.855	77%	0.769	S	S	*	*			cis	65.2	133.9	49.9	-69.2	-165.7	-5.4	0	0	114.4
715	C	22.7	Very low	24.9	Very low	106 Å²	106	142 Å²	142	72%	0.716	78%	0.775	S	S	*	*			cis	-142.2	173.2	13	-137.5	0	0	0	0	110
716	C	24.3	Very low	25.2	Very low	117 Å²	117	144.9 Å²	144.9	79%	0.791	78%	0.78	S	S	*	*			cis	-141.7	175.5	31.6	-69.2	0	0	0	0	113.8
717	T	24.3	Very low	25.3	Very low	117 Å²	117	145 Å²	145	72%	0.718	79%	0.787	S	S	*	*			trans	-134.7	179.8	176.9	66.1	0	0	0	0	110
718	Y	23.5	Very low	25.6	Very low	166 Å²	166	146.8 Å²	146.8	65%	0.651	79%	0.789	S	S	*	*			cis	-158	-159.1	12.7	-126.6	-26.6	0	0	0	107.4	K720	Y718-K720 HydrophobicContact CD1-CG 4.39Å; Y718-K720 HydrophobicContact CE1-CD 4.25Å; Y718-K720 HydrophobicContact CE1-CG 3.88Å; Y718-K720 VanDerWaalsContact OH-CE 3.23Å; Y718-K720 WeakPolarHBondContact OH-CE 3.48Å; Y718-K720 PolarHBondContact OH-NZ 3.32Å
719	P	34.7	Very low	25.9	Very low	123 Å²	123	154.9 Å²	154.9	80%	0.799	80%	0.796	S	S	*	*			cis	-125.3	-176.9	1.4	40.3	-21.8	0	0	0	115.6
720	K	26.7	Very low	26.2	Very low	151 Å²	151	152.9 Å²	152.9	66%	0.657	79%	0.794	S	S	*	*			trans	-101.5	164.1	-173.1	-58.5	171.1	175.8	172	0	114.1	Y718	Y718-K720 HydrophobicContact CD1-CG 4.39Å; Y718-K720 HydrophobicContact CE1-CD 4.25Å; Y718-K720 HydrophobicContact CE1-CG 3.88Å; Y718-K720 VanDerWaalsContact OH-CE 3.23Å; Y718-K720 WeakPolarHBondContact OH-CE 3.48Å; Y718-K720 PolarHBondContact OH-NZ 3.32Å
721	K	25.2	Very low	26.5	Very low	216 Å²	216	152.3 Å²	152.3	94%	0.939	80%	0.799	S	S	*	*			trans	-148.9	165.9	132.5	-118.3	175	-175.3	179.9	0	112.3
722	I	25.9	Very low	26.8	Very low	137 Å²	137	153.6 Å²	153.6	70%	0.703	80%	0.803	S	S	*	*			trans	-125.2	140.4	-162.6	-60.4	160.9	0	0	0	110
723	T	25.6	Very low	27	Very low	144 Å²	144	154.1 Å²	154.1	88%	0.883	81%	0.806	S	S	*	*			trans	-153.8	155.6	149.8	18.1	0	0	0	0	110.9
724	N	23.6	Very low	27.2	Very low	138 Å²	138	156.6 Å²	156.6	74%	0.738	81%	0.81	S	S	*	*			trans	-92.1	153.8	-174.3	-73.2	-20.4	0	0	0	113.4
725	I	28.6	Very low	27.3	Very low	146 Å²	146	150.8 Å²	150.8	75%	0.749	80%	0.799	S	S	*	*			trans	20.9	120.6	139.3	-40.5	166.9	0	0	0	117
726	W	26.4	Very low	27.5	Very low	251 Å²	251	154.3 Å²	154.3	95%	0.951	81%	0.807	S	S	*	*				-166.5	143.9	127.2	-104.4	25.3	0	0	0	111.2
727	T	26.9	Very low	27.6	Very low	140 Å²	140	156 Å²	156	86%	0.859	81%	0.808	S	S	*	*			trans	-87.4	137	-177.2	39.2	0	0	0	0	111.4
728	K	29.1	Very low	27.8	Very low	207 Å²	207	158 Å²	158	90%	0.9	81%	0.813	S	S	*	*			trans	-84.2	128.2	173.2	-74.2	-175.5	174.9	-178	0	111.1
729	R	26.9	Very low	27.9	Very low	248 Å²	248	157.4 Å²	157.4	94%	0.936	82%	0.816	S	S	*	*			trans	-113.1	162.4	143.3	-98.9	-170	176.1	-164.6	-0	109.6
730	S	30.8	Very low	27.4	Very low	112 Å²	112	162.3 Å²	162.3	78%	0.783	82%	0.82	S	S	*	*			trans	-83.2	148.9	-165.5	49.5	0	0	0	0	114.6
731	L	29.4	Very low	27.4	Very low	181 Å²	181	161.7 Å²	161.7	95%	0.948	82%	0.824	S	S	*	*			trans	-142.5	159.6	145.5	-107.8	169.3	0	0	0	109.5
732	S	31	Very low	27.6	Very low	103 Å²	103	158.8 Å²	158.8	72%	0.72	82%	0.819	S	S	*	*			trans	-110.3	144.2	-160.5	-179.4	0	0	0	0	113.4
733	V	28.4	Very low	27.7	Very low	136 Å²	136	159.4 Å²	159.4	82%	0.824	82%	0.824	S	S	*	*			trans	-143.7	112.4	152.3	-174.5	0	0	0	0	110.6
734	N	30	Very low	27.8	Very low	166 Å²	166	158.8 Å²	158.8	89%	0.888	82%	0.815	S	S	*	*			trans	-137.6	143	140.8	-94.7	-19.2	0	0	0	104.5
735	G	29.8	Very low	28.1	Very low	61 Å²	61	159 Å²	159	63%	0.629	82%	0.816	S	S	*	*			cis	160.5	67.8	4.6	0	0	0	0	0	107.9	L737	G735-L737 PolarHBondContact O-N 3.24Å
736	M	26.3	Very low	28.1	Very low	181 Å²	181	157.9 Å²	157.9	89%	0.892	82%	0.815	S	S	*	*			trans	-68.6	113.4	-169.6	-172.8	-175.7	-67.6	0	0	110.8
737	L	27	Very low	28.3	Very low	152 Å²	152	152.5 Å²	152.5	80%	0.796	81%	0.811	S	S	*	*			trans	-111.2	91.9	-176	-152.3	169.8	0	0	0	109.7	G735	G735-L737 PolarHBondContact O-N 3.24Å
738	L	28.4	Very low	28.4	Very low	159 Å²	159	150 Å²	150	83%	0.832	81%	0.812	S	S	*	*			trans	-82.8	121.7	164.4	-84.4	167.7	0	0	0	108.6
739	Q	25.7	Very low	28.4	Very low	153 Å²	153	144.8 Å²	144.8	72%	0.715	81%	0.808	S	S	*	*			trans	-92.5	127.1	176	-175.8	175.8	-5.8	0	0	109.6
740	Y	23.7	Very low	28.5	Very low	226 Å²	226	143 Å²	143	89%	0.886	81%	0.807	S	S	*	*			trans	-147.1	137.6	165.9	-132.6	-93.7	0	0	0	108.2
741	D	26.5	Very low	28.3	Very low	139 Å²	139	141.1 Å²	141.1	74%	0.743	81%	0.805	S	S	*	*			trans	-81.9	142.1	-168.7	-58.5	-59	0	0	0	112.7
742	D	29.3	Very low	28.2	Very low	154 Å²	154	139.2 Å²	139.2	82%	0.824	80%	0.801	S	S	*	*			trans	-73.6	139.4	172.1	-91.9	-48.6	0	0	0	111.8
743	N	27.6	Very low	28.1	Very low	151 Å²	151	145.8 Å²	145.8	81%	0.807	81%	0.812	S	S	*	*				-171.1	152.8	127.8	-97.3	-43.1	0	0	0	114.1
744	D	28.3	Very low	28	Very low	130 Å²	130	142.6 Å²	142.6	70%	0.695	81%	0.807	S	S	*	*			trans	61.6	97.9	157.8	-69.2	-15.4	0	0	0	122.4
745	L	30	Very low	28	Very low	144 Å²	144	140.3 Å²	140.3	75%	0.754	80%	0.804	S	S	*	*				54.4	102.5	113.1	-72.4	164.7	0	0	0	119.5
746	T	29.1	Very low	28.2	Very low	121 Å²	121	141.4 Å²	141.4	74%	0.742	80%	0.802	S	S	*	*				166	145.6	96.1	41.1	0	0	0	0	115.1
747	T	30.5	Very low	28.5	Very low	139 Å²	139	138.5 Å²	138.5	85%	0.853	79%	0.786	S	S	*	*			trans	35.1	121.2	150.6	58.6	0	0	0	0	122.1
748	G	27.8	Very low	28.8	Very low	86 Å²	86	142.4 Å²	142.4	89%	0.887	79%	0.79	S	S	*	*			trans	166.3	128.6	155.5	0	0	0	0	0	113.2
749	A	29.1	Very low	29.3	Very low	99 Å²	99	138.5 Å²	138.5	82%	0.818	77%	0.773	S	S	*	*			trans	-130.4	131.3	-174.4	0	0	0	0	0	113.8
750	K	29.5	Very low	29.8	Very low	211 Å²	211	139.2 Å²	139.2	92%	0.917	78%	0.778	S	S	*	*			trans	146.2	132	137.7	-85	178.6	176.2	-178.8	0	113.7
751	G	27	Very low	30.2	Very low	71 Å²	71	134 Å²	134	73%	0.732	76%	0.762	S	S	*	*			trans	83.3	145.1	154.5	0	0	0	0	0	116
752	T	27.2	Very low	30.6	Very low	142 Å²	142	130.2 Å²	130.2	87%	0.871	75%	0.746	S	S	*	*			cis	-152.6	145.8	-6.5	-42.9	0	0	0	0	108.9
753	Y	29.8	Very low	30.8	Very low	241 Å²	241	128.4 Å²	128.4	95%	0.945	74%	0.741	S	S	*	*			trans	-67.8	133.6	175.1	-91.4	-90.2	0	0	0	111.9
754	G	26.5	Very low	31	Very low	69 Å²	69	129.5 Å²	129.5	71%	0.711	75%	0.753	S	S	*	*			trans	-109.7	148.9	163.2	0	0	0	0	0	110.4
755	S	30	Very low	31.2	Very low	118 Å²	118	129.5 Å²	129.5	83%	0.825	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-62.1	147.2	-174.4	-170.4	0	0	0	0	113.2
756	S	32.4	Very low	31.2	Very low	84 Å²	84	128.7 Å²	128.7	59%	0.587	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-64.5	134.6	162.4	41.5	0	0	0	0	110.7
757	E	34.4	Very low	31.4	Very low	120 Å²	120	129.2 Å²	129.2	56%	0.561	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-83	131.7	159.7	-75.4	-173.6	134.2	0	0	108.7	N464	N464-E757 PolarHBondContact ND2-OE1 2.92Å
758	W	32.1	Very low	31.4	Very low	233 Å²	233	128.6 Å²	128.6	88%	0.883	75%	0.751	S	S	*	*			trans	-105.2	116.1	167.1	-72.6	84.9	0	0	0	108.6
759	V	38.8	Very low	31.6	Very low	77 Å²	77	131.3 Å²	131.3	47%	0.467	74%	0.742	S	S	.	*			trans	-101	122.9	171	-179.5	0	0	0	0	107.7
760	M	35.8	Very low	31.8	Very low	169 Å²	169	133.4 Å²	133.4	83%	0.833	74%	0.737	S	S	*	*			trans	-89.8	129.1	168.4	-73.7	-165.3	-67	0	0	109.8
761	E	33.6	Very low	32	Very low	117 Å²	117	127.9 Å²	127.9	55%	0.547	72%	0.724	S	S	.	*	B	Isolated β-bridge	trans	-105.8	133.8	170.9	-178.7	143.9	-116.1	0	0	108.4	R458	R458-E761 IonicContact CZ-OE1 3.68Å; R458-E761 IonicContact NE-OE1 2.73Å; R458-E761 PolarHBondContact NE-OE1 3.16Å; R458-E761 IonicContact NH2-OE1 3.82Å; R458-E761 PolarHBondContact NH2-OE1 3.03Å; R458-E761 IonicContact NH2-OE2 2.83Å; R458-E761 PolarHBondContact NH2-OE2 3.35Å
762	S	34.8	Very low	32.3	Very low	58 Å²	58	132.2 Å²	132.2	41%	0.406	72%	0.724	S	S	.	*			trans	-147.5	113.3	-175.5	-176	0	0	0	0	109	Y457	Y457-S762 PolarHBondContact OH-OG 3.49Å
763	T	31.9	Very low	32.8	Very low	117 Å²	117	131.4 Å²	131.4	72%	0.718	71%	0.711	S	S	*	*			trans	-80.1	144.6	162.8	51.8	0	0	0	0	109.3
764	V	33.5	Very low	33	Very low	174 Å²	174	121.5 Å²	121.5	100%	1.055	69%	0.69	S	S	*	*			trans	-109.9	0	170.2	172.2	0	0	0	0	108.2	Y457	Y457-V764 HydrophobicContact CE1-CG2 3.8Å; Y457-V764 WeakPolarHBondContact OH-CG2 3.25Å

Retrieved 764 of 764 residues in 1034.6 ms (Link to these results)

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